| Chain sequence(s) |
A: LVIWINGDKGYNGLAEVGKKFEKDTGIKVTVEHPDKLEEKFPQVAATGDGPDIIFWAHDRFGGYAQSGLLAEITPDKAFQDKLYPFTWDAVRYNGKLIAYPIAVEALSLIYNKDLLPNPPKTWEEIPALDKELKAKGKSALMFNLQEPYFTWPLIAADGGYAFKYENGKYDIKDVGVDNAGAKAGLTFLVDLIKNKHMNADTDYSIAEAAFNKGETAMTINGPWAWSNIDTSKVNYGVTVLPTFKGQPSKPFVGVLSAGINAASPNKELAKEFLENYLLTDEGLEAVNKDKPLGAVALKSYEEELAKDPRIAATMENAQKGEIMPNIPQMSAFWYAVRTAVINAASGRQTVDEALKDAQTRITKGSSVPTNLEVVAATPTSLLISWDASYSSSVSYYRITYGETGGNSPVQEFTVPGSKSTATISGLKPGVDYTITVYAYSYYYYYYSSPISINYRT
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 (00:07:32)
[INFO] Main: Simulation completed successfully. (00:07:35)
|
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 | |
| 7 | L | A | 0.0000 | |
| 8 | V | A | 0.2047 | |
| 9 | I | A | 0.0000 | |
| 10 | W | A | 0.0000 | |
| 11 | I | A | 0.0000 | |
| 12 | N | A | -2.0548 | |
| 13 | G | A | -2.5233 | |
| 14 | D | A | -2.6491 | |
| 15 | K | A | -2.2981 | |
| 16 | G | A | 0.0000 | |
| 17 | Y | A | -1.6420 | |
| 18 | N | A | -2.2064 | |
| 19 | G | A | 0.0000 | |
| 20 | L | A | 0.0000 | |
| 21 | A | A | -1.8912 | |
| 22 | E | A | -3.0029 | |
| 23 | V | A | 0.0000 | |
| 24 | G | A | 0.0000 | |
| 25 | K | A | -4.1007 | |
| 26 | K | A | -3.6497 | |
| 27 | F | A | 0.0000 | |
| 28 | E | A | -3.6850 | |
| 29 | K | A | -4.0608 | |
| 30 | D | A | -3.3637 | |
| 31 | T | A | -2.1908 | |
| 32 | G | A | -2.0994 | |
| 33 | I | A | -1.6075 | |
| 34 | K | A | -2.0667 | |
| 35 | V | A | -1.2807 | |
| 36 | T | A | -0.4810 | |
| 37 | V | A | -0.7424 | |
| 38 | E | A | -1.5177 | |
| 39 | H | A | -2.1867 | |
| 40 | P | A | -2.1584 | |
| 41 | D | A | -3.3903 | |
| 42 | K | A | -3.5448 | |
| 43 | L | A | 0.0000 | |
| 44 | E | A | 0.0000 | |
| 45 | E | A | -3.3493 | |
| 46 | K | A | -2.8612 | |
| 47 | F | A | 0.0000 | |
| 48 | P | A | -1.4773 | |
| 49 | Q | A | -2.0335 | |
| 50 | V | A | -1.5188 | |
| 51 | A | A | 0.0000 | |
| 52 | A | A | -0.6528 | |
| 53 | T | A | -0.9116 | |
| 54 | G | A | -1.4314 | |
| 55 | D | A | -2.1452 | |
| 56 | G | A | -1.1970 | |
| 57 | P | A | 0.0000 | |
| 58 | D | A | 0.0000 | |
| 59 | I | A | 0.0000 | |
| 60 | I | A | 0.0000 | |
| 61 | F | A | 0.0000 | |
| 62 | W | A | -0.2626 | |
| 63 | A | A | -0.7325 | |
| 64 | H | A | 0.0000 | |
| 65 | D | A | -2.1127 | |
| 66 | R | A | -2.0441 | |
| 67 | F | A | 0.0000 | |
| 68 | G | A | 0.0000 | |
| 69 | G | A | -1.1675 | |
| 70 | Y | A | 0.0000 | |
| 71 | A | A | -1.0927 | |
| 72 | Q | A | 0.0000 | |
| 73 | S | A | -0.4796 | |
| 74 | G | A | -0.7220 | |
| 75 | L | A | 0.0000 | |
| 76 | L | A | 0.0000 | |
| 77 | A | A | -1.2096 | |
| 78 | E | A | -2.3503 | |
| 79 | I | A | 0.0000 | |
| 80 | T | A | -1.4242 | |
| 81 | P | A | 0.0000 | |
| 82 | D | A | -2.9748 | |
| 83 | K | A | -3.2648 | |
| 84 | A | A | -2.3645 | |
| 85 | F | A | 0.0000 | |
| 86 | Q | A | -2.6493 | |
| 87 | D | A | -3.2427 | |
| 88 | K | A | -2.4096 | |
| 89 | L | A | 0.0000 | |
| 90 | Y | A | -0.8830 | |
| 91 | P | A | -0.8867 | |
| 92 | F | A | -0.1677 | |
| 93 | T | A | 0.0000 | |
| 94 | W | A | 0.0000 | |
| 95 | D | A | -1.2780 | |
| 96 | A | A | 0.0000 | |
| 97 | V | A | 0.0000 | |
| 98 | R | A | -2.3052 | |
| 99 | Y | A | 0.0000 | |
| 100 | N | A | -2.2666 | |
| 101 | G | A | -2.2778 | |
| 102 | K | A | -2.7536 | |
| 103 | L | A | -1.7502 | |
| 104 | I | A | 0.0000 | |
| 105 | A | A | 0.0000 | |
| 106 | Y | A | 0.0000 | |
| 107 | P | A | 0.0000 | |
| 108 | I | A | 0.0000 | |
| 109 | A | A | 0.0000 | |
| 110 | V | A | 0.0000 | |
| 111 | E | A | -0.8301 | |
| 112 | A | A | 0.0000 | |
| 113 | L | A | 0.0000 | |
| 114 | S | A | 0.0000 | |
| 115 | L | A | 0.0000 | |
| 116 | I | A | 0.0000 | |
| 117 | Y | A | 0.0000 | |
| 118 | N | A | 0.0000 | |
| 119 | K | A | -2.4747 | |
| 120 | D | A | -2.6128 | |
| 121 | L | A | -1.6950 | |
| 122 | L | A | 0.0000 | |
| 123 | P | A | -1.8308 | |
| 124 | N | A | -1.9791 | |
| 125 | P | A | -1.2202 | |
| 126 | P | A | 0.0000 | |
| 127 | K | A | -2.1025 | |
| 128 | T | A | -1.8433 | |
| 129 | W | A | 0.0000 | |
| 130 | E | A | -1.8940 | |
| 131 | E | A | -1.3522 | |
| 132 | I | A | 0.0000 | |
| 133 | P | A | -1.4750 | |
| 134 | A | A | -1.2143 | |
| 135 | L | A | -1.3518 | |
| 136 | D | A | 0.0000 | |
| 137 | K | A | -3.3417 | |
| 138 | E | A | -3.3928 | |
| 139 | L | A | 0.0000 | |
| 140 | K | A | -3.0888 | |
| 141 | A | A | -2.4984 | |
| 142 | K | A | -2.9979 | |
| 143 | G | A | -2.4445 | |
| 144 | K | A | -2.6883 | |
| 145 | S | A | -1.8317 | |
| 146 | A | A | 0.0000 | |
| 147 | L | A | 0.0000 | |
| 148 | M | A | -0.0892 | |
| 149 | F | A | 0.0000 | |
| 150 | N | A | 0.0000 | |
| 151 | L | A | 0.0000 | |
| 152 | Q | A | -1.0723 | |
| 153 | E | A | -0.6587 | |
| 154 | P | A | 0.0000 | |
| 155 | Y | A | -0.1288 | |
| 156 | F | A | 0.0000 | |
| 157 | T | A | 0.0000 | |
| 158 | W | A | 0.0000 | |
| 159 | P | A | 0.0000 | |
| 160 | L | A | 0.0000 | |
| 161 | I | A | 0.0000 | |
| 162 | A | A | 0.0000 | |
| 163 | A | A | 0.0000 | |
| 164 | D | A | -1.8667 | |
| 165 | G | A | -0.9472 | |
| 166 | G | A | 0.0000 | |
| 167 | Y | A | -0.3290 | |
| 168 | A | A | 0.0000 | |
| 169 | F | A | 0.0000 | |
| 170 | K | A | -2.0835 | |
| 171 | Y | A | -1.9316 | |
| 172 | E | A | -3.1013 | |
| 173 | N | A | -2.9079 | |
| 174 | G | A | -2.5828 | |
| 175 | K | A | -3.4144 | |
| 176 | Y | A | -2.2147 | |
| 177 | D | A | -2.6238 | |
| 178 | I | A | -1.4714 | |
| 179 | K | A | -2.4482 | |
| 180 | D | A | -1.7369 | |
| 181 | V | A | 0.0000 | |
| 182 | G | A | 0.0000 | |
| 183 | V | A | 0.0000 | |
| 184 | D | A | -1.9308 | |
| 185 | N | A | -1.3702 | |
| 186 | A | A | -0.8817 | |
| 187 | G | A | 0.0000 | |
| 188 | A | A | 0.0000 | |
| 189 | K | A | -1.4506 | |
| 190 | A | A | -0.7722 | |
| 191 | G | A | 0.0000 | |
| 192 | L | A | 0.0000 | |
| 193 | T | A | -0.5133 | |
| 194 | F | A | -0.3004 | |
| 195 | L | A | 0.0000 | |
| 196 | V | A | -0.9590 | |
| 197 | D | A | -1.6183 | |
| 198 | L | A | 0.0000 | |
| 199 | I | A | -2.3095 | |
| 200 | K | A | -3.0869 | |
| 201 | N | A | -2.9395 | |
| 202 | K | A | -3.2262 | |
| 203 | H | A | 0.0000 | |
| 204 | M | A | -1.7252 | |
| 205 | N | A | -2.4883 | |
| 206 | A | A | -1.9445 | |
| 207 | D | A | -2.1384 | |
| 208 | T | A | 0.0000 | |
| 209 | D | A | -0.7540 | |
| 210 | Y | A | 0.2521 | |
| 211 | S | A | 0.3280 | |
| 212 | I | A | 0.8193 | |
| 213 | A | A | 0.0000 | |
| 214 | E | A | -0.4345 | |
| 215 | A | A | -0.6531 | |
| 216 | A | A | 0.0000 | |
| 217 | F | A | 0.0000 | |
| 218 | N | A | -2.1951 | |
| 219 | K | A | -2.5759 | |
| 220 | G | A | -2.3821 | |
| 221 | E | A | -2.5828 | |
| 222 | T | A | 0.0000 | |
| 223 | A | A | 0.0000 | |
| 224 | M | A | 0.0000 | |
| 225 | T | A | 0.0000 | |
| 226 | I | A | 0.0000 | |
| 227 | N | A | 0.0000 | |
| 228 | G | A | 0.0000 | |
| 229 | P | A | -0.0382 | |
| 230 | W | A | 0.2064 | |
| 231 | A | A | 0.0000 | |
| 232 | W | A | 0.0000 | |
| 233 | S | A | -1.2872 | |
| 234 | N | A | -2.0900 | |
| 235 | I | A | 0.0000 | |
| 236 | D | A | -2.7921 | |
| 237 | T | A | -1.9050 | |
| 238 | S | A | -2.2408 | |
| 239 | K | A | -2.8481 | |
| 240 | V | A | -2.4806 | |
| 241 | N | A | -2.5569 | |
| 242 | Y | A | -1.6065 | |
| 243 | G | A | 0.0000 | |
| 244 | V | A | 0.0000 | |
| 245 | T | A | -0.2675 | |
| 246 | V | A | -0.2229 | |
| 247 | L | A | 0.0000 | |
| 248 | P | A | 0.0000 | |
| 249 | T | A | -1.5787 | |
| 250 | F | A | 0.0000 | |
| 251 | K | A | -2.5461 | |
| 252 | G | A | -2.0733 | |
| 253 | Q | A | -1.8974 | |
| 254 | P | A | -1.3186 | |
| 255 | S | A | 0.0000 | |
| 256 | K | A | -0.9510 | |
| 257 | P | A | 0.0000 | |
| 258 | F | A | 0.0000 | |
| 259 | V | A | 0.0000 | |
| 260 | G | A | -0.6738 | |
| 261 | V | A | 0.0000 | |
| 262 | L | A | -0.1199 | |
| 263 | S | A | 0.0000 | |
| 264 | A | A | 0.0000 | |
| 265 | G | A | 0.0000 | |
| 266 | I | A | 0.0000 | |
| 267 | N | A | 0.0000 | |
| 268 | A | A | -0.5858 | |
| 269 | A | A | -0.6284 | |
| 270 | S | A | 0.0000 | |
| 271 | P | A | -0.8617 | |
| 272 | N | A | -1.3023 | |
| 273 | K | A | -2.3179 | |
| 274 | E | A | -2.8000 | |
| 275 | L | A | -1.5900 | |
| 276 | A | A | 0.0000 | |
| 277 | K | A | -2.5060 | |
| 278 | E | A | -2.5393 | |
| 279 | F | A | 0.0000 | |
| 280 | L | A | 0.0000 | |
| 281 | E | A | 0.0000 | |
| 282 | N | A | -1.7122 | |
| 283 | Y | A | -1.4090 | |
| 284 | L | A | 0.0000 | |
| 285 | L | A | 0.0000 | |
| 286 | T | A | -1.6498 | |
| 287 | D | A | -2.4178 | |
| 288 | E | A | -2.5808 | |
| 289 | G | A | 0.0000 | |
| 290 | L | A | 0.0000 | |
| 291 | E | A | -2.5438 | |
| 292 | A | A | -2.4979 | |
| 293 | V | A | 0.0000 | |
| 294 | N | A | -2.2945 | |
| 295 | K | A | -2.8952 | |
| 296 | D | A | -2.5067 | |
| 297 | K | A | -3.1712 | |
| 298 | P | A | -1.7676 | |
| 299 | L | A | -0.9544 | |
| 300 | G | A | -0.4830 | |
| 301 | A | A | 0.0000 | |
| 302 | V | A | 0.0000 | |
| 303 | A | A | 0.0000 | |
| 304 | L | A | 0.0000 | |
| 305 | K | A | -2.0416 | |
| 306 | S | A | -1.8092 | |
| 307 | Y | A | 0.0000 | |
| 308 | E | A | 0.0000 | |
| 309 | E | A | -3.2335 | |
| 310 | E | A | -3.4074 | |
| 311 | L | A | -2.2511 | |
| 312 | A | A | -2.3803 | |
| 313 | K | A | -2.8774 | |
| 314 | D | A | -2.0119 | |
| 315 | P | A | -1.1765 | |
| 316 | R | A | -1.0468 | |
| 317 | I | A | 0.0000 | |
| 318 | A | A | -1.4129 | |
| 319 | A | A | 0.0000 | |
| 320 | T | A | 0.0000 | |
| 321 | M | A | 0.0000 | |
| 322 | E | A | -1.8634 | |
| 323 | N | A | 0.0000 | |
| 324 | A | A | 0.0000 | |
| 325 | Q | A | -1.8983 | |
| 326 | K | A | -1.8626 | |
| 327 | G | A | -1.1934 | |
| 328 | E | A | -0.4566 | |
| 329 | I | A | -0.3059 | |
| 330 | M | A | -0.2586 | |
| 331 | P | A | 0.0000 | |
| 332 | N | A | -1.0634 | |
| 333 | I | A | -0.3373 | |
| 334 | P | A | -0.5058 | |
| 335 | Q | A | -0.1699 | |
| 336 | M | A | 0.0000 | |
| 337 | S | A | 0.2381 | |
| 338 | A | A | -0.0371 | |
| 339 | F | A | 0.0000 | |
| 340 | W | A | 0.4069 | |
| 341 | Y | A | 0.8188 | |
| 342 | A | A | 0.0000 | |
| 343 | V | A | 0.0000 | |
| 344 | R | A | -0.8825 | |
| 345 | T | A | -0.3553 | |
| 346 | A | A | 0.0000 | |
| 347 | V | A | 0.0000 | |
| 348 | I | A | -0.8272 | |
| 349 | N | A | -1.1631 | |
| 350 | A | A | 0.0000 | |
| 351 | A | A | -1.1908 | |
| 352 | S | A | -1.5331 | |
| 353 | G | A | -1.6705 | |
| 354 | R | A | -2.3149 | |
| 355 | Q | A | -1.8437 | |
| 356 | T | A | -1.6530 | |
| 357 | V | A | -1.7295 | |
| 358 | D | A | -2.9094 | |
| 359 | E | A | -2.7250 | |
| 360 | A | A | 0.0000 | |
| 361 | L | A | 0.0000 | |
| 362 | K | A | -3.0552 | |
| 363 | D | A | -2.0173 | |
| 364 | A | A | 0.0000 | |
| 365 | Q | A | -1.7673 | |
| 366 | T | A | -1.7273 | |
| 367 | R | A | -1.7003 | |
| 368 | I | A | -1.0724 | |
| 369 | T | A | -1.7178 | |
| 370 | K | A | -2.4752 | |
| 1001 | G | A | -1.5538 | |
| 1002 | S | A | -0.8946 | |
| 1003 | S | A | -0.4581 | |
| 1004 | V | A | 0.1761 | |
| 1005 | P | A | 0.0000 | |
| 1006 | T | A | -0.5114 | |
| 1007 | N | A | -1.0601 | |
| 1008 | L | A | 0.0000 | |
| 1009 | E | A | -1.7171 | |
| 1010 | V | A | -0.4998 | |
| 1011 | V | A | -0.2654 | |
| 1012 | A | A | -0.1397 | |
| 1013 | A | A | -0.2567 | |
| 1014 | T | A | -0.2138 | |
| 1015 | P | A | -1.1134 | |
| 1016 | T | A | -0.9733 | |
| 1017 | S | A | -0.5468 | |
| 1018 | L | A | 0.0000 | |
| 1019 | L | A | 0.1903 | |
| 1020 | I | A | 0.0000 | |
| 1021 | S | A | 0.0000 | |
| 1022 | W | A | 0.0000 | |
| 1023 | D | A | 0.0000 | |
| 1024 | A | A | -0.4842 | |
| 1025 | S | A | -0.6168 | |
| 1026 | Y | A | 0.1177 | |
| 1027 | S | A | -0.3780 | |
| 1028 | S | A | -0.0914 | |
| 1029 | S | A | 0.2486 | |
| 1030 | V | A | 0.0000 | |
| 1031 | S | A | 0.9993 | |
| 1032 | Y | A | 0.4669 | |
| 1033 | Y | A | 0.0000 | |
| 1034 | R | A | -0.2914 | |
| 1035 | I | A | 0.0000 | |
| 1036 | T | A | 0.0000 | |
| 1037 | Y | A | -0.4540 | |
| 1038 | G | A | -1.1460 | |
| 1039 | E | A | -2.2966 | |
| 1040 | T | A | -1.9564 | |
| 1041 | G | A | -1.5011 | |
| 1042 | G | A | -1.7232 | |
| 1043 | N | A | -1.6856 | |
| 1044 | S | A | -1.0090 | |
| 1045 | P | A | -0.4562 | |
| 1046 | V | A | 0.2426 | |
| 1047 | Q | A | -1.1690 | |
| 1048 | E | A | -1.7129 | |
| 1049 | F | A | -0.4982 | |
| 1050 | T | A | -0.2215 | |
| 1051 | V | A | 0.0000 | |
| 1052 | P | A | -0.4573 | |
| 1053 | G | A | 0.0000 | |
| 1054 | S | A | -0.8934 | |
| 1055 | K | A | -1.2426 | |
| 1056 | S | A | -0.7555 | |
| 1057 | T | A | -0.5621 | |
| 1058 | A | A | 0.0000 | |
| 1059 | T | A | 0.0293 | |
| 1060 | I | A | 0.0000 | |
| 1061 | S | A | -0.6765 | |
| 1062 | G | A | -1.0091 | |
| 1063 | L | A | 0.0000 | |
| 1064 | K | A | -2.5543 | |
| 1065 | P | A | -1.8068 | |
| 1066 | G | A | -1.6582 | |
| 1067 | V | A | -1.9793 | |
| 1068 | D | A | -3.1265 | |
| 1069 | Y | A | 0.0000 | |
| 1070 | T | A | -1.0954 | |
| 1071 | I | A | 0.0000 | |
| 1072 | T | A | -0.1358 | |
| 1073 | V | A | 0.0000 | |
| 1074 | Y | A | 0.5613 | |
| 1075 | A | A | 0.0000 | |
| 1076 | Y | A | 1.8766 | |
| 1077 | S | A | 0.0000 | |
| 1078 | Y | A | 2.7069 | |
| 1079 | Y | A | 3.0760 | |
| 1080 | Y | A | 3.1337 | |
| 1081 | Y | A | 2.9494 | |
| 1082 | Y | A | 2.2034 | |
| 1083 | Y | A | 1.0175 | |
| 1084 | S | A | 0.1288 | |
| 1085 | S | A | -0.1723 | |
| 1086 | P | A | 0.1109 | |
| 1087 | I | A | 0.0450 | |
| 1088 | S | A | -0.4892 | |
| 1089 | I | A | -0.5800 | |
| 1090 | N | A | -1.9617 | |
| 1091 | Y | A | -1.7083 | |
| 1092 | R | A | -2.9626 | |
| 1093 | T | A | -1.7285 |
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