| Chain sequence(s) |
A: MVSYWDTGVLLCALLSCLLLTGSSSGSDTGRPFVEMYSEIPEIIHMTEGRELVIPCRVTSPNITVTLKKFPLDTLIPDGKRIIWDSRKGFIISNATYKEIGLLTCEATVNGHLYKTNYLTHRQTNTIIDVVLSPSHGIELSVGEKLVLNCTARTELNVGIDFNWEYPSSKHQHKKLVNRDLKTQSGSEMKKFLSTLTIDGVTRSDQGLYTCAASSGLMTKKNSTFVRVHEKDKTHTCPPCPAPELLGGPSVFLFPPKPKDTLMISRTPEVTCVVVDVSHEDPEVKFNWYVDGVEVHNAKTKPREEQYNSTYRVVSVLTVLHQDWLNGKEYKCKVSNKALPAPIEKTISKAKGQPREPQVYTLPPSRDELTKNQVSLTCLVKGFYPSDIAVEWESNGQPENNYKTTPPVLDSDGSFFLYSKLTVDKSRWQQGNVFSCSVMHEALHNHYTQKSLSLSPGK
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 (00:06:46)
[INFO] Main: Simulation completed successfully. (00:06:49)
|
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 | 2.0012 | |
| 2 | V | A | 2.6641 | |
| 3 | S | A | 1.6299 | |
| 4 | Y | A | 1.8808 | |
| 5 | W | A | 1.0725 | |
| 6 | D | A | -0.5423 | |
| 7 | T | A | 0.3135 | |
| 8 | G | A | 0.6476 | |
| 9 | V | A | 2.0113 | |
| 10 | L | A | 1.8131 | |
| 11 | L | A | 1.8466 | |
| 12 | C | A | 1.7588 | |
| 13 | A | A | 1.3117 | |
| 14 | L | A | 1.5007 | |
| 15 | L | A | 1.4959 | |
| 16 | S | A | 1.3568 | |
| 17 | C | A | 1.9175 | |
| 18 | L | A | 2.0933 | |
| 19 | L | A | 2.5826 | |
| 20 | L | A | 2.4616 | |
| 21 | T | A | 0.9128 | |
| 22 | G | A | -0.1267 | |
| 23 | S | A | -0.5044 | |
| 24 | S | A | -0.6999 | |
| 25 | S | A | -0.8873 | |
| 26 | G | A | -1.1705 | |
| 27 | S | A | -1.5602 | |
| 28 | D | A | -2.3770 | |
| 29 | T | A | -1.4571 | |
| 30 | G | A | -1.6479 | |
| 31 | R | A | -1.7875 | |
| 32 | P | A | 0.0000 | |
| 33 | F | A | 0.0000 | |
| 34 | V | A | 0.1904 | |
| 35 | E | A | -0.0422 | |
| 36 | M | A | -0.0684 | |
| 37 | Y | A | -0.1042 | |
| 38 | S | A | -0.7078 | |
| 39 | E | A | -0.7335 | |
| 40 | I | A | 1.0751 | |
| 41 | P | A | 0.0000 | |
| 42 | E | A | -0.4516 | |
| 43 | I | A | 0.1817 | |
| 44 | I | A | -0.2958 | |
| 45 | H | A | -1.1346 | |
| 46 | M | A | 0.0000 | |
| 47 | T | A | -2.4634 | |
| 48 | E | A | -2.9779 | |
| 49 | G | A | -2.5734 | |
| 50 | R | A | -3.7943 | |
| 51 | E | A | -3.3524 | |
| 52 | L | A | 0.0000 | |
| 53 | V | A | -0.1715 | |
| 54 | I | A | 0.0000 | |
| 55 | P | A | -0.8814 | |
| 56 | C | A | 0.0000 | |
| 57 | R | A | -1.6092 | |
| 58 | V | A | 0.0000 | |
| 59 | T | A | -0.7701 | |
| 60 | S | A | -0.9875 | |
| 61 | P | A | -1.3648 | |
| 62 | N | A | -1.3217 | |
| 63 | I | A | -0.5188 | |
| 64 | T | A | -0.2109 | |
| 65 | V | A | -0.2456 | |
| 66 | T | A | 0.1320 | |
| 67 | L | A | 0.0000 | |
| 68 | K | A | -0.2266 | |
| 69 | K | A | -0.1608 | |
| 70 | F | A | 0.6961 | |
| 71 | P | A | 0.5781 | |
| 72 | L | A | 1.1321 | |
| 73 | D | A | 0.0378 | |
| 74 | T | A | 0.2933 | |
| 75 | L | A | 0.0000 | |
| 76 | I | A | 1.3387 | |
| 77 | P | A | -0.2185 | |
| 78 | D | A | -1.9974 | |
| 79 | G | A | -1.7126 | |
| 80 | K | A | -2.6709 | |
| 81 | R | A | -1.9543 | |
| 82 | I | A | 0.0000 | |
| 83 | I | A | -0.1675 | |
| 84 | W | A | -0.0732 | |
| 85 | D | A | -1.2012 | |
| 86 | S | A | -1.8839 | |
| 87 | R | A | -2.7707 | |
| 88 | K | A | -2.2908 | |
| 89 | G | A | 0.0000 | |
| 90 | F | A | 0.0000 | |
| 91 | I | A | -0.4393 | |
| 92 | I | A | 0.0000 | |
| 93 | S | A | -2.0923 | |
| 94 | N | A | -3.0907 | |
| 95 | A | A | 0.0000 | |
| 96 | T | A | -1.0442 | |
| 97 | Y | A | 0.6048 | |
| 98 | K | A | -0.3469 | |
| 99 | E | A | 0.0000 | |
| 100 | I | A | 0.2825 | |
| 101 | G | A | 0.3114 | |
| 102 | L | A | 0.0000 | |
| 103 | L | A | 0.0000 | |
| 104 | T | A | 0.0000 | |
| 105 | C | A | 0.0000 | |
| 106 | E | A | -0.4007 | |
| 107 | A | A | 0.0000 | |
| 108 | T | A | -0.4752 | |
| 109 | V | A | -0.7408 | |
| 110 | N | A | -1.5537 | |
| 111 | G | A | -1.2357 | |
| 112 | H | A | -1.2070 | |
| 113 | L | A | -0.0029 | |
| 114 | Y | A | -0.3344 | |
| 115 | K | A | -0.9982 | |
| 116 | T | A | 0.0000 | |
| 117 | N | A | -0.4695 | |
| 118 | Y | A | 0.0000 | |
| 119 | L | A | 0.1954 | |
| 120 | T | A | 0.0000 | |
| 121 | H | A | -0.7526 | |
| 122 | R | A | -1.4036 | |
| 123 | Q | A | -2.0948 | |
| 124 | T | A | -1.3384 | |
| 125 | N | A | -0.4039 | |
| 126 | T | A | -0.3463 | |
| 127 | I | A | 0.0000 | |
| 128 | I | A | -0.0233 | |
| 129 | D | A | -0.5870 | |
| 130 | V | A | 0.0000 | |
| 131 | V | A | 0.1991 | |
| 132 | L | A | 0.0000 | |
| 133 | S | A | -0.1448 | |
| 134 | P | A | -0.3562 | |
| 135 | S | A | -0.6932 | |
| 136 | H | A | -1.4134 | |
| 137 | G | A | -1.6237 | |
| 138 | I | A | 0.0000 | |
| 139 | E | A | -2.9932 | |
| 140 | L | A | -2.7138 | |
| 141 | S | A | -2.9145 | |
| 142 | V | A | -2.4546 | |
| 143 | G | A | -2.2801 | |
| 144 | E | A | -2.6572 | |
| 145 | K | A | -2.3925 | |
| 146 | L | A | 0.0000 | |
| 147 | V | A | -0.3222 | |
| 148 | L | A | 0.0000 | |
| 149 | N | A | -0.0338 | |
| 150 | C | A | 0.0000 | |
| 151 | T | A | -0.5179 | |
| 152 | A | A | 0.0000 | |
| 153 | R | A | -0.7387 | |
| 154 | T | A | 0.0000 | |
| 155 | E | A | -1.3319 | |
| 156 | L | A | -1.3310 | |
| 157 | N | A | -1.8113 | |
| 158 | V | A | 0.0000 | |
| 159 | G | A | -1.5780 | |
| 160 | I | A | -1.6276 | |
| 161 | D | A | -2.2276 | |
| 162 | F | A | -1.4741 | |
| 163 | N | A | -2.1262 | |
| 164 | W | A | 0.0000 | |
| 165 | E | A | -1.6263 | |
| 166 | Y | A | -0.5636 | |
| 167 | P | A | -0.7789 | |
| 168 | S | A | 0.0000 | |
| 169 | S | A | -1.6753 | |
| 170 | K | A | -2.4323 | |
| 171 | H | A | -2.5636 | |
| 172 | Q | A | -2.8955 | |
| 173 | H | A | -3.2086 | |
| 174 | K | A | -3.0631 | |
| 175 | K | A | -1.9453 | |
| 176 | L | A | 0.3529 | |
| 177 | V | A | 0.2033 | |
| 178 | N | A | -1.8601 | |
| 179 | R | A | -3.2015 | |
| 180 | D | A | -3.4421 | |
| 181 | L | A | -2.5040 | |
| 182 | K | A | -2.8119 | |
| 183 | T | A | -2.0976 | |
| 184 | Q | A | -2.0862 | |
| 185 | S | A | -1.4693 | |
| 186 | G | A | -1.3480 | |
| 187 | S | A | -1.6017 | |
| 188 | E | A | -2.2440 | |
| 189 | M | A | -1.4588 | |
| 190 | K | A | -2.0287 | |
| 191 | K | A | -1.7638 | |
| 192 | F | A | 0.0000 | |
| 193 | L | A | -1.0813 | |
| 194 | S | A | 0.0000 | |
| 195 | T | A | -0.1038 | |
| 196 | L | A | 0.0000 | |
| 197 | T | A | -1.1150 | |
| 198 | I | A | 0.0000 | |
| 199 | D | A | -3.5475 | |
| 200 | G | A | -2.2794 | |
| 201 | V | A | 0.0000 | |
| 202 | T | A | -1.9877 | |
| 203 | R | A | -2.9202 | |
| 204 | S | A | -1.3964 | |
| 205 | D | A | 0.0000 | |
| 206 | Q | A | -1.9515 | |
| 207 | G | A | -0.1236 | |
| 208 | L | A | 1.1980 | |
| 209 | Y | A | 0.0000 | |
| 210 | T | A | -0.8419 | |
| 211 | C | A | 0.0000 | |
| 212 | A | A | 0.0000 | |
| 213 | A | A | 0.0000 | |
| 214 | S | A | -1.0513 | |
| 215 | S | A | -0.3474 | |
| 216 | G | A | -0.0170 | |
| 217 | L | A | 1.4232 | |
| 218 | M | A | 0.7633 | |
| 219 | T | A | -0.6647 | |
| 220 | K | A | -1.5639 | |
| 221 | K | A | -2.4388 | |
| 222 | N | A | -1.3797 | |
| 223 | S | A | -0.4074 | |
| 224 | T | A | 0.0000 | |
| 225 | F | A | 0.2780 | |
| 226 | V | A | 0.0000 | |
| 227 | R | A | -2.9352 | |
| 228 | V | A | 0.0000 | |
| 229 | H | A | -3.5936 | |
| 230 | E | A | -3.8422 | |
| 231 | K | A | -4.2320 | |
| 232 | D | A | -4.1342 | |
| 233 | K | A | -3.5373 | |
| 234 | T | A | -2.1139 | |
| 235 | H | A | -1.8005 | |
| 236 | T | A | -0.6034 | |
| 237 | C | A | 0.3458 | |
| 238 | P | A | 0.0006 | |
| 239 | P | A | 0.0924 | |
| 240 | C | A | 0.5093 | |
| 241 | P | A | -0.2375 | |
| 242 | A | A | -0.2708 | |
| 243 | P | A | -0.4477 | |
| 244 | E | A | -0.8419 | |
| 245 | L | A | 1.1649 | |
| 246 | L | A | 1.4849 | |
| 247 | G | A | 0.2633 | |
| 248 | G | A | -0.1477 | |
| 249 | P | A | 0.0000 | |
| 250 | S | A | -0.1850 | |
| 251 | V | A | 0.0000 | |
| 252 | F | A | 0.7129 | |
| 253 | L | A | 0.7350 | |
| 254 | F | A | 0.9958 | |
| 255 | P | A | -0.2163 | |
| 256 | P | A | 0.0000 | |
| 257 | K | A | -2.1556 | |
| 258 | P | A | -1.5260 | |
| 259 | K | A | -1.5172 | |
| 260 | D | A | 0.0000 | |
| 261 | T | A | 0.0000 | |
| 262 | L | A | 0.0000 | |
| 263 | M | A | 0.1150 | |
| 264 | I | A | 1.2642 | |
| 265 | S | A | -0.0830 | |
| 266 | R | A | -1.5217 | |
| 267 | T | A | -0.9708 | |
| 268 | P | A | 0.0000 | |
| 269 | E | A | -1.3047 | |
| 270 | V | A | 0.0000 | |
| 271 | T | A | 0.1083 | |
| 272 | C | A | 0.0000 | |
| 273 | V | A | 0.0000 | |
| 274 | V | A | 0.0000 | |
| 275 | V | A | -0.9866 | |
| 276 | D | A | -1.4723 | |
| 277 | V | A | 0.0000 | |
| 278 | S | A | -2.1512 | |
| 279 | H | A | -2.6931 | |
| 280 | E | A | -3.0477 | |
| 281 | D | A | -2.7630 | |
| 282 | P | A | -2.7089 | |
| 283 | E | A | -3.2439 | |
| 284 | V | A | -2.1073 | |
| 285 | K | A | -2.2483 | |
| 286 | F | A | -1.1011 | |
| 287 | N | A | -1.0658 | |
| 288 | W | A | 0.0000 | |
| 289 | Y | A | -0.5965 | |
| 290 | V | A | -0.8843 | |
| 291 | D | A | -2.1751 | |
| 292 | G | A | -0.8924 | |
| 293 | V | A | 0.5901 | |
| 294 | E | A | -0.6390 | |
| 295 | V | A | -0.5396 | |
| 296 | H | A | -1.8816 | |
| 297 | N | A | -2.1792 | |
| 298 | A | A | -1.9010 | |
| 299 | K | A | -2.3730 | |
| 300 | T | A | -1.8696 | |
| 301 | K | A | -2.2457 | |
| 302 | P | A | -2.4756 | |
| 303 | R | A | -3.8579 | |
| 304 | E | A | -3.9750 | |
| 305 | E | A | -3.6217 | |
| 306 | Q | A | -2.3372 | |
| 307 | Y | A | -1.1821 | |
| 308 | N | A | -1.1479 | |
| 309 | S | A | -1.3286 | |
| 310 | T | A | -2.0643 | |
| 311 | Y | A | 0.0000 | |
| 312 | R | A | -2.4675 | |
| 313 | V | A | 0.0000 | |
| 314 | V | A | -0.9822 | |
| 315 | S | A | 0.0000 | |
| 316 | V | A | 0.0000 | |
| 317 | L | A | 0.0000 | |
| 318 | T | A | -0.7763 | |
| 319 | V | A | 0.0000 | |
| 320 | L | A | 0.5058 | |
| 321 | H | A | -0.2718 | |
| 322 | Q | A | -1.1780 | |
| 323 | D | A | -1.4462 | |
| 324 | W | A | 0.0000 | |
| 325 | L | A | -0.9704 | |
| 326 | N | A | -2.0816 | |
| 327 | G | A | -2.1058 | |
| 328 | K | A | -2.2227 | |
| 329 | E | A | -2.2392 | |
| 330 | Y | A | 0.0000 | |
| 331 | K | A | -1.4103 | |
| 332 | C | A | 0.0000 | |
| 333 | K | A | -1.2068 | |
| 334 | V | A | 0.0000 | |
| 335 | S | A | -1.3776 | |
| 336 | N | A | 0.0000 | |
| 337 | K | A | -2.6177 | |
| 338 | A | A | -1.2148 | |
| 339 | L | A | -0.4835 | |
| 340 | P | A | -0.3159 | |
| 341 | A | A | -0.3465 | |
| 342 | P | A | -0.7017 | |
| 343 | I | A | -0.3112 | |
| 344 | E | A | -1.2865 | |
| 345 | K | A | -0.9130 | |
| 346 | T | A | -0.8826 | |
| 347 | I | A | -0.2255 | |
| 348 | S | A | -1.1996 | |
| 349 | K | A | -1.3028 | |
| 350 | A | A | -1.1724 | |
| 351 | K | A | -2.3455 | |
| 352 | G | A | -1.9682 | |
| 353 | Q | A | -2.1232 | |
| 354 | P | A | -1.7467 | |
| 355 | R | A | -2.1975 | |
| 356 | E | A | -2.8216 | |
| 357 | P | A | 0.0000 | |
| 358 | Q | A | -1.5479 | |
| 359 | V | A | -0.5094 | |
| 360 | Y | A | 0.5776 | |
| 361 | T | A | 0.3363 | |
| 362 | L | A | 0.5259 | |
| 363 | P | A | -0.2215 | |
| 364 | P | A | -0.9451 | |
| 365 | S | A | -1.7272 | |
| 366 | R | A | -2.8746 | |
| 367 | D | A | -3.1173 | |
| 368 | E | A | -2.6217 | |
| 369 | L | A | -2.2904 | |
| 370 | T | A | -2.1372 | |
| 371 | K | A | -3.0759 | |
| 372 | N | A | -2.8810 | |
| 373 | Q | A | -2.5468 | |
| 374 | V | A | 0.0000 | |
| 375 | S | A | -0.7177 | |
| 376 | L | A | 0.0000 | |
| 377 | T | A | -0.1616 | |
| 378 | C | A | 0.0000 | |
| 379 | L | A | 0.5043 | |
| 380 | V | A | 0.0000 | |
| 381 | K | A | -0.6411 | |
| 382 | G | A | -1.3539 | |
| 383 | F | A | 0.0000 | |
| 384 | Y | A | -1.0129 | |
| 385 | P | A | 0.0000 | |
| 386 | S | A | 0.0033 | |
| 387 | D | A | -1.2036 | |
| 388 | I | A | 0.0000 | |
| 389 | A | A | -0.7128 | |
| 390 | V | A | 0.0000 | |
| 391 | E | A | -1.2945 | |
| 392 | W | A | 0.0000 | |
| 393 | E | A | -2.0041 | |
| 394 | S | A | 0.0000 | |
| 395 | N | A | -1.9296 | |
| 396 | G | A | -1.8280 | |
| 397 | Q | A | -2.3392 | |
| 398 | P | A | -2.0675 | |
| 399 | E | A | -2.0535 | |
| 400 | N | A | -2.4920 | |
| 401 | N | A | -2.3100 | |
| 402 | Y | A | -2.1258 | |
| 403 | K | A | -2.4368 | |
| 404 | T | A | -1.0675 | |
| 405 | T | A | -0.3216 | |
| 406 | P | A | 0.0598 | |
| 407 | P | A | 0.6900 | |
| 408 | V | A | 1.6434 | |
| 409 | L | A | 1.3694 | |
| 410 | D | A | -0.4581 | |
| 411 | S | A | -1.0412 | |
| 412 | D | A | -1.9796 | |
| 413 | G | A | -0.7849 | |
| 414 | S | A | 0.0000 | |
| 415 | F | A | 0.4418 | |
| 416 | F | A | 0.7668 | |
| 417 | L | A | 0.0000 | |
| 418 | Y | A | 0.4199 | |
| 419 | S | A | 0.0000 | |
| 420 | K | A | -1.6869 | |
| 421 | L | A | 0.0000 | |
| 422 | T | A | -1.4923 | |
| 423 | V | A | 0.0000 | |
| 424 | D | A | -2.5345 | |
| 425 | K | A | -2.6978 | |
| 426 | S | A | -2.1595 | |
| 427 | R | A | -2.0003 | |
| 428 | W | A | 0.0000 | |
| 429 | Q | A | -2.3072 | |
| 430 | Q | A | -2.1293 | |
| 431 | G | A | -1.2504 | |
| 432 | N | A | -0.8982 | |
| 433 | V | A | -0.0569 | |
| 434 | F | A | 0.0000 | |
| 435 | S | A | -1.0788 | |
| 436 | C | A | 0.0000 | |
| 437 | S | A | 0.0000 | |
| 438 | V | A | 0.0000 | |
| 439 | M | A | 0.0000 | |
| 440 | H | A | 0.0000 | |
| 441 | E | A | -1.1487 | |
| 442 | A | A | -1.5119 | |
| 443 | L | A | -1.5074 | |
| 444 | H | A | -1.7712 | |
| 445 | N | A | -1.6974 | |
| 446 | H | A | -1.0697 | |
| 447 | Y | A | -0.5545 | |
| 448 | T | A | -1.0123 | |
| 449 | Q | A | -1.5116 | |
| 450 | K | A | -1.1866 | |
| 451 | S | A | -0.5892 | |
| 452 | L | A | 0.0000 | |
| 453 | S | A | -0.1924 | |
| 454 | L | A | -0.4085 | |
| 455 | S | A | -0.7381 | |
| 456 | P | A | -0.9459 | |
| 457 | G | A | -1.4161 | |
| 458 | K | A | -2.0250 |
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