| Chain sequence(s) |
A: FQTSTVTTDNAYNSYARVRAVVMTRDDSSGGWLPLGGSGLSCVTVFRVPHQEENGCADFFIHGERLRDKMVVLECMLKKDLIYNKVTPTFHHWKIDDKKFGLTFQSPADARAFDRGIRRAIEDISQGCPASKNEAEEPEDDLQAPEEDTSSSLVKDHLFQQDTVITSEPYRSSNIRPSPFEDLNARRAYVQSQANQITFSQPGLDIQSRGMEYVQRQISKECGSLKSQNRVPLKSIRHVSFQDEDEIVRINPRDILIRRYADYRHPDMWKNDLERDDTDTSIPFSKPDSKKSDYLYSCGDETKLSSLKDSVVFKTQPSSLKFKKSKRRKEDGERSRCVYCQERFNHEENGRGKCQDAPDPIKRCIYQVSCMLCAESMLYHCMSDSEGDFSDPCSCDTSDDKFCLRWLALVALSFIVPCMCCYVPLRMCHRCGEACGCCGGKHKAAG
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 (00:12:44)
[INFO] Main: Simulation completed successfully. (00:12:52)
|
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 | F | A | 1.2970 | |
| 2 | Q | A | -0.3149 | |
| 3 | T | A | -0.1134 | |
| 4 | S | A | 0.1126 | |
| 5 | T | A | 0.2990 | |
| 6 | V | A | 1.0446 | |
| 7 | T | A | 0.0762 | |
| 8 | T | A | -0.6305 | |
| 9 | D | A | -1.6975 | |
| 10 | N | A | -1.2182 | |
| 11 | A | A | -0.6069 | |
| 12 | Y | A | 0.4435 | |
| 13 | N | A | -0.1681 | |
| 14 | S | A | -0.2544 | |
| 15 | Y | A | -0.7013 | |
| 16 | A | A | 0.0000 | |
| 17 | R | A | -2.1543 | |
| 18 | V | A | 0.0000 | |
| 19 | R | A | -2.2415 | |
| 20 | A | A | 0.0000 | |
| 21 | V | A | -0.0908 | |
| 22 | V | A | 0.0000 | |
| 23 | M | A | 0.1502 | |
| 24 | T | A | 0.0000 | |
| 25 | R | A | -2.2735 | |
| 26 | D | A | -2.4485 | |
| 27 | D | A | -2.9613 | |
| 28 | S | A | -1.7709 | |
| 29 | S | A | -1.4519 | |
| 30 | G | A | -1.6750 | |
| 31 | G | A | -1.0699 | |
| 32 | W | A | -0.4005 | |
| 33 | L | A | 0.3010 | |
| 34 | P | A | 0.3037 | |
| 35 | L | A | 0.2739 | |
| 36 | G | A | 0.0894 | |
| 37 | G | A | -0.2727 | |
| 38 | S | A | -0.1883 | |
| 39 | G | A | -0.4799 | |
| 40 | L | A | -0.5589 | |
| 41 | S | A | 0.0000 | |
| 42 | C | A | -1.2040 | |
| 43 | V | A | 0.0000 | |
| 44 | T | A | -1.2580 | |
| 45 | V | A | 0.0000 | |
| 46 | F | A | -0.2689 | |
| 47 | R | A | -0.6234 | |
| 48 | V | A | -0.3254 | |
| 49 | P | A | -1.1633 | |
| 50 | H | A | -2.6114 | |
| 51 | Q | A | -2.9841 | |
| 52 | E | A | -3.7793 | |
| 53 | E | A | -3.6523 | |
| 54 | N | A | -2.9493 | |
| 55 | G | A | -2.1690 | |
| 56 | C | A | -0.9787 | |
| 57 | A | A | -1.0479 | |
| 58 | D | A | -0.7294 | |
| 59 | F | A | 0.0000 | |
| 60 | F | A | -0.1951 | |
| 61 | I | A | 0.0000 | |
| 62 | H | A | -0.7457 | |
| 63 | G | A | 0.0000 | |
| 64 | E | A | -1.3292 | |
| 65 | R | A | -1.5302 | |
| 66 | L | A | -1.6104 | |
| 67 | R | A | -2.9034 | |
| 68 | D | A | -3.0961 | |
| 69 | K | A | -2.5966 | |
| 70 | M | A | -0.7831 | |
| 71 | V | A | 0.2558 | |
| 72 | V | A | 0.0452 | |
| 73 | L | A | 0.0000 | |
| 74 | E | A | -1.5099 | |
| 75 | C | A | 0.0000 | |
| 76 | M | A | -0.1638 | |
| 77 | L | A | 0.0000 | |
| 78 | K | A | -2.0612 | |
| 79 | K | A | -3.1652 | |
| 80 | D | A | -2.5955 | |
| 81 | L | A | -1.2859 | |
| 82 | I | A | 0.1223 | |
| 83 | Y | A | -0.0386 | |
| 84 | N | A | -0.0875 | |
| 85 | K | A | -0.3122 | |
| 86 | V | A | 1.1387 | |
| 87 | T | A | 0.3782 | |
| 88 | P | A | -0.0906 | |
| 89 | T | A | -0.2528 | |
| 90 | F | A | 0.3383 | |
| 91 | H | A | 0.0000 | |
| 92 | H | A | -0.2348 | |
| 93 | W | A | 0.0000 | |
| 94 | K | A | -2.3747 | |
| 95 | I | A | -2.2059 | |
| 96 | D | A | -3.1071 | |
| 97 | D | A | -3.3950 | |
| 98 | K | A | -3.3009 | |
| 99 | K | A | -2.6054 | |
| 100 | F | A | -0.9243 | |
| 101 | G | A | 0.0000 | |
| 102 | L | A | 0.0000 | |
| 103 | T | A | -0.3611 | |
| 104 | F | A | 0.0000 | |
| 105 | Q | A | -1.6324 | |
| 106 | S | A | -1.1392 | |
| 107 | P | A | -0.6919 | |
| 108 | A | A | -0.6606 | |
| 109 | D | A | -1.6380 | |
| 110 | A | A | 0.0000 | |
| 111 | R | A | -1.0944 | |
| 112 | A | A | -0.9494 | |
| 113 | F | A | 0.0000 | |
| 114 | D | A | 0.0000 | |
| 115 | R | A | -1.8717 | |
| 116 | G | A | 0.0000 | |
| 117 | I | A | 0.0000 | |
| 118 | R | A | -2.9733 | |
| 119 | R | A | -3.0139 | |
| 120 | A | A | 0.0000 | |
| 121 | I | A | -3.0018 | |
| 122 | E | A | -3.6232 | |
| 123 | D | A | -2.8915 | |
| 124 | I | A | 0.0000 | |
| 125 | S | A | -2.2711 | |
| 126 | Q | A | -1.9711 | |
| 127 | G | A | -1.1763 | |
| 128 | C | A | -0.4018 | |
| 129 | P | A | -0.6029 | |
| 130 | A | A | -0.9210 | |
| 131 | S | A | -1.5248 | |
| 132 | K | A | -2.9686 | |
| 133 | N | A | -3.0527 | |
| 134 | E | A | -3.5019 | |
| 135 | A | A | -2.6379 | |
| 136 | E | A | -3.3427 | |
| 137 | E | A | -3.6571 | |
| 138 | P | A | -3.0180 | |
| 139 | E | A | -3.8806 | |
| 140 | D | A | -3.5573 | |
| 141 | D | A | -2.5395 | |
| 142 | L | A | -0.2802 | |
| 143 | Q | A | -0.8039 | |
| 144 | A | A | -0.6836 | |
| 145 | P | A | -1.7382 | |
| 146 | E | A | -3.2286 | |
| 147 | E | A | -3.7232 | |
| 148 | D | A | -3.1878 | |
| 149 | T | A | -1.5442 | |
| 150 | S | A | -0.7842 | |
| 151 | S | A | -0.1067 | |
| 152 | S | A | 0.5902 | |
| 153 | L | A | 1.8945 | |
| 154 | V | A | 1.0814 | |
| 155 | K | A | -1.6297 | |
| 156 | D | A | -2.0175 | |
| 157 | H | A | -0.8896 | |
| 158 | L | A | 1.1706 | |
| 159 | F | A | 1.2120 | |
| 160 | Q | A | -0.7893 | |
| 161 | Q | A | -2.0700 | |
| 162 | D | A | -1.8384 | |
| 163 | T | A | 0.1146 | |
| 164 | V | A | 2.3283 | |
| 165 | I | A | 2.6068 | |
| 166 | T | A | 0.8264 | |
| 167 | S | A | -0.7805 | |
| 168 | E | A | -1.8123 | |
| 169 | P | A | -0.9737 | |
| 170 | Y | A | -0.1535 | |
| 171 | R | A | -1.3759 | |
| 172 | S | A | -1.2363 | |
| 173 | S | A | -0.9550 | |
| 174 | N | A | -0.7787 | |
| 175 | I | A | 0.3730 | |
| 176 | R | A | -1.2567 | |
| 177 | P | A | -0.8957 | |
| 178 | S | A | -0.4220 | |
| 179 | P | A | 0.1670 | |
| 180 | F | A | 0.5450 | |
| 181 | E | A | -1.4976 | |
| 182 | D | A | -1.8085 | |
| 183 | L | A | -0.5273 | |
| 184 | N | A | -1.4318 | |
| 185 | A | A | -1.6224 | |
| 186 | R | A | -2.6764 | |
| 187 | R | A | -2.3139 | |
| 188 | A | A | -0.3500 | |
| 189 | Y | A | 1.2209 | |
| 190 | V | A | 1.6330 | |
| 191 | Q | A | -0.3070 | |
| 192 | S | A | -0.8593 | |
| 193 | Q | A | -1.7756 | |
| 194 | A | A | -1.4779 | |
| 195 | N | A | -1.6941 | |
| 196 | Q | A | -0.8294 | |
| 197 | I | A | 1.4934 | |
| 198 | T | A | 1.5675 | |
| 199 | F | A | 1.8764 | |
| 200 | S | A | 0.1310 | |
| 201 | Q | A | -1.0974 | |
| 202 | P | A | -0.6695 | |
| 203 | G | A | -0.4348 | |
| 204 | L | A | 0.7613 | |
| 205 | D | A | -0.3685 | |
| 206 | I | A | 0.7987 | |
| 207 | Q | A | -1.1385 | |
| 208 | S | A | -1.2707 | |
| 209 | R | A | -2.3953 | |
| 210 | G | A | -1.3449 | |
| 211 | M | A | -0.0606 | |
| 212 | E | A | -0.6310 | |
| 213 | Y | A | 1.0285 | |
| 214 | V | A | 0.8963 | |
| 215 | Q | A | -1.1900 | |
| 216 | R | A | -1.9044 | |
| 217 | Q | A | -1.2372 | |
| 218 | I | A | 0.1800 | |
| 219 | S | A | -0.9260 | |
| 220 | K | A | -2.1326 | |
| 221 | E | A | -2.2447 | |
| 222 | C | A | -0.8141 | |
| 223 | G | A | -0.2355 | |
| 224 | S | A | 0.0595 | |
| 225 | L | A | 0.4758 | |
| 226 | K | A | -1.4014 | |
| 227 | S | A | -1.6014 | |
| 228 | Q | A | -2.7914 | |
| 229 | N | A | -2.4518 | |
| 230 | R | A | -1.9189 | |
| 231 | V | A | 0.8054 | |
| 232 | P | A | 0.4355 | |
| 233 | L | A | 0.9602 | |
| 234 | K | A | -0.9105 | |
| 235 | S | A | -0.4338 | |
| 236 | I | A | 0.6517 | |
| 237 | R | A | -1.1778 | |
| 238 | H | A | -0.4335 | |
| 239 | V | A | 1.2968 | |
| 240 | S | A | 0.6093 | |
| 241 | F | A | 0.9193 | |
| 242 | Q | A | -1.6409 | |
| 243 | D | A | -3.4203 | |
| 244 | E | A | -3.7829 | |
| 245 | D | A | -3.3448 | |
| 246 | E | A | -2.1010 | |
| 247 | I | A | 1.0205 | |
| 248 | V | A | 1.5390 | |
| 249 | R | A | -0.0547 | |
| 250 | I | A | 1.0863 | |
| 251 | N | A | -1.1038 | |
| 252 | P | A | -0.6231 | |
| 253 | R | A | -1.3785 | |
| 254 | D | A | -0.3909 | |
| 255 | I | A | 1.4254 | |
| 256 | L | A | 1.5904 | |
| 257 | I | A | 1.3448 | |
| 258 | R | A | -1.2739 | |
| 259 | R | A | -1.3809 | |
| 260 | Y | A | -0.9697 | |
| 261 | A | A | -1.5237 | |
| 262 | D | A | -2.4367 | |
| 263 | Y | A | -0.4918 | |
| 264 | R | A | -1.3534 | |
| 265 | H | A | -1.6381 | |
| 266 | P | A | -1.1819 | |
| 267 | D | A | -1.7159 | |
| 268 | M | A | -0.1796 | |
| 269 | W | A | -0.3421 | |
| 270 | K | A | -2.0343 | |
| 271 | N | A | -2.1846 | |
| 272 | D | A | -2.7754 | |
| 273 | L | A | -1.4768 | |
| 274 | E | A | -3.4056 | |
| 275 | R | A | -4.0216 | |
| 276 | D | A | -4.1763 | |
| 277 | D | A | -3.8344 | |
| 278 | T | A | -2.4659 | |
| 279 | D | A | -2.5526 | |
| 280 | T | A | -0.8343 | |
| 281 | S | A | 0.3113 | |
| 282 | I | A | 2.1529 | |
| 283 | P | A | 1.5233 | |
| 284 | F | A | 1.7711 | |
| 285 | S | A | -0.1848 | |
| 286 | K | A | -1.9099 | |
| 287 | P | A | -2.0993 | |
| 288 | D | A | -2.6869 | |
| 289 | S | A | -2.3208 | |
| 290 | K | A | -3.0179 | |
| 291 | K | A | -2.9594 | |
| 292 | S | A | -1.7917 | |
| 293 | D | A | -1.2850 | |
| 294 | Y | A | 1.2552 | |
| 295 | L | A | 2.2611 | |
| 296 | Y | A | 2.3950 | |
| 297 | S | A | 0.8141 | |
| 298 | C | A | 0.3286 | |
| 299 | G | A | -1.4691 | |
| 300 | D | A | -2.8459 | |
| 301 | E | A | -3.1979 | |
| 302 | T | A | -1.9168 | |
| 303 | K | A | -1.3684 | |
| 304 | L | A | 0.5358 | |
| 305 | S | A | 0.4182 | |
| 306 | S | A | 0.4243 | |
| 307 | L | A | 0.1779 | |
| 308 | K | A | -1.9051 | |
| 309 | D | A | -2.0516 | |
| 310 | S | A | -0.2101 | |
| 311 | V | A | 2.3999 | |
| 312 | V | A | 3.1884 | |
| 313 | F | A | 2.2298 | |
| 314 | K | A | -0.5757 | |
| 315 | T | A | -0.8245 | |
| 316 | Q | A | -1.6832 | |
| 317 | P | A | -1.0308 | |
| 318 | S | A | -0.5211 | |
| 319 | S | A | 0.0509 | |
| 320 | L | A | 0.8568 | |
| 321 | K | A | -0.6843 | |
| 322 | F | A | 0.2939 | |
| 323 | K | A | -2.0363 | |
| 324 | K | A | -3.3369 | |
| 325 | S | A | -2.7937 | |
| 326 | K | A | -4.3324 | |
| 327 | R | A | -4.7381 | |
| 328 | R | A | -5.0526 | |
| 329 | K | A | -4.7035 | |
| 330 | E | A | -5.0289 | |
| 331 | D | A | -4.3898 | |
| 332 | G | A | -4.0682 | |
| 333 | E | A | -4.3774 | |
| 334 | R | A | -4.9731 | |
| 335 | S | A | -3.8621 | |
| 336 | R | A | -4.3510 | |
| 337 | C | A | 0.0000 | |
| 338 | V | A | -1.6971 | |
| 339 | Y | A | -1.8494 | |
| 340 | C | A | -2.3192 | |
| 341 | Q | A | -3.2161 | |
| 342 | E | A | -3.9137 | |
| 343 | R | A | -4.5896 | |
| 344 | F | A | 0.0000 | |
| 345 | N | A | -4.3802 | |
| 346 | H | A | -3.9013 | |
| 347 | E | A | -3.7755 | |
| 348 | E | A | -3.6234 | |
| 349 | N | A | -3.3342 | |
| 350 | G | A | -2.7289 | |
| 351 | R | A | -2.5113 | |
| 352 | G | A | -2.8439 | |
| 353 | K | A | -3.5336 | |
| 354 | C | A | 0.0000 | |
| 355 | Q | A | -2.7612 | |
| 356 | D | A | -2.7525 | |
| 357 | A | A | 0.0000 | |
| 358 | P | A | -1.3530 | |
| 359 | D | A | 0.0000 | |
| 360 | P | A | -0.6496 | |
| 361 | I | A | -0.3305 | |
| 362 | K | A | -1.4937 | |
| 363 | R | A | -1.7842 | |
| 364 | C | A | -0.2916 | |
| 365 | I | A | 0.0000 | |
| 366 | Y | A | -0.2384 | |
| 367 | Q | A | -0.3691 | |
| 368 | V | A | 1.0887 | |
| 369 | S | A | 0.0000 | |
| 370 | C | A | 0.8192 | |
| 371 | M | A | 0.0000 | |
| 372 | L | A | 0.8547 | |
| 373 | C | A | 0.4927 | |
| 374 | A | A | 0.0000 | |
| 375 | E | A | -0.3845 | |
| 376 | S | A | 0.2792 | |
| 377 | M | A | 0.2891 | |
| 378 | L | A | 0.0000 | |
| 379 | Y | A | 0.0995 | |
| 380 | H | A | -0.2891 | |
| 381 | C | A | 0.4458 | |
| 382 | M | A | 0.0261 | |
| 383 | S | A | -0.9374 | |
| 384 | D | A | -2.0717 | |
| 385 | S | A | -1.8562 | |
| 386 | E | A | -2.5813 | |
| 387 | G | A | -1.8803 | |
| 388 | D | A | -2.0079 | |
| 389 | F | A | -1.0254 | |
| 390 | S | A | -1.1181 | |
| 391 | D | A | -1.7440 | |
| 392 | P | A | 0.0000 | |
| 393 | C | A | 0.2430 | |
| 394 | S | A | -0.2197 | |
| 395 | C | A | 0.2560 | |
| 396 | D | A | -1.0142 | |
| 397 | T | A | -0.7206 | |
| 398 | S | A | -1.3152 | |
| 399 | D | A | -1.4297 | |
| 400 | D | A | -2.1888 | |
| 401 | K | A | -0.7739 | |
| 402 | F | A | 0.5632 | |
| 403 | C | A | 1.8376 | |
| 404 | L | A | 2.2955 | |
| 405 | R | A | 0.0000 | |
| 406 | W | A | 2.9047 | |
| 407 | L | A | 2.8932 | |
| 408 | A | A | 2.0301 | |
| 409 | L | A | 2.1105 | |
| 410 | V | A | 2.3463 | |
| 411 | A | A | 1.9665 | |
| 412 | L | A | 0.0000 | |
| 413 | S | A | 2.2482 | |
| 414 | F | A | 3.1587 | |
| 415 | I | A | 3.1041 | |
| 416 | V | A | 2.0254 | |
| 417 | P | A | 1.4191 | |
| 418 | C | A | 1.2419 | |
| 419 | M | A | 1.8143 | |
| 420 | C | A | 1.7897 | |
| 421 | C | A | 1.5673 | |
| 422 | Y | A | 0.0000 | |
| 423 | V | A | 2.2846 | |
| 424 | P | A | 1.1771 | |
| 425 | L | A | 1.2432 | |
| 426 | R | A | 0.4096 | |
| 427 | M | A | 0.6151 | |
| 428 | C | A | 0.6231 | |
| 429 | H | A | -0.3681 | |
| 430 | R | A | -1.6226 | |
| 431 | C | A | -0.0404 | |
| 432 | G | A | -0.4520 | |
| 433 | E | A | -1.9017 | |
| 434 | A | A | -0.7639 | |
| 435 | C | A | 0.1165 | |
| 436 | G | A | -0.9164 | |
| 437 | C | A | -0.0125 | |
| 438 | C | A | 0.0000 | |
| 439 | G | A | 0.0000 | |
| 440 | G | A | 0.0000 | |
| 441 | K | A | -3.0113 | |
| 442 | H | A | -3.6270 | |
| 443 | K | A | -2.4344 | |
| 444 | A | A | -2.6159 | |
| 445 | A | A | -1.0527 | |
| 446 | G | A | -0.8164 |
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