| Chain sequence(s) |
A: GLLPLNPEPELIDTDEYVTPTDLLYVAETDLITEEGHPFRDIVVDGKVLLPRVSAYQWRVFLLTLPDPNTMPLPSEDFLDPSTERLIWRLLALKIHIGGPLGTGTVGHPNFNRFGDVTNPTSYQHEGADDTVAYSFTPIYKQSYIVGDEPPTGVYTDKAEPKPGLPPGAVPPTTKVTTIIQHGDMADIGFGAKNYKELEPEKNNVPDIIVDTVTKVPDIEGMKAEPTGRRMFTYNEKTKSSNKDTYRRCGPEKNPLPSGPPPSPLYTKPPPSSPYWTLPSTDIFTVPDQGEITEEDLLFNKPIFFDKAPGKNNFILWNNRLYITILDNSRAEIETIETQLSTPAINVYDPSNYVTSRRYRREYRIELIVQLCRIPLTPEVLALLERLDRSILVNWNLPDIPKVEREDKYKGLKFHNIDLTNKLSTDLESTELGRYYLNR
input PDB |
| Selected Chain(s) | A |
| Distance of aggregation | 10 Å |
| FoldX usage | No |
| 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] runJob: FoldX not utilized. Treating input pdb file as it was already optimized. (00:00:00)
[INFO] Analysis: Starting Aggrescan3D on folded.pdb (00:00:01)
[INFO] Main: Simulation completed successfully. (00:00:04)
|
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 | G | A | 0.6620 | |
| 2 | L | A | 2.2224 | |
| 3 | L | A | 2.2414 | |
| 4 | P | A | 1.1780 | |
| 5 | L | A | 1.1337 | |
| 6 | N | A | -1.0099 | |
| 7 | P | A | -1.7426 | |
| 8 | E | A | -2.6847 | |
| 9 | P | A | -2.3760 | |
| 10 | E | A | -2.2648 | |
| 11 | L | A | -0.9164 | |
| 12 | I | A | -0.5995 | |
| 13 | D | A | -1.6429 | |
| 14 | T | A | 0.0000 | |
| 15 | D | A | -2.5245 | |
| 16 | E | A | -2.5200 | |
| 17 | Y | A | 0.0000 | |
| 18 | V | A | 0.0000 | |
| 19 | T | A | -0.9012 | |
| 20 | P | A | -0.8899 | |
| 21 | T | A | 0.0000 | |
| 22 | D | A | -1.6279 | |
| 23 | L | A | -0.4996 | |
| 24 | L | A | -0.2352 | |
| 25 | Y | A | -0.0665 | |
| 26 | V | A | 0.0000 | |
| 27 | A | A | 0.0000 | |
| 28 | E | A | -1.2526 | |
| 29 | T | A | 0.0000 | |
| 30 | D | A | -1.6025 | |
| 31 | L | A | -0.1802 | |
| 32 | I | A | 0.0000 | |
| 33 | T | A | -0.9846 | |
| 34 | E | A | -1.2917 | |
| 35 | E | A | -2.0195 | |
| 36 | G | A | 0.0000 | |
| 37 | H | A | 0.0000 | |
| 38 | P | A | 0.0000 | |
| 39 | F | A | 0.0000 | |
| 40 | R | A | -2.0468 | |
| 41 | D | A | -0.8326 | |
| 42 | I | A | 1.2951 | |
| 43 | V | A | 2.2273 | |
| 44 | V | A | 1.5237 | |
| 45 | D | A | -1.0142 | |
| 46 | G | A | -0.5872 | |
| 47 | K | A | -0.2556 | |
| 48 | V | A | 1.9205 | |
| 49 | L | A | 2.4788 | |
| 50 | L | A | 1.0202 | |
| 51 | P | A | -0.2487 | |
| 52 | R | A | -1.2805 | |
| 53 | V | A | 0.0000 | |
| 54 | S | A | 0.0000 | |
| 55 | A | A | 0.0000 | |
| 56 | Y | A | 0.0000 | |
| 57 | Q | A | 0.0000 | |
| 58 | W | A | 0.0000 | |
| 59 | R | A | 0.0000 | |
| 60 | V | A | 0.0000 | |
| 61 | F | A | 0.0000 | |
| 62 | L | A | 0.0000 | |
| 63 | L | A | 0.0000 | |
| 64 | T | A | -1.1179 | |
| 65 | L | A | 0.0000 | |
| 66 | P | A | 0.0000 | |
| 67 | D | A | -0.7314 | |
| 68 | P | A | 0.0000 | |
| 69 | N | A | -0.5424 | |
| 70 | T | A | -0.2477 | |
| 71 | M | A | -0.0424 | |
| 72 | P | A | -0.2135 | |
| 73 | L | A | -0.2896 | |
| 74 | P | A | -0.6215 | |
| 75 | S | A | -1.5126 | |
| 76 | E | A | -2.8339 | |
| 77 | D | A | -2.8494 | |
| 78 | F | A | -1.5699 | |
| 79 | L | A | 0.0000 | |
| 80 | D | A | -2.2990 | |
| 81 | P | A | -1.2220 | |
| 82 | S | A | -0.9437 | |
| 83 | T | A | -0.8602 | |
| 84 | E | A | -1.2126 | |
| 85 | R | A | -0.9197 | |
| 86 | L | A | 0.0000 | |
| 87 | I | A | 0.0000 | |
| 88 | W | A | 0.0000 | |
| 89 | R | A | -0.3176 | |
| 90 | L | A | 0.0000 | |
| 91 | L | A | -0.1882 | |
| 92 | A | A | 0.0000 | |
| 93 | L | A | 0.0000 | |
| 94 | K | A | 0.0000 | |
| 95 | I | A | 0.0000 | |
| 96 | H | A | -0.9687 | |
| 97 | I | A | 0.0000 | |
| 98 | G | A | -0.8539 | |
| 99 | G | A | -1.1316 | |
| 100 | P | A | -0.5259 | |
| 101 | L | A | -0.2592 | |
| 102 | G | A | -0.5172 | |
| 103 | T | A | -0.8070 | |
| 104 | G | A | 0.0000 | |
| 105 | T | A | -0.4181 | |
| 106 | V | A | 0.0000 | |
| 107 | G | A | -0.4741 | |
| 108 | H | A | -0.8823 | |
| 109 | P | A | -0.7806 | |
| 110 | N | A | -1.7211 | |
| 111 | F | A | 0.0000 | |
| 112 | N | A | 0.0000 | |
| 113 | R | A | -0.4483 | |
| 114 | F | A | 0.0000 | |
| 115 | G | A | -0.7073 | |
| 116 | D | A | -0.8078 | |
| 117 | V | A | -0.0553 | |
| 118 | T | A | -0.9832 | |
| 119 | N | A | -1.5230 | |
| 120 | P | A | -1.0007 | |
| 121 | T | A | -0.6391 | |
| 122 | S | A | -0.5921 | |
| 123 | Y | A | 0.0174 | |
| 124 | Q | A | -1.0154 | |
| 125 | H | A | -1.4658 | |
| 126 | E | A | -2.0590 | |
| 127 | G | A | -1.8188 | |
| 128 | A | A | -1.3280 | |
| 129 | D | A | -2.3511 | |
| 130 | D | A | -1.8614 | |
| 131 | T | A | -1.1073 | |
| 132 | V | A | -0.2628 | |
| 133 | A | A | -0.2027 | |
| 134 | Y | A | -0.1424 | |
| 135 | S | A | -0.1721 | |
| 136 | F | A | 0.0000 | |
| 137 | T | A | -0.4688 | |
| 138 | P | A | 0.0000 | |
| 139 | I | A | -0.4834 | |
| 140 | Y | A | 0.0000 | |
| 141 | K | A | 0.0000 | |
| 142 | Q | A | 0.0000 | |
| 143 | S | A | 0.0000 | |
| 144 | Y | A | 0.0000 | |
| 145 | I | A | 0.0000 | |
| 146 | V | A | 0.0000 | |
| 147 | G | A | 0.0000 | |
| 148 | D | A | 0.0000 | |
| 149 | E | A | -0.3467 | |
| 150 | P | A | 0.0000 | |
| 151 | P | A | 0.0000 | |
| 152 | T | A | 0.0124 | |
| 153 | G | A | 0.0000 | |
| 154 | V | A | 0.1058 | |
| 155 | Y | A | -0.2747 | |
| 156 | T | A | -0.9669 | |
| 157 | D | A | -1.8305 | |
| 158 | K | A | -2.2513 | |
| 159 | A | A | -2.0152 | |
| 160 | E | A | -2.6670 | |
| 161 | P | A | -1.9262 | |
| 162 | K | A | -2.3185 | |
| 163 | P | A | -1.4321 | |
| 164 | G | A | -0.8115 | |
| 165 | L | A | -0.1017 | |
| 166 | P | A | -0.1045 | |
| 167 | P | A | -0.2702 | |
| 168 | G | A | -0.3839 | |
| 169 | A | A | 0.3286 | |
| 170 | V | A | 1.2447 | |
| 171 | P | A | -0.1920 | |
| 172 | P | A | -0.6720 | |
| 173 | T | A | -1.0630 | |
| 174 | T | A | -1.4578 | |
| 175 | K | A | -1.7147 | |
| 176 | V | A | -0.6113 | |
| 177 | T | A | -0.1388 | |
| 178 | T | A | 0.0255 | |
| 179 | I | A | 0.0385 | |
| 180 | I | A | 0.0000 | |
| 181 | Q | A | -0.7964 | |
| 182 | H | A | -1.0145 | |
| 183 | G | A | -0.7582 | |
| 184 | D | A | -0.5924 | |
| 185 | M | A | 0.0000 | |
| 186 | A | A | 0.0000 | |
| 187 | D | A | -0.1412 | |
| 188 | I | A | 0.0000 | |
| 189 | G | A | -0.2408 | |
| 190 | F | A | 0.0158 | |
| 191 | G | A | -0.2265 | |
| 192 | A | A | -0.2259 | |
| 193 | K | A | -0.9481 | |
| 194 | N | A | -1.5291 | |
| 195 | Y | A | 0.0000 | |
| 196 | K | A | -3.6830 | |
| 197 | E | A | -2.8785 | |
| 198 | L | A | -1.8194 | |
| 199 | E | A | -2.4256 | |
| 200 | P | A | -2.5963 | |
| 201 | E | A | -2.7967 | |
| 202 | K | A | -3.4280 | |
| 203 | N | A | -2.0359 | |
| 204 | N | A | -1.3557 | |
| 205 | V | A | 0.0000 | |
| 206 | P | A | 0.0000 | |
| 207 | D | A | -1.4318 | |
| 208 | I | A | 0.0000 | |
| 209 | I | A | 0.0000 | |
| 210 | V | A | -2.1749 | |
| 211 | D | A | -2.9099 | |
| 212 | T | A | -1.3938 | |
| 213 | V | A | -0.6126 | |
| 214 | T | A | 0.0000 | |
| 215 | K | A | 0.0000 | |
| 216 | V | A | 0.3907 | |
| 217 | P | A | -0.0223 | |
| 218 | D | A | -0.8379 | |
| 219 | I | A | -1.2421 | |
| 220 | E | A | -2.5324 | |
| 221 | G | A | -1.7593 | |
| 222 | M | A | 0.0000 | |
| 223 | K | A | -2.6268 | |
| 224 | A | A | -1.5989 | |
| 225 | E | A | -1.4124 | |
| 226 | P | A | -0.8603 | |
| 227 | T | A | -0.5661 | |
| 228 | G | A | 0.0000 | |
| 229 | R | A | 0.0000 | |
| 230 | R | A | -0.6997 | |
| 231 | M | A | 0.0000 | |
| 232 | F | A | 0.0000 | |
| 233 | T | A | -0.3989 | |
| 234 | Y | A | -0.0498 | |
| 235 | N | A | -0.8735 | |
| 236 | E | A | -1.1548 | |
| 237 | K | A | -1.2197 | |
| 238 | T | A | -0.9160 | |
| 239 | K | A | -1.3359 | |
| 240 | S | A | -1.4766 | |
| 241 | S | A | -1.8864 | |
| 242 | N | A | -2.4506 | |
| 243 | K | A | -2.7267 | |
| 244 | D | A | -1.8424 | |
| 245 | T | A | -0.6028 | |
| 246 | Y | A | 0.0000 | |
| 247 | R | A | 0.1344 | |
| 248 | R | A | 0.0000 | |
| 249 | C | A | -0.9940 | |
| 250 | G | A | -1.1911 | |
| 251 | P | A | -1.3835 | |
| 252 | E | A | -2.1164 | |
| 253 | K | A | -2.4153 | |
| 254 | N | A | -2.4549 | |
| 255 | P | A | -1.4912 | |
| 256 | L | A | 0.0361 | |
| 257 | P | A | -0.0956 | |
| 258 | S | A | -0.1639 | |
| 259 | G | A | -0.6483 | |
| 260 | P | A | -0.6857 | |
| 261 | P | A | -0.7412 | |
| 262 | P | A | -0.4436 | |
| 263 | S | A | 0.0232 | |
| 264 | P | A | 0.4326 | |
| 265 | L | A | 1.5157 | |
| 266 | Y | A | 0.7898 | |
| 267 | T | A | 0.0619 | |
| 268 | K | A | -0.0888 | |
| 269 | P | A | 0.0239 | |
| 270 | P | A | -0.2879 | |
| 271 | P | A | -0.2781 | |
| 272 | S | A | -0.2380 | |
| 273 | S | A | 0.0768 | |
| 274 | P | A | 0.2163 | |
| 275 | Y | A | 1.0383 | |
| 276 | W | A | 0.6992 | |
| 277 | T | A | 0.4265 | |
| 278 | L | A | 0.5768 | |
| 279 | P | A | -0.2229 | |
| 280 | S | A | 0.0000 | |
| 281 | T | A | -0.2612 | |
| 282 | D | A | -0.6564 | |
| 283 | I | A | 1.3379 | |
| 284 | F | A | 0.7555 | |
| 285 | T | A | -0.3314 | |
| 286 | V | A | 0.0000 | |
| 287 | P | A | 0.0000 | |
| 288 | D | A | -1.7910 | |
| 289 | Q | A | 0.0000 | |
| 290 | G | A | -1.7706 | |
| 291 | E | A | -2.0270 | |
| 292 | I | A | -1.4279 | |
| 293 | T | A | -1.8134 | |
| 294 | E | A | -2.5984 | |
| 295 | E | A | -2.7306 | |
| 296 | D | A | -1.9875 | |
| 297 | L | A | -1.3107 | |
| 298 | L | A | -1.0869 | |
| 299 | F | A | 0.0000 | |
| 300 | N | A | -1.3897 | |
| 301 | K | A | -1.5742 | |
| 302 | P | A | -0.5763 | |
| 303 | I | A | -0.0682 | |
| 304 | F | A | -0.1625 | |
| 305 | F | A | 0.0000 | |
| 306 | D | A | -2.4666 | |
| 307 | K | A | -2.7750 | |
| 308 | A | A | 0.0000 | |
| 309 | P | A | -1.3076 | |
| 310 | G | A | -1.2498 | |
| 311 | K | A | -1.3295 | |
| 312 | N | A | 0.0000 | |
| 313 | N | A | 0.0000 | |
| 314 | F | A | 0.0000 | |
| 315 | I | A | 0.0000 | |
| 316 | L | A | 0.0000 | |
| 317 | W | A | 0.0000 | |
| 318 | N | A | -0.5246 | |
| 319 | N | A | -0.6305 | |
| 320 | R | A | -0.6857 | |
| 321 | L | A | 0.0000 | |
| 322 | Y | A | 0.0000 | |
| 323 | I | A | 0.0000 | |
| 324 | T | A | 0.0000 | |
| 325 | I | A | 0.0000 | |
| 326 | L | A | 0.0000 | |
| 327 | D | A | 0.0000 | |
| 328 | N | A | 0.0000 | |
| 329 | S | A | 0.0000 | |
| 330 | R | A | 0.0000 | |
| 331 | A | A | 0.0000 | |
| 332 | E | A | -2.3793 | |
| 333 | I | A | -1.7391 | |
| 334 | E | A | -2.3022 | |
| 335 | T | A | -1.0976 | |
| 336 | I | A | -0.0649 | |
| 337 | E | A | -1.0571 | |
| 338 | T | A | -0.1417 | |
| 339 | Q | A | 0.0525 | |
| 340 | L | A | 1.2433 | |
| 341 | S | A | 0.4158 | |
| 342 | T | A | 0.0091 | |
| 343 | P | A | -0.4001 | |
| 344 | A | A | -0.0744 | |
| 345 | I | A | 0.3727 | |
| 346 | N | A | -0.0186 | |
| 347 | V | A | 1.6923 | |
| 348 | Y | A | 1.5048 | |
| 349 | D | A | -0.0206 | |
| 350 | P | A | -0.1067 | |
| 351 | S | A | -0.0693 | |
| 352 | N | A | 0.3179 | |
| 353 | Y | A | 0.5258 | |
| 354 | V | A | 0.9060 | |
| 355 | T | A | -0.1063 | |
| 356 | S | A | -0.4957 | |
| 357 | R | A | -1.1380 | |
| 358 | R | A | -1.7794 | |
| 359 | Y | A | 0.0000 | |
| 360 | R | A | -2.9530 | |
| 361 | R | A | 0.0000 | |
| 362 | E | A | -1.1718 | |
| 363 | Y | A | 0.0000 | |
| 364 | R | A | -1.2438 | |
| 365 | I | A | 0.0000 | |
| 366 | E | A | 0.0000 | |
| 367 | L | A | 0.0000 | |
| 368 | I | A | 0.0000 | |
| 369 | V | A | 0.0000 | |
| 370 | Q | A | -0.3222 | |
| 371 | L | A | 0.0000 | |
| 372 | C | A | 0.0000 | |
| 373 | R | A | -0.6926 | |
| 374 | I | A | 0.0000 | |
| 375 | P | A | -0.7266 | |
| 376 | L | A | -0.4198 | |
| 377 | T | A | -0.6484 | |
| 378 | P | A | -0.9739 | |
| 379 | E | A | -1.8201 | |
| 380 | V | A | 0.0000 | |
| 381 | L | A | -0.6616 | |
| 382 | A | A | -1.2904 | |
| 383 | L | A | 0.0000 | |
| 384 | L | A | 0.0000 | |
| 385 | E | A | -1.4783 | |
| 386 | R | A | -1.7625 | |
| 387 | L | A | -0.6682 | |
| 388 | D | A | 0.0000 | |
| 389 | R | A | -1.3763 | |
| 390 | S | A | -1.6230 | |
| 391 | I | A | 0.0000 | |
| 392 | L | A | 0.0000 | |
| 393 | V | A | -1.3830 | |
| 394 | N | A | -1.2854 | |
| 395 | W | A | -0.7967 | |
| 396 | N | A | -1.8426 | |
| 397 | L | A | 0.0000 | |
| 398 | P | A | -1.5525 | |
| 399 | D | A | -2.1850 | |
| 400 | I | A | -1.2708 | |
| 401 | P | A | -1.2151 | |
| 402 | K | A | -2.0111 | |
| 403 | V | A | -0.6001 | |
| 404 | E | A | -2.6014 | |
| 405 | R | A | -3.5013 | |
| 406 | E | A | -3.8759 | |
| 407 | D | A | -3.6249 | |
| 408 | K | A | -3.2282 | |
| 409 | Y | A | -2.2273 | |
| 410 | K | A | -3.0915 | |
| 411 | G | A | -1.7070 | |
| 412 | L | A | -1.2949 | |
| 413 | K | A | -2.0683 | |
| 414 | F | A | -1.1476 | |
| 415 | H | A | -1.3458 | |
| 416 | N | A | -1.9102 | |
| 417 | I | A | -1.5884 | |
| 418 | D | A | -2.4240 | |
| 419 | L | A | 0.0000 | |
| 420 | T | A | -1.4890 | |
| 421 | N | A | -1.9857 | |
| 422 | K | A | -2.0391 | |
| 423 | L | A | -0.8949 | |
| 424 | S | A | -1.1320 | |
| 425 | T | A | -0.9426 | |
| 426 | D | A | -2.4065 | |
| 427 | L | A | -1.7065 | |
| 428 | E | A | -2.7680 | |
| 429 | S | A | -2.1179 | |
| 430 | T | A | 0.0000 | |
| 431 | E | A | -1.4887 | |
| 432 | L | A | 0.0000 | |
| 433 | G | A | 0.0000 | |
| 434 | R | A | -2.3749 | |
| 435 | Y | A | -0.8287 | |
| 436 | Y | A | -0.4075 | |
| 437 | L | A | -0.3609 | |
| 438 | N | A | -1.5904 | |
| 439 | R | A | -1.9101 |
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