| Chain sequence(s) |
A: EYGWINIDSRWYFFDSINLIAKKGYQEIEGERYYFNPNTGVQESGVFLTPNGLEYFTNKHASSKRWGRAINYTGWLTLDGNKYYFQSNSKAVTGLQKISDKYYYFNDNGQMQIKWQIINNNKYYFDGNTGEAIIGWFNNNKERYYFDSEGRLLTGYQVIGDKSYYFSDNINGNWEEGSGVLKSGIFKTPSGFKLFSSEGDKSAINYKGWLDLNGNKYYFNSDSIAVTGSYNIKGIQYYFNPKTAVLTNGWYTLDNNNYYVSNGHNVLGYQDIDGKGYYFDPSTGIQKAGVFPTPNGLRYFTMKPIDGQRWGQCIDYTGWLHLNGNKYYFGYYNSAVTGWRVLGGKRYFFNIKTGAATTGLLTLSGKRYYFNEKGEQLTLV
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] (00:00:02)
[WARNING] runJob: Working directory already exists (possibly overwriting previous results -ow
to prevent this behavior) (00:00:02)
[INFO] runJob: Starting aggrescan3d job on: input.pdb with A chain(s) selected (00:00:02)
[INFO] runJob: Creating pdb object from: input.pdb (00:00:02)
[INFO] FoldX: Starting FoldX energy minimalization (00:00:02)
[INFO] Analysis: Starting Aggrescan3D on folded.pdb (00:08:50)
[INFO] Main: Simulation completed successfully. (00:08:56)
|
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 | E | A | -0.4659 | |
| 2 | Y | A | 1.5003 | |
| 3 | G | A | 0.7762 | |
| 4 | W | A | 0.6134 | |
| 5 | I | A | 0.0252 | |
| 6 | N | A | -1.0394 | |
| 7 | I | A | -0.7410 | |
| 8 | D | A | -2.1212 | |
| 9 | S | A | -1.7623 | |
| 10 | R | A | -2.2230 | |
| 11 | W | A | -0.6466 | |
| 12 | Y | A | 0.2861 | |
| 13 | F | A | 0.7973 | |
| 14 | F | A | 1.5377 | |
| 15 | D | A | 1.3990 | |
| 16 | S | A | 1.3348 | |
| 17 | I | A | 2.2048 | |
| 18 | N | A | 1.1409 | |
| 19 | L | A | 2.3174 | |
| 20 | I | A | 2.3634 | |
| 21 | A | A | 0.8467 | |
| 22 | K | A | -0.3671 | |
| 23 | K | A | -1.4561 | |
| 24 | G | A | -0.7840 | |
| 25 | Y | A | -0.5184 | |
| 26 | Q | A | -1.6995 | |
| 27 | E | A | -2.7128 | |
| 28 | I | A | 0.0000 | |
| 29 | E | A | -2.5869 | |
| 30 | G | A | -2.0058 | |
| 31 | E | A | 0.0000 | |
| 32 | R | A | -1.7602 | |
| 33 | Y | A | 0.0000 | |
| 34 | Y | A | -0.5418 | |
| 35 | F | A | 0.0000 | |
| 36 | N | A | -1.1504 | |
| 37 | P | A | -1.4765 | |
| 38 | N | A | -1.7060 | |
| 39 | T | A | -1.0534 | |
| 40 | G | A | 0.0000 | |
| 41 | V | A | 0.0000 | |
| 42 | Q | A | 0.0000 | |
| 43 | E | A | -0.8107 | |
| 44 | S | A | -0.8488 | |
| 45 | G | A | 0.0000 | |
| 46 | V | A | 0.0000 | |
| 47 | F | A | 0.7617 | |
| 48 | L | A | 0.9577 | |
| 49 | T | A | 0.2859 | |
| 50 | P | A | -0.3839 | |
| 51 | N | A | -0.8866 | |
| 52 | G | A | -0.3403 | |
| 53 | L | A | 0.0000 | |
| 54 | E | A | 0.0000 | |
| 55 | Y | A | 0.0000 | |
| 56 | F | A | 0.0000 | |
| 57 | T | A | 0.0000 | |
| 58 | N | A | -2.4313 | |
| 59 | K | A | -3.0140 | |
| 60 | H | A | -2.5612 | |
| 61 | A | A | -1.6913 | |
| 62 | S | A | -1.1558 | |
| 63 | S | A | -1.2112 | |
| 64 | K | A | -2.1205 | |
| 65 | R | A | -1.9304 | |
| 66 | W | A | -1.5989 | |
| 67 | G | A | 0.0000 | |
| 68 | R | A | -1.4175 | |
| 69 | A | A | 0.0000 | |
| 70 | I | A | -0.1423 | |
| 71 | N | A | -1.1357 | |
| 72 | Y | A | -0.4882 | |
| 73 | T | A | -0.6185 | |
| 74 | G | A | -0.0040 | |
| 75 | W | A | 0.4389 | |
| 76 | L | A | 0.1675 | |
| 77 | T | A | -0.6882 | |
| 78 | L | A | -1.2637 | |
| 79 | D | A | -2.1841 | |
| 80 | G | A | -1.6900 | |
| 81 | N | A | -1.6004 | |
| 82 | K | A | -1.0712 | |
| 83 | Y | A | 0.0000 | |
| 84 | Y | A | 0.0845 | |
| 85 | F | A | 0.0000 | |
| 86 | Q | A | -1.3688 | |
| 87 | S | A | -1.4688 | |
| 88 | N | A | -1.9485 | |
| 89 | S | A | 0.0000 | |
| 90 | K | A | -1.1173 | |
| 91 | A | A | 0.0000 | |
| 92 | V | A | 0.0000 | |
| 93 | T | A | -0.9376 | |
| 94 | G | A | -0.7271 | |
| 95 | L | A | 0.0304 | |
| 96 | Q | A | -1.1076 | |
| 97 | K | A | -2.4844 | |
| 98 | I | A | 0.0000 | |
| 99 | S | A | -1.7683 | |
| 100 | D | A | -2.8404 | |
| 101 | K | A | -2.4037 | |
| 102 | Y | A | -1.2458 | |
| 103 | Y | A | -0.4716 | |
| 104 | Y | A | -0.0415 | |
| 105 | F | A | 0.0000 | |
| 106 | N | A | -1.5629 | |
| 107 | D | A | -2.3604 | |
| 108 | N | A | -1.8774 | |
| 109 | G | A | 0.0000 | |
| 110 | Q | A | -1.2379 | |
| 111 | M | A | -0.5228 | |
| 112 | Q | A | -0.2094 | |
| 113 | I | A | -0.1030 | |
| 114 | K | A | -0.9769 | |
| 115 | W | A | 0.1936 | |
| 116 | Q | A | 0.4316 | |
| 117 | I | A | 1.1028 | |
| 118 | I | A | -0.0699 | |
| 119 | N | A | -1.5041 | |
| 120 | N | A | -1.6314 | |
| 121 | N | A | -1.0407 | |
| 122 | K | A | -0.3556 | |
| 123 | Y | A | 0.0000 | |
| 124 | Y | A | 0.0000 | |
| 125 | F | A | 0.0000 | |
| 126 | D | A | -1.0957 | |
| 127 | G | A | -1.1895 | |
| 128 | N | A | -1.5855 | |
| 129 | T | A | -0.8276 | |
| 130 | G | A | 0.0000 | |
| 131 | E | A | -0.9158 | |
| 132 | A | A | 0.0000 | |
| 133 | I | A | 0.7295 | |
| 134 | I | A | 1.7068 | |
| 135 | G | A | 0.9712 | |
| 136 | W | A | 0.6754 | |
| 137 | F | A | -0.1844 | |
| 138 | N | A | -2.3232 | |
| 139 | N | A | -2.3119 | |
| 140 | N | A | -2.8863 | |
| 141 | K | A | -3.1416 | |
| 142 | E | A | -2.6824 | |
| 143 | R | A | -2.0188 | |
| 144 | Y | A | 0.0000 | |
| 145 | Y | A | 0.5255 | |
| 146 | F | A | 0.0000 | |
| 147 | D | A | -0.4046 | |
| 148 | S | A | -0.7265 | |
| 149 | E | A | -1.6944 | |
| 150 | G | A | 0.0000 | |
| 151 | R | A | -0.9386 | |
| 152 | L | A | 0.0302 | |
| 153 | L | A | -0.0760 | |
| 154 | T | A | -0.2688 | |
| 155 | G | A | 0.0000 | |
| 156 | Y | A | 0.3139 | |
| 157 | Q | A | 0.6261 | |
| 158 | V | A | 1.0007 | |
| 159 | I | A | 0.0962 | |
| 160 | G | A | -1.1138 | |
| 161 | D | A | -2.0566 | |
| 162 | K | A | -1.4936 | |
| 163 | S | A | -0.1306 | |
| 164 | Y | A | 0.0000 | |
| 165 | Y | A | 0.0000 | |
| 166 | F | A | 0.0000 | |
| 167 | S | A | 0.0000 | |
| 168 | D | A | -1.2996 | |
| 169 | N | A | -1.8662 | |
| 170 | I | A | -0.1984 | |
| 171 | N | A | -1.5343 | |
| 172 | G | A | -1.6632 | |
| 173 | N | A | -2.0001 | |
| 174 | W | A | -1.3118 | |
| 175 | E | A | -2.8269 | |
| 176 | E | A | -2.8806 | |
| 177 | G | A | -1.6386 | |
| 178 | S | A | -1.2885 | |
| 179 | G | A | 0.0000 | |
| 180 | V | A | -0.6712 | |
| 181 | L | A | 0.0000 | |
| 182 | K | A | -0.7719 | |
| 183 | S | A | -0.7655 | |
| 184 | G | A | -0.1005 | |
| 185 | I | A | 0.1772 | |
| 186 | F | A | -0.0302 | |
| 187 | K | A | -1.2095 | |
| 188 | T | A | 0.0000 | |
| 189 | P | A | -0.6426 | |
| 190 | S | A | -0.7428 | |
| 191 | G | A | -0.7745 | |
| 192 | F | A | 0.0000 | |
| 193 | K | A | -0.5778 | |
| 194 | L | A | 0.0000 | |
| 195 | F | A | 0.0000 | |
| 196 | S | A | 0.0000 | |
| 197 | S | A | -1.4650 | |
| 198 | E | A | -2.4537 | |
| 199 | G | A | -1.8819 | |
| 200 | D | A | -1.8254 | |
| 201 | K | A | -1.6084 | |
| 202 | S | A | -1.0098 | |
| 203 | A | A | -0.0008 | |
| 204 | I | A | -0.0009 | |
| 205 | N | A | -1.4205 | |
| 206 | Y | A | -1.0312 | |
| 207 | K | A | -2.0060 | |
| 208 | G | A | -0.5600 | |
| 209 | W | A | -0.3461 | |
| 210 | L | A | -1.0760 | |
| 211 | D | A | -2.3808 | |
| 212 | L | A | -1.5522 | |
| 213 | N | A | -2.0762 | |
| 214 | G | A | -1.9325 | |
| 215 | N | A | -1.9931 | |
| 216 | K | A | -1.9899 | |
| 217 | Y | A | -0.6100 | |
| 218 | Y | A | -0.1795 | |
| 219 | F | A | 0.0000 | |
| 220 | N | A | -1.3010 | |
| 221 | S | A | -1.7337 | |
| 222 | D | A | -2.4329 | |
| 223 | S | A | 0.0000 | |
| 224 | I | A | -0.9685 | |
| 225 | A | A | 0.0000 | |
| 226 | V | A | 0.0000 | |
| 227 | T | A | -0.3025 | |
| 228 | G | A | -0.2670 | |
| 229 | S | A | -0.4921 | |
| 230 | Y | A | -0.4948 | |
| 231 | N | A | -1.5752 | |
| 232 | I | A | -1.1085 | |
| 233 | K | A | -1.9149 | |
| 234 | G | A | -1.2248 | |
| 235 | I | A | -0.5036 | |
| 236 | Q | A | -1.2460 | |
| 237 | Y | A | -0.7285 | |
| 238 | Y | A | -0.5052 | |
| 239 | F | A | 0.0000 | |
| 240 | N | A | -0.9404 | |
| 241 | P | A | -1.1794 | |
| 242 | K | A | -2.2307 | |
| 243 | T | A | -1.2265 | |
| 244 | A | A | 0.0000 | |
| 245 | V | A | -0.8225 | |
| 246 | L | A | 0.0000 | |
| 247 | T | A | -1.0215 | |
| 248 | N | A | -1.5957 | |
| 249 | G | A | -0.6959 | |
| 250 | W | A | 0.0818 | |
| 251 | Y | A | 0.1159 | |
| 252 | T | A | -0.5823 | |
| 253 | L | A | -0.9198 | |
| 254 | D | A | -2.3838 | |
| 255 | N | A | -2.2606 | |
| 256 | N | A | -1.6159 | |
| 257 | N | A | -0.8036 | |
| 258 | Y | A | 0.0698 | |
| 259 | Y | A | 0.0993 | |
| 260 | V | A | 0.0000 | |
| 261 | S | A | -1.2188 | |
| 262 | N | A | -1.8011 | |
| 263 | G | A | 0.0000 | |
| 264 | H | A | -1.0850 | |
| 265 | N | A | -0.4269 | |
| 266 | V | A | 0.0000 | |
| 267 | L | A | 0.8012 | |
| 268 | G | A | 0.3220 | |
| 269 | Y | A | -0.1518 | |
| 270 | Q | A | -1.2935 | |
| 271 | D | A | -2.8632 | |
| 272 | I | A | 0.0000 | |
| 273 | D | A | -2.8776 | |
| 274 | G | A | -2.4547 | |
| 275 | K | A | -2.7276 | |
| 276 | G | A | 0.0000 | |
| 277 | Y | A | 0.0000 | |
| 278 | Y | A | 0.0000 | |
| 279 | F | A | 0.0000 | |
| 280 | D | A | -0.0775 | |
| 281 | P | A | -0.0432 | |
| 282 | S | A | -0.1978 | |
| 283 | T | A | -0.0300 | |
| 284 | G | A | 0.0000 | |
| 285 | I | A | -0.0566 | |
| 286 | Q | A | 0.0000 | |
| 287 | K | A | -0.4281 | |
| 288 | A | A | -0.2024 | |
| 289 | G | A | 0.0000 | |
| 290 | V | A | 0.1608 | |
| 291 | F | A | -0.0472 | |
| 292 | P | A | -0.6305 | |
| 293 | T | A | -0.6630 | |
| 294 | P | A | -0.9585 | |
| 295 | N | A | -1.4535 | |
| 296 | G | A | -0.8345 | |
| 297 | L | A | 0.0000 | |
| 298 | R | A | -0.5099 | |
| 299 | Y | A | 0.0000 | |
| 300 | F | A | 0.0000 | |
| 301 | T | A | 0.0000 | |
| 302 | M | A | -0.4189 | |
| 303 | K | A | -1.4084 | |
| 304 | P | A | -0.6312 | |
| 305 | I | A | 0.3945 | |
| 306 | D | A | -1.4960 | |
| 307 | G | A | -1.2238 | |
| 308 | Q | A | -1.2387 | |
| 309 | R | A | -1.3135 | |
| 310 | W | A | -0.2977 | |
| 311 | G | A | 0.0000 | |
| 312 | Q | A | -0.9126 | |
| 313 | C | A | -0.6646 | |
| 314 | I | A | -0.7290 | |
| 315 | D | A | -1.2623 | |
| 316 | Y | A | -0.2120 | |
| 317 | T | A | 0.2693 | |
| 318 | G | A | 0.3987 | |
| 319 | W | A | 0.2648 | |
| 320 | L | A | 0.0000 | |
| 321 | H | A | -1.4899 | |
| 322 | L | A | -1.2741 | |
| 323 | N | A | -1.8990 | |
| 324 | G | A | -1.6708 | |
| 325 | N | A | -1.9086 | |
| 326 | K | A | -1.4637 | |
| 327 | Y | A | 0.0000 | |
| 328 | Y | A | 0.1271 | |
| 329 | F | A | 0.0000 | |
| 330 | G | A | 1.0676 | |
| 331 | Y | A | 1.6765 | |
| 332 | Y | A | 1.3717 | |
| 333 | N | A | 0.1284 | |
| 334 | S | A | -0.0423 | |
| 335 | A | A | 0.0000 | |
| 336 | V | A | 0.5020 | |
| 337 | T | A | 0.2052 | |
| 338 | G | A | 0.1432 | |
| 339 | W | A | 0.1481 | |
| 340 | R | A | -0.4356 | |
| 341 | V | A | 0.4368 | |
| 342 | L | A | -0.1067 | |
| 343 | G | A | -0.7597 | |
| 344 | G | A | -0.9723 | |
| 345 | K | A | -1.3883 | |
| 346 | R | A | -1.0633 | |
| 347 | Y | A | 0.0000 | |
| 348 | F | A | 0.0000 | |
| 349 | F | A | 0.0000 | |
| 350 | N | A | 0.0159 | |
| 351 | I | A | 0.9694 | |
| 352 | K | A | -0.8991 | |
| 353 | T | A | -0.4394 | |
| 354 | G | A | 0.0000 | |
| 355 | A | A | -0.5044 | |
| 356 | A | A | -0.7685 | |
| 357 | T | A | -0.4974 | |
| 358 | T | A | -0.7062 | |
| 359 | G | A | 0.2614 | |
| 360 | L | A | 1.6246 | |
| 361 | L | A | 0.3831 | |
| 362 | T | A | -0.5626 | |
| 363 | L | A | -0.8414 | |
| 364 | S | A | -1.0410 | |
| 365 | G | A | -1.6343 | |
| 366 | K | A | -2.0981 | |
| 367 | R | A | -1.2333 | |
| 368 | Y | A | 0.0000 | |
| 369 | Y | A | 1.6869 | |
| 370 | F | A | 0.0000 | |
| 371 | N | A | -1.0557 | |
| 372 | E | A | -2.6976 | |
| 373 | K | A | -2.6301 | |
| 374 | G | A | 0.0000 | |
| 375 | E | A | -1.1467 | |
| 376 | Q | A | -0.0413 | |
| 377 | L | A | 1.2698 | |
| 378 | T | A | 1.3963 | |
| 379 | L | A | 1.7056 | |
| 380 | V | A | 1.9196 |
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