| Chain sequence(s) |
A: TTERHGAPTPKQKPAAPEPILSIDDAQEPVAIIGFDGRFPGANHPTDFWNQVINEEMAISDLPKDAFRFKDAPVDDIERFGGGFLQDIDRFDAAFFSIDDQEARLMDPQQRLLLQSVWKTVEHAGYRMEQLSERQTGLFIGVGSSDYLQLMCAGDSAFNSHTQVGISPSMLANRISYHLNLKGPSEISDTACSSSIVAIHRAIRSLREGECELAIVGGVSLLLSARGYQGLKHLGFLSPSRASRSFDARADGYVRGEGVGSVLLKPLSQAERDHDHIHAVIKGSAVYHGGKSTLSLIAPSKNGQIGAMVRAYRNADVNPAAVQYVEAHGTATSFGDPAEISALKQAFVQLETEPRNGARCGIGALKPNIGHLEAASGMASLIKLTLALKMKKKPPLAGFHSLNPGIILESSPFYIVREPEDWVRTDVPRRAGLNSYGFGGVNSHLVLEEYVPKERKPSETYEIVTL
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] (00:00:02)
[WARNING] runJob: Working directory already exists (possibly overwriting previous results -ow
to prevent this behavior) (00:00:02)
[INFO] runJob: Starting aggrescan3d job on: input.pdb with A chain(s) selected (00:00:02)
[INFO] runJob: Creating pdb object from: input.pdb (00:00:02)
[INFO] FoldX: Starting FoldX energy minimalization (00:00:02)
[INFO] Analysis: Starting Aggrescan3D on folded.pdb (00:05:55)
[INFO] Main: Simulation completed successfully. (00:05:58)
|
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 | T | A | -0.7537 | |
| 2 | T | A | -1.5661 | |
| 3 | E | A | -3.0747 | |
| 4 | R | A | -3.3455 | |
| 5 | H | A | -2.6062 | |
| 6 | G | A | -1.6834 | |
| 7 | A | A | -0.7990 | |
| 8 | P | A | -0.7800 | |
| 9 | T | A | -0.9332 | |
| 10 | P | A | -1.7121 | |
| 11 | K | A | -2.9291 | |
| 12 | Q | A | -2.9772 | |
| 13 | K | A | -2.8565 | |
| 14 | P | A | -1.5866 | |
| 15 | A | A | -0.9984 | |
| 16 | A | A | -0.8469 | |
| 17 | P | A | -1.4399 | |
| 18 | E | A | -1.7266 | |
| 19 | P | A | -0.5023 | |
| 20 | I | A | 0.3099 | |
| 21 | L | A | 0.3442 | |
| 22 | S | A | -0.8211 | |
| 23 | I | A | -1.5418 | |
| 24 | D | A | -2.9025 | |
| 25 | D | A | -3.1329 | |
| 26 | A | A | -2.2437 | |
| 27 | Q | A | -2.3662 | |
| 28 | E | A | -1.5674 | |
| 29 | P | A | -0.6247 | |
| 30 | V | A | 0.0000 | |
| 31 | A | A | 0.0000 | |
| 32 | I | A | 0.0000 | |
| 33 | I | A | 0.0000 | |
| 34 | G | A | 0.0000 | |
| 35 | F | A | 0.0000 | |
| 36 | D | A | 0.0000 | |
| 37 | G | A | 0.0000 | |
| 38 | R | A | -1.2912 | |
| 39 | F | A | 0.0000 | |
| 40 | P | A | 0.0000 | |
| 41 | G | A | -1.3735 | |
| 42 | A | A | 0.0000 | |
| 43 | N | A | -2.2999 | |
| 44 | H | A | -1.8460 | |
| 45 | P | A | 0.0000 | |
| 46 | T | A | -1.5944 | |
| 47 | D | A | -2.8242 | |
| 48 | F | A | 0.0000 | |
| 49 | W | A | 0.0000 | |
| 50 | N | A | -2.6476 | |
| 51 | Q | A | 0.0000 | |
| 52 | V | A | 0.0000 | |
| 53 | I | A | -1.9365 | |
| 54 | N | A | -2.8484 | |
| 55 | E | A | -3.2167 | |
| 56 | E | A | -2.7316 | |
| 57 | M | A | -0.7083 | |
| 58 | A | A | -0.2094 | |
| 59 | I | A | -0.2416 | |
| 60 | S | A | -0.8611 | |
| 61 | D | A | -2.6647 | |
| 62 | L | A | 0.0000 | |
| 63 | P | A | -1.8277 | |
| 64 | K | A | -2.2722 | |
| 65 | D | A | -1.9014 | |
| 66 | A | A | -0.8267 | |
| 67 | F | A | -0.7879 | |
| 68 | R | A | 0.0000 | |
| 69 | F | A | 0.0000 | |
| 70 | K | A | -1.8867 | |
| 71 | D | A | 0.0000 | |
| 72 | A | A | -1.0812 | |
| 73 | P | A | -1.4700 | |
| 74 | V | A | -1.9654 | |
| 75 | D | A | -2.9772 | |
| 76 | D | A | -3.0007 | |
| 77 | I | A | 0.0000 | |
| 78 | E | A | -3.4328 | |
| 79 | R | A | -3.1973 | |
| 80 | F | A | 0.0000 | |
| 81 | G | A | 0.0000 | |
| 82 | G | A | 0.0000 | |
| 83 | G | A | 0.0000 | |
| 84 | F | A | -0.4509 | |
| 85 | L | A | 0.0000 | |
| 86 | Q | A | -2.2791 | |
| 87 | D | A | -2.4852 | |
| 88 | I | A | 0.0000 | |
| 89 | D | A | -3.2900 | |
| 90 | R | A | -3.2997 | |
| 91 | F | A | -2.2464 | |
| 92 | D | A | -2.0430 | |
| 93 | A | A | -1.7894 | |
| 94 | A | A | -0.5442 | |
| 95 | F | A | 0.7326 | |
| 96 | F | A | 0.0000 | |
| 97 | S | A | -0.6296 | |
| 98 | I | A | 0.0000 | |
| 99 | D | A | -3.1744 | |
| 100 | D | A | -3.6593 | |
| 101 | Q | A | -2.9455 | |
| 102 | E | A | -2.3271 | |
| 103 | A | A | -2.8798 | |
| 104 | R | A | -3.0352 | |
| 105 | L | A | -1.2404 | |
| 106 | M | A | 0.0000 | |
| 107 | D | A | 0.0000 | |
| 108 | P | A | 0.0000 | |
| 109 | Q | A | 0.0000 | |
| 110 | Q | A | 0.0000 | |
| 111 | R | A | 0.0000 | |
| 112 | L | A | 0.0000 | |
| 113 | L | A | 0.0000 | |
| 114 | L | A | 0.0000 | |
| 115 | Q | A | -0.6718 | |
| 116 | S | A | 0.0000 | |
| 117 | V | A | 0.0000 | |
| 118 | W | A | -0.8922 | |
| 119 | K | A | -1.3662 | |
| 120 | T | A | 0.0000 | |
| 121 | V | A | 0.0000 | |
| 122 | E | A | -2.7385 | |
| 123 | H | A | -1.9314 | |
| 124 | A | A | -1.5873 | |
| 125 | G | A | -1.8438 | |
| 126 | Y | A | -2.2049 | |
| 127 | R | A | -3.2579 | |
| 128 | M | A | -2.4350 | |
| 129 | E | A | -3.3204 | |
| 130 | Q | A | -2.9875 | |
| 131 | L | A | 0.0000 | |
| 132 | S | A | -2.6743 | |
| 133 | E | A | -3.2341 | |
| 134 | R | A | -2.8514 | |
| 135 | Q | A | -2.0415 | |
| 136 | T | A | 0.0000 | |
| 137 | G | A | 0.0000 | |
| 138 | L | A | 0.0000 | |
| 139 | F | A | 0.0000 | |
| 140 | I | A | 0.0000 | |
| 141 | G | A | 0.0000 | |
| 142 | V | A | 0.0000 | |
| 143 | G | A | -0.7717 | |
| 144 | S | A | -0.5534 | |
| 145 | S | A | -0.0867 | |
| 146 | D | A | 0.0000 | |
| 147 | Y | A | 0.3934 | |
| 148 | L | A | 0.4020 | |
| 149 | Q | A | -0.2055 | |
| 150 | L | A | 0.0000 | |
| 151 | M | A | 0.0000 | |
| 152 | C | A | 0.5376 | |
| 153 | A | A | -0.4864 | |
| 154 | G | A | -1.2738 | |
| 155 | D | A | -1.6444 | |
| 156 | S | A | -0.5742 | |
| 157 | A | A | 0.2619 | |
| 158 | F | A | 1.0745 | |
| 159 | N | A | -0.2827 | |
| 160 | S | A | -0.5308 | |
| 161 | H | A | -0.8383 | |
| 162 | T | A | 0.0000 | |
| 163 | Q | A | -0.6978 | |
| 164 | V | A | 0.0228 | |
| 165 | G | A | 0.0000 | |
| 166 | I | A | 0.0000 | |
| 167 | S | A | -0.1070 | |
| 168 | P | A | -0.2946 | |
| 169 | S | A | 0.0349 | |
| 170 | M | A | 0.2295 | |
| 171 | L | A | 0.0000 | |
| 172 | A | A | 0.0000 | |
| 173 | N | A | 0.0813 | |
| 174 | R | A | 0.0000 | |
| 175 | I | A | 0.0000 | |
| 176 | S | A | 0.0000 | |
| 177 | Y | A | 0.7138 | |
| 178 | H | A | 0.0365 | |
| 179 | L | A | 0.0000 | |
| 180 | N | A | -1.3861 | |
| 181 | L | A | 0.0000 | |
| 182 | K | A | -2.4037 | |
| 183 | G | A | -1.8557 | |
| 184 | P | A | -1.0380 | |
| 185 | S | A | -0.2943 | |
| 186 | E | A | -0.4064 | |
| 187 | I | A | -0.1794 | |
| 188 | S | A | -0.8961 | |
| 189 | D | A | -1.7092 | |
| 190 | T | A | -0.8220 | |
| 191 | A | A | -0.6301 | |
| 192 | C | A | 0.0000 | |
| 193 | S | A | 0.0000 | |
| 194 | S | A | 0.0000 | |
| 195 | S | A | 0.0000 | |
| 196 | I | A | 0.0000 | |
| 197 | V | A | 0.0000 | |
| 198 | A | A | 0.0000 | |
| 199 | I | A | 0.0000 | |
| 200 | H | A | -1.1282 | |
| 201 | R | A | -2.0457 | |
| 202 | A | A | 0.0000 | |
| 203 | I | A | 0.0000 | |
| 204 | R | A | -3.1263 | |
| 205 | S | A | -2.6608 | |
| 206 | L | A | 0.0000 | |
| 207 | R | A | -2.8771 | |
| 208 | E | A | -3.4061 | |
| 209 | G | A | -2.0773 | |
| 210 | E | A | -2.8031 | |
| 211 | C | A | 0.0000 | |
| 212 | E | A | -0.8757 | |
| 213 | L | A | 0.0000 | |
| 214 | A | A | 0.0000 | |
| 215 | I | A | 0.0000 | |
| 216 | V | A | 0.0000 | |
| 217 | G | A | 0.0000 | |
| 218 | G | A | 0.0000 | |
| 219 | V | A | 0.0000 | |
| 220 | S | A | 0.0000 | |
| 221 | L | A | 0.0000 | |
| 222 | L | A | 0.0000 | |
| 223 | L | A | 0.0000 | |
| 224 | S | A | 0.0000 | |
| 225 | A | A | 0.0000 | |
| 226 | R | A | -1.8264 | |
| 227 | G | A | -1.0719 | |
| 228 | Y | A | 0.0000 | |
| 229 | Q | A | -1.4815 | |
| 230 | G | A | -1.0592 | |
| 231 | L | A | -0.4944 | |
| 232 | K | A | -1.2293 | |
| 233 | H | A | -0.9190 | |
| 234 | L | A | 0.3690 | |
| 235 | G | A | -0.5135 | |
| 236 | F | A | 0.0000 | |
| 237 | L | A | 0.0000 | |
| 238 | S | A | 0.0000 | |
| 239 | P | A | -1.0577 | |
| 240 | S | A | -1.0374 | |
| 241 | R | A | -1.2751 | |
| 242 | A | A | -0.6095 | |
| 243 | S | A | 0.0000 | |
| 244 | R | A | -1.0376 | |
| 245 | S | A | 0.0000 | |
| 246 | F | A | 0.0000 | |
| 247 | D | A | 0.0000 | |
| 248 | A | A | -0.8993 | |
| 249 | R | A | -1.4834 | |
| 250 | A | A | 0.0000 | |
| 251 | D | A | -1.1000 | |
| 252 | G | A | 0.0000 | |
| 253 | Y | A | 0.0000 | |
| 254 | V | A | 0.0000 | |
| 255 | R | A | 0.0000 | |
| 256 | G | A | 0.0000 | |
| 257 | E | A | 0.0000 | |
| 258 | G | A | 0.0000 | |
| 259 | V | A | 0.0000 | |
| 260 | G | A | 0.0000 | |
| 261 | S | A | 0.0000 | |
| 262 | V | A | 0.0000 | |
| 263 | L | A | 0.0000 | |
| 264 | L | A | 0.0000 | |
| 265 | K | A | 0.0000 | |
| 266 | P | A | 0.0000 | |
| 267 | L | A | -0.4826 | |
| 268 | S | A | -0.9720 | |
| 269 | Q | A | -1.4969 | |
| 270 | A | A | 0.0000 | |
| 271 | E | A | -2.4901 | |
| 272 | R | A | -3.0588 | |
| 273 | D | A | -3.2944 | |
| 274 | H | A | -2.8336 | |
| 275 | D | A | -2.1640 | |
| 276 | H | A | -1.7037 | |
| 277 | I | A | 0.0000 | |
| 278 | H | A | 0.0000 | |
| 279 | A | A | 0.0000 | |
| 280 | V | A | 0.0000 | |
| 281 | I | A | 0.0000 | |
| 282 | K | A | -1.0090 | |
| 283 | G | A | 0.0000 | |
| 284 | S | A | 0.0000 | |
| 285 | A | A | 0.0000 | |
| 286 | V | A | 0.1891 | |
| 287 | Y | A | -0.0478 | |
| 288 | H | A | -1.0759 | |
| 289 | G | A | -1.3327 | |
| 290 | G | A | -1.5719 | |
| 291 | K | A | -1.6074 | |
| 292 | S | A | -0.3860 | |
| 293 | T | A | 0.3993 | |
| 294 | L | A | 1.5922 | |
| 295 | S | A | 1.1929 | |
| 296 | L | A | 1.5260 | |
| 297 | I | A | 1.4677 | |
| 298 | A | A | 0.9117 | |
| 299 | P | A | 0.3071 | |
| 300 | S | A | -0.9795 | |
| 301 | K | A | -1.6047 | |
| 302 | N | A | -1.8748 | |
| 303 | G | A | 0.0000 | |
| 304 | Q | A | 0.0000 | |
| 305 | I | A | -0.9288 | |
| 306 | G | A | -0.6673 | |
| 307 | A | A | 0.0000 | |
| 308 | M | A | 0.0000 | |
| 309 | V | A | -1.1792 | |
| 310 | R | A | -2.0099 | |
| 311 | A | A | 0.0000 | |
| 312 | Y | A | 0.0000 | |
| 313 | R | A | -3.2029 | |
| 314 | N | A | -2.3724 | |
| 315 | A | A | 0.0000 | |
| 316 | D | A | -2.9403 | |
| 317 | V | A | 0.0000 | |
| 318 | N | A | -1.4243 | |
| 319 | P | A | 0.0000 | |
| 320 | A | A | -0.9264 | |
| 321 | A | A | -0.5902 | |
| 322 | V | A | 0.0000 | |
| 323 | Q | A | -0.3461 | |
| 324 | Y | A | 0.0000 | |
| 325 | V | A | 0.0000 | |
| 326 | E | A | 0.0000 | |
| 327 | A | A | 0.0000 | |
| 328 | H | A | 0.0000 | |
| 329 | G | A | 0.0000 | |
| 330 | T | A | 0.0000 | |
| 331 | A | A | 0.0000 | |
| 332 | T | A | 0.0034 | |
| 333 | S | A | 0.1801 | |
| 334 | F | A | 1.6198 | |
| 335 | G | A | 0.6649 | |
| 336 | D | A | 0.0000 | |
| 337 | P | A | 0.4683 | |
| 338 | A | A | -0.0433 | |
| 339 | E | A | 0.0000 | |
| 340 | I | A | 0.0000 | |
| 341 | S | A | -0.2695 | |
| 342 | A | A | 0.0000 | |
| 343 | L | A | 0.0000 | |
| 344 | K | A | -0.2332 | |
| 345 | Q | A | -0.7720 | |
| 346 | A | A | 0.0000 | |
| 347 | F | A | 0.0000 | |
| 348 | V | A | 0.5735 | |
| 349 | Q | A | -0.5035 | |
| 350 | L | A | -0.8075 | |
| 351 | E | A | -0.8872 | |
| 352 | T | A | -1.2175 | |
| 353 | E | A | -2.3509 | |
| 354 | P | A | -1.9059 | |
| 355 | R | A | -2.6584 | |
| 356 | N | A | -2.4111 | |
| 357 | G | A | -1.6255 | |
| 358 | A | A | -0.9482 | |
| 359 | R | A | -0.7603 | |
| 360 | C | A | 0.0000 | |
| 361 | G | A | 0.0000 | |
| 362 | I | A | 0.0000 | |
| 363 | G | A | 0.0000 | |
| 364 | A | A | 0.0000 | |
| 365 | L | A | 0.0000 | |
| 366 | K | A | 0.0000 | |
| 367 | P | A | 0.0000 | |
| 368 | N | A | 0.0000 | |
| 369 | I | A | 0.0000 | |
| 370 | G | A | 0.0000 | |
| 371 | H | A | 0.0000 | |
| 372 | L | A | 0.0000 | |
| 373 | E | A | -0.2392 | |
| 374 | A | A | 0.0000 | |
| 375 | A | A | 0.0000 | |
| 376 | S | A | 0.0000 | |
| 377 | G | A | 0.0000 | |
| 378 | M | A | 0.0000 | |
| 379 | A | A | 0.0000 | |
| 380 | S | A | 0.0000 | |
| 381 | L | A | 0.0000 | |
| 382 | I | A | 0.0000 | |
| 383 | K | A | 0.0000 | |
| 384 | L | A | 0.0000 | |
| 385 | T | A | 0.0000 | |
| 386 | L | A | 0.0000 | |
| 387 | A | A | 0.0000 | |
| 388 | L | A | 0.0000 | |
| 389 | K | A | -0.9220 | |
| 390 | M | A | -1.0279 | |
| 391 | K | A | -2.1257 | |
| 392 | K | A | -1.8728 | |
| 393 | K | A | 0.0000 | |
| 394 | P | A | 0.0000 | |
| 395 | P | A | 0.0000 | |
| 396 | L | A | 0.0000 | |
| 397 | A | A | 0.0000 | |
| 398 | G | A | -1.3487 | |
| 399 | F | A | -1.3487 | |
| 400 | H | A | -1.4185 | |
| 401 | S | A | -0.5984 | |
| 402 | L | A | 0.1479 | |
| 403 | N | A | -0.1253 | |
| 404 | P | A | -0.0834 | |
| 405 | G | A | 0.1588 | |
| 406 | I | A | 0.0000 | |
| 407 | I | A | 1.3727 | |
| 408 | L | A | 0.2554 | |
| 409 | E | A | -1.2509 | |
| 410 | S | A | -1.0535 | |
| 411 | S | A | 0.0000 | |
| 412 | P | A | -0.8918 | |
| 413 | F | A | 0.0000 | |
| 414 | Y | A | -0.0906 | |
| 415 | I | A | 0.0000 | |
| 416 | V | A | 0.0000 | |
| 417 | R | A | -3.0728 | |
| 418 | E | A | -3.3650 | |
| 419 | P | A | -2.4989 | |
| 420 | E | A | -2.3021 | |
| 421 | D | A | -2.5131 | |
| 422 | W | A | 0.0000 | |
| 423 | V | A | -0.1549 | |
| 424 | R | A | -1.8480 | |
| 425 | T | A | -1.2934 | |
| 426 | D | A | -2.0654 | |
| 427 | V | A | -0.8903 | |
| 428 | P | A | -0.4459 | |
| 429 | R | A | -0.7802 | |
| 430 | R | A | -0.6033 | |
| 431 | A | A | 0.0000 | |
| 432 | G | A | 0.0000 | |
| 433 | L | A | 0.0000 | |
| 434 | N | A | 0.0000 | |
| 435 | S | A | 0.0000 | |
| 436 | Y | A | 0.0000 | |
| 437 | G | A | 0.0000 | |
| 438 | F | A | 0.5608 | |
| 439 | G | A | 0.0739 | |
| 440 | G | A | -0.3175 | |
| 441 | V | A | -0.0052 | |
| 442 | N | A | 0.0000 | |
| 443 | S | A | 0.0000 | |
| 444 | H | A | 0.0000 | |
| 445 | L | A | 0.0000 | |
| 446 | V | A | 0.0000 | |
| 447 | L | A | 0.0000 | |
| 448 | E | A | 0.0000 | |
| 449 | E | A | -0.3358 | |
| 450 | Y | A | 0.3425 | |
| 451 | V | A | 0.6784 | |
| 452 | P | A | -1.1818 | |
| 453 | K | A | -3.0926 | |
| 454 | E | A | -3.9141 | |
| 455 | R | A | -4.1805 | |
| 456 | K | A | -3.7217 | |
| 457 | P | A | -2.4256 | |
| 458 | S | A | -1.8781 | |
| 459 | E | A | -2.1319 | |
| 460 | T | A | -0.6344 | |
| 461 | Y | A | 0.7442 | |
| 462 | E | A | 0.0646 | |
| 463 | I | A | 2.5255 | |
| 464 | V | A | 2.7874 | |
| 465 | T | A | 1.8849 | |
| 466 | L | A | 2.2317 |
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