| Chain sequence(s) |
A: CKKGRQWVSAGRRVCKKGRQWVSAGRRVCKKGRQWVSAGRRVCKKGPENAKEKPCKKGRQWVSAGRRVCKKGPGIKADSLDICKKGRQWVSAGRRVCKKGYKAADMWGPPNDPACKKGRQWVSAGRRVCKKGELGGTNVPAEPVSSEAQPGDPNAPSCKKGPENAKEKPCKKGPGIKADSLDICKKGPENAKEKPCKKGELGGTNVPAECKKGPGIKADSLDICKKGELGGTNVPAEPVSSEAQPGDPNAPSCKKGYKAADMWGPPNDPACKKGRQWVSAGRRVCKKGYKAADMWGPPNDPACKKGPENAKEKPCKKGYKAADMWGPPNDPACKKGPGIKADSLDICKKGYKAADMWGPPNDPACKKGELGGTNVPAECKKGYKAADMWGPPNDPACKKGYKAADMWGPPNDPA
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 (00:00:01)
[INFO] Analysis: Starting Aggrescan3D on folded.pdb (00:06:05)
[INFO] Main: Simulation completed successfully. (00:06:09)
|
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 | C | A | -0.6103 | |
| 2 | K | A | -2.2575 | |
| 3 | K | A | -2.9047 | |
| 4 | G | A | -2.7207 | |
| 5 | R | A | -2.9343 | |
| 6 | Q | A | -1.7373 | |
| 7 | W | A | 1.1399 | |
| 8 | V | A | 2.0647 | |
| 9 | S | A | 0.6395 | |
| 10 | A | A | -0.5368 | |
| 11 | G | A | -1.6040 | |
| 12 | R | A | -2.4218 | |
| 13 | R | A | -1.8276 | |
| 14 | V | A | 0.2954 | |
| 15 | C | A | -0.3165 | |
| 16 | K | A | -2.0567 | |
| 17 | K | A | -3.1453 | |
| 18 | G | A | -2.7753 | |
| 19 | R | A | -2.9482 | |
| 20 | Q | A | -1.3863 | |
| 21 | W | A | 0.9684 | |
| 22 | V | A | 1.5059 | |
| 23 | S | A | 0.2437 | |
| 24 | A | A | -0.3831 | |
| 25 | G | A | -1.4763 | |
| 26 | R | A | -2.3665 | |
| 27 | R | A | -1.7859 | |
| 28 | V | A | -0.2258 | |
| 29 | C | A | -0.9874 | |
| 30 | K | A | -2.6306 | |
| 31 | K | A | -3.1911 | |
| 32 | G | A | -2.6376 | |
| 33 | R | A | -2.9432 | |
| 34 | Q | A | -1.4411 | |
| 35 | W | A | 0.9895 | |
| 36 | V | A | 1.9306 | |
| 37 | S | A | 0.5596 | |
| 38 | A | A | -0.0171 | |
| 39 | G | A | -1.4577 | |
| 40 | R | A | -2.5197 | |
| 41 | R | A | -1.7873 | |
| 42 | V | A | 0.4017 | |
| 43 | C | A | -0.0662 | |
| 44 | K | A | -1.8935 | |
| 45 | K | A | -2.6796 | |
| 46 | G | A | -2.4019 | |
| 47 | P | A | -2.2399 | |
| 48 | E | A | -2.6604 | |
| 49 | N | A | -2.5861 | |
| 50 | A | A | -2.1916 | |
| 51 | K | A | -3.1323 | |
| 52 | E | A | -3.4883 | |
| 53 | K | A | -2.8633 | |
| 54 | P | A | -1.6037 | |
| 55 | C | A | -1.0271 | |
| 56 | K | A | -2.3180 | |
| 57 | K | A | -3.1767 | |
| 58 | G | A | -2.9127 | |
| 59 | R | A | -2.5960 | |
| 60 | Q | A | -1.6490 | |
| 61 | W | A | 0.6894 | |
| 62 | V | A | 1.7083 | |
| 63 | S | A | 0.5085 | |
| 64 | A | A | -0.1117 | |
| 65 | G | A | -1.3045 | |
| 66 | R | A | -2.5940 | |
| 67 | R | A | -1.8981 | |
| 68 | V | A | -0.0910 | |
| 69 | C | A | -0.1993 | |
| 70 | K | A | -2.0358 | |
| 71 | K | A | -2.1754 | |
| 72 | G | A | -1.5763 | |
| 73 | P | A | -1.0956 | |
| 74 | G | A | -0.3801 | |
| 75 | I | A | 0.3938 | |
| 76 | K | A | -1.3036 | |
| 77 | A | A | -1.2981 | |
| 78 | D | A | -1.7112 | |
| 79 | S | A | -0.8913 | |
| 80 | L | A | 0.6461 | |
| 81 | D | A | -0.0286 | |
| 82 | I | A | 1.2174 | |
| 83 | C | A | 0.2692 | |
| 84 | K | A | -2.1389 | |
| 85 | K | A | -3.0481 | |
| 86 | G | A | -2.6864 | |
| 87 | R | A | -2.7911 | |
| 88 | Q | A | -1.3928 | |
| 89 | W | A | 0.8417 | |
| 90 | V | A | 1.6551 | |
| 91 | S | A | 0.4902 | |
| 92 | A | A | -0.3200 | |
| 93 | G | A | -1.4777 | |
| 94 | R | A | -2.4826 | |
| 95 | R | A | -1.8834 | |
| 96 | V | A | 0.2614 | |
| 97 | C | A | -0.3577 | |
| 98 | K | A | -1.9963 | |
| 99 | K | A | -2.2764 | |
| 100 | G | A | -1.4808 | |
| 101 | Y | A | -0.3055 | |
| 102 | K | A | -1.3416 | |
| 103 | A | A | -0.9078 | |
| 104 | A | A | -0.8871 | |
| 105 | D | A | -1.1299 | |
| 106 | M | A | 0.6368 | |
| 107 | W | A | 0.8262 | |
| 108 | G | A | -0.1831 | |
| 109 | P | A | -0.7426 | |
| 110 | P | A | -1.3377 | |
| 111 | N | A | -2.4511 | |
| 112 | D | A | -2.4721 | |
| 113 | P | A | -1.4961 | |
| 114 | A | A | -1.0378 | |
| 115 | C | A | -1.0031 | |
| 116 | K | A | -2.5620 | |
| 117 | K | A | -3.0732 | |
| 118 | G | A | -2.7213 | |
| 119 | R | A | -2.7348 | |
| 120 | Q | A | -1.3398 | |
| 121 | W | A | 0.8749 | |
| 122 | V | A | 1.5455 | |
| 123 | S | A | 0.5167 | |
| 124 | A | A | -0.2641 | |
| 125 | G | A | -1.3156 | |
| 126 | R | A | -2.4568 | |
| 127 | R | A | -1.9734 | |
| 128 | V | A | 0.1057 | |
| 129 | C | A | -0.0476 | |
| 130 | K | A | -2.2744 | |
| 131 | K | A | -2.6947 | |
| 132 | G | A | -2.2496 | |
| 133 | E | A | -2.2841 | |
| 134 | L | A | -0.0953 | |
| 135 | G | A | -0.7221 | |
| 136 | G | A | -0.8718 | |
| 137 | T | A | -0.4758 | |
| 138 | N | A | -0.6742 | |
| 139 | V | A | 0.7989 | |
| 140 | P | A | 0.0026 | |
| 141 | A | A | -0.5071 | |
| 142 | E | A | -1.3973 | |
| 143 | P | A | -0.5483 | |
| 144 | V | A | 1.0758 | |
| 145 | S | A | -0.0690 | |
| 146 | S | A | -0.9659 | |
| 147 | E | A | -2.2271 | |
| 148 | A | A | -1.6458 | |
| 149 | Q | A | -2.0538 | |
| 150 | P | A | -1.7150 | |
| 151 | G | A | -2.0202 | |
| 152 | D | A | -2.6378 | |
| 153 | P | A | -1.9072 | |
| 154 | N | A | -1.9584 | |
| 155 | A | A | -1.0226 | |
| 156 | P | A | -0.5151 | |
| 157 | S | A | -0.6390 | |
| 158 | C | A | -0.7871 | |
| 159 | K | A | -2.3209 | |
| 160 | K | A | -2.8557 | |
| 161 | G | A | -2.4557 | |
| 162 | P | A | -2.3702 | |
| 163 | E | A | -3.1019 | |
| 164 | N | A | -2.9061 | |
| 165 | A | A | -2.5356 | |
| 166 | K | A | -3.6704 | |
| 167 | E | A | -3.5661 | |
| 168 | K | A | -3.7193 | |
| 169 | P | A | -2.8439 | |
| 170 | C | A | -1.5521 | |
| 171 | K | A | -2.5699 | |
| 172 | K | A | -3.0438 | |
| 173 | G | A | -1.7414 | |
| 174 | P | A | -0.6705 | |
| 175 | G | A | -0.2049 | |
| 176 | I | A | 0.8196 | |
| 177 | K | A | -1.2418 | |
| 178 | A | A | -1.3241 | |
| 179 | D | A | -2.0433 | |
| 180 | S | A | -0.6101 | |
| 181 | L | A | 0.6949 | |
| 182 | D | A | -0.1398 | |
| 183 | I | A | 0.9514 | |
| 184 | C | A | 0.0859 | |
| 185 | K | A | -1.9924 | |
| 186 | K | A | -2.6043 | |
| 187 | G | A | -2.2950 | |
| 188 | P | A | -2.1056 | |
| 189 | E | A | -2.8416 | |
| 190 | N | A | -2.6081 | |
| 191 | A | A | -2.4930 | |
| 192 | K | A | -3.1897 | |
| 193 | E | A | -3.4832 | |
| 194 | K | A | -3.0760 | |
| 195 | P | A | -1.8244 | |
| 196 | C | A | -1.3038 | |
| 197 | K | A | -2.8411 | |
| 198 | K | A | -3.0420 | |
| 199 | G | A | -2.2082 | |
| 200 | E | A | -2.0792 | |
| 201 | L | A | 0.2049 | |
| 202 | G | A | -0.5813 | |
| 203 | G | A | -0.8993 | |
| 204 | T | A | -0.5259 | |
| 205 | N | A | -0.6413 | |
| 206 | V | A | 0.8156 | |
| 207 | P | A | 0.1221 | |
| 208 | A | A | -0.5856 | |
| 209 | E | A | -1.9169 | |
| 210 | C | A | -1.4563 | |
| 211 | K | A | -2.7931 | |
| 212 | K | A | -2.9388 | |
| 213 | G | A | -1.7920 | |
| 214 | P | A | -1.1997 | |
| 215 | G | A | -0.4176 | |
| 216 | I | A | 0.5794 | |
| 217 | K | A | -1.3280 | |
| 218 | A | A | -1.0175 | |
| 219 | D | A | -1.8353 | |
| 220 | S | A | -0.6929 | |
| 221 | L | A | 0.5037 | |
| 222 | D | A | -0.3455 | |
| 223 | I | A | 1.2190 | |
| 224 | C | A | 0.1815 | |
| 225 | K | A | -2.2661 | |
| 226 | K | A | -2.7671 | |
| 227 | G | A | -2.3968 | |
| 228 | E | A | -2.0003 | |
| 229 | L | A | 0.1967 | |
| 230 | G | A | -0.2805 | |
| 231 | G | A | -0.4954 | |
| 232 | T | A | -0.7202 | |
| 233 | N | A | -0.5785 | |
| 234 | V | A | 0.7433 | |
| 235 | P | A | -0.0224 | |
| 236 | A | A | -0.5757 | |
| 237 | E | A | -1.4007 | |
| 238 | P | A | -0.4538 | |
| 239 | V | A | 1.1032 | |
| 240 | S | A | 0.1285 | |
| 241 | S | A | -0.8955 | |
| 242 | E | A | -2.1902 | |
| 243 | A | A | -1.5289 | |
| 244 | Q | A | -1.7874 | |
| 245 | P | A | -1.4217 | |
| 246 | G | A | -1.9103 | |
| 247 | D | A | -2.4872 | |
| 248 | P | A | -1.9748 | |
| 249 | N | A | -1.9226 | |
| 250 | A | A | -1.0819 | |
| 251 | P | A | -0.6770 | |
| 252 | S | A | -0.7677 | |
| 253 | C | A | -0.6711 | |
| 254 | K | A | -2.2246 | |
| 255 | K | A | -2.4376 | |
| 256 | G | A | -1.3455 | |
| 257 | Y | A | -0.4861 | |
| 258 | K | A | -1.6565 | |
| 259 | A | A | -1.1495 | |
| 260 | A | A | -1.1363 | |
| 261 | D | A | -1.4937 | |
| 262 | M | A | -0.2904 | |
| 263 | W | A | 0.7179 | |
| 264 | G | A | 0.0045 | |
| 265 | P | A | -0.6091 | |
| 266 | P | A | -1.4495 | |
| 267 | N | A | -2.4738 | |
| 268 | D | A | -2.5649 | |
| 269 | P | A | -1.5234 | |
| 270 | A | A | -0.8810 | |
| 271 | C | A | -0.8122 | |
| 272 | K | A | -2.5040 | |
| 273 | K | A | -3.1192 | |
| 274 | G | A | -2.6695 | |
| 275 | R | A | -2.7855 | |
| 276 | Q | A | -1.4037 | |
| 277 | W | A | 0.9509 | |
| 278 | V | A | 1.7027 | |
| 279 | S | A | 0.5572 | |
| 280 | A | A | -0.4189 | |
| 281 | G | A | -1.5183 | |
| 282 | R | A | -2.4692 | |
| 283 | R | A | -2.1830 | |
| 284 | V | A | -0.3850 | |
| 285 | C | A | -0.5003 | |
| 286 | K | A | -1.9312 | |
| 287 | K | A | -2.2897 | |
| 288 | G | A | -1.3092 | |
| 289 | Y | A | -0.1963 | |
| 290 | K | A | -1.5202 | |
| 291 | A | A | -0.7837 | |
| 292 | A | A | -0.6719 | |
| 293 | D | A | -1.1682 | |
| 294 | M | A | 0.6415 | |
| 295 | W | A | 0.9355 | |
| 296 | G | A | -0.0007 | |
| 297 | P | A | -0.7467 | |
| 298 | P | A | -1.3584 | |
| 299 | N | A | -2.4130 | |
| 300 | D | A | -2.5549 | |
| 301 | P | A | -1.6208 | |
| 302 | A | A | -0.8638 | |
| 303 | C | A | -0.7435 | |
| 304 | K | A | -2.2990 | |
| 305 | K | A | -2.8793 | |
| 306 | G | A | -2.4322 | |
| 307 | P | A | -2.0243 | |
| 308 | E | A | -3.2249 | |
| 309 | N | A | -3.2795 | |
| 310 | A | A | -2.3048 | |
| 311 | K | A | -3.4960 | |
| 312 | E | A | -3.5769 | |
| 313 | K | A | -3.1310 | |
| 314 | P | A | -2.1176 | |
| 315 | C | A | -1.2709 | |
| 316 | K | A | -2.3944 | |
| 317 | K | A | -2.4951 | |
| 318 | G | A | -1.3620 | |
| 319 | Y | A | -0.2487 | |
| 320 | K | A | -1.5336 | |
| 321 | A | A | -0.9815 | |
| 322 | A | A | -0.6241 | |
| 323 | D | A | -1.2040 | |
| 324 | M | A | 0.6964 | |
| 325 | W | A | 1.0369 | |
| 326 | G | A | 0.0366 | |
| 327 | P | A | -0.7388 | |
| 328 | P | A | -1.4691 | |
| 329 | N | A | -2.3981 | |
| 330 | D | A | -2.5606 | |
| 331 | P | A | -1.5945 | |
| 332 | A | A | -0.9043 | |
| 333 | C | A | -0.7411 | |
| 334 | K | A | -2.2795 | |
| 335 | K | A | -2.7229 | |
| 336 | G | A | -1.6780 | |
| 337 | P | A | -0.9306 | |
| 338 | G | A | -0.2414 | |
| 339 | I | A | 0.8589 | |
| 340 | K | A | -1.1951 | |
| 341 | A | A | -1.2044 | |
| 342 | D | A | -2.0219 | |
| 343 | S | A | -0.5468 | |
| 344 | L | A | 0.6735 | |
| 345 | D | A | -0.3734 | |
| 346 | I | A | 1.3293 | |
| 347 | C | A | 0.3446 | |
| 348 | K | A | -1.9353 | |
| 349 | K | A | -2.2850 | |
| 350 | G | A | -1.4092 | |
| 351 | Y | A | -0.2851 | |
| 352 | K | A | -1.5691 | |
| 353 | A | A | -0.8780 | |
| 354 | A | A | -0.6465 | |
| 355 | D | A | -1.1265 | |
| 356 | M | A | 0.5552 | |
| 357 | W | A | 1.0478 | |
| 358 | G | A | 0.2100 | |
| 359 | P | A | -0.8583 | |
| 360 | P | A | -1.3479 | |
| 361 | N | A | -2.3908 | |
| 362 | D | A | -2.4967 | |
| 363 | P | A | -1.4310 | |
| 364 | A | A | -0.9448 | |
| 365 | C | A | -0.7769 | |
| 366 | K | A | -2.2993 | |
| 367 | K | A | -3.0673 | |
| 368 | G | A | -2.3888 | |
| 369 | E | A | -1.8254 | |
| 370 | L | A | 0.2053 | |
| 371 | G | A | -0.2153 | |
| 372 | G | A | -0.4790 | |
| 373 | T | A | -0.6336 | |
| 374 | N | A | -0.5665 | |
| 375 | V | A | 0.9455 | |
| 376 | P | A | -0.0113 | |
| 377 | A | A | -0.5801 | |
| 378 | E | A | -2.1576 | |
| 379 | C | A | -1.4609 | |
| 380 | K | A | -2.7463 | |
| 381 | K | A | -2.7451 | |
| 382 | G | A | -1.4708 | |
| 383 | Y | A | -0.1767 | |
| 384 | K | A | -1.4032 | |
| 385 | A | A | -0.8103 | |
| 386 | A | A | -0.7020 | |
| 387 | D | A | -1.2076 | |
| 388 | M | A | 0.3816 | |
| 389 | W | A | 1.0473 | |
| 390 | G | A | 0.0344 | |
| 391 | P | A | -0.7535 | |
| 392 | P | A | -1.4684 | |
| 393 | N | A | -2.4278 | |
| 394 | D | A | -2.6080 | |
| 395 | P | A | -1.5266 | |
| 396 | A | A | -0.9297 | |
| 397 | C | A | -1.3234 | |
| 398 | K | A | -2.6300 | |
| 399 | K | A | -2.3218 | |
| 400 | G | A | -1.2933 | |
| 401 | Y | A | -0.1292 | |
| 402 | K | A | -1.0550 | |
| 403 | A | A | -0.8119 | |
| 404 | A | A | -0.9257 | |
| 405 | D | A | -0.9969 | |
| 406 | M | A | 0.6910 | |
| 407 | W | A | 1.0562 | |
| 408 | G | A | 0.1375 | |
| 409 | P | A | -0.5754 | |
| 410 | P | A | -1.3444 | |
| 411 | N | A | -2.3815 | |
| 412 | D | A | -2.5770 | |
| 413 | P | A | -1.4052 | |
| 414 | A | A | -0.7080 |
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