| Chain sequence(s) |
A: MLSQLAMLQGSLLLVVATMSVAQQTRQEADRGCETLVVQHGHCSYTFLLPKSEPCPPGPEVSRDSNTLQRESLANPLHLGKLPTQQVKQLEQALQNNTQWLKKLERAIKTILRSKLEQVQQQMAQNQTAPMLELGTSLLNQTTAQIRKLTDMEAQLLNQTSRMDAQMPETFLSTNKLENQLLLQRQKLQQLQGQNSALEKRLQALETKQQEELASILSKKAKLLNTLSRQSAALTNIERGLRGVRHNSSLLQDQQHSLRQLLVLLRHLVQERANASAPAFIMAGEQVFQDCAEIQRSGASASGVYTIQVSNATKPRKVFCDLQSSGGRWTLIQRRENGTVNFQRNWKDYKQGFGDPAGEHWLGNEVVHQLTRRAAYSLRVELQDWEGHEAYAQYEHFHLGSENQLYRLSVVGYSGSAGRQSSLVLQNTSFSTLDSDNDHCLCKCAQVMSGGWWFDACGLSNLNGVYYHAPDNKYKMDGIRWHYFKGPSYSLRASRMMIRPLDI
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 (00:07:44)
[INFO] Main: Simulation completed successfully. (00:07:47)
|
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 | 1.7160 | |
| 2 | L | A | 2.1764 | |
| 3 | S | A | 1.1495 | |
| 4 | Q | A | 0.7868 | |
| 5 | L | A | 2.1643 | |
| 6 | A | A | 1.3726 | |
| 7 | M | A | 1.8123 | |
| 8 | L | A | 2.2388 | |
| 9 | Q | A | 1.2408 | |
| 10 | G | A | 1.6360 | |
| 11 | S | A | 2.1903 | |
| 12 | L | A | 3.3152 | |
| 13 | L | A | 3.3250 | |
| 14 | L | A | 3.3944 | |
| 15 | V | A | 3.3868 | |
| 16 | V | A | 3.2211 | |
| 17 | A | A | 2.5634 | |
| 18 | T | A | 2.0549 | |
| 19 | M | A | 1.8168 | |
| 20 | S | A | 0.6157 | |
| 21 | V | A | 1.0746 | |
| 22 | A | A | -0.2725 | |
| 23 | Q | A | -2.0100 | |
| 24 | Q | A | -2.3895 | |
| 25 | T | A | -2.5358 | |
| 26 | R | A | -4.0409 | |
| 27 | Q | A | -4.3135 | |
| 28 | E | A | -4.3509 | |
| 29 | A | A | -3.3037 | |
| 30 | D | A | -4.0165 | |
| 31 | R | A | -4.0558 | |
| 32 | G | A | -2.6918 | |
| 33 | C | A | -1.2108 | |
| 34 | E | A | -1.3721 | |
| 35 | T | A | 1.0578 | |
| 36 | L | A | 2.6250 | |
| 37 | V | A | 2.7676 | |
| 38 | V | A | 1.1799 | |
| 39 | Q | A | -1.1535 | |
| 40 | H | A | -1.7425 | |
| 41 | G | A | -1.6590 | |
| 42 | H | A | -1.5992 | |
| 43 | C | A | -0.8093 | |
| 44 | S | A | -0.1706 | |
| 45 | Y | A | 1.5271 | |
| 46 | T | A | 2.3723 | |
| 47 | F | A | 3.1877 | |
| 48 | L | A | 2.1957 | |
| 49 | L | A | 1.1272 | |
| 50 | P | A | -1.1738 | |
| 51 | K | A | -2.6755 | |
| 52 | S | A | -2.0066 | |
| 53 | E | A | -2.4348 | |
| 54 | P | A | -1.1285 | |
| 55 | C | A | -0.1118 | |
| 56 | P | A | -0.4752 | |
| 57 | P | A | -0.7589 | |
| 58 | G | A | -0.9492 | |
| 59 | P | A | -1.0450 | |
| 60 | E | A | -1.5106 | |
| 61 | V | A | 0.0911 | |
| 62 | S | A | -1.1996 | |
| 63 | R | A | -2.8994 | |
| 64 | D | A | -2.9999 | |
| 65 | S | A | -2.1199 | |
| 66 | N | A | -1.7953 | |
| 67 | T | A | -0.7206 | |
| 68 | L | A | -0.0531 | |
| 69 | Q | A | -1.9637 | |
| 70 | R | A | -3.0416 | |
| 71 | E | A | -2.5539 | |
| 72 | S | A | -0.9015 | |
| 73 | L | A | 0.7271 | |
| 74 | A | A | 0.0970 | |
| 75 | N | A | -0.8033 | |
| 76 | P | A | 0.0277 | |
| 77 | L | A | 1.0719 | |
| 78 | H | A | 0.0188 | |
| 79 | L | A | 0.9422 | |
| 80 | G | A | -0.4816 | |
| 81 | K | A | -1.4173 | |
| 82 | L | A | -0.3430 | |
| 83 | P | A | -0.9378 | |
| 84 | T | A | -1.2286 | |
| 85 | Q | A | -1.9394 | |
| 86 | Q | A | -1.8570 | |
| 87 | V | A | -1.0963 | |
| 88 | K | A | -2.8851 | |
| 89 | Q | A | -2.6206 | |
| 90 | L | A | -1.1224 | |
| 91 | E | A | -2.7035 | |
| 92 | Q | A | -2.9031 | |
| 93 | A | A | -1.5857 | |
| 94 | L | A | -0.8268 | |
| 95 | Q | A | -2.1854 | |
| 96 | N | A | -2.2147 | |
| 97 | N | A | -1.6081 | |
| 98 | T | A | -1.1177 | |
| 99 | Q | A | -1.7709 | |
| 100 | W | A | -0.7826 | |
| 101 | L | A | -0.8216 | |
| 102 | K | A | -2.5020 | |
| 103 | K | A | -2.6760 | |
| 104 | L | A | -1.1004 | |
| 105 | E | A | -2.7612 | |
| 106 | R | A | -2.9300 | |
| 107 | A | A | -1.1335 | |
| 108 | I | A | -0.3607 | |
| 109 | K | A | -2.0558 | |
| 110 | T | A | -0.6233 | |
| 111 | I | A | 0.9015 | |
| 112 | L | A | 0.2593 | |
| 113 | R | A | -1.5969 | |
| 114 | S | A | -1.4244 | |
| 115 | K | A | -1.9189 | |
| 116 | L | A | -0.9244 | |
| 117 | E | A | -2.8612 | |
| 118 | Q | A | -2.7954 | |
| 119 | V | A | -1.7894 | |
| 120 | Q | A | -2.5544 | |
| 121 | Q | A | -3.1097 | |
| 122 | Q | A | -2.4155 | |
| 123 | M | A | -1.6851 | |
| 124 | A | A | -1.8884 | |
| 125 | Q | A | -2.4978 | |
| 126 | N | A | -2.5694 | |
| 127 | Q | A | -1.7240 | |
| 128 | T | A | -0.5738 | |
| 129 | A | A | -0.4887 | |
| 130 | P | A | -0.3006 | |
| 131 | M | A | 0.9356 | |
| 132 | L | A | 1.4311 | |
| 133 | E | A | 0.1370 | |
| 134 | L | A | 1.7459 | |
| 135 | G | A | 1.2181 | |
| 136 | T | A | 0.6014 | |
| 137 | S | A | 0.4893 | |
| 138 | L | A | 1.5322 | |
| 139 | L | A | 1.0431 | |
| 140 | N | A | -0.5481 | |
| 141 | Q | A | -1.0603 | |
| 142 | T | A | -0.3456 | |
| 143 | T | A | -0.5309 | |
| 144 | A | A | -1.1904 | |
| 145 | Q | A | -1.4417 | |
| 146 | I | A | -0.2834 | |
| 147 | R | A | -2.5533 | |
| 148 | K | A | -2.6586 | |
| 149 | L | A | -1.2257 | |
| 150 | T | A | -1.8496 | |
| 151 | D | A | -2.6995 | |
| 152 | M | A | -1.2664 | |
| 153 | E | A | -2.0078 | |
| 154 | A | A | -1.3210 | |
| 155 | Q | A | -1.4200 | |
| 156 | L | A | -0.1477 | |
| 157 | L | A | 0.2202 | |
| 158 | N | A | -1.4287 | |
| 159 | Q | A | -1.9199 | |
| 160 | T | A | -1.1603 | |
| 161 | S | A | -1.7326 | |
| 162 | R | A | -2.5963 | |
| 163 | M | A | -1.6018 | |
| 164 | D | A | -2.7224 | |
| 165 | A | A | -2.0813 | |
| 166 | Q | A | -1.8585 | |
| 167 | M | A | -0.6880 | |
| 168 | P | A | -0.3857 | |
| 169 | E | A | -1.3118 | |
| 170 | T | A | -0.0912 | |
| 171 | F | A | 1.3842 | |
| 172 | L | A | 0.8286 | |
| 173 | S | A | -0.2253 | |
| 174 | T | A | -0.7670 | |
| 175 | N | A | -1.9817 | |
| 176 | K | A | -2.2851 | |
| 177 | L | A | -0.7604 | |
| 178 | E | A | -2.3138 | |
| 179 | N | A | -2.4146 | |
| 180 | Q | A | -1.7005 | |
| 181 | L | A | -0.9445 | |
| 182 | L | A | 0.1337 | |
| 183 | L | A | 0.0370 | |
| 184 | Q | A | -1.7534 | |
| 185 | R | A | -2.2648 | |
| 186 | Q | A | -2.3221 | |
| 187 | K | A | -2.3129 | |
| 188 | L | A | -1.2287 | |
| 189 | Q | A | -3.0278 | |
| 190 | Q | A | -3.0091 | |
| 191 | L | A | -1.7828 | |
| 192 | Q | A | -2.3924 | |
| 193 | G | A | -2.0878 | |
| 194 | Q | A | -2.3900 | |
| 195 | N | A | -3.0155 | |
| 196 | S | A | -2.3201 | |
| 197 | A | A | -2.1732 | |
| 198 | L | A | -2.3757 | |
| 199 | E | A | -3.3716 | |
| 200 | K | A | -3.6419 | |
| 201 | R | A | -3.1376 | |
| 202 | L | A | -2.0269 | |
| 203 | Q | A | -3.0275 | |
| 204 | A | A | -2.2413 | |
| 205 | L | A | -2.0066 | |
| 206 | E | A | -3.6041 | |
| 207 | T | A | -3.1682 | |
| 208 | K | A | -3.8675 | |
| 209 | Q | A | -3.9444 | |
| 210 | Q | A | -3.6813 | |
| 211 | E | A | -3.8677 | |
| 212 | E | A | -3.3348 | |
| 213 | L | A | -1.1752 | |
| 214 | A | A | -1.0931 | |
| 215 | S | A | -0.9876 | |
| 216 | I | A | -0.0758 | |
| 217 | L | A | 0.5187 | |
| 218 | S | A | -0.5865 | |
| 219 | K | A | -1.3355 | |
| 220 | K | A | -1.1295 | |
| 221 | A | A | -0.7069 | |
| 222 | K | A | -1.6138 | |
| 223 | L | A | -0.0771 | |
| 224 | L | A | 0.4429 | |
| 225 | N | A | -1.2104 | |
| 226 | T | A | -0.6645 | |
| 227 | L | A | 0.5659 | |
| 228 | S | A | -0.5523 | |
| 229 | R | A | -1.8963 | |
| 230 | Q | A | -1.4410 | |
| 231 | S | A | -0.7352 | |
| 232 | A | A | -0.6876 | |
| 233 | A | A | -0.6745 | |
| 234 | L | A | -0.1216 | |
| 235 | T | A | -0.7507 | |
| 236 | N | A | -1.3523 | |
| 237 | I | A | -0.0888 | |
| 238 | E | A | -1.6091 | |
| 239 | R | A | -2.7826 | |
| 240 | G | A | -1.4168 | |
| 241 | L | A | -1.3379 | |
| 242 | R | A | -2.9939 | |
| 243 | G | A | -1.8956 | |
| 244 | V | A | -0.8447 | |
| 245 | R | A | -2.3968 | |
| 246 | H | A | -2.0036 | |
| 247 | N | A | -1.2812 | |
| 248 | S | A | -1.1004 | |
| 249 | S | A | -1.0103 | |
| 250 | L | A | -0.1900 | |
| 251 | L | A | -0.2513 | |
| 252 | Q | A | -1.6476 | |
| 253 | D | A | -2.5141 | |
| 254 | Q | A | -2.2902 | |
| 255 | Q | A | -2.4096 | |
| 256 | H | A | -2.6680 | |
| 257 | S | A | -1.6615 | |
| 258 | L | A | -0.4445 | |
| 259 | R | A | -1.6020 | |
| 260 | Q | A | -0.6221 | |
| 261 | L | A | 1.4012 | |
| 262 | L | A | 1.1071 | |
| 263 | V | A | 0.8857 | |
| 264 | L | A | 2.2179 | |
| 265 | L | A | 2.0088 | |
| 266 | R | A | -0.2472 | |
| 267 | H | A | -0.3183 | |
| 268 | L | A | 1.5686 | |
| 269 | V | A | 0.8112 | |
| 270 | Q | A | -1.9401 | |
| 271 | E | A | -3.1357 | |
| 272 | R | A | -3.2371 | |
| 273 | A | A | -2.0425 | |
| 274 | N | A | -1.8345 | |
| 275 | A | A | -0.6691 | |
| 276 | S | A | -0.4747 | |
| 277 | A | A | -0.1672 | |
| 278 | P | A | 0.1376 | |
| 279 | A | A | 1.4489 | |
| 280 | F | A | 3.1403 | |
| 281 | I | A | 3.4228 | |
| 282 | M | A | 2.1817 | |
| 283 | A | A | 0.4723 | |
| 284 | G | A | -0.8960 | |
| 285 | E | A | -1.9924 | |
| 286 | Q | A | -1.3937 | |
| 287 | V | A | 0.5107 | |
| 288 | F | A | -0.0690 | |
| 289 | Q | A | -0.1868 | |
| 290 | D | A | 0.0000 | |
| 291 | C | A | 0.0000 | |
| 292 | A | A | 0.0000 | |
| 293 | E | A | -1.4667 | |
| 294 | I | A | 0.0000 | |
| 295 | Q | A | -1.9593 | |
| 296 | R | A | -2.3648 | |
| 297 | S | A | -1.7413 | |
| 298 | G | A | -1.4014 | |
| 299 | A | A | -1.0083 | |
| 300 | S | A | -0.9533 | |
| 301 | A | A | -0.3803 | |
| 302 | S | A | -0.3603 | |
| 303 | G | A | 0.3112 | |
| 304 | V | A | 0.1677 | |
| 305 | Y | A | 0.0373 | |
| 306 | T | A | -0.4233 | |
| 307 | I | A | 0.0000 | |
| 308 | Q | A | -0.9393 | |
| 309 | V | A | 0.0000 | |
| 310 | S | A | -1.2747 | |
| 311 | N | A | -1.6325 | |
| 312 | A | A | -1.4659 | |
| 313 | T | A | -1.3678 | |
| 314 | K | A | -2.3520 | |
| 315 | P | A | -1.5106 | |
| 316 | R | A | -1.8735 | |
| 317 | K | A | -2.1391 | |
| 318 | V | A | 0.0000 | |
| 319 | F | A | -0.0933 | |
| 320 | C | A | 0.0000 | |
| 321 | D | A | 0.0000 | |
| 322 | L | A | 0.0000 | |
| 323 | Q | A | -1.5854 | |
| 324 | S | A | -0.9781 | |
| 325 | S | A | -0.8351 | |
| 326 | G | A | -1.0278 | |
| 327 | G | A | 0.0000 | |
| 328 | R | A | -1.3149 | |
| 329 | W | A | 0.0000 | |
| 330 | T | A | 0.0000 | |
| 331 | L | A | 0.0000 | |
| 332 | I | A | 0.0000 | |
| 333 | Q | A | 0.0000 | |
| 334 | R | A | -0.9892 | |
| 335 | R | A | 0.0000 | |
| 336 | E | A | -1.8261 | |
| 337 | N | A | -2.0228 | |
| 338 | G | A | -1.2657 | |
| 339 | T | A | -0.8959 | |
| 340 | V | A | -1.1652 | |
| 341 | N | A | -1.5627 | |
| 342 | F | A | 0.0000 | |
| 343 | Q | A | -1.9142 | |
| 344 | R | A | -2.2403 | |
| 345 | N | A | -2.2277 | |
| 346 | W | A | -2.0158 | |
| 347 | K | A | -2.7614 | |
| 348 | D | A | -2.2047 | |
| 349 | Y | A | 0.0000 | |
| 350 | K | A | -1.8053 | |
| 351 | Q | A | -1.7868 | |
| 352 | G | A | -1.4356 | |
| 353 | F | A | -1.2260 | |
| 354 | G | A | -1.4932 | |
| 355 | D | A | -2.1440 | |
| 356 | P | A | -1.2147 | |
| 357 | A | A | -0.6781 | |
| 358 | G | A | -1.1536 | |
| 359 | E | A | 0.0000 | |
| 360 | H | A | 0.0000 | |
| 361 | W | A | 0.0000 | |
| 362 | L | A | 0.0000 | |
| 363 | G | A | 0.0000 | |
| 364 | N | A | 0.0000 | |
| 365 | E | A | -1.1089 | |
| 366 | V | A | 0.0000 | |
| 367 | V | A | 0.0000 | |
| 368 | H | A | 0.0000 | |
| 369 | Q | A | -1.6542 | |
| 370 | L | A | 0.0000 | |
| 371 | T | A | 0.0000 | |
| 372 | R | A | -2.8695 | |
| 373 | R | A | -2.8025 | |
| 374 | A | A | -1.6744 | |
| 375 | A | A | -1.2935 | |
| 376 | Y | A | 0.0000 | |
| 377 | S | A | 0.0000 | |
| 378 | L | A | 0.0000 | |
| 379 | R | A | -0.6140 | |
| 380 | V | A | 0.0000 | |
| 381 | E | A | -0.7479 | |
| 382 | L | A | 0.0000 | |
| 383 | Q | A | -2.0313 | |
| 384 | D | A | 0.0000 | |
| 385 | W | A | -1.6209 | |
| 386 | E | A | -2.5737 | |
| 387 | G | A | -2.3393 | |
| 388 | H | A | -2.6509 | |
| 389 | E | A | -2.6898 | |
| 390 | A | A | 0.0000 | |
| 391 | Y | A | -0.2831 | |
| 392 | A | A | 0.0000 | |
| 393 | Q | A | -0.6166 | |
| 394 | Y | A | 0.0000 | |
| 395 | E | A | -1.5970 | |
| 396 | H | A | -0.6841 | |
| 397 | F | A | 0.0000 | |
| 398 | H | A | -0.9635 | |
| 399 | L | A | 0.0000 | |
| 400 | G | A | -1.5088 | |
| 401 | S | A | -1.4784 | |
| 402 | E | A | -1.5749 | |
| 403 | N | A | -1.8925 | |
| 404 | Q | A | -1.6197 | |
| 405 | L | A | -0.8597 | |
| 406 | Y | A | 0.0000 | |
| 407 | R | A | -1.8521 | |
| 408 | L | A | 0.0000 | |
| 409 | S | A | -0.4861 | |
| 410 | V | A | 0.0000 | |
| 411 | V | A | 0.9627 | |
| 412 | G | A | -0.1437 | |
| 413 | Y | A | -0.4941 | |
| 414 | S | A | -0.9608 | |
| 415 | G | A | -0.8097 | |
| 416 | S | A | -0.9384 | |
| 417 | A | A | 0.0000 | |
| 418 | G | A | -1.3530 | |
| 419 | R | A | -2.4467 | |
| 420 | Q | A | -1.9729 | |
| 421 | S | A | -0.4580 | |
| 422 | S | A | 0.0000 | |
| 423 | L | A | 0.0000 | |
| 424 | V | A | 0.2738 | |
| 425 | L | A | 0.5403 | |
| 426 | Q | A | -1.1516 | |
| 427 | N | A | -1.9581 | |
| 428 | T | A | 0.0000 | |
| 429 | S | A | -1.5126 | |
| 430 | F | A | 0.0000 | |
| 431 | S | A | 0.0000 | |
| 432 | T | A | 0.0000 | |
| 433 | L | A | -1.8600 | |
| 434 | D | A | -2.8646 | |
| 435 | S | A | -2.2579 | |
| 436 | D | A | -2.7468 | |
| 437 | N | A | -1.8436 | |
| 438 | D | A | -1.5442 | |
| 439 | H | A | -1.2495 | |
| 440 | C | A | -0.1878 | |
| 441 | L | A | 1.0371 | |
| 442 | C | A | 0.1729 | |
| 443 | K | A | -1.4883 | |
| 444 | C | A | 0.0000 | |
| 445 | A | A | 0.0000 | |
| 446 | Q | A | -1.3168 | |
| 447 | V | A | 0.9871 | |
| 448 | M | A | 0.0000 | |
| 449 | S | A | 0.0000 | |
| 450 | G | A | 0.0000 | |
| 451 | G | A | 0.0000 | |
| 452 | W | A | 0.0000 | |
| 453 | W | A | 0.0000 | |
| 454 | F | A | 0.0000 | |
| 455 | D | A | -0.8840 | |
| 456 | A | A | -0.2282 | |
| 457 | C | A | 0.0804 | |
| 458 | G | A | -0.0094 | |
| 459 | L | A | 0.5305 | |
| 460 | S | A | 0.0000 | |
| 461 | N | A | 0.0000 | |
| 462 | L | A | 0.0000 | |
| 463 | N | A | 0.0000 | |
| 464 | G | A | 0.0000 | |
| 465 | V | A | 0.1701 | |
| 466 | Y | A | -0.5985 | |
| 467 | Y | A | -1.0436 | |
| 468 | H | A | -1.7881 | |
| 469 | A | A | -1.6120 | |
| 470 | P | A | -1.5114 | |
| 471 | D | A | -2.2553 | |
| 472 | N | A | 0.0000 | |
| 473 | K | A | -1.1582 | |
| 474 | Y | A | 0.4677 | |
| 475 | K | A | 0.0129 | |
| 476 | M | A | 0.7836 | |
| 477 | D | A | 0.4540 | |
| 478 | G | A | 0.0000 | |
| 479 | I | A | 0.0000 | |
| 480 | R | A | 0.0000 | |
| 481 | W | A | 0.0000 | |
| 482 | H | A | -0.2996 | |
| 483 | Y | A | -0.5366 | |
| 484 | F | A | -0.7751 | |
| 485 | K | A | -0.8306 | |
| 486 | G | A | -0.2715 | |
| 487 | P | A | -0.0620 | |
| 488 | S | A | 0.0556 | |
| 489 | Y | A | -0.4243 | |
| 490 | S | A | 0.0000 | |
| 491 | L | A | 0.0000 | |
| 492 | R | A | -1.4779 | |
| 493 | A | A | 0.0000 | |
| 494 | S | A | 0.0000 | |
| 495 | R | A | -0.6089 | |
| 496 | M | A | 0.0000 | |
| 497 | M | A | 0.0000 | |
| 498 | I | A | 0.0000 | |
| 499 | R | A | -0.5843 | |
| 500 | P | A | 0.0000 | |
| 501 | L | A | -0.1598 | |
| 502 | D | A | -0.5513 | |
| 503 | I | A | 0.8541 |
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