| Chain sequence(s) |
A: MHFSTVTRDMEAFTASSLSSLGAAGGFPGAASPGADPYGPREPPPPPPRYDPCAAAAPGAPGPPPPPHAYPFAPAAGAATSAAAEPEGPGASCAAAAKAPVKKNAKVAGVSVQLEMKALWDEFNQLGTEMIVTKAGRRMFPTFQVKLFGMDPMADYMLLMDFVPVDDKRYRYAFHSSSWLVAGKADPATPGRVHYHPDSPAKGAQWMKQIVSFDKLKLTNNLLDDNGHIILNSMHRYQPRFHVVYVDPRKDSEKYAEENFKTFVFEETRFTAVTAYQNHRITQLKIASNPFAKGFRDCDPEDWPRNHRPGALPLMSAFARSRNPVASPTQPSGTEKDAAEARREFQRDAGGPAVLGDPAHPPQLLARVLSPSLPGAGGAGGLVPLPGAPGGRPSPPNPELRLEAPGASEPLHHHPYKYPAAAYDHYLGAKSRPAPYPLPGLRGHGYHPHAHPHHHHHPVSPAAAAAAAAAAAAAAANMYSSAGAAPPGSYDYCPR
input PDB |
| Selected Chain(s) | A |
| Distance of aggregation | 10 Å |
| FoldX usage | Yes |
| Dynamic mode | No |
| Automated mutations | No |
| Mutated residues | PT141A |
| Energy difference between WT (input) and mutated protein (by FoldX) | 9.26433 kcal/mol
CAUTION: Your mutation/s can destabilize the protein structure |
| 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] FoldX: Building mutant model (00:06:54)
[INFO] FoldX: Starting FoldX energy minimalization (00:07:03)
[INFO] Analysis: Starting Aggrescan3D on folded.pdb (00:10:15)
[INFO] Main: Simulation completed successfully. (00:10:21)
|
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 | 1.3270 | |
| 2 | H | A | 0.7775 | |
| 3 | F | A | 1.9865 | |
| 4 | S | A | 0.6478 | |
| 5 | T | A | 0.0751 | |
| 6 | V | A | 0.7318 | |
| 7 | T | A | -0.5034 | |
| 8 | R | A | -2.2525 | |
| 9 | D | A | -2.4503 | |
| 10 | M | A | -1.4347 | |
| 11 | E | A | -1.9577 | |
| 12 | A | A | -1.2287 | |
| 13 | F | A | -0.9659 | |
| 14 | T | A | 0.0000 | |
| 15 | A | A | -0.6756 | |
| 16 | S | A | -0.3073 | |
| 17 | S | A | -0.2842 | |
| 18 | L | A | 0.0000 | |
| 19 | S | A | -0.3323 | |
| 20 | S | A | -0.0858 | |
| 21 | L | A | 0.2704 | |
| 22 | G | A | -0.3390 | |
| 23 | A | A | -0.0813 | |
| 24 | A | A | 0.0343 | |
| 25 | G | A | -0.2077 | |
| 26 | G | A | 0.0969 | |
| 27 | F | A | 1.3742 | |
| 28 | P | A | 0.3119 | |
| 29 | G | A | -0.0713 | |
| 30 | A | A | -0.0496 | |
| 31 | A | A | -0.2727 | |
| 32 | S | A | -0.4462 | |
| 33 | P | A | -0.5509 | |
| 34 | G | A | -0.9920 | |
| 35 | A | A | -1.0376 | |
| 36 | D | A | -1.7009 | |
| 37 | P | A | -0.6591 | |
| 38 | Y | A | 0.2433 | |
| 39 | G | A | -0.9223 | |
| 40 | P | A | -1.5795 | |
| 41 | R | A | -2.9061 | |
| 42 | E | A | -3.0460 | |
| 43 | P | A | -1.8275 | |
| 44 | P | A | -1.2233 | |
| 45 | P | A | -0.8651 | |
| 46 | P | A | -0.9065 | |
| 47 | P | A | -0.8835 | |
| 48 | P | A | -1.2406 | |
| 49 | R | A | -1.9111 | |
| 50 | Y | A | -0.5317 | |
| 51 | D | A | -1.5954 | |
| 52 | P | A | -0.6079 | |
| 53 | C | A | 0.3518 | |
| 54 | A | A | 0.4116 | |
| 55 | A | A | 0.2289 | |
| 56 | A | A | 0.0905 | |
| 57 | A | A | -0.1237 | |
| 58 | P | A | -0.4492 | |
| 59 | G | A | -0.6517 | |
| 60 | A | A | -0.4571 | |
| 61 | P | A | -0.6783 | |
| 62 | G | A | -0.8375 | |
| 63 | P | A | -0.7458 | |
| 64 | P | A | -0.7224 | |
| 65 | P | A | -0.7847 | |
| 66 | P | A | -0.8109 | |
| 67 | P | A | -0.7881 | |
| 68 | H | A | -0.8810 | |
| 69 | A | A | 0.2698 | |
| 70 | Y | A | 1.4427 | |
| 71 | P | A | 1.2141 | |
| 72 | F | A | 2.1272 | |
| 73 | A | A | 0.9661 | |
| 74 | P | A | 0.1960 | |
| 75 | A | A | 0.0653 | |
| 76 | A | A | -0.1851 | |
| 77 | G | A | -0.4100 | |
| 78 | A | A | -0.1405 | |
| 79 | A | A | -0.0919 | |
| 80 | T | A | -0.1187 | |
| 81 | S | A | -0.1930 | |
| 82 | A | A | -0.0200 | |
| 83 | A | A | -0.3437 | |
| 84 | A | A | -0.8997 | |
| 85 | E | A | -2.2729 | |
| 86 | P | A | -2.1127 | |
| 87 | E | A | -2.6588 | |
| 88 | G | A | -1.6621 | |
| 89 | P | A | -1.1217 | |
| 90 | G | A | -0.8913 | |
| 91 | A | A | -0.2058 | |
| 92 | S | A | 0.0330 | |
| 93 | C | A | 0.6446 | |
| 94 | A | A | 0.4171 | |
| 95 | A | A | 0.0951 | |
| 96 | A | A | -0.2434 | |
| 97 | A | A | -0.7302 | |
| 98 | K | A | -1.5622 | |
| 99 | A | A | -0.9068 | |
| 100 | P | A | -0.9338 | |
| 101 | V | A | -1.1540 | |
| 102 | K | A | -2.2561 | |
| 103 | K | A | -2.3884 | |
| 104 | N | A | -1.5787 | |
| 105 | A | A | -1.1170 | |
| 106 | K | A | -1.2764 | |
| 107 | V | A | 0.0000 | |
| 108 | A | A | -1.1878 | |
| 109 | G | A | -0.8872 | |
| 110 | V | A | 0.0000 | |
| 111 | S | A | -0.2197 | |
| 112 | V | A | -0.0981 | |
| 113 | Q | A | -0.9044 | |
| 114 | L | A | 0.0000 | |
| 115 | E | A | -0.8432 | |
| 116 | M | A | -0.6217 | |
| 117 | K | A | -2.1371 | |
| 118 | A | A | -1.5917 | |
| 119 | L | A | -1.3715 | |
| 120 | W | A | 0.0000 | |
| 121 | D | A | -3.5866 | |
| 122 | E | A | -3.1256 | |
| 123 | F | A | 0.0000 | |
| 124 | N | A | -2.6753 | |
| 125 | Q | A | -2.3800 | |
| 126 | L | A | -1.5952 | |
| 127 | G | A | -1.3362 | |
| 128 | T | A | 0.0000 | |
| 129 | E | A | 0.0000 | |
| 130 | M | A | 0.0000 | |
| 131 | I | A | -0.0467 | |
| 132 | V | A | 0.0000 | |
| 133 | T | A | -1.3493 | |
| 134 | K | A | -1.7002 | |
| 135 | A | A | -1.2722 | |
| 136 | G | A | -1.6069 | |
| 137 | R | A | -1.7939 | |
| 138 | R | A | -2.3120 | |
| 139 | M | A | 0.0000 | |
| 140 | F | A | -0.2623 | |
| 141 | T | A | 0.0000 | mutated: PT141A |
| 142 | T | A | -0.6840 | |
| 143 | F | A | 0.0000 | |
| 144 | Q | A | -0.6310 | |
| 145 | V | A | 0.0000 | |
| 146 | K | A | -0.9197 | |
| 147 | L | A | 0.0000 | |
| 148 | F | A | 0.2523 | |
| 149 | G | A | -0.3331 | |
| 150 | M | A | 0.0000 | |
| 151 | D | A | -0.5508 | |
| 152 | P | A | -0.5306 | |
| 153 | M | A | 0.3352 | |
| 154 | A | A | -0.3684 | |
| 155 | D | A | -1.1634 | |
| 156 | Y | A | 0.0000 | |
| 157 | M | A | 0.0000 | |
| 158 | L | A | 0.0000 | |
| 159 | L | A | 0.0000 | |
| 160 | M | A | 0.0000 | |
| 161 | D | A | 0.0000 | |
| 162 | F | A | 0.0823 | |
| 163 | V | A | 0.0584 | |
| 164 | P | A | -0.5886 | |
| 165 | V | A | -0.3722 | |
| 166 | D | A | -1.5531 | |
| 167 | D | A | -3.1737 | |
| 168 | K | A | -2.3502 | |
| 169 | R | A | -1.9753 | |
| 170 | Y | A | 0.0000 | |
| 171 | R | A | -0.8037 | |
| 172 | Y | A | 0.0000 | |
| 173 | A | A | 0.3373 | |
| 174 | F | A | 0.9550 | |
| 175 | H | A | -0.2371 | |
| 176 | S | A | -0.0454 | |
| 177 | S | A | -0.1014 | |
| 178 | S | A | 0.1207 | |
| 179 | W | A | 0.7639 | |
| 180 | L | A | 1.4340 | |
| 181 | V | A | 1.3812 | |
| 182 | A | A | -0.0065 | |
| 183 | G | A | -1.4203 | |
| 184 | K | A | -2.9343 | |
| 185 | A | A | -2.8595 | |
| 186 | D | A | -2.8249 | |
| 187 | P | A | -1.5500 | |
| 188 | A | A | -0.8722 | |
| 189 | T | A | -0.4419 | |
| 190 | P | A | -0.3750 | |
| 191 | G | A | -0.7367 | |
| 192 | R | A | -0.7938 | |
| 193 | V | A | -0.3706 | |
| 194 | H | A | -0.5108 | |
| 195 | Y | A | -0.3558 | |
| 196 | H | A | 0.0000 | |
| 197 | P | A | -1.3249 | |
| 198 | D | A | -2.1091 | |
| 199 | S | A | -1.1790 | |
| 200 | P | A | -0.8915 | |
| 201 | A | A | -1.2644 | |
| 202 | K | A | -1.3437 | |
| 203 | G | A | 0.0000 | |
| 204 | A | A | -1.1716 | |
| 205 | Q | A | -2.3206 | |
| 206 | W | A | 0.0000 | |
| 207 | M | A | -1.1779 | |
| 208 | K | A | -2.3900 | |
| 209 | Q | A | -1.9539 | |
| 210 | I | A | -0.6186 | |
| 211 | V | A | 0.0000 | |
| 212 | S | A | -0.7998 | |
| 213 | F | A | 0.0000 | |
| 214 | D | A | -2.1353 | |
| 215 | K | A | -2.6953 | |
| 216 | L | A | 0.0000 | |
| 217 | K | A | -2.0076 | |
| 218 | L | A | 0.0000 | |
| 219 | T | A | 0.0000 | |
| 220 | N | A | -0.7296 | |
| 221 | N | A | -0.2444 | |
| 222 | L | A | 1.2043 | |
| 223 | L | A | 1.1262 | |
| 224 | D | A | 0.0000 | |
| 225 | D | A | -2.0370 | |
| 226 | N | A | -2.2392 | |
| 227 | G | A | -1.6149 | |
| 228 | H | A | -1.9182 | |
| 229 | I | A | 0.0000 | |
| 230 | I | A | 0.0000 | |
| 231 | L | A | 0.0000 | |
| 232 | N | A | -0.6897 | |
| 233 | S | A | -0.4983 | |
| 234 | M | A | -0.6859 | |
| 235 | H | A | 0.0000 | |
| 236 | R | A | -0.9093 | |
| 237 | Y | A | 0.0000 | |
| 238 | Q | A | 0.0000 | |
| 239 | P | A | 0.0000 | |
| 240 | R | A | 0.0238 | |
| 241 | F | A | 0.0000 | |
| 242 | H | A | 0.0000 | |
| 243 | V | A | 0.0000 | |
| 244 | V | A | 0.0000 | |
| 245 | Y | A | -0.2986 | |
| 246 | V | A | -0.4607 | |
| 247 | D | A | -1.4487 | |
| 248 | P | A | -1.7501 | |
| 249 | R | A | -3.2261 | |
| 250 | K | A | -3.5665 | |
| 251 | D | A | -3.8317 | |
| 252 | S | A | -3.0077 | |
| 253 | E | A | -3.2501 | |
| 254 | K | A | -2.9949 | |
| 255 | Y | A | -1.8867 | |
| 256 | A | A | 0.0000 | |
| 257 | E | A | -1.8827 | |
| 258 | E | A | -1.9861 | |
| 259 | N | A | 0.0000 | |
| 260 | F | A | -0.4902 | |
| 261 | K | A | -0.6930 | |
| 262 | T | A | 0.1593 | |
| 263 | F | A | 0.2704 | |
| 264 | V | A | 0.3857 | |
| 265 | F | A | -0.7182 | |
| 266 | E | A | -2.1331 | |
| 267 | E | A | -2.5115 | |
| 268 | T | A | 0.0000 | |
| 269 | R | A | -1.4335 | |
| 270 | F | A | 0.0000 | |
| 271 | T | A | 0.0000 | |
| 272 | A | A | 0.0000 | |
| 273 | V | A | 0.0000 | |
| 274 | T | A | -0.1334 | |
| 275 | A | A | 0.2800 | |
| 276 | Y | A | 0.0333 | |
| 277 | Q | A | -0.4222 | |
| 278 | N | A | -0.9776 | |
| 279 | H | A | -1.9207 | |
| 280 | R | A | -2.6054 | |
| 281 | I | A | 0.0000 | |
| 282 | T | A | -1.2628 | |
| 283 | Q | A | -1.9138 | |
| 284 | L | A | -1.1987 | |
| 285 | K | A | 0.0000 | |
| 286 | I | A | -0.6848 | |
| 287 | A | A | -0.6921 | |
| 288 | S | A | -0.2808 | |
| 289 | N | A | -0.1099 | |
| 290 | P | A | 0.0279 | |
| 291 | F | A | 1.3675 | |
| 292 | A | A | -0.0653 | |
| 293 | K | A | -1.6952 | |
| 294 | G | A | -1.0251 | |
| 295 | F | A | -0.6854 | |
| 296 | R | A | -2.3839 | |
| 297 | D | A | -2.5378 | |
| 298 | C | A | -1.7015 | |
| 299 | D | A | -3.0434 | |
| 300 | P | A | -2.5875 | |
| 301 | E | A | -3.2477 | |
| 302 | D | A | -2.9053 | |
| 303 | W | A | -1.3956 | |
| 304 | P | A | -1.9334 | |
| 305 | R | A | -3.5082 | |
| 306 | N | A | -3.1310 | |
| 307 | H | A | -3.2383 | |
| 308 | R | A | -3.2723 | |
| 309 | P | A | -1.5985 | |
| 310 | G | A | -0.8215 | |
| 311 | A | A | 0.2956 | |
| 312 | L | A | 1.8610 | |
| 313 | P | A | 1.4819 | |
| 314 | L | A | 2.3052 | |
| 315 | M | A | 2.0780 | |
| 316 | S | A | 1.2647 | |
| 317 | A | A | 1.1920 | |
| 318 | F | A | 1.5970 | |
| 319 | A | A | 0.0600 | |
| 320 | R | A | -1.9893 | |
| 321 | S | A | -2.0387 | |
| 322 | R | A | -3.0243 | |
| 323 | N | A | -2.1719 | |
| 324 | P | A | -0.4289 | |
| 325 | V | A | 1.3770 | |
| 326 | A | A | 0.6950 | |
| 327 | S | A | 0.0455 | |
| 328 | P | A | -0.6335 | |
| 329 | T | A | -0.8557 | |
| 330 | Q | A | -1.4719 | |
| 331 | P | A | -1.1265 | |
| 332 | S | A | -0.8307 | |
| 333 | G | A | -1.0139 | |
| 334 | T | A | -1.6225 | |
| 335 | E | A | -3.2948 | |
| 336 | K | A | -3.5977 | |
| 337 | D | A | -3.1587 | |
| 338 | A | A | -1.7325 | |
| 339 | A | A | -1.3684 | |
| 340 | E | A | -2.5495 | |
| 341 | A | A | -2.0478 | |
| 342 | R | A | -3.4742 | |
| 343 | R | A | -3.4782 | |
| 344 | E | A | -2.3773 | |
| 345 | F | A | -0.7527 | |
| 346 | Q | A | -2.0039 | |
| 347 | R | A | -2.9836 | |
| 348 | D | A | -2.9415 | |
| 349 | A | A | -1.8120 | |
| 350 | G | A | -1.0755 | |
| 351 | G | A | -0.8100 | |
| 352 | P | A | -0.2592 | |
| 353 | A | A | 1.0263 | |
| 354 | V | A | 2.3942 | |
| 355 | L | A | 1.7787 | |
| 356 | G | A | -0.2631 | |
| 357 | D | A | -1.7694 | |
| 358 | P | A | -1.3811 | |
| 359 | A | A | -0.9956 | |
| 360 | H | A | -1.3350 | |
| 361 | P | A | -0.9532 | |
| 362 | P | A | -0.6902 | |
| 363 | Q | A | -0.3120 | |
| 364 | L | A | 1.4498 | |
| 365 | L | A | 1.7367 | |
| 366 | A | A | 0.8301 | |
| 367 | R | A | -0.0036 | |
| 368 | V | A | 1.7286 | |
| 369 | L | A | 1.7313 | |
| 370 | S | A | 0.7232 | |
| 371 | P | A | 0.4689 | |
| 372 | S | A | 0.4401 | |
| 373 | L | A | 1.1017 | |
| 374 | P | A | 0.1351 | |
| 375 | G | A | -0.3003 | |
| 376 | A | A | -0.3712 | |
| 377 | G | A | -0.8566 | |
| 378 | G | A | -0.8672 | |
| 379 | A | A | -0.4771 | |
| 380 | G | A | -0.4833 | |
| 381 | G | A | 0.3609 | |
| 382 | L | A | 2.0441 | |
| 383 | V | A | 2.6315 | |
| 384 | P | A | 1.7336 | |
| 385 | L | A | 1.5622 | |
| 386 | P | A | 0.3601 | |
| 387 | G | A | -0.2641 | |
| 388 | A | A | -0.2996 | |
| 389 | P | A | -0.6577 | |
| 390 | G | A | -1.2595 | |
| 391 | G | A | -1.7358 | |
| 392 | R | A | -2.3619 | |
| 393 | P | A | -1.3807 | |
| 394 | S | A | -0.8689 | |
| 395 | P | A | -0.9929 | |
| 396 | P | A | -1.0835 | |
| 397 | N | A | -1.9807 | |
| 398 | P | A | -1.5093 | |
| 399 | E | A | -1.8822 | |
| 400 | L | A | -0.0690 | |
| 401 | R | A | -1.0394 | |
| 402 | L | A | 0.0415 | |
| 403 | E | A | -1.4187 | |
| 404 | A | A | -0.8154 | |
| 405 | P | A | -0.8501 | |
| 406 | G | A | -0.5915 | |
| 407 | A | A | -0.7472 | |
| 408 | S | A | -1.2122 | |
| 409 | E | A | -1.7383 | |
| 410 | P | A | -0.6565 | |
| 411 | L | A | 0.2765 | |
| 412 | H | A | -0.8972 | |
| 413 | H | A | -1.6380 | |
| 414 | H | A | -1.7484 | |
| 415 | P | A | -0.6883 | |
| 416 | Y | A | 0.4704 | |
| 417 | K | A | -0.6489 | |
| 418 | Y | A | 0.6955 | |
| 419 | P | A | 0.1458 | |
| 420 | A | A | 0.2530 | |
| 421 | A | A | 0.3649 | |
| 422 | A | A | 0.1205 | |
| 423 | Y | A | 0.4382 | |
| 424 | D | A | -1.1032 | |
| 425 | H | A | -0.5857 | |
| 426 | Y | A | 1.2340 | |
| 427 | L | A | 1.3595 | |
| 428 | G | A | 0.4054 | |
| 429 | A | A | -0.5542 | |
| 430 | K | A | -2.1587 | |
| 431 | S | A | -2.0025 | |
| 432 | R | A | -2.5081 | |
| 433 | P | A | -1.2839 | |
| 434 | A | A | -0.4022 | |
| 435 | P | A | 0.0764 | |
| 436 | Y | A | 1.4047 | |
| 437 | P | A | 0.9587 | |
| 438 | L | A | 1.6833 | |
| 439 | P | A | 0.4840 | |
| 440 | G | A | 0.0746 | |
| 441 | L | A | 0.3376 | |
| 442 | R | A | -1.6615 | |
| 443 | G | A | -1.6064 | |
| 444 | H | A | -1.3640 | |
| 445 | G | A | -0.6203 | |
| 446 | Y | A | 0.3276 | |
| 447 | H | A | -0.7567 | |
| 448 | P | A | -0.9269 | |
| 449 | H | A | -1.4906 | |
| 450 | A | A | -1.0039 | |
| 451 | H | A | -1.6446 | |
| 452 | P | A | -1.4755 | |
| 453 | H | A | -2.1897 | |
| 454 | H | A | -2.4841 | |
| 455 | H | A | -2.4783 | |
| 456 | H | A | -2.1507 | |
| 457 | H | A | -1.5437 | |
| 458 | P | A | -0.3215 | |
| 459 | V | A | 1.1358 | |
| 460 | S | A | 0.3633 | |
| 461 | P | A | 0.1092 | |
| 462 | A | A | 0.1959 | |
| 463 | A | A | 0.2597 | |
| 464 | A | A | 0.0661 | |
| 465 | A | A | 0.4988 | |
| 466 | A | A | 0.3882 | |
| 467 | A | A | 0.1856 | |
| 468 | A | A | 0.2244 | |
| 469 | A | A | 0.5160 | |
| 470 | A | A | 0.1764 | |
| 471 | A | A | 0.0318 | |
| 472 | A | A | 0.0127 | |
| 473 | A | A | -0.0141 | |
| 474 | A | A | 0.1426 | |
| 475 | A | A | 0.2851 | |
| 476 | A | A | 0.0402 | |
| 477 | N | A | -0.4512 | |
| 478 | M | A | 0.9238 | |
| 479 | Y | A | 1.2103 | |
| 480 | S | A | 0.0056 | |
| 481 | S | A | -0.0028 | |
| 482 | A | A | 0.2041 | |
| 483 | G | A | -0.3495 | |
| 484 | A | A | -0.2558 | |
| 485 | A | A | -0.2798 | |
| 486 | P | A | -0.5418 | |
| 487 | P | A | -0.4948 | |
| 488 | G | A | -0.6272 | |
| 489 | S | A | -0.1960 | |
| 490 | Y | A | 0.5962 | |
| 491 | D | A | -0.4304 | |
| 492 | Y | A | 0.8441 | |
| 493 | C | A | 0.4992 | |
| 494 | P | A | -0.4771 | |
| 495 | R | A | -1.6564 |
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