| Chain sequence(s) |
A: MNLDIHCEQLSDARWTELLPLLQQYEVVRLDDCGLTEEHCKDIGSALRANPSLTELCLRTNELGDAGVHLVLQGLQSPTCKIQKLSLQNCSLTEAGCGVLPSTLRSLPTLRELHLSDNPLGDAGLRLLCEGLLDPQCHLEKLQLEYCRLTAASCEPLASVLRATRALKELTVSNNDIGEAGARVLGQGLADSACQLETLRLENCGLTPANCKDLCGIVASQASLRELDLGSNGLGDAGIAELCPGLLSPASRLKTLWLWECDITASGCRDLCRVLQAKETLKELSLAGNKLGDEGARLLCESLLQPGCQLESLWVKSCSLTAACCQHVSLMLTQNKHLLELQLSSNKLGDSGIQELCQALSQPGTTLRVLCLGDCEVTNSGCSSLASLLLANRSLRELDLSNNCVGDPGVLQLLGSLEQPGCALEQLVLYDTYWTEEVEDRLQALEGSKPGLRVIS
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 (00:05:17)
[INFO] Main: Simulation completed successfully. (00:05:19)
|
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 | 0.2536 | |
| 2 | N | A | -0.8443 | |
| 3 | L | A | -0.4369 | |
| 4 | D | A | -0.8837 | |
| 5 | I | A | -1.1472 | |
| 6 | H | A | -1.6953 | |
| 7 | C | A | -1.1104 | |
| 8 | E | A | -2.2061 | |
| 9 | Q | A | -2.3648 | |
| 10 | L | A | -1.5105 | |
| 11 | S | A | -1.6823 | |
| 12 | D | A | -2.3949 | |
| 13 | A | A | -1.5853 | |
| 14 | R | A | -2.0196 | |
| 15 | W | A | 0.0000 | |
| 16 | T | A | -1.5665 | |
| 17 | E | A | -2.2202 | |
| 18 | L | A | 0.0000 | |
| 19 | L | A | -0.6520 | |
| 20 | P | A | -0.5809 | |
| 21 | L | A | -0.2571 | |
| 22 | L | A | 0.0000 | |
| 23 | Q | A | -1.2402 | |
| 24 | Q | A | -1.0898 | |
| 25 | Y | A | -0.5669 | |
| 26 | E | A | -0.9377 | |
| 27 | V | A | -0.6948 | |
| 28 | V | A | 0.0000 | |
| 29 | R | A | -1.2811 | |
| 30 | L | A | 0.0000 | |
| 31 | D | A | -1.8073 | |
| 32 | D | A | -2.3174 | |
| 33 | C | A | 0.0000 | |
| 34 | G | A | -1.5564 | |
| 35 | L | A | 0.0000 | |
| 36 | T | A | -1.9761 | |
| 37 | E | A | -2.6689 | |
| 38 | E | A | -2.8647 | |
| 39 | H | A | -2.2537 | |
| 40 | C | A | 0.0000 | |
| 41 | K | A | -2.8580 | |
| 42 | D | A | -1.8874 | |
| 43 | I | A | 0.0000 | |
| 44 | G | A | -1.6776 | |
| 45 | S | A | -1.4924 | |
| 46 | A | A | 0.0000 | |
| 47 | L | A | 0.0000 | |
| 48 | R | A | -2.2944 | |
| 49 | A | A | -1.3119 | |
| 50 | N | A | 0.0000 | |
| 51 | P | A | -1.1006 | |
| 52 | S | A | -1.0334 | |
| 53 | L | A | 0.0000 | |
| 54 | T | A | -0.8024 | |
| 55 | E | A | 0.0000 | |
| 56 | L | A | 0.0000 | |
| 57 | C | A | 0.0000 | |
| 58 | L | A | 0.0000 | |
| 59 | R | A | -2.3917 | |
| 60 | T | A | -1.9353 | |
| 61 | N | A | 0.0000 | |
| 62 | E | A | -2.5349 | |
| 63 | L | A | 0.0000 | |
| 64 | G | A | -1.2345 | |
| 65 | D | A | -1.2064 | |
| 66 | A | A | -0.7696 | |
| 67 | G | A | 0.0000 | |
| 68 | V | A | 0.0000 | |
| 69 | H | A | -1.2974 | |
| 70 | L | A | -1.2365 | |
| 71 | V | A | 0.0000 | |
| 72 | L | A | 0.0000 | |
| 73 | Q | A | -1.8979 | |
| 74 | G | A | 0.0000 | |
| 75 | L | A | 0.0000 | |
| 76 | Q | A | -1.3273 | |
| 77 | S | A | -1.2226 | |
| 78 | P | A | -0.7784 | |
| 79 | T | A | -0.8286 | |
| 80 | C | A | -1.0021 | |
| 81 | K | A | -1.2781 | |
| 82 | I | A | 0.0000 | |
| 83 | Q | A | -1.2504 | |
| 84 | K | A | -1.1422 | |
| 85 | L | A | 0.0000 | |
| 86 | S | A | 0.0000 | |
| 87 | L | A | 0.0000 | |
| 88 | Q | A | -1.3414 | |
| 89 | N | A | -1.6808 | |
| 90 | C | A | 0.0000 | |
| 91 | S | A | -1.2517 | |
| 92 | L | A | 0.0000 | |
| 93 | T | A | -0.8599 | |
| 94 | E | A | -1.5685 | |
| 95 | A | A | -0.7518 | |
| 96 | G | A | 0.0000 | |
| 97 | C | A | 0.0000 | |
| 98 | G | A | -0.9394 | |
| 99 | V | A | -0.4458 | |
| 100 | L | A | 0.0000 | |
| 101 | P | A | -0.5323 | |
| 102 | S | A | -0.7495 | |
| 103 | T | A | 0.0000 | |
| 104 | L | A | 0.0000 | |
| 105 | R | A | -1.1875 | |
| 106 | S | A | -0.8550 | |
| 107 | L | A | 0.0000 | |
| 108 | P | A | -1.0147 | |
| 109 | T | A | -0.9795 | |
| 110 | L | A | 0.0000 | |
| 111 | R | A | -1.4641 | |
| 112 | E | A | -1.5521 | |
| 113 | L | A | 0.0000 | |
| 114 | H | A | -0.9221 | |
| 115 | L | A | 0.0000 | |
| 116 | S | A | 0.0000 | |
| 117 | D | A | -1.2148 | |
| 118 | N | A | 0.0000 | |
| 119 | P | A | -1.0647 | |
| 120 | L | A | 0.0000 | |
| 121 | G | A | -1.3204 | |
| 122 | D | A | -1.2685 | |
| 123 | A | A | -1.1162 | |
| 124 | G | A | 0.0000 | |
| 125 | L | A | 0.0000 | |
| 126 | R | A | -2.1942 | |
| 127 | L | A | -0.9948 | |
| 128 | L | A | 0.0000 | |
| 129 | C | A | 0.0000 | |
| 130 | E | A | -1.7874 | |
| 131 | G | A | 0.0000 | |
| 132 | L | A | 0.0000 | |
| 133 | L | A | -0.1996 | |
| 134 | D | A | -0.8335 | |
| 135 | P | A | -1.0556 | |
| 136 | Q | A | -1.4716 | |
| 137 | C | A | -1.0219 | |
| 138 | H | A | -1.4784 | |
| 139 | L | A | 0.0000 | |
| 140 | E | A | -1.7699 | |
| 141 | K | A | -1.7620 | |
| 142 | L | A | 0.0000 | |
| 143 | Q | A | -0.6919 | |
| 144 | L | A | 0.0000 | |
| 145 | E | A | -0.5403 | |
| 146 | Y | A | -0.1898 | |
| 147 | C | A | 0.0000 | |
| 148 | R | A | -2.1057 | |
| 149 | L | A | 0.0000 | |
| 150 | T | A | -1.1787 | |
| 151 | A | A | -0.8309 | |
| 152 | A | A | -0.6223 | |
| 153 | S | A | 0.0000 | |
| 154 | C | A | 0.0000 | |
| 155 | E | A | -1.9894 | |
| 156 | P | A | 0.0000 | |
| 157 | L | A | 0.0000 | |
| 158 | A | A | 0.0000 | |
| 159 | S | A | -1.1925 | |
| 160 | V | A | 0.0000 | |
| 161 | L | A | 0.0000 | |
| 162 | R | A | -2.6750 | |
| 163 | A | A | -1.3955 | |
| 164 | T | A | -1.5486 | |
| 165 | R | A | -2.5999 | |
| 166 | A | A | -1.7015 | |
| 167 | L | A | 0.0000 | |
| 168 | K | A | -1.8592 | |
| 169 | E | A | -1.6597 | |
| 170 | L | A | 0.0000 | |
| 171 | T | A | 0.0000 | |
| 172 | V | A | 0.0000 | |
| 173 | S | A | 0.0000 | |
| 174 | N | A | -1.1158 | |
| 175 | N | A | 0.0000 | |
| 176 | D | A | -2.4687 | |
| 177 | I | A | 0.0000 | |
| 178 | G | A | -1.4153 | |
| 179 | E | A | -1.3929 | |
| 180 | A | A | -0.5219 | |
| 181 | G | A | 0.0000 | |
| 182 | A | A | 0.0000 | |
| 183 | R | A | -1.2087 | |
| 184 | V | A | -0.4762 | |
| 185 | L | A | 0.0000 | |
| 186 | G | A | 0.0000 | |
| 187 | Q | A | -1.6203 | |
| 188 | G | A | 0.0000 | |
| 189 | L | A | 0.0000 | |
| 190 | A | A | -1.4084 | |
| 191 | D | A | -2.2383 | |
| 192 | S | A | -2.2565 | |
| 193 | A | A | -1.6725 | |
| 194 | C | A | 0.0000 | |
| 195 | Q | A | -1.9349 | |
| 196 | L | A | 0.0000 | |
| 197 | E | A | -1.8525 | |
| 198 | T | A | -1.4672 | |
| 199 | L | A | 0.0000 | |
| 200 | R | A | -1.1198 | |
| 201 | L | A | 0.0000 | |
| 202 | E | A | -1.2003 | |
| 203 | N | A | -1.7843 | |
| 204 | C | A | 0.0000 | |
| 205 | G | A | -1.5453 | |
| 206 | L | A | 0.0000 | |
| 207 | T | A | -0.7493 | |
| 208 | P | A | -0.8639 | |
| 209 | A | A | -0.9998 | |
| 210 | N | A | 0.0000 | |
| 211 | C | A | 0.0000 | |
| 212 | K | A | -2.1255 | |
| 213 | D | A | -1.4179 | |
| 214 | L | A | 0.0000 | |
| 215 | C | A | -0.8875 | |
| 216 | G | A | -0.9278 | |
| 217 | I | A | -0.6346 | |
| 218 | V | A | 0.0000 | |
| 219 | A | A | -0.3767 | |
| 220 | S | A | -0.4534 | |
| 221 | Q | A | -0.8308 | |
| 222 | A | A | -0.8946 | |
| 223 | S | A | -1.2830 | |
| 224 | L | A | 0.0000 | |
| 225 | R | A | -1.8858 | |
| 226 | E | A | -1.8152 | |
| 227 | L | A | 0.0000 | |
| 228 | D | A | 0.0000 | |
| 229 | L | A | 0.0000 | |
| 230 | G | A | 0.0000 | |
| 231 | S | A | -1.3762 | |
| 232 | N | A | 0.0000 | |
| 233 | G | A | -1.5436 | |
| 234 | L | A | 0.0000 | |
| 235 | G | A | -1.2984 | |
| 236 | D | A | -1.2798 | |
| 237 | A | A | -0.6597 | |
| 238 | G | A | 0.0000 | |
| 239 | I | A | 0.0000 | |
| 240 | A | A | -1.0685 | |
| 241 | E | A | -1.4124 | |
| 242 | L | A | 0.0000 | |
| 243 | C | A | 0.0000 | |
| 244 | P | A | -0.6265 | |
| 245 | G | A | 0.0000 | |
| 246 | L | A | 0.0000 | |
| 247 | L | A | -0.3555 | |
| 248 | S | A | -0.3367 | |
| 249 | P | A | -0.4576 | |
| 250 | A | A | -0.4959 | |
| 251 | S | A | 0.0000 | |
| 252 | R | A | -2.1773 | |
| 253 | L | A | 0.0000 | |
| 254 | K | A | -2.2064 | |
| 255 | T | A | -1.3713 | |
| 256 | L | A | 0.0000 | |
| 257 | W | A | -0.2276 | |
| 258 | L | A | 0.0000 | |
| 259 | W | A | -0.7029 | |
| 260 | E | A | -2.3089 | |
| 261 | C | A | 0.0000 | |
| 262 | D | A | -2.7973 | |
| 263 | I | A | 0.0000 | |
| 264 | T | A | -1.5966 | |
| 265 | A | A | -1.5930 | |
| 266 | S | A | -1.0874 | |
| 267 | G | A | 0.0000 | |
| 268 | C | A | 0.0000 | |
| 269 | R | A | -2.7695 | |
| 270 | D | A | -2.3348 | |
| 271 | L | A | 0.0000 | |
| 272 | C | A | 0.0000 | |
| 273 | R | A | -2.6610 | |
| 274 | V | A | 0.0000 | |
| 275 | L | A | 0.0000 | |
| 276 | Q | A | -2.0670 | |
| 277 | A | A | -1.4849 | |
| 278 | K | A | -2.0189 | |
| 279 | E | A | -2.6552 | |
| 280 | T | A | -2.0747 | |
| 281 | L | A | 0.0000 | |
| 282 | K | A | -2.1162 | |
| 283 | E | A | -1.4646 | |
| 284 | L | A | 0.0000 | |
| 285 | S | A | 0.0000 | |
| 286 | L | A | 0.0000 | |
| 287 | A | A | -0.7106 | |
| 288 | G | A | -1.5570 | |
| 289 | N | A | 0.0000 | |
| 290 | K | A | -2.5133 | |
| 291 | L | A | 0.0000 | |
| 292 | G | A | -1.5625 | |
| 293 | D | A | -1.8607 | |
| 294 | E | A | -2.3681 | |
| 295 | G | A | 0.0000 | |
| 296 | A | A | 0.0000 | |
| 297 | R | A | -2.3133 | |
| 298 | L | A | -1.9251 | |
| 299 | L | A | 0.0000 | |
| 300 | C | A | 0.0000 | |
| 301 | E | A | -1.9699 | |
| 302 | S | A | 0.0000 | |
| 303 | L | A | 0.0000 | |
| 304 | L | A | -0.8454 | |
| 305 | Q | A | -1.2658 | |
| 306 | P | A | -1.2689 | |
| 307 | G | A | -1.3869 | |
| 308 | C | A | 0.0000 | |
| 309 | Q | A | -2.0975 | |
| 310 | L | A | 0.0000 | |
| 311 | E | A | -1.6279 | |
| 312 | S | A | 0.0000 | |
| 313 | L | A | 0.0000 | |
| 314 | W | A | 0.1676 | |
| 315 | V | A | 0.0000 | |
| 316 | K | A | -0.9111 | |
| 317 | S | A | -1.3190 | |
| 318 | C | A | 0.0000 | |
| 319 | S | A | -1.2012 | |
| 320 | L | A | 0.0000 | |
| 321 | T | A | -0.7470 | |
| 322 | A | A | -1.0094 | |
| 323 | A | A | -0.8771 | |
| 324 | C | A | 0.0000 | |
| 325 | C | A | 0.0000 | |
| 326 | Q | A | -1.5227 | |
| 327 | H | A | -1.1823 | |
| 328 | V | A | 0.0000 | |
| 329 | S | A | 0.0000 | |
| 330 | L | A | 0.1490 | |
| 331 | M | A | 0.0000 | |
| 332 | L | A | 0.0000 | |
| 333 | T | A | -0.8645 | |
| 334 | Q | A | -1.4713 | |
| 335 | N | A | 0.0000 | |
| 336 | K | A | -2.3131 | |
| 337 | H | A | -1.9275 | |
| 338 | L | A | 0.0000 | |
| 339 | L | A | -0.8630 | |
| 340 | E | A | -0.9580 | |
| 341 | L | A | 0.0000 | |
| 342 | Q | A | 0.0000 | |
| 343 | L | A | 0.0000 | |
| 344 | S | A | 0.0000 | |
| 345 | S | A | -1.6158 | |
| 346 | N | A | 0.0000 | |
| 347 | K | A | -2.5011 | |
| 348 | L | A | 0.0000 | |
| 349 | G | A | -1.7321 | |
| 350 | D | A | -1.6332 | |
| 351 | S | A | -0.9876 | |
| 352 | G | A | 0.0000 | |
| 353 | I | A | 0.0000 | |
| 354 | Q | A | -1.9168 | |
| 355 | E | A | -2.3447 | |
| 356 | L | A | 0.0000 | |
| 357 | C | A | 0.0000 | |
| 358 | Q | A | -2.0050 | |
| 359 | A | A | 0.0000 | |
| 360 | L | A | 0.0000 | |
| 361 | S | A | -1.1702 | |
| 362 | Q | A | -1.4061 | |
| 363 | P | A | -1.1711 | |
| 364 | G | A | -1.3846 | |
| 365 | T | A | 0.0000 | |
| 366 | T | A | -1.4013 | |
| 367 | L | A | 0.0000 | |
| 368 | R | A | -1.4265 | |
| 369 | V | A | -0.7978 | |
| 370 | L | A | 0.0000 | |
| 371 | C | A | -0.3441 | |
| 372 | L | A | 0.0000 | |
| 373 | G | A | 0.0000 | |
| 374 | D | A | -2.6245 | |
| 375 | C | A | 0.0000 | |
| 376 | E | A | -2.7600 | |
| 377 | V | A | 0.0000 | |
| 378 | T | A | -0.6599 | |
| 379 | N | A | -0.8344 | |
| 380 | S | A | -0.6703 | |
| 381 | G | A | 0.0000 | |
| 382 | C | A | 0.0000 | |
| 383 | S | A | -0.6179 | |
| 384 | S | A | -0.9545 | |
| 385 | L | A | 0.0000 | |
| 386 | A | A | 0.0319 | |
| 387 | S | A | 0.0335 | |
| 388 | L | A | 0.0000 | |
| 389 | L | A | 0.0000 | |
| 390 | L | A | 0.8837 | |
| 391 | A | A | -0.1205 | |
| 392 | N | A | -1.0729 | |
| 393 | R | A | -2.0869 | |
| 394 | S | A | -1.4262 | |
| 395 | L | A | 0.0000 | |
| 396 | R | A | -1.7948 | |
| 397 | E | A | -1.7279 | |
| 398 | L | A | 0.0000 | |
| 399 | D | A | -0.3376 | |
| 400 | L | A | 0.0000 | |
| 401 | S | A | -0.8101 | |
| 402 | N | A | -1.7782 | |
| 403 | N | A | -1.4802 | |
| 404 | C | A | -0.5127 | |
| 405 | V | A | -0.2323 | |
| 406 | G | A | 0.1767 | |
| 407 | D | A | -0.7473 | |
| 408 | P | A | -0.5695 | |
| 409 | G | A | 0.0000 | |
| 410 | V | A | 0.0000 | |
| 411 | L | A | -0.5522 | |
| 412 | Q | A | -0.6866 | |
| 413 | L | A | 0.0000 | |
| 414 | L | A | 0.0000 | |
| 415 | G | A | -0.9499 | |
| 416 | S | A | 0.0000 | |
| 417 | L | A | 0.0000 | |
| 418 | E | A | -2.6707 | |
| 419 | Q | A | -1.7195 | |
| 420 | P | A | -1.1364 | |
| 421 | G | A | -0.9993 | |
| 422 | C | A | 0.0000 | |
| 423 | A | A | -1.1201 | |
| 424 | L | A | 0.0000 | |
| 425 | E | A | -2.5095 | |
| 426 | Q | A | -1.8282 | |
| 427 | L | A | 0.0000 | |
| 428 | V | A | 0.0000 | |
| 429 | L | A | 0.0000 | |
| 430 | Y | A | 0.2009 | |
| 431 | D | A | -1.3694 | |
| 432 | T | A | 0.0000 | |
| 433 | Y | A | 0.6869 | |
| 434 | W | A | -0.1771 | |
| 435 | T | A | -1.6537 | |
| 436 | E | A | -3.4938 | |
| 437 | E | A | -3.9757 | |
| 438 | V | A | 0.0000 | |
| 439 | E | A | -3.3735 | |
| 440 | D | A | -4.4159 | |
| 441 | R | A | -4.0708 | |
| 442 | L | A | -3.2113 | |
| 443 | Q | A | -3.1383 | |
| 444 | A | A | -2.6812 | |
| 445 | L | A | 0.0000 | |
| 446 | E | A | -3.5257 | |
| 447 | G | A | -2.1055 | |
| 448 | S | A | -1.6775 | |
| 449 | K | A | -2.2154 | |
| 450 | P | A | -1.8983 | |
| 451 | G | A | -1.8428 | |
| 452 | L | A | 0.0000 | |
| 453 | R | A | -2.7685 | |
| 454 | V | A | -1.1316 | |
| 455 | I | A | 0.1559 | |
| 456 | S | A | 0.1638 |
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