| Chain sequence(s) |
A: MHHHHHHGSAEAWYNLGNAYYKQGDYDEAIEYYQKALELDPNNAEAWYNLGNAYYKQGDYDEAIEYYQKALELDPNNAEAWYNLGNAYYKQGDYDEAIEYYQKALELDPNNAEAWYNLGNAYYKQGDYDEAIEYYQKALELDPNNAEAWYNLGNAYYKQGDYDEAIEYYQKALELDPNNKRRWKKNFIAVSAANRFKKISSSGALGGGGSMFTLEDFVGDWEQTAAYNLDQVLEQGGVSSLLQNLAVSVTPIQRIVRSGENALKIDIHVIIPYEGLSADQMAQIEEVFKVVYPVDDHHFKVILPYGTLVIDGVTPNMLNYFGRPYEGIAVFDGKKITVTGTLWNGNKIIDERLITPDGSMLFRVTINS
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] (00:00:01)
[WARNING] runJob: Working directory already exists (possibly overwriting previous results -ow
to prevent this behavior) (00:00:01)
[INFO] runJob: Starting aggrescan3d job on: input.pdb with A chain(s) selected (00:00:01)
[INFO] runJob: Creating pdb object from: input.pdb (00:00:01)
[INFO] FoldX: Starting FoldX energy minimalization (00:00:01)
[INFO] Analysis: Starting Aggrescan3D on folded.pdb (00:08:39)
[INFO] Main: Simulation completed successfully. (00:08:42)
|
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 | 0.1780 | |
| 2 | H | A | -1.4266 | |
| 3 | H | A | -2.1388 | |
| 4 | H | A | -2.6273 | |
| 5 | H | A | -2.7747 | |
| 6 | H | A | -2.4452 | |
| 7 | H | A | -1.9293 | |
| 8 | G | A | 0.0000 | |
| 9 | S | A | -1.3510 | |
| 10 | A | A | 0.0000 | |
| 11 | E | A | -2.0577 | |
| 12 | A | A | -1.2805 | |
| 13 | W | A | -1.1432 | |
| 14 | Y | A | -1.4967 | |
| 15 | N | A | -1.1848 | |
| 16 | L | A | -0.1816 | |
| 17 | G | A | 0.0000 | |
| 18 | N | A | -0.9178 | |
| 19 | A | A | -0.9444 | |
| 20 | Y | A | -1.4952 | |
| 21 | Y | A | -1.6502 | |
| 22 | K | A | -2.2964 | |
| 23 | Q | A | -2.3239 | |
| 24 | G | A | -2.2008 | |
| 25 | D | A | -2.3522 | |
| 26 | Y | A | -2.2013 | |
| 27 | D | A | -2.7808 | |
| 28 | E | A | -2.5614 | |
| 29 | A | A | 0.0000 | |
| 30 | I | A | -1.6814 | |
| 31 | E | A | -2.4972 | |
| 32 | Y | A | -1.4564 | |
| 33 | Y | A | 0.0000 | |
| 34 | Q | A | -1.9157 | |
| 35 | K | A | -1.8097 | |
| 36 | A | A | 0.0000 | |
| 37 | L | A | 0.0000 | |
| 38 | E | A | -2.4437 | |
| 39 | L | A | -1.6845 | |
| 40 | D | A | -2.5038 | |
| 41 | P | A | -2.0427 | |
| 42 | N | A | -2.5482 | |
| 43 | N | A | -2.2433 | |
| 44 | A | A | 0.0000 | |
| 45 | E | A | -2.1177 | |
| 46 | A | A | 0.0000 | |
| 47 | W | A | -1.0904 | |
| 48 | Y | A | -1.2494 | |
| 49 | N | A | -0.4020 | |
| 50 | L | A | 0.0000 | |
| 51 | G | A | 0.0000 | |
| 52 | N | A | 0.0000 | |
| 53 | A | A | 0.0000 | |
| 54 | Y | A | -1.1280 | |
| 55 | Y | A | -1.1925 | |
| 56 | K | A | -1.4351 | |
| 57 | Q | A | -1.8112 | |
| 58 | G | A | -1.7724 | |
| 59 | D | A | -1.8708 | |
| 60 | Y | A | -1.8734 | |
| 61 | D | A | -2.4410 | |
| 62 | E | A | -2.0035 | |
| 63 | A | A | 0.0000 | |
| 64 | I | A | -1.3232 | |
| 65 | E | A | -2.0368 | |
| 66 | Y | A | -1.2714 | |
| 67 | Y | A | 0.0000 | |
| 68 | Q | A | -1.7635 | |
| 69 | K | A | -1.9954 | |
| 70 | A | A | 0.0000 | |
| 71 | L | A | 0.0000 | |
| 72 | E | A | -2.6491 | |
| 73 | L | A | -1.9758 | |
| 74 | D | A | -2.6319 | |
| 75 | P | A | -2.0376 | |
| 76 | N | A | -2.5532 | |
| 77 | N | A | -2.2816 | |
| 78 | A | A | -2.1783 | |
| 79 | E | A | -2.1528 | |
| 80 | A | A | 0.0000 | |
| 81 | W | A | -1.1427 | |
| 82 | Y | A | -1.3329 | |
| 83 | N | A | -0.3634 | |
| 84 | L | A | 0.0000 | |
| 85 | G | A | 0.0000 | |
| 86 | N | A | 0.0000 | |
| 87 | A | A | 0.0000 | |
| 88 | Y | A | -1.4699 | |
| 89 | Y | A | -1.3469 | |
| 90 | K | A | -1.8073 | |
| 91 | Q | A | -1.8940 | |
| 92 | G | A | -1.8516 | |
| 93 | D | A | -2.0456 | |
| 94 | Y | A | -2.0772 | |
| 95 | D | A | -2.7368 | |
| 96 | E | A | -2.4908 | |
| 97 | A | A | 0.0000 | |
| 98 | I | A | -1.6765 | |
| 99 | E | A | -2.6189 | |
| 100 | Y | A | -1.5937 | |
| 101 | Y | A | 0.0000 | |
| 102 | Q | A | -1.9862 | |
| 103 | K | A | -2.1646 | |
| 104 | A | A | 0.0000 | |
| 105 | L | A | 0.0000 | |
| 106 | E | A | -2.6792 | |
| 107 | L | A | -2.0125 | |
| 108 | D | A | -2.7487 | |
| 109 | P | A | -2.1023 | |
| 110 | N | A | -2.5977 | |
| 111 | N | A | -2.3355 | |
| 112 | A | A | -2.1869 | |
| 113 | E | A | -2.1526 | |
| 114 | A | A | 0.0000 | |
| 115 | W | A | -1.1601 | |
| 116 | Y | A | -1.2779 | |
| 117 | N | A | -0.3742 | |
| 118 | L | A | 0.0000 | |
| 119 | G | A | 0.0000 | |
| 120 | N | A | 0.0000 | |
| 121 | A | A | 0.0000 | |
| 122 | Y | A | -1.2917 | |
| 123 | Y | A | -1.3724 | |
| 124 | K | A | -1.6734 | |
| 125 | Q | A | -1.8872 | |
| 126 | G | A | -1.8290 | |
| 127 | D | A | -2.2515 | |
| 128 | Y | A | -2.1812 | |
| 129 | D | A | -2.7779 | |
| 130 | E | A | -2.5266 | |
| 131 | A | A | 0.0000 | |
| 132 | I | A | -1.6943 | |
| 133 | E | A | -2.6435 | |
| 134 | Y | A | -1.6023 | |
| 135 | Y | A | 0.0000 | |
| 136 | Q | A | -1.9844 | |
| 137 | K | A | -2.1679 | |
| 138 | A | A | 0.0000 | |
| 139 | L | A | 0.0000 | |
| 140 | E | A | -2.6576 | |
| 141 | L | A | -1.9844 | |
| 142 | D | A | -2.6497 | |
| 143 | P | A | -2.0389 | |
| 144 | N | A | -2.4038 | |
| 145 | N | A | -2.0791 | |
| 146 | A | A | -1.7764 | |
| 147 | E | A | -1.6755 | |
| 148 | A | A | 0.0000 | |
| 149 | W | A | -1.0174 | |
| 150 | Y | A | -0.7721 | |
| 151 | N | A | -0.3098 | |
| 152 | L | A | 0.0000 | |
| 153 | G | A | 0.0000 | |
| 154 | N | A | -0.4993 | |
| 155 | A | A | 0.0000 | |
| 156 | Y | A | -1.3178 | |
| 157 | Y | A | -1.1715 | |
| 158 | K | A | -1.9527 | |
| 159 | Q | A | -1.8800 | |
| 160 | G | A | -1.6261 | |
| 161 | D | A | -1.9989 | |
| 162 | Y | A | -1.9955 | |
| 163 | D | A | -2.5611 | |
| 164 | E | A | -2.3125 | |
| 165 | A | A | 0.0000 | |
| 166 | I | A | -1.3741 | |
| 167 | E | A | -2.4914 | |
| 168 | Y | A | -1.5293 | |
| 169 | Y | A | 0.0000 | |
| 170 | Q | A | -1.9263 | |
| 171 | K | A | -1.9661 | |
| 172 | A | A | 0.0000 | |
| 173 | L | A | 0.0000 | |
| 174 | E | A | -2.4639 | |
| 175 | L | A | -1.5373 | |
| 176 | D | A | -2.0872 | |
| 177 | P | A | -2.3172 | |
| 178 | N | A | -2.8556 | |
| 179 | N | A | -2.9619 | |
| 180 | K | A | -3.9986 | |
| 181 | R | A | -4.1640 | |
| 182 | R | A | -3.8692 | |
| 183 | W | A | 0.0000 | |
| 184 | K | A | -2.7191 | |
| 185 | K | A | -2.3110 | |
| 186 | N | A | -1.2551 | |
| 187 | F | A | -0.4831 | |
| 188 | I | A | 0.4894 | |
| 189 | A | A | 0.0000 | |
| 190 | V | A | 0.0000 | |
| 191 | S | A | -0.5925 | |
| 192 | A | A | -0.4509 | |
| 193 | A | A | -1.0104 | |
| 194 | N | A | -1.8826 | |
| 195 | R | A | -2.6604 | |
| 196 | F | A | 0.0000 | |
| 197 | K | A | -2.1606 | |
| 198 | K | A | -2.3079 | |
| 199 | I | A | -1.3169 | |
| 200 | S | A | -1.2042 | |
| 201 | S | A | -0.9905 | |
| 202 | S | A | -0.5169 | |
| 203 | G | A | 0.0114 | |
| 204 | A | A | 0.4103 | |
| 205 | L | A | 0.9549 | |
| 206 | G | A | -0.1202 | |
| 207 | G | A | -0.7102 | |
| 208 | G | A | -0.6793 | |
| 209 | G | A | -0.4727 | |
| 210 | S | A | -0.0131 | |
| 211 | M | A | 0.5754 | |
| 212 | F | A | 0.0722 | |
| 213 | T | A | -0.4799 | |
| 214 | L | A | -1.1957 | |
| 215 | E | A | -1.9950 | |
| 216 | D | A | -1.3153 | |
| 217 | F | A | 0.0000 | |
| 218 | V | A | -1.0940 | |
| 219 | G | A | -1.5664 | |
| 220 | D | A | -2.3407 | |
| 221 | W | A | -1.7709 | |
| 222 | E | A | -2.4601 | |
| 223 | Q | A | -1.4753 | |
| 224 | T | A | -0.7824 | |
| 225 | A | A | 0.0305 | |
| 226 | A | A | 0.3406 | |
| 227 | Y | A | 0.2370 | |
| 228 | N | A | -0.5285 | |
| 229 | L | A | -0.3853 | |
| 230 | D | A | -1.5001 | |
| 231 | Q | A | -1.9146 | |
| 232 | V | A | -1.2189 | |
| 233 | L | A | 0.0000 | |
| 234 | E | A | -2.7189 | |
| 235 | Q | A | -2.1318 | |
| 236 | G | A | 0.0000 | |
| 237 | G | A | -1.3568 | |
| 238 | V | A | 0.0000 | |
| 239 | S | A | -0.7601 | |
| 240 | S | A | -1.0122 | |
| 241 | L | A | -0.5388 | |
| 242 | L | A | 0.0000 | |
| 243 | Q | A | -0.9454 | |
| 244 | N | A | -0.8794 | |
| 245 | L | A | -0.0459 | |
| 246 | A | A | 0.3715 | |
| 247 | V | A | 1.0530 | |
| 248 | S | A | 0.3247 | |
| 249 | V | A | 0.5337 | |
| 250 | T | A | -0.0742 | |
| 251 | P | A | -0.1197 | |
| 252 | I | A | -0.9754 | |
| 253 | Q | A | -1.1533 | |
| 254 | R | A | -1.5847 | |
| 255 | I | A | 0.0000 | |
| 256 | V | A | -0.8941 | |
| 257 | R | A | -2.3692 | |
| 258 | S | A | -1.6603 | |
| 259 | G | A | -2.0860 | |
| 260 | E | A | -2.7432 | |
| 261 | N | A | -2.1866 | |
| 262 | A | A | -1.5931 | |
| 263 | L | A | 0.0000 | |
| 264 | K | A | -0.8831 | |
| 265 | I | A | 0.0000 | |
| 266 | D | A | -0.4783 | |
| 267 | I | A | -0.1053 | |
| 268 | H | A | 0.0000 | |
| 269 | V | A | 0.0000 | |
| 270 | I | A | 1.2426 | |
| 271 | I | A | 0.0000 | |
| 272 | P | A | -0.8560 | |
| 273 | Y | A | -1.1252 | |
| 274 | E | A | -2.1203 | |
| 275 | G | A | -1.1303 | |
| 276 | L | A | -0.7480 | |
| 277 | S | A | -1.0161 | |
| 278 | A | A | -0.9472 | |
| 279 | D | A | -2.1880 | |
| 280 | Q | A | -1.7552 | |
| 281 | M | A | -1.2374 | |
| 282 | A | A | -1.9745 | |
| 283 | Q | A | -2.1949 | |
| 284 | I | A | 0.0000 | |
| 285 | E | A | -2.6499 | |
| 286 | E | A | -2.7623 | |
| 287 | V | A | -1.2374 | |
| 288 | F | A | 0.0000 | |
| 289 | K | A | -1.9560 | |
| 290 | V | A | 0.2086 | |
| 291 | V | A | 0.5713 | |
| 292 | Y | A | 1.2362 | |
| 293 | P | A | 0.0608 | |
| 294 | V | A | 0.4648 | |
| 295 | D | A | -1.9610 | |
| 296 | D | A | -2.7986 | |
| 297 | H | A | -2.2376 | |
| 298 | H | A | -1.1210 | |
| 299 | F | A | 0.0000 | |
| 300 | K | A | 0.7795 | |
| 301 | V | A | 0.0000 | |
| 302 | I | A | 0.6418 | |
| 303 | L | A | 0.2692 | |
| 304 | P | A | -0.2717 | |
| 305 | Y | A | 0.0000 | |
| 306 | G | A | -0.0468 | |
| 307 | T | A | -0.2166 | |
| 308 | L | A | 0.0000 | |
| 309 | V | A | 0.0478 | |
| 310 | I | A | 0.0000 | |
| 311 | D | A | -0.3165 | |
| 312 | G | A | 0.5541 | |
| 313 | V | A | 1.5849 | |
| 314 | T | A | 0.6642 | |
| 315 | P | A | 0.0217 | |
| 316 | N | A | 0.0000 | |
| 317 | M | A | 0.2739 | |
| 318 | L | A | 0.0000 | |
| 319 | N | A | -0.8170 | |
| 320 | Y | A | 0.0000 | |
| 321 | F | A | -0.0473 | |
| 322 | G | A | -0.9149 | |
| 323 | R | A | -1.0362 | |
| 324 | P | A | -0.9284 | |
| 325 | Y | A | 0.0000 | |
| 326 | E | A | -1.4806 | |
| 327 | G | A | 0.0000 | |
| 328 | I | A | 0.6938 | |
| 329 | A | A | 0.0000 | |
| 330 | V | A | 0.7459 | |
| 331 | F | A | -0.3531 | |
| 332 | D | A | -1.3208 | |
| 333 | G | A | -0.3678 | |
| 334 | K | A | -0.6176 | |
| 335 | K | A | -0.2772 | |
| 336 | I | A | 0.0000 | |
| 337 | T | A | 0.2478 | |
| 338 | V | A | 0.0000 | |
| 339 | T | A | -0.1402 | |
| 340 | G | A | -0.7542 | |
| 341 | T | A | -1.2899 | |
| 342 | L | A | 0.0000 | |
| 343 | W | A | -0.7185 | |
| 344 | N | A | -1.0892 | |
| 345 | G | A | -1.2204 | |
| 346 | N | A | -1.6428 | |
| 347 | K | A | -1.8748 | |
| 348 | I | A | 0.0000 | |
| 349 | I | A | -0.1288 | |
| 350 | D | A | 0.0000 | |
| 351 | E | A | 0.0000 | |
| 352 | R | A | 0.0000 | |
| 353 | L | A | 0.0000 | |
| 354 | I | A | 0.0000 | |
| 355 | T | A | 0.0000 | |
| 356 | P | A | -1.3097 | |
| 357 | D | A | -2.1548 | |
| 358 | G | A | -1.5326 | |
| 359 | S | A | -0.9690 | |
| 360 | M | A | -0.4606 | |
| 361 | L | A | 0.0855 | |
| 362 | F | A | 0.4900 | |
| 363 | R | A | 0.0768 | |
| 364 | V | A | 0.3362 | |
| 365 | T | A | -0.4396 | |
| 366 | I | A | 0.0000 | |
| 367 | N | A | -1.7104 | |
| 368 | S | A | -0.8538 |
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