| Chain sequence(s) |
A: RITECGLSCSQGFACRSHRNRNIFNSFCRPRPVSMSRSVLEALTSSTAMQCVPSDGCAMLLRVRASITLHERLRGLEACAMSLDTQETQCQSVWVARASHRQQGGQQLQVHFGCFAVSVAQHLYVTLRTIPHFCGVQLDQRHLVEDCGEEDVGRSVPDCLAGKLSYWVDRRRKAILVQVPRASGSPDYYLRLCLKRFTCEDAGAPVRVTANSVSQAVFLPYSQELPCLCLEGWSATPDAVRIQICPFENDTEALEVLWDTVYYHPESQTLSWEPACPVSGHVSLCWRPGPGAGCRKLQQSSQLVHRRVQYPLVDTQPQLCLKFSTSWGSWVRCPFEQRRFPTWKMTIQPSPTKGHLRVTFFSSSPAHFQVHLCHRRKSQLPACQRTLQASPLPSASGDLAAAPAFAFLDLPREEACAPGICIQGWRTDVHFSVPQQLCNLRSSGCPSLRG
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 (00:04:42)
[INFO] Main: Simulation completed successfully. (00:04:45)
|
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 | |
| 24 | R | A | -2.0043 | |
| 25 | I | A | -1.2747 | |
| 26 | T | A | -1.0453 | |
| 27 | E | A | -1.9884 | |
| 28 | C | A | -0.8148 | |
| 29 | G | A | -0.5152 | |
| 30 | L | A | -0.3198 | |
| 31 | S | A | -0.7120 | |
| 32 | C | A | -0.8818 | |
| 33 | S | A | -1.2227 | |
| 34 | Q | A | -1.5223 | |
| 35 | G | A | -1.0598 | |
| 36 | F | A | -0.7874 | |
| 37 | A | A | -0.6461 | |
| 38 | C | A | -0.8817 | |
| 39 | R | A | -2.1172 | |
| 40 | S | A | -1.9301 | |
| 41 | H | A | -2.7255 | |
| 42 | R | A | -3.3414 | |
| 43 | N | A | -2.0876 | |
| 44 | R | A | -2.3887 | |
| 45 | N | A | -0.8778 | |
| 46 | I | A | 2.0672 | |
| 47 | F | A | 2.6872 | |
| 48 | N | A | 0.0000 | |
| 49 | S | A | 1.7110 | |
| 50 | F | A | 2.7249 | |
| 51 | C | A | 0.9076 | |
| 52 | R | A | -0.4820 | |
| 53 | P | A | -0.8893 | |
| 54 | R | A | -1.9986 | |
| 55 | P | A | 0.0000 | |
| 56 | V | A | 1.1990 | |
| 57 | S | A | -0.0920 | |
| 58 | M | A | 0.0000 | |
| 59 | S | A | -1.1373 | |
| 60 | R | A | -2.5477 | |
| 61 | S | A | -1.5822 | |
| 62 | V | A | 0.0000 | |
| 63 | L | A | 0.0000 | |
| 64 | E | A | -1.6012 | |
| 65 | A | A | -0.8212 | |
| 66 | L | A | -0.7313 | |
| 67 | T | A | -0.7921 | |
| 68 | S | A | -0.6105 | |
| 69 | S | A | -0.2281 | |
| 70 | T | A | -0.3606 | |
| 71 | A | A | -0.6861 | |
| 72 | M | A | 0.0000 | |
| 73 | Q | A | -0.6729 | |
| 74 | C | A | -0.0165 | |
| 75 | V | A | 0.7700 | |
| 76 | P | A | -0.0781 | |
| 77 | S | A | -0.8447 | |
| 78 | D | A | -1.6543 | |
| 79 | G | A | -1.0838 | |
| 80 | C | A | 0.0000 | |
| 81 | A | A | -0.4299 | |
| 82 | M | A | 0.0000 | |
| 83 | L | A | 0.0000 | |
| 84 | L | A | 0.0000 | |
| 85 | R | A | -0.6982 | |
| 86 | V | A | 0.0000 | |
| 87 | R | A | -1.1411 | |
| 88 | A | A | 0.0000 | |
| 89 | S | A | -1.2192 | |
| 90 | I | A | 0.0000 | |
| 91 | T | A | -1.5118 | |
| 92 | L | A | 0.0000 | |
| 93 | H | A | 0.0000 | |
| 94 | E | A | -3.6381 | |
| 95 | R | A | -3.2980 | |
| 96 | L | A | 0.0000 | |
| 97 | R | A | -2.3475 | |
| 98 | G | A | 0.0000 | |
| 99 | L | A | 0.0000 | |
| 100 | E | A | 0.0000 | |
| 101 | A | A | 0.0000 | |
| 102 | C | A | -0.2131 | |
| 103 | A | A | 0.0000 | |
| 104 | M | A | -1.0974 | |
| 105 | S | A | 0.0000 | |
| 106 | L | A | -1.3546 | |
| 107 | D | A | -2.3458 | |
| 108 | T | A | -2.0379 | |
| 109 | Q | A | -2.4441 | |
| 110 | E | A | -2.7601 | |
| 111 | T | A | -1.3279 | |
| 112 | Q | A | -1.0549 | |
| 113 | C | A | -0.4242 | |
| 114 | Q | A | -0.8146 | |
| 115 | S | A | 0.0000 | |
| 116 | V | A | 0.0000 | |
| 117 | W | A | -1.1229 | |
| 118 | V | A | 0.0000 | |
| 119 | A | A | -1.4952 | |
| 120 | R | A | -2.8297 | |
| 121 | A | A | -1.7452 | |
| 122 | S | A | 0.0000 | |
| 123 | H | A | -3.1880 | |
| 124 | R | A | -3.4149 | |
| 125 | Q | A | -2.7867 | |
| 126 | Q | A | -2.2332 | |
| 127 | G | A | -2.5762 | |
| 128 | G | A | -2.1984 | |
| 129 | Q | A | -2.4823 | |
| 130 | Q | A | -2.3977 | |
| 131 | L | A | 0.0000 | |
| 132 | Q | A | -1.9976 | |
| 133 | V | A | 0.0000 | |
| 134 | H | A | -0.7857 | |
| 135 | F | A | 0.0000 | |
| 136 | G | A | 0.0000 | |
| 137 | C | A | -0.1769 | |
| 138 | F | A | 0.0000 | |
| 139 | A | A | 0.0398 | |
| 140 | V | A | 0.0528 | |
| 141 | S | A | -0.6881 | |
| 142 | V | A | 0.0000 | |
| 143 | A | A | -0.6624 | |
| 144 | Q | A | -0.6025 | |
| 145 | H | A | -0.5987 | |
| 146 | L | A | 0.0000 | |
| 147 | Y | A | -0.5897 | |
| 148 | V | A | 0.0000 | |
| 149 | T | A | -1.0122 | |
| 150 | L | A | 0.0000 | |
| 151 | R | A | -0.7162 | |
| 152 | T | A | 0.0000 | |
| 153 | I | A | 0.0000 | |
| 154 | P | A | -0.5705 | |
| 155 | H | A | 0.0000 | |
| 156 | F | A | 0.0000 | |
| 157 | C | A | -0.7228 | |
| 158 | G | A | -1.2107 | |
| 159 | V | A | 0.0000 | |
| 160 | Q | A | -1.6593 | |
| 161 | L | A | -1.4319 | |
| 162 | D | A | -2.3101 | |
| 163 | Q | A | -1.9901 | |
| 164 | R | A | -1.9714 | |
| 165 | H | A | -0.6742 | |
| 166 | L | A | 0.4593 | |
| 167 | V | A | 0.0000 | |
| 168 | E | A | -1.8450 | |
| 169 | D | A | -2.3934 | |
| 170 | C | A | -1.9942 | |
| 171 | G | A | -2.2049 | |
| 172 | E | A | -2.9215 | |
| 173 | E | A | -3.3643 | |
| 174 | D | A | -2.6400 | |
| 175 | V | A | 0.0000 | |
| 176 | G | A | -2.8400 | |
| 177 | R | A | -2.8979 | |
| 178 | S | A | 0.0000 | |
| 179 | V | A | 0.0000 | |
| 180 | P | A | -1.4642 | |
| 181 | D | A | -1.4175 | |
| 182 | C | A | 0.0000 | |
| 183 | L | A | -1.2110 | |
| 184 | A | A | 0.0000 | |
| 185 | G | A | -1.3088 | |
| 186 | K | A | -1.7653 | |
| 187 | L | A | 0.0000 | |
| 188 | S | A | -0.2142 | |
| 189 | Y | A | 0.9919 | |
| 190 | W | A | 1.4463 | |
| 191 | V | A | 0.2324 | |
| 192 | D | A | 0.0000 | |
| 193 | R | A | -3.3903 | |
| 194 | R | A | -3.8053 | |
| 195 | R | A | -3.7301 | |
| 196 | K | A | -3.5935 | |
| 197 | A | A | 0.0000 | |
| 198 | I | A | 0.0000 | |
| 199 | L | A | 0.9545 | |
| 200 | V | A | 0.0000 | |
| 201 | Q | A | -0.4581 | |
| 202 | V | A | 0.0000 | |
| 203 | P | A | -0.7142 | |
| 204 | R | A | -0.7494 | |
| 205 | A | A | -0.9359 | |
| 206 | S | A | -1.1934 | |
| 207 | G | A | -1.3266 | |
| 208 | S | A | -1.2444 | |
| 209 | P | A | -0.7868 | |
| 210 | D | A | -0.9627 | |
| 211 | Y | A | 0.0000 | |
| 212 | Y | A | -0.5069 | |
| 213 | L | A | 0.0000 | |
| 214 | R | A | -0.8313 | |
| 215 | L | A | 0.0000 | |
| 216 | C | A | 0.0000 | |
| 217 | L | A | -1.0316 | |
| 218 | K | A | -1.1134 | |
| 219 | R | A | -0.3265 | |
| 220 | F | A | 1.2369 | |
| 221 | T | A | -0.0816 | |
| 222 | C | A | -1.1860 | |
| 223 | E | A | -2.3638 | |
| 224 | D | A | -2.6784 | |
| 225 | A | A | -1.4656 | |
| 226 | G | A | -1.0925 | |
| 227 | A | A | -0.7055 | |
| 228 | P | A | -0.7205 | |
| 229 | V | A | -0.4013 | |
| 230 | R | A | -1.6028 | |
| 231 | V | A | 0.0000 | |
| 232 | T | A | -0.8645 | |
| 233 | A | A | -0.9052 | |
| 234 | N | A | -1.1767 | |
| 235 | S | A | -0.2722 | |
| 236 | V | A | 0.8822 | |
| 237 | S | A | -0.2738 | |
| 238 | Q | A | -0.8291 | |
| 239 | A | A | -0.0304 | |
| 240 | V | A | 0.0000 | |
| 241 | F | A | 0.8617 | |
| 242 | L | A | 0.0000 | |
| 243 | P | A | -1.0874 | |
| 244 | Y | A | 0.0000 | |
| 245 | S | A | -1.2415 | |
| 246 | Q | A | -1.7463 | |
| 247 | E | A | -1.8893 | |
| 248 | L | A | -1.2630 | |
| 249 | P | A | -1.7374 | |
| 250 | C | A | 0.0000 | |
| 251 | L | A | 0.0000 | |
| 252 | C | A | 0.0000 | |
| 253 | L | A | 0.0000 | |
| 254 | E | A | 0.0000 | |
| 255 | G | A | 0.0000 | |
| 256 | W | A | -0.5995 | |
| 257 | S | A | -0.7188 | |
| 258 | A | A | -0.5861 | |
| 259 | T | A | -0.6855 | |
| 260 | P | A | -0.9631 | |
| 261 | D | A | -1.7578 | |
| 262 | A | A | -0.8757 | |
| 263 | V | A | -0.0341 | |
| 264 | R | A | -1.1181 | |
| 265 | I | A | -0.3474 | |
| 266 | Q | A | -0.4635 | |
| 267 | I | A | -0.0241 | |
| 268 | C | A | -0.7137 | |
| 269 | P | A | -0.4679 | |
| 270 | F | A | 0.0000 | |
| 271 | E | A | -2.4653 | |
| 272 | N | A | -2.3962 | |
| 273 | D | A | -2.3072 | |
| 274 | T | A | -2.0253 | |
| 275 | E | A | -2.6251 | |
| 276 | A | A | 0.0000 | |
| 277 | L | A | -1.7481 | |
| 278 | E | A | -2.6243 | |
| 279 | V | A | -1.5439 | |
| 280 | L | A | 0.0000 | |
| 281 | W | A | 0.0000 | |
| 282 | D | A | -1.8982 | |
| 283 | T | A | -0.4608 | |
| 284 | V | A | -0.1127 | |
| 285 | Y | A | 0.8712 | |
| 286 | Y | A | 0.1254 | |
| 287 | H | A | -0.7757 | |
| 288 | P | A | -1.2487 | |
| 289 | E | A | -2.2419 | |
| 290 | S | A | -1.3104 | |
| 291 | Q | A | -1.0261 | |
| 292 | T | A | 0.0000 | |
| 293 | L | A | 0.0000 | |
| 294 | S | A | -0.5601 | |
| 295 | W | A | 0.0000 | |
| 296 | E | A | -1.9597 | |
| 297 | P | A | 0.0000 | |
| 298 | A | A | -0.6830 | |
| 299 | C | A | 0.0000 | |
| 300 | P | A | -0.9981 | |
| 301 | V | A | -0.5088 | |
| 302 | S | A | -0.6006 | |
| 303 | G | A | -0.4172 | |
| 304 | H | A | -0.9617 | |
| 305 | V | A | 0.0000 | |
| 306 | S | A | 0.0000 | |
| 307 | L | A | 0.0000 | |
| 308 | C | A | 0.0000 | |
| 309 | W | A | -1.0005 | |
| 310 | R | A | -1.3847 | |
| 311 | P | A | -0.8954 | |
| 312 | G | A | -0.8459 | |
| 313 | P | A | -0.7425 | |
| 314 | G | A | -0.7877 | |
| 315 | A | A | -0.8154 | |
| 316 | G | A | -1.1081 | |
| 317 | C | A | -1.4248 | |
| 318 | R | A | -2.1580 | |
| 319 | K | A | -2.7988 | |
| 320 | L | A | -1.8252 | |
| 321 | Q | A | -2.2922 | |
| 322 | Q | A | -2.1684 | |
| 323 | S | A | 0.0000 | |
| 324 | S | A | -1.1629 | |
| 325 | Q | A | -0.6031 | |
| 326 | L | A | 0.0444 | |
| 327 | V | A | 0.0000 | |
| 328 | H | A | -2.2900 | |
| 329 | R | A | -3.2312 | |
| 330 | R | A | -3.4438 | |
| 331 | V | A | 0.0000 | |
| 332 | Q | A | -1.4209 | |
| 333 | Y | A | 0.0000 | |
| 334 | P | A | -0.5216 | |
| 335 | L | A | -0.2101 | |
| 336 | V | A | 0.0000 | |
| 337 | D | A | 0.0000 | |
| 338 | T | A | 0.0000 | |
| 339 | Q | A | 0.0000 | |
| 340 | P | A | -1.4968 | |
| 341 | Q | A | -1.2644 | |
| 342 | L | A | 0.0000 | |
| 343 | C | A | 0.0000 | |
| 344 | L | A | 0.0000 | |
| 345 | K | A | -1.0075 | |
| 346 | F | A | 0.0000 | |
| 347 | S | A | -0.2922 | |
| 348 | T | A | -0.1105 | |
| 349 | S | A | 0.1294 | |
| 350 | W | A | 0.8320 | |
| 351 | G | A | 0.2681 | |
| 352 | S | A | -0.1412 | |
| 353 | W | A | 0.0000 | |
| 354 | V | A | -0.4043 | |
| 355 | R | A | -1.5484 | |
| 356 | C | A | -1.2421 | |
| 357 | P | A | -1.0271 | |
| 358 | F | A | 0.0000 | |
| 359 | E | A | -3.0170 | |
| 360 | Q | A | -2.6901 | |
| 361 | R | A | -2.2198 | |
| 362 | R | A | -1.8613 | |
| 363 | F | A | 0.3247 | |
| 364 | P | A | -0.1012 | |
| 365 | T | A | -0.0038 | |
| 366 | W | A | 0.0000 | |
| 367 | K | A | -0.2010 | |
| 368 | M | A | 0.0000 | |
| 369 | T | A | -0.2051 | |
| 370 | I | A | 0.0000 | |
| 371 | Q | A | -1.0457 | |
| 372 | P | A | -1.3543 | |
| 373 | S | A | -1.3564 | |
| 374 | P | A | -1.0958 | |
| 375 | T | A | -1.4016 | |
| 376 | K | A | -2.2738 | |
| 377 | G | A | -2.1962 | |
| 378 | H | A | -2.2445 | |
| 379 | L | A | 0.0000 | |
| 380 | R | A | -0.8638 | |
| 381 | V | A | 0.0000 | |
| 382 | T | A | 0.0000 | |
| 383 | F | A | 0.0000 | |
| 384 | F | A | 0.6360 | |
| 385 | S | A | 0.0000 | |
| 386 | S | A | -0.0318 | |
| 387 | S | A | -0.2199 | |
| 388 | P | A | -0.2885 | |
| 389 | A | A | 0.0000 | |
| 390 | H | A | -0.6820 | |
| 391 | F | A | 0.0000 | |
| 392 | Q | A | -0.8551 | |
| 393 | V | A | 0.0000 | |
| 394 | H | A | -1.1665 | |
| 395 | L | A | 0.0000 | |
| 396 | C | A | 0.0000 | |
| 397 | H | A | -2.1973 | |
| 398 | R | A | -3.3700 | |
| 399 | R | A | -3.8131 | |
| 400 | K | A | -3.2798 | |
| 401 | S | A | -2.0265 | |
| 402 | Q | A | -1.6978 | |
| 403 | L | A | -0.0593 | |
| 404 | P | A | -1.0798 | |
| 405 | A | A | -0.7382 | |
| 406 | C | A | -0.9209 | |
| 407 | Q | A | -2.0595 | |
| 408 | R | A | -2.4472 | |
| 409 | T | A | -1.3772 | |
| 410 | L | A | -0.9690 | |
| 411 | Q | A | -1.3212 | |
| 412 | A | A | 0.0000 | |
| 413 | S | A | -0.2984 | |
| 414 | P | A | 0.2348 | |
| 415 | L | A | 0.6960 | |
| 416 | P | A | 0.0079 | |
| 417 | S | A | -0.2813 | |
| 418 | A | A | -0.4367 | |
| 419 | S | A | -0.8087 | |
| 420 | G | A | -1.0081 | |
| 421 | D | A | -1.3113 | |
| 422 | L | A | 0.5570 | |
| 423 | A | A | 0.1154 | |
| 424 | A | A | 0.1574 | |
| 425 | A | A | 0.0950 | |
| 426 | P | A | 0.0503 | |
| 427 | A | A | 0.4087 | |
| 428 | F | A | 1.1868 | |
| 429 | A | A | 0.0000 | |
| 430 | F | A | 0.6132 | |
| 431 | L | A | 0.0000 | |
| 432 | D | A | -0.8703 | |
| 433 | L | A | 0.0000 | |
| 434 | P | A | -1.7681 | |
| 435 | R | A | -2.4880 | |
| 436 | E | A | -2.6224 | |
| 437 | E | A | -1.6883 | |
| 438 | A | A | 0.0000 | |
| 439 | C | A | -1.3205 | |
| 440 | A | A | -0.8966 | |
| 441 | P | A | -0.8582 | |
| 442 | G | A | -1.2006 | |
| 443 | I | A | -1.0862 | |
| 444 | C | A | 0.0000 | |
| 445 | I | A | 0.0000 | |
| 446 | Q | A | -0.3047 | |
| 447 | G | A | 0.0000 | |
| 448 | W | A | -0.2317 | |
| 449 | R | A | 0.0000 | |
| 450 | T | A | -0.9140 | |
| 451 | D | A | -1.1775 | |
| 452 | V | A | -0.6634 | |
| 453 | H | A | -1.0862 | |
| 454 | F | A | 0.0000 | |
| 455 | S | A | -0.3227 | |
| 456 | V | A | 0.0000 | |
| 457 | P | A | -0.2406 | |
| 458 | Q | A | -0.5186 | |
| 459 | Q | A | -0.3623 | |
| 460 | L | A | -0.0141 | |
| 461 | C | A | -0.9173 | |
| 462 | N | A | -1.5223 | |
| 463 | L | A | 0.0000 | |
| 464 | R | A | -2.3050 | |
| 465 | S | A | -1.5376 | |
| 466 | S | A | 0.0000 | |
| 467 | G | A | -1.3197 | |
| 468 | C | A | -1.4169 | |
| 469 | P | A | -1.1262 | |
| 470 | S | A | -0.8627 | |
| 471 | L | A | -0.0757 | |
| 472 | R | A | -1.4499 | |
| 473 | G | A | -0.9387 |
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