| Chain sequence(s) |
A: LATTLERIEKNFVITDPRLPDNPIIFASDSFLQLTEYSREEILGRNCRFLQGPETDRATVRKIRDAIDNQTEVTVQLINYTKSGKKFWNLFHLQPMRDQKGDVQYFIGVQLDGTEHVRDAAEREGVMLIKKTAENIDEAAKELMLNTVKISSCELINADCLEFIRSLPENSVDLIVTDPPYFKVKPEGWDNQWKGDDDYLKWLDQCLAQFWRVLKPAGSLYLFCGHRLASDIEIMMRERFSVLNHIIWAKPSGRWNGCNKESLRAYFPATERILFAEHYQGPYRPKDAGYEAKGRALKQHVMAPLIAYFRDARAALGITAKQIADATGKKNMVPHWFSASQWQLPNESDYLKLQSLFARVAEEKHQRGELEKPHHQLVSTYSELNRKYMELLSEYKNLRRYFGVTVQVPYTDVWTYKPVQYYPGKHPCEKPAEMLQQIISASSRPGDLVADFFMGSGSTVKAAMALGRRAIGVELETGRFEQTVREVQDLIV
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 (00:13:00)
[INFO] Main: Simulation completed successfully. (00:13:06)
|
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 | L | A | 0.7572 | |
| 2 | A | A | 0.0390 | |
| 3 | T | A | -1.0921 | |
| 4 | T | A | -0.9541 | |
| 5 | L | A | 0.0000 | |
| 6 | E | A | -2.3661 | |
| 7 | R | A | -2.9075 | |
| 8 | I | A | -2.1962 | |
| 9 | E | A | -2.9276 | |
| 10 | K | A | -1.8596 | |
| 11 | N | A | -1.3246 | |
| 12 | F | A | 0.0000 | |
| 13 | V | A | 0.0000 | |
| 14 | I | A | 0.0000 | |
| 15 | T | A | 0.0000 | |
| 16 | D | A | 0.0000 | |
| 17 | P | A | -1.3585 | |
| 18 | R | A | -1.8654 | |
| 19 | L | A | -0.7619 | |
| 20 | P | A | -1.4631 | |
| 21 | D | A | -2.4023 | |
| 22 | N | A | -1.4539 | |
| 23 | P | A | 0.0000 | |
| 24 | I | A | 0.0000 | |
| 25 | I | A | 0.6832 | |
| 26 | F | A | 0.0000 | |
| 27 | A | A | 0.0000 | |
| 28 | S | A | 0.0000 | |
| 29 | D | A | -2.8950 | |
| 30 | S | A | -2.0100 | |
| 31 | F | A | 0.0000 | |
| 32 | L | A | -1.3551 | |
| 33 | Q | A | -1.7180 | |
| 34 | L | A | -1.1536 | |
| 35 | T | A | 0.0000 | |
| 36 | E | A | -1.6625 | |
| 37 | Y | A | -1.3458 | |
| 38 | S | A | -1.6468 | |
| 39 | R | A | -1.6499 | |
| 40 | E | A | -2.4157 | |
| 41 | E | A | -1.8442 | |
| 42 | I | A | 0.0000 | |
| 43 | L | A | -0.6744 | |
| 44 | G | A | -1.2178 | |
| 45 | R | A | -2.1773 | |
| 46 | N | A | -1.6874 | |
| 47 | C | A | -1.2273 | |
| 48 | R | A | -1.8343 | |
| 49 | F | A | -1.0888 | |
| 50 | L | A | 0.0000 | |
| 51 | Q | A | -1.7512 | |
| 52 | G | A | -1.5109 | |
| 53 | P | A | -1.6350 | |
| 54 | E | A | -2.4701 | |
| 55 | T | A | 0.0000 | |
| 56 | D | A | -2.8702 | |
| 57 | R | A | -3.3323 | |
| 58 | A | A | -2.3717 | |
| 59 | T | A | -2.4252 | |
| 60 | V | A | -3.0496 | |
| 61 | R | A | -4.2054 | |
| 62 | K | A | -3.9255 | |
| 63 | I | A | -3.1940 | |
| 64 | R | A | -4.2811 | |
| 65 | D | A | -4.7600 | |
| 66 | A | A | 0.0000 | |
| 67 | I | A | -2.9508 | |
| 68 | D | A | -3.6136 | |
| 69 | N | A | -3.1809 | |
| 70 | Q | A | -2.6343 | |
| 71 | T | A | -1.9578 | |
| 72 | E | A | -2.2593 | |
| 73 | V | A | -1.5115 | |
| 74 | T | A | -0.6226 | |
| 75 | V | A | 0.0000 | |
| 76 | Q | A | -0.5214 | |
| 77 | L | A | 0.0000 | |
| 78 | I | A | -1.2759 | |
| 79 | N | A | 0.0000 | |
| 80 | Y | A | -1.8389 | |
| 81 | T | A | 0.0000 | |
| 82 | K | A | -2.2683 | |
| 83 | S | A | -1.9278 | |
| 84 | G | A | -2.2968 | |
| 85 | K | A | -3.0624 | |
| 86 | K | A | -2.8668 | |
| 87 | F | A | -1.6800 | |
| 88 | W | A | -1.0841 | |
| 89 | N | A | 0.0000 | |
| 90 | L | A | 0.0000 | |
| 91 | F | A | 0.0000 | |
| 92 | H | A | 0.0000 | |
| 93 | L | A | 0.0000 | |
| 94 | Q | A | -1.5405 | |
| 95 | P | A | 0.0000 | |
| 96 | M | A | 0.0000 | |
| 97 | R | A | -3.0975 | |
| 98 | D | A | -3.0614 | |
| 99 | Q | A | -3.0358 | |
| 100 | K | A | -3.3642 | |
| 101 | G | A | -2.9472 | |
| 102 | D | A | -3.3313 | |
| 103 | V | A | 0.0000 | |
| 104 | Q | A | -1.4836 | |
| 105 | Y | A | -0.8066 | |
| 106 | F | A | 0.0000 | |
| 107 | I | A | 0.0000 | |
| 108 | G | A | 0.0000 | |
| 109 | V | A | 0.0000 | |
| 110 | Q | A | 0.0000 | |
| 111 | L | A | -0.6034 | |
| 112 | D | A | -1.9255 | |
| 113 | G | A | -1.4778 | |
| 114 | T | A | -1.5739 | |
| 115 | E | A | -2.4624 | |
| 116 | H | A | -2.0984 | |
| 117 | V | A | -2.0460 | |
| 118 | R | A | -3.3063 | |
| 119 | D | A | -3.2480 | |
| 120 | A | A | -2.3477 | |
| 121 | A | A | -2.2088 | |
| 122 | E | A | -2.9531 | |
| 123 | R | A | -3.1590 | |
| 124 | E | A | -2.4515 | |
| 125 | G | A | -1.3536 | |
| 126 | V | A | -0.8376 | |
| 127 | M | A | -0.3399 | |
| 128 | L | A | -0.3270 | |
| 129 | I | A | 0.0000 | |
| 130 | K | A | -1.6952 | |
| 131 | K | A | -2.3315 | |
| 132 | T | A | 0.0000 | |
| 133 | A | A | 0.0000 | |
| 134 | E | A | -3.5564 | |
| 135 | N | A | -2.9681 | |
| 136 | I | A | 0.0000 | |
| 137 | D | A | -3.1388 | |
| 138 | E | A | -3.6058 | |
| 139 | A | A | -2.1586 | |
| 140 | A | A | 0.0000 | |
| 141 | K | A | -2.8420 | |
| 142 | E | A | -2.3787 | |
| 143 | L | A | -0.6699 | |
| 144 | M | A | -0.3740 | |
| 145 | L | A | -0.0769 | |
| 146 | N | A | -0.4678 | |
| 147 | T | A | -0.2909 | |
| 148 | V | A | -0.6244 | |
| 149 | K | A | -1.8618 | |
| 150 | I | A | 0.0000 | |
| 151 | S | A | -0.6755 | |
| 152 | S | A | -1.2255 | |
| 153 | C | A | 0.0000 | |
| 154 | E | A | -1.4815 | |
| 155 | L | A | 0.0000 | |
| 156 | I | A | 0.0000 | |
| 157 | N | A | -0.6212 | |
| 158 | A | A | -0.7944 | |
| 159 | D | A | -1.2440 | |
| 160 | C | A | 0.0000 | |
| 161 | L | A | -1.5026 | |
| 162 | E | A | -2.4666 | |
| 163 | F | A | -1.2999 | |
| 164 | I | A | 0.0000 | |
| 165 | R | A | -2.6034 | |
| 166 | S | A | -1.5602 | |
| 167 | L | A | -1.1571 | |
| 168 | P | A | -1.6303 | |
| 169 | E | A | -2.7441 | |
| 170 | N | A | -2.2563 | |
| 171 | S | A | -1.4114 | |
| 172 | V | A | 0.0000 | |
| 173 | D | A | -0.8751 | |
| 174 | L | A | 0.0000 | |
| 175 | I | A | 0.0000 | |
| 176 | V | A | 0.0000 | |
| 177 | T | A | 0.0000 | |
| 178 | D | A | -0.1876 | |
| 179 | P | A | 0.0000 | |
| 180 | P | A | -0.1509 | |
| 181 | Y | A | -0.1901 | |
| 182 | F | A | 0.0000 | |
| 183 | K | A | -1.4341 | |
| 184 | V | A | 0.4634 | |
| 185 | K | A | -0.4103 | |
| 186 | P | A | -0.8495 | |
| 187 | E | A | -1.2575 | |
| 188 | G | A | -1.3956 | |
| 189 | W | A | -0.9168 | |
| 190 | D | A | 0.0000 | |
| 191 | N | A | -1.8581 | |
| 192 | Q | A | -2.2270 | |
| 193 | W | A | 0.0000 | |
| 194 | K | A | -2.7311 | |
| 195 | G | A | -2.4594 | |
| 196 | D | A | -2.7335 | |
| 197 | D | A | -3.4198 | |
| 198 | D | A | -3.2041 | |
| 199 | Y | A | 0.0000 | |
| 200 | L | A | 0.0000 | |
| 201 | K | A | -2.8456 | |
| 202 | W | A | -1.5735 | |
| 203 | L | A | 0.0000 | |
| 204 | D | A | -1.7284 | |
| 205 | Q | A | -1.2332 | |
| 206 | C | A | 0.0000 | |
| 207 | L | A | 0.0000 | |
| 208 | A | A | -0.5823 | |
| 209 | Q | A | -0.8984 | |
| 210 | F | A | 0.0000 | |
| 211 | W | A | -0.2723 | |
| 212 | R | A | -1.4013 | |
| 213 | V | A | 0.0000 | |
| 214 | L | A | 0.0000 | |
| 215 | K | A | -1.7574 | |
| 216 | P | A | -1.0481 | |
| 217 | A | A | -0.9738 | |
| 218 | G | A | 0.0000 | |
| 219 | S | A | 0.0000 | |
| 220 | L | A | 0.0000 | |
| 221 | Y | A | 0.0000 | |
| 222 | L | A | 0.0000 | |
| 223 | F | A | 0.0000 | |
| 224 | C | A | 0.0000 | |
| 225 | G | A | -0.6729 | |
| 226 | H | A | -1.4945 | |
| 227 | R | A | -1.8543 | |
| 228 | L | A | 0.0000 | |
| 229 | A | A | 0.0000 | |
| 230 | S | A | -0.8576 | |
| 231 | D | A | -1.3113 | |
| 232 | I | A | 0.0000 | |
| 233 | E | A | -0.3186 | |
| 234 | I | A | 0.6889 | |
| 235 | M | A | -0.5965 | |
| 236 | M | A | 0.0000 | |
| 237 | R | A | -1.1672 | |
| 238 | E | A | -2.0284 | |
| 239 | R | A | -1.3679 | |
| 240 | F | A | 0.0000 | |
| 241 | S | A | 0.0000 | |
| 242 | V | A | 0.0000 | |
| 243 | L | A | 0.1397 | |
| 244 | N | A | -0.6148 | |
| 245 | H | A | -0.4959 | |
| 246 | I | A | 0.0000 | |
| 247 | I | A | 0.4769 | |
| 248 | W | A | 0.0000 | |
| 249 | A | A | 0.0003 | |
| 250 | K | A | -0.8274 | |
| 251 | P | A | -0.9699 | |
| 252 | S | A | -1.3549 | |
| 253 | G | A | -1.7930 | |
| 254 | R | A | -2.3724 | |
| 255 | W | A | -1.7324 | |
| 256 | N | A | -2.3970 | |
| 257 | G | A | -2.0529 | |
| 258 | C | A | -2.0556 | |
| 259 | N | A | -2.6387 | |
| 260 | K | A | -3.0167 | |
| 261 | E | A | -3.0814 | |
| 262 | S | A | -2.0807 | |
| 263 | L | A | -1.3731 | |
| 264 | R | A | -1.7615 | |
| 265 | A | A | -0.0205 | |
| 266 | Y | A | 1.0134 | |
| 267 | F | A | 0.1923 | |
| 268 | P | A | -0.2499 | |
| 269 | A | A | -0.4644 | |
| 270 | T | A | -0.1187 | |
| 271 | E | A | 0.0000 | |
| 272 | R | A | -0.5219 | |
| 273 | I | A | 0.0000 | |
| 274 | L | A | 0.0000 | |
| 275 | F | A | 0.0000 | |
| 276 | A | A | 0.0000 | |
| 277 | E | A | -0.3145 | |
| 278 | H | A | -0.5540 | |
| 279 | Y | A | -0.3148 | |
| 280 | Q | A | -1.0868 | |
| 281 | G | A | -0.5952 | |
| 282 | P | A | -0.2964 | |
| 283 | Y | A | -0.1221 | |
| 284 | R | A | -2.3059 | |
| 285 | P | A | -2.1462 | |
| 286 | K | A | -2.9354 | |
| 287 | D | A | -3.0929 | |
| 288 | A | A | -1.7501 | |
| 289 | G | A | -1.9774 | |
| 290 | Y | A | -1.9873 | |
| 291 | E | A | -2.6306 | |
| 292 | A | A | -2.4048 | |
| 293 | K | A | -2.9154 | |
| 294 | G | A | -2.5753 | |
| 295 | R | A | -3.5428 | |
| 296 | A | A | -2.4061 | |
| 297 | L | A | 0.0000 | |
| 298 | K | A | -2.2712 | |
| 299 | Q | A | -2.1913 | |
| 300 | H | A | -1.7603 | |
| 301 | V | A | 0.0000 | |
| 302 | M | A | 0.0000 | |
| 303 | A | A | -0.6106 | |
| 304 | P | A | -0.2859 | |
| 305 | L | A | 0.0000 | |
| 306 | I | A | 0.0000 | |
| 307 | A | A | -0.8946 | |
| 308 | Y | A | -0.9649 | |
| 309 | F | A | 0.0000 | |
| 310 | R | A | -2.1152 | |
| 311 | D | A | -2.1784 | |
| 312 | A | A | 0.0000 | |
| 313 | R | A | -1.5486 | |
| 314 | A | A | -1.1096 | |
| 315 | A | A | -1.2918 | |
| 316 | L | A | 0.0000 | |
| 317 | G | A | -0.6835 | |
| 318 | I | A | 0.0000 | |
| 319 | T | A | -0.9407 | |
| 320 | A | A | -1.7605 | |
| 321 | K | A | -2.8713 | |
| 322 | Q | A | -2.1434 | |
| 323 | I | A | 0.0000 | |
| 324 | A | A | -2.9014 | |
| 325 | D | A | -2.9821 | |
| 326 | A | A | -1.9330 | |
| 327 | T | A | 0.0000 | |
| 328 | G | A | -2.2766 | |
| 329 | K | A | -2.5792 | |
| 330 | K | A | -3.4172 | |
| 331 | N | A | -2.3366 | |
| 332 | M | A | -1.5769 | |
| 333 | V | A | 0.0000 | |
| 334 | P | A | -1.1056 | |
| 335 | H | A | -1.1348 | |
| 336 | W | A | 0.0000 | |
| 337 | F | A | 0.0000 | |
| 338 | S | A | -0.9739 | |
| 339 | A | A | -1.3083 | |
| 340 | S | A | -1.4219 | |
| 341 | Q | A | -1.8305 | |
| 342 | W | A | -1.1997 | |
| 343 | Q | A | -1.2231 | |
| 344 | L | A | -0.4410 | |
| 345 | P | A | 0.0000 | |
| 346 | N | A | -1.5538 | |
| 347 | E | A | -2.1508 | |
| 348 | S | A | -1.1400 | |
| 349 | D | A | 0.0000 | |
| 350 | Y | A | 0.0000 | |
| 351 | L | A | 0.1968 | |
| 352 | K | A | -0.8385 | |
| 353 | L | A | 0.0000 | |
| 354 | Q | A | -0.9950 | |
| 355 | S | A | -0.5916 | |
| 356 | L | A | -0.9189 | |
| 357 | F | A | 0.0000 | |
| 358 | A | A | -2.8279 | |
| 359 | R | A | -3.3219 | |
| 360 | V | A | 0.0000 | |
| 361 | A | A | 0.0000 | |
| 362 | E | A | -4.7388 | |
| 363 | E | A | -4.2338 | |
| 364 | K | A | -4.0438 | |
| 365 | H | A | -3.9206 | |
| 366 | Q | A | -4.0966 | |
| 367 | R | A | -3.7158 | |
| 368 | G | A | -3.1860 | |
| 369 | E | A | -2.9028 | |
| 370 | L | A | 0.0000 | |
| 371 | E | A | -2.9730 | |
| 372 | K | A | -2.3619 | |
| 373 | P | A | -1.4978 | |
| 374 | H | A | -1.5124 | |
| 375 | H | A | -1.4931 | |
| 376 | Q | A | -1.1535 | |
| 377 | L | A | 0.0000 | |
| 378 | V | A | -0.1543 | |
| 379 | S | A | -0.6099 | |
| 380 | T | A | -0.7867 | |
| 381 | Y | A | -0.5863 | |
| 382 | S | A | -1.3473 | |
| 383 | E | A | -2.5555 | |
| 384 | L | A | -1.8219 | |
| 385 | N | A | -2.1377 | |
| 386 | R | A | -3.1753 | |
| 387 | K | A | -2.8070 | |
| 388 | Y | A | 0.0000 | |
| 389 | M | A | -1.2719 | |
| 390 | E | A | -2.7058 | |
| 391 | L | A | -1.8177 | |
| 392 | L | A | -1.5166 | |
| 393 | S | A | -1.8661 | |
| 394 | E | A | -2.5634 | |
| 395 | Y | A | -1.5610 | |
| 396 | K | A | -2.5887 | |
| 397 | N | A | -2.2573 | |
| 398 | L | A | -0.7074 | |
| 399 | R | A | -1.6098 | |
| 400 | R | A | -0.8613 | |
| 401 | Y | A | 0.1697 | |
| 402 | F | A | 1.3863 | |
| 403 | G | A | 1.0577 | |
| 404 | V | A | 1.6087 | |
| 405 | T | A | 1.1712 | |
| 406 | V | A | 1.7444 | |
| 407 | Q | A | 0.1518 | |
| 408 | V | A | 0.6921 | |
| 409 | P | A | 1.0323 | |
| 410 | Y | A | 1.7094 | |
| 411 | T | A | 0.5882 | |
| 412 | D | A | -0.2084 | |
| 413 | V | A | 1.0557 | |
| 414 | W | A | 0.0000 | |
| 415 | T | A | -0.1773 | |
| 416 | Y | A | -0.8691 | |
| 417 | K | A | -1.9168 | |
| 418 | P | A | -0.8844 | |
| 419 | V | A | -0.3099 | |
| 420 | Q | A | -0.5757 | |
| 421 | Y | A | 0.8126 | |
| 422 | Y | A | 0.5710 | |
| 423 | P | A | -0.0319 | |
| 424 | G | A | -0.4651 | |
| 425 | K | A | -0.3818 | |
| 426 | H | A | -0.2796 | |
| 427 | P | A | -0.2150 | |
| 428 | C | A | -0.1493 | |
| 429 | E | A | -0.2992 | |
| 430 | K | A | 0.0000 | |
| 431 | P | A | 0.0000 | |
| 432 | A | A | -0.9469 | |
| 433 | E | A | -2.0159 | |
| 434 | M | A | 0.0000 | |
| 435 | L | A | 0.0000 | |
| 436 | Q | A | -0.9460 | |
| 437 | Q | A | 0.0000 | |
| 438 | I | A | 0.0000 | |
| 439 | I | A | 0.0000 | |
| 440 | S | A | 0.1054 | |
| 441 | A | A | 0.0000 | |
| 442 | S | A | 0.0000 | |
| 443 | S | A | 0.0000 | |
| 444 | R | A | -0.6439 | |
| 445 | P | A | -0.9086 | |
| 446 | G | A | -1.0255 | |
| 447 | D | A | 0.0000 | |
| 448 | L | A | -0.6849 | |
| 449 | V | A | 0.0000 | |
| 450 | A | A | 0.0000 | |
| 451 | D | A | 0.0000 | |
| 452 | F | A | 0.0000 | |
| 453 | F | A | 0.1280 | |
| 454 | M | A | 0.0000 | |
| 455 | G | A | 0.0000 | |
| 456 | S | A | 0.0000 | |
| 457 | G | A | 0.0000 | |
| 458 | S | A | -0.4519 | |
| 459 | T | A | 0.0000 | |
| 460 | V | A | 0.0000 | |
| 461 | K | A | -0.0868 | |
| 462 | A | A | 0.0000 | |
| 463 | A | A | 0.0000 | |
| 464 | M | A | -0.0764 | |
| 465 | A | A | 0.0697 | |
| 466 | L | A | -0.2411 | |
| 467 | G | A | -0.7622 | |
| 468 | R | A | 0.0000 | |
| 469 | R | A | -1.6100 | |
| 470 | A | A | 0.0000 | |
| 471 | I | A | 0.0000 | |
| 472 | G | A | 0.0000 | |
| 473 | V | A | 0.0000 | |
| 474 | E | A | -0.7062 | |
| 475 | L | A | -0.2977 | |
| 476 | E | A | -1.7964 | |
| 477 | T | A | -1.5142 | |
| 478 | G | A | -1.6487 | |
| 479 | R | A | -1.6384 | |
| 480 | F | A | 0.0000 | |
| 481 | E | A | -2.8146 | |
| 482 | Q | A | -2.0199 | |
| 483 | T | A | 0.0000 | |
| 484 | V | A | 0.0000 | |
| 485 | R | A | -3.0547 | |
| 486 | E | A | -1.8981 | |
| 487 | V | A | 0.0000 | |
| 488 | Q | A | -1.0746 | |
| 489 | D | A | -0.8571 | |
| 490 | L | A | 1.4732 | |
| 491 | I | A | 2.7241 | |
| 492 | V | A | 2.4432 |
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