| Chain sequence(s) |
A: MAGGQHEIQGCKGFKRTSQDGKIQSTKPNKGKRFFPKLKCKAQRARVNIGLAFERWRALKAAQGLKTDAEVAHCLLDVMKRFPTASISSEASDKKIKISQSEVQTLIKQEVCSAVRKNETRLQDLIETIQKLDHGVDYERSIQKLEARVNSLSKKAEVAFAYMTKTQTKSPHTSPTDMNINRAEPECETMENTSQTDRKNMDWMDKDRELFQMMETTKMSLKKMRADNDNLTAAIADLKEKPSPLIPSPFGSPKCKEYGSAMKKEPEEEQCKEDDKKLKAERVKVEHLPSSNSNTPNPTEPEKDKLSYPPLPFTIFPSILSMEAASYNIPQKPEVHLALIREPAGLSVLWKVDKEDPSAPPMDSYSIYMTTEKVKGSGTFPKWNMLGEVRAIKLPMCVMITKYKPGRKVCVAVVGKDIFGRYGPYSKVVAANIPD
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 (00:07:42)
[INFO] Main: Simulation completed successfully. (00:07:45)
|
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 | |
| 1 | M | A | 0.9328 | |
| 2 | A | A | 0.1251 | |
| 3 | G | A | -0.8324 | |
| 4 | G | A | -1.4644 | |
| 5 | Q | A | -2.4949 | |
| 6 | H | A | -2.3237 | |
| 7 | E | A | -1.8648 | |
| 8 | I | A | 0.0957 | |
| 9 | Q | A | -0.6082 | |
| 10 | G | A | -0.6091 | |
| 11 | C | A | -0.7148 | |
| 12 | K | A | -1.2499 | |
| 13 | G | A | -0.5374 | |
| 14 | F | A | 0.1488 | |
| 15 | K | A | -1.7240 | |
| 16 | R | A | -2.3717 | |
| 17 | T | A | -1.6937 | |
| 18 | S | A | -1.6132 | |
| 19 | Q | A | -2.3256 | |
| 20 | D | A | -3.0267 | |
| 21 | G | A | -2.0514 | |
| 22 | K | A | -1.5384 | |
| 23 | I | A | 0.4436 | |
| 24 | Q | A | -0.6737 | |
| 25 | S | A | -0.8408 | |
| 26 | T | A | -1.2880 | |
| 27 | K | A | -2.3831 | |
| 28 | P | A | -2.1758 | |
| 29 | N | A | -2.9702 | |
| 30 | K | A | -3.4019 | |
| 31 | G | A | -2.7480 | |
| 32 | K | A | -2.6294 | |
| 33 | R | A | -1.6269 | |
| 34 | F | A | 1.2332 | |
| 35 | F | A | 1.8129 | |
| 36 | P | A | 0.3244 | |
| 37 | K | A | -0.9593 | |
| 38 | L | A | 0.0245 | |
| 39 | K | A | -1.8172 | |
| 40 | C | A | -1.4698 | |
| 41 | K | A | -2.5728 | |
| 42 | A | A | -2.1806 | |
| 43 | Q | A | -2.9620 | |
| 44 | R | A | -3.1956 | |
| 45 | A | A | -1.9059 | |
| 46 | R | A | -2.0164 | |
| 47 | V | A | 0.0328 | |
| 48 | N | A | -0.4101 | |
| 49 | I | A | 0.2836 | |
| 50 | G | A | 0.4631 | |
| 51 | L | A | 1.0335 | |
| 52 | A | A | -0.1927 | |
| 53 | F | A | -0.2920 | |
| 54 | E | A | -2.2976 | |
| 55 | R | A | -2.4517 | |
| 56 | W | A | -1.6728 | |
| 57 | R | A | -2.7488 | |
| 58 | A | A | -1.8321 | |
| 59 | L | A | -1.3111 | |
| 60 | K | A | -2.2782 | |
| 61 | A | A | -1.2934 | |
| 62 | A | A | -0.7937 | |
| 63 | Q | A | -1.7015 | |
| 64 | G | A | -1.3560 | |
| 65 | L | A | -1.7305 | |
| 66 | K | A | -2.3218 | |
| 67 | T | A | -1.8495 | |
| 68 | D | A | -2.5986 | |
| 69 | A | A | -1.6298 | |
| 70 | E | A | -1.6465 | |
| 71 | V | A | 0.0000 | |
| 72 | A | A | -0.5311 | |
| 73 | H | A | -0.8752 | |
| 74 | C | A | -0.4095 | |
| 75 | L | A | 0.5279 | |
| 76 | L | A | 0.2953 | |
| 77 | D | A | -0.7429 | |
| 78 | V | A | 0.4620 | |
| 79 | M | A | 0.6769 | |
| 80 | K | A | -1.2985 | |
| 81 | R | A | -1.3099 | |
| 82 | F | A | 0.7800 | |
| 83 | P | A | 0.0060 | |
| 84 | T | A | 0.2629 | |
| 85 | A | A | 0.6245 | |
| 86 | S | A | 0.6656 | |
| 87 | I | A | 1.5539 | |
| 88 | S | A | 0.2526 | |
| 89 | S | A | -0.7416 | |
| 90 | E | A | -1.7557 | |
| 91 | A | A | -1.6442 | |
| 92 | S | A | -2.1999 | |
| 93 | D | A | -2.8602 | |
| 94 | K | A | -3.0874 | |
| 95 | K | A | -2.3823 | |
| 96 | I | A | 0.1104 | |
| 97 | K | A | -1.0914 | |
| 98 | I | A | 0.5837 | |
| 99 | S | A | -0.6580 | |
| 100 | Q | A | -1.4840 | |
| 101 | S | A | -1.0316 | |
| 102 | E | A | -1.3194 | |
| 103 | V | A | -0.0571 | |
| 104 | Q | A | -1.2837 | |
| 105 | T | A | -0.8756 | |
| 106 | L | A | 0.3218 | |
| 107 | I | A | 0.2379 | |
| 108 | K | A | -1.4720 | |
| 109 | Q | A | -1.3342 | |
| 110 | E | A | -1.3834 | |
| 111 | V | A | 0.1132 | |
| 112 | C | A | -0.6299 | |
| 113 | S | A | -1.6202 | |
| 114 | A | A | -1.4715 | |
| 115 | V | A | -1.3570 | |
| 116 | R | A | -3.2290 | |
| 117 | K | A | -3.6448 | |
| 118 | N | A | -3.7157 | |
| 119 | E | A | -3.9978 | |
| 120 | T | A | -3.4599 | |
| 121 | R | A | -3.7089 | |
| 122 | L | A | -2.0050 | |
| 123 | Q | A | -2.5896 | |
| 124 | D | A | -2.7294 | |
| 125 | L | A | -0.6376 | |
| 126 | I | A | -0.2331 | |
| 127 | E | A | -1.9473 | |
| 128 | T | A | -0.8294 | |
| 129 | I | A | -0.1269 | |
| 130 | Q | A | -2.0495 | |
| 131 | K | A | -2.0183 | |
| 132 | L | A | -0.3599 | |
| 133 | D | A | -2.1067 | |
| 134 | H | A | -1.9593 | |
| 135 | G | A | -0.7775 | |
| 136 | V | A | 0.1641 | |
| 137 | D | A | -1.5859 | |
| 138 | Y | A | -1.1259 | |
| 139 | E | A | -2.3736 | |
| 140 | R | A | -3.0571 | |
| 141 | S | A | -1.9049 | |
| 142 | I | A | 0.0000 | |
| 143 | Q | A | -3.0129 | |
| 144 | K | A | -3.1071 | |
| 145 | L | A | -1.8469 | |
| 146 | E | A | -2.1576 | |
| 147 | A | A | -1.7507 | |
| 148 | R | A | -2.1687 | |
| 149 | V | A | -1.5688 | |
| 150 | N | A | -2.2845 | |
| 151 | S | A | -1.7737 | |
| 152 | L | A | -0.9047 | |
| 153 | S | A | -1.7345 | |
| 154 | K | A | -3.0583 | |
| 155 | K | A | -2.5449 | |
| 156 | A | A | -1.3753 | |
| 157 | E | A | -2.1257 | |
| 158 | V | A | -0.6018 | |
| 159 | A | A | -0.3412 | |
| 160 | F | A | -0.1982 | |
| 161 | A | A | 0.1023 | |
| 162 | Y | A | 0.8285 | |
| 163 | M | A | 0.0935 | |
| 164 | T | A | -0.6648 | |
| 165 | K | A | -1.7747 | |
| 166 | T | A | -1.5006 | |
| 167 | Q | A | -2.1005 | |
| 168 | T | A | -2.1719 | |
| 169 | K | A | -2.7957 | |
| 170 | S | A | -2.0097 | |
| 171 | P | A | -1.5853 | |
| 172 | H | A | -1.5324 | |
| 173 | T | A | -1.0491 | |
| 174 | S | A | -0.9279 | |
| 175 | P | A | -0.8547 | |
| 176 | T | A | -1.0245 | |
| 177 | D | A | -1.6944 | |
| 178 | M | A | -0.0496 | |
| 179 | N | A | -0.4601 | |
| 180 | I | A | 0.6357 | |
| 181 | N | A | -1.4863 | |
| 182 | R | A | -2.4625 | |
| 183 | A | A | -2.0966 | |
| 184 | E | A | -2.7102 | |
| 185 | P | A | -1.8986 | |
| 186 | E | A | -2.4807 | |
| 187 | C | A | -1.3186 | |
| 188 | E | A | -1.7274 | |
| 189 | T | A | -0.8052 | |
| 190 | M | A | -0.6097 | |
| 191 | E | A | -2.1411 | |
| 192 | N | A | -2.2249 | |
| 193 | T | A | -1.9845 | |
| 194 | S | A | -2.8724 | |
| 195 | Q | A | -3.4180 | |
| 196 | T | A | -3.0091 | |
| 197 | D | A | -3.7211 | |
| 198 | R | A | -3.9839 | |
| 199 | K | A | -3.8103 | |
| 200 | N | A | -2.5307 | |
| 201 | M | A | -1.9147 | |
| 202 | D | A | -2.8540 | |
| 203 | W | A | -2.0100 | |
| 204 | M | A | -1.8189 | |
| 205 | D | A | -3.4936 | |
| 206 | K | A | -3.4812 | |
| 207 | D | A | -2.3912 | |
| 208 | R | A | -3.3007 | |
| 209 | E | A | -3.2459 | |
| 210 | L | A | -1.1011 | |
| 211 | F | A | -0.3622 | |
| 212 | Q | A | -1.5731 | |
| 213 | M | A | -0.2548 | |
| 214 | M | A | -0.0543 | |
| 215 | E | A | -0.8090 | |
| 216 | T | A | -0.5215 | |
| 217 | T | A | -0.8201 | |
| 218 | K | A | -1.9458 | |
| 219 | M | A | -1.1990 | |
| 220 | S | A | -1.4873 | |
| 221 | L | A | 0.0000 | |
| 222 | K | A | -3.0930 | |
| 223 | K | A | -3.3448 | |
| 224 | M | A | -2.5636 | |
| 225 | R | A | -2.9133 | |
| 226 | A | A | -2.9369 | |
| 227 | D | A | -3.2989 | |
| 228 | N | A | 0.0000 | |
| 229 | D | A | -2.9113 | |
| 230 | N | A | -2.1189 | |
| 231 | L | A | -0.5028 | |
| 232 | T | A | -0.6984 | |
| 233 | A | A | -0.6756 | |
| 234 | A | A | -0.1918 | |
| 235 | I | A | 0.0926 | |
| 236 | A | A | -1.1296 | |
| 237 | D | A | -2.1460 | |
| 238 | L | A | -1.0098 | |
| 239 | K | A | -2.7704 | |
| 240 | E | A | -3.5584 | |
| 241 | K | A | -3.2206 | |
| 242 | P | A | -1.5677 | |
| 243 | S | A | -0.6059 | |
| 244 | P | A | 0.6379 | |
| 245 | L | A | 2.2094 | |
| 246 | I | A | 2.4529 | |
| 247 | P | A | 1.1995 | |
| 248 | S | A | 0.7600 | |
| 249 | P | A | 0.6705 | |
| 250 | F | A | 1.4530 | |
| 251 | G | A | 0.2778 | |
| 252 | S | A | -0.5337 | |
| 253 | P | A | -1.3072 | |
| 254 | K | A | -2.0983 | |
| 255 | C | A | -1.4236 | |
| 256 | K | A | -2.4529 | |
| 257 | E | A | -2.1811 | |
| 258 | Y | A | -0.2263 | |
| 259 | G | A | -0.3144 | |
| 260 | S | A | -0.1007 | |
| 261 | A | A | -0.2006 | |
| 262 | M | A | -0.1959 | |
| 263 | K | A | -2.3902 | |
| 264 | K | A | -3.2739 | |
| 265 | E | A | -3.4432 | |
| 266 | P | A | -2.6299 | |
| 267 | E | A | -3.5029 | |
| 268 | E | A | -3.8622 | |
| 269 | E | A | -3.5049 | |
| 270 | Q | A | -2.4284 | |
| 271 | C | A | -1.6513 | |
| 272 | K | A | -3.1296 | |
| 273 | E | A | -4.0074 | |
| 274 | D | A | -4.5107 | |
| 275 | D | A | -4.4460 | |
| 276 | K | A | -3.8952 | |
| 277 | K | A | -2.8658 | |
| 278 | L | A | -0.6762 | |
| 279 | K | A | -1.9274 | |
| 280 | A | A | -1.9946 | |
| 281 | E | A | -2.8180 | |
| 282 | R | A | -2.0850 | |
| 283 | V | A | 0.0018 | |
| 284 | K | A | -1.0017 | |
| 285 | V | A | -0.0731 | |
| 286 | E | A | -1.4948 | |
| 287 | H | A | -0.7864 | |
| 288 | L | A | 0.4943 | |
| 289 | P | A | 0.1422 | |
| 290 | S | A | -0.4046 | |
| 291 | S | A | -1.0215 | |
| 292 | N | A | -1.8158 | |
| 293 | S | A | -1.5265 | |
| 294 | N | A | -1.8957 | |
| 295 | T | A | -1.3055 | |
| 296 | P | A | -1.2644 | |
| 297 | N | A | -1.9727 | |
| 298 | P | A | -1.4562 | |
| 299 | T | A | -1.8535 | |
| 300 | E | A | -3.0432 | |
| 301 | P | A | -2.7860 | |
| 302 | E | A | -4.0552 | |
| 303 | K | A | -4.3114 | |
| 304 | D | A | -3.9255 | |
| 305 | K | A | -3.2599 | |
| 306 | L | A | -1.3366 | |
| 307 | S | A | -0.5309 | |
| 308 | Y | A | 0.0661 | |
| 309 | P | A | -0.2398 | |
| 310 | P | A | 0.0597 | |
| 311 | L | A | 0.4324 | |
| 312 | P | A | 0.9780 | |
| 313 | F | A | 2.7192 | |
| 314 | T | A | 2.4676 | |
| 315 | I | A | 3.4474 | |
| 316 | F | A | 3.4971 | |
| 317 | P | A | 2.1722 | |
| 318 | S | A | 1.6584 | |
| 319 | I | A | 2.5453 | |
| 320 | L | A | 1.6842 | |
| 321 | S | A | 0.5380 | |
| 322 | M | A | 0.5251 | |
| 323 | E | A | -1.0713 | |
| 324 | A | A | 0.0000 | |
| 325 | A | A | 0.0594 | |
| 326 | S | A | -0.4361 | |
| 327 | Y | A | 0.1573 | |
| 328 | N | A | 0.2433 | |
| 329 | I | A | 1.0865 | |
| 330 | P | A | 0.0000 | |
| 331 | Q | A | -1.7087 | |
| 332 | K | A | -2.5516 | |
| 333 | P | A | 0.0000 | |
| 334 | E | A | -2.2911 | |
| 335 | V | A | -0.9422 | |
| 336 | H | A | -0.6283 | |
| 337 | L | A | 0.5336 | |
| 338 | A | A | 0.3293 | |
| 339 | L | A | 0.2836 | |
| 340 | I | A | -0.3317 | |
| 341 | R | A | -2.2463 | |
| 342 | E | A | -2.5448 | |
| 343 | P | A | -1.5888 | |
| 344 | A | A | -1.2944 | |
| 345 | G | A | 0.0000 | |
| 346 | L | A | 0.0000 | |
| 347 | S | A | 0.7974 | |
| 348 | V | A | 0.0000 | |
| 349 | L | A | 0.3676 | |
| 350 | W | A | 0.0000 | |
| 351 | K | A | -2.0517 | |
| 352 | V | A | -2.5222 | |
| 353 | D | A | -3.5701 | |
| 354 | K | A | -3.7620 | |
| 355 | E | A | -3.3366 | |
| 356 | D | A | -2.0449 | |
| 357 | P | A | -1.1269 | |
| 358 | S | A | -0.4081 | |
| 359 | A | A | -0.3449 | |
| 360 | P | A | 0.0000 | |
| 361 | P | A | 0.4938 | |
| 362 | M | A | 0.3014 | |
| 363 | D | A | -0.3552 | |
| 364 | S | A | 0.0000 | |
| 365 | Y | A | 0.0000 | |
| 366 | S | A | 0.0000 | |
| 367 | I | A | 0.0000 | |
| 368 | Y | A | 0.0000 | |
| 369 | M | A | 0.0000 | |
| 370 | T | A | 0.0000 | |
| 371 | T | A | -1.3475 | |
| 372 | E | A | 0.0000 | |
| 373 | K | A | -1.6347 | |
| 374 | V | A | -0.1590 | |
| 375 | K | A | -1.9493 | |
| 376 | G | A | -1.4688 | |
| 377 | S | A | -0.7732 | |
| 378 | G | A | -1.1130 | |
| 379 | T | A | -0.5723 | |
| 380 | F | A | 0.0000 | |
| 381 | P | A | -1.2156 | |
| 382 | K | A | -2.0211 | |
| 383 | W | A | 0.0000 | |
| 384 | N | A | -1.0509 | |
| 385 | M | A | 0.1311 | |
| 386 | L | A | 0.0574 | |
| 387 | G | A | -0.7203 | |
| 388 | E | A | -1.9374 | |
| 389 | V | A | -1.0888 | |
| 390 | R | A | -1.7842 | |
| 391 | A | A | -0.4508 | |
| 392 | I | A | 0.7409 | |
| 393 | K | A | -0.7164 | |
| 394 | L | A | -0.2059 | |
| 395 | P | A | -0.2868 | |
| 396 | M | A | 0.0000 | |
| 397 | C | A | 0.8569 | |
| 398 | V | A | 0.9011 | |
| 399 | M | A | 0.6813 | |
| 400 | I | A | 0.0000 | |
| 401 | T | A | -0.8090 | |
| 402 | K | A | -1.8077 | |
| 403 | Y | A | -1.4705 | |
| 404 | K | A | -2.6099 | |
| 405 | P | A | -2.3463 | |
| 406 | G | A | -2.2193 | |
| 407 | R | A | -2.5301 | |
| 408 | K | A | -2.0057 | |
| 409 | V | A | 0.0000 | |
| 410 | C | A | 0.0000 | |
| 411 | V | A | 0.0000 | |
| 412 | A | A | 0.0000 | |
| 413 | V | A | 0.0000 | |
| 414 | V | A | 0.0000 | |
| 415 | G | A | 0.0000 | |
| 416 | K | A | -0.1091 | |
| 417 | D | A | 0.0000 | |
| 418 | I | A | 1.5518 | |
| 419 | F | A | 1.4676 | |
| 420 | G | A | 1.5703 | |
| 421 | R | A | 0.0000 | |
| 422 | Y | A | 1.4488 | |
| 423 | G | A | 0.1304 | |
| 424 | P | A | -0.6468 | |
| 425 | Y | A | -0.8343 | |
| 426 | S | A | 0.0000 | |
| 427 | K | A | -2.0638 | |
| 428 | V | A | 0.0000 | |
| 429 | V | A | -0.2608 | |
| 430 | A | A | -0.3879 | |
| 431 | A | A | -0.7154 | |
| 432 | N | A | -1.8867 | |
| 433 | I | A | 0.0000 | |
| 434 | P | A | -1.7553 | |
| 435 | D | A | -2.4236 |
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