| Chain sequence(s) |
A: AVSPAPDTAPVPDVDSRGAILRRQYNLSTSPLTSSVASGTNLVLYAAPLNPLLPLQDGTNTHIMATEASNYAQYRVARATIRYRPLVPNAVGGYAISISFWPQTTTTPTSVDMNSITSTDVRILVQPGIASELVIPSERLHYRNQGWRSVETTGVAEEEATSGLVMLCIHGSPVNSYTNTPYTGALGLLDFALELEFRNLTPGNTNTRVSRYSSTARHRLRRGADGTAELTTTAATRFMKDLHFTGTNGVGEVGRGIALTLFNLADTLLGGLPTELISSAGGQLFYSRPVVSANGEPTVKLYTSVENAQQDKGITIPHDIDLGESRVVIQDYDNQHEQDRPTPSPAPSRPFSGLRANDVLWLSLTAAEYDQATYGSSTNPMYVSDTVTFVNVATGAQAVARSLDWSKVTLDGRPLTTIQQYSKTFFVLPLRGKLSFWEAGTTKAGYPYNYNTTASDQILIENAAGHRVAISTYTTSLGAGPASISAVAVLAPHSALA
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 (00:03:12)
[INFO] Main: Simulation completed successfully. (00:03:15)
|
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 | A | A | 0.8657 | |
| 2 | V | A | 1.6401 | |
| 3 | S | A | 0.3288 | |
| 4 | P | A | -0.1292 | |
| 5 | A | A | -0.5554 | |
| 6 | P | A | -0.8829 | |
| 7 | D | A | -1.9897 | |
| 8 | T | A | -0.8661 | |
| 9 | A | A | -0.2117 | |
| 10 | P | A | 0.2490 | |
| 11 | V | A | 1.3332 | |
| 12 | P | A | -0.1154 | |
| 13 | D | A | -1.1311 | |
| 14 | V | A | -0.1062 | |
| 15 | D | A | -1.9986 | |
| 16 | S | A | -1.7280 | |
| 17 | R | A | -2.2920 | |
| 18 | G | A | -1.7168 | |
| 19 | A | A | 0.0000 | |
| 20 | I | A | -0.2072 | |
| 21 | L | A | -0.6582 | |
| 22 | R | A | -2.4373 | |
| 23 | R | A | -2.6492 | |
| 24 | Q | A | -2.6649 | |
| 25 | Y | A | 0.0000 | |
| 26 | N | A | -1.3042 | |
| 27 | L | A | -0.5345 | |
| 28 | S | A | -0.7128 | |
| 29 | T | A | 0.0000 | |
| 30 | S | A | -1.0782 | |
| 31 | P | A | -0.6822 | |
| 32 | L | A | 0.0000 | |
| 33 | T | A | -0.1375 | |
| 34 | S | A | 0.0000 | |
| 35 | S | A | -0.4406 | |
| 36 | V | A | 0.0000 | |
| 37 | A | A | -0.1806 | |
| 38 | S | A | -0.7292 | |
| 39 | G | A | 0.0000 | |
| 40 | T | A | -0.5226 | |
| 41 | N | A | -0.5913 | |
| 42 | L | A | 0.0000 | |
| 43 | V | A | 0.0000 | |
| 44 | L | A | 0.0000 | |
| 45 | Y | A | 0.0000 | |
| 46 | A | A | 0.0000 | |
| 47 | A | A | 0.0000 | |
| 48 | P | A | 0.0000 | |
| 49 | L | A | 0.0000 | |
| 50 | N | A | 0.0000 | |
| 51 | P | A | 0.0000 | |
| 52 | L | A | 0.0000 | |
| 53 | L | A | 0.0000 | |
| 54 | P | A | 0.0000 | |
| 55 | L | A | 0.0000 | |
| 56 | Q | A | -2.1193 | |
| 57 | D | A | -2.3865 | |
| 58 | G | A | -1.2594 | |
| 59 | T | A | -1.0489 | |
| 60 | N | A | -1.3461 | |
| 61 | T | A | -0.4417 | |
| 62 | H | A | 0.2007 | |
| 63 | I | A | 1.1772 | |
| 64 | M | A | 0.0000 | |
| 65 | A | A | 0.0000 | |
| 66 | T | A | 0.0874 | |
| 67 | E | A | -0.1913 | |
| 68 | A | A | 0.0000 | |
| 69 | S | A | 0.0000 | |
| 70 | N | A | -0.7247 | |
| 71 | Y | A | -0.2587 | |
| 72 | A | A | -0.5442 | |
| 73 | Q | A | -0.8866 | |
| 74 | Y | A | 0.0000 | |
| 75 | R | A | -1.2015 | |
| 76 | V | A | 0.0000 | |
| 77 | A | A | 0.0000 | |
| 78 | R | A | -1.8580 | |
| 79 | A | A | 0.0000 | |
| 80 | T | A | -0.4588 | |
| 81 | I | A | 0.0000 | |
| 82 | R | A | -1.7615 | |
| 83 | Y | A | 0.0000 | |
| 84 | R | A | -1.1600 | |
| 85 | P | A | -0.3404 | |
| 86 | L | A | 0.4114 | |
| 87 | V | A | 0.0004 | |
| 88 | P | A | -0.6853 | |
| 89 | N | A | -1.2855 | |
| 90 | A | A | -0.4991 | |
| 91 | V | A | 0.0000 | |
| 92 | G | A | -0.7801 | |
| 93 | G | A | -0.6574 | |
| 94 | Y | A | 0.0000 | |
| 95 | A | A | -0.3756 | |
| 96 | I | A | 0.0000 | |
| 97 | S | A | 0.0000 | |
| 98 | I | A | 0.0000 | |
| 99 | S | A | 0.0000 | |
| 100 | F | A | 0.0000 | |
| 101 | W | A | -0.6457 | |
| 102 | P | A | 0.0000 | |
| 103 | Q | A | -1.4423 | |
| 104 | T | A | 0.0000 | |
| 105 | T | A | -0.9887 | |
| 106 | T | A | -0.4457 | |
| 107 | T | A | -0.3115 | |
| 108 | P | A | 0.0000 | |
| 109 | T | A | -0.1752 | |
| 110 | S | A | -0.4383 | |
| 111 | V | A | 0.0000 | |
| 112 | D | A | -1.0416 | |
| 113 | M | A | -0.6162 | |
| 114 | N | A | -1.4007 | |
| 115 | S | A | -0.8858 | |
| 116 | I | A | 0.0000 | |
| 117 | T | A | -0.8734 | |
| 118 | S | A | -1.0271 | |
| 119 | T | A | -1.2099 | |
| 120 | D | A | -1.7761 | |
| 121 | V | A | 0.0000 | |
| 122 | R | A | -1.0237 | |
| 123 | I | A | -0.0854 | |
| 124 | L | A | 0.0426 | |
| 125 | V | A | 0.0000 | |
| 126 | Q | A | -0.9221 | |
| 127 | P | A | -0.7931 | |
| 128 | G | A | -0.4674 | |
| 129 | I | A | 0.5080 | |
| 130 | A | A | -0.4407 | |
| 131 | S | A | -1.1169 | |
| 132 | E | A | -1.9043 | |
| 133 | L | A | 0.0000 | |
| 134 | V | A | 0.7821 | |
| 135 | I | A | 0.0000 | |
| 136 | P | A | -0.8007 | |
| 137 | S | A | -1.4983 | |
| 138 | E | A | -2.2520 | |
| 139 | R | A | -1.5441 | |
| 140 | L | A | 0.0000 | |
| 141 | H | A | -2.0338 | |
| 142 | Y | A | -1.1179 | |
| 143 | R | A | -2.9667 | |
| 144 | N | A | -2.7187 | |
| 145 | Q | A | -2.4004 | |
| 146 | G | A | 0.0000 | |
| 147 | W | A | -1.4335 | |
| 148 | R | A | 0.0000 | |
| 149 | S | A | -0.8731 | |
| 150 | V | A | 0.0000 | |
| 151 | E | A | -0.6038 | |
| 152 | T | A | 0.0000 | |
| 153 | T | A | -0.5542 | |
| 154 | G | A | -0.6601 | |
| 155 | V | A | -0.8765 | |
| 156 | A | A | -1.3240 | |
| 157 | E | A | 0.0000 | |
| 158 | E | A | -2.3536 | |
| 159 | E | A | -2.6564 | |
| 160 | A | A | 0.0000 | |
| 161 | T | A | 0.0000 | |
| 162 | S | A | 0.0000 | |
| 163 | G | A | 0.0000 | |
| 164 | L | A | 0.0000 | |
| 165 | V | A | 0.0000 | |
| 166 | M | A | 0.0000 | |
| 167 | L | A | 0.0000 | |
| 168 | C | A | 0.0000 | |
| 169 | I | A | 0.0000 | |
| 170 | H | A | 0.0000 | |
| 171 | G | A | -0.3238 | |
| 172 | S | A | -0.2447 | |
| 173 | P | A | 0.0000 | |
| 174 | V | A | 0.0049 | |
| 175 | N | A | -0.4057 | |
| 176 | S | A | -0.2554 | |
| 177 | Y | A | 0.8023 | |
| 178 | T | A | -0.1232 | |
| 179 | N | A | -0.9729 | |
| 180 | T | A | -0.4590 | |
| 181 | P | A | -0.3917 | |
| 182 | Y | A | -0.0891 | |
| 183 | T | A | -0.0824 | |
| 184 | G | A | -0.1168 | |
| 185 | A | A | 0.0826 | |
| 186 | L | A | 0.0000 | |
| 187 | G | A | 0.0000 | |
| 188 | L | A | 0.0000 | |
| 189 | L | A | 0.0000 | |
| 190 | D | A | 0.0000 | |
| 191 | F | A | 0.0000 | |
| 192 | A | A | -0.9538 | |
| 193 | L | A | 0.0000 | |
| 194 | E | A | 0.0000 | |
| 195 | L | A | 0.0000 | |
| 196 | E | A | 0.0000 | |
| 197 | F | A | 0.0000 | |
| 198 | R | A | -0.9967 | |
| 199 | N | A | -0.7422 | |
| 200 | L | A | 0.7039 | |
| 201 | T | A | -0.1065 | |
| 202 | P | A | -0.4832 | |
| 203 | G | A | -0.7104 | |
| 204 | N | A | -0.5243 | |
| 205 | T | A | 0.0000 | |
| 206 | N | A | 0.0000 | |
| 207 | T | A | -0.4748 | |
| 208 | R | A | -1.0086 | |
| 209 | V | A | 0.0000 | |
| 210 | S | A | 0.0000 | |
| 211 | R | A | 0.0000 | |
| 212 | Y | A | -0.3185 | |
| 213 | S | A | -0.2929 | |
| 214 | S | A | -0.3292 | |
| 215 | T | A | -0.9931 | |
| 216 | A | A | -1.7170 | |
| 217 | R | A | -3.0254 | |
| 218 | H | A | 0.0000 | |
| 219 | R | A | -2.9058 | |
| 220 | L | A | 0.0000 | |
| 221 | R | A | -2.9334 | |
| 222 | R | A | -3.5110 | |
| 223 | G | A | -2.1201 | |
| 224 | A | A | -1.4035 | |
| 225 | D | A | -2.1670 | |
| 226 | G | A | 0.0000 | |
| 227 | T | A | -1.9027 | |
| 228 | A | A | 0.0000 | |
| 229 | E | A | -1.3824 | |
| 230 | L | A | 0.0000 | |
| 231 | T | A | -0.9726 | |
| 232 | T | A | 0.0000 | |
| 233 | T | A | -0.3112 | |
| 234 | A | A | 0.0000 | |
| 235 | A | A | 0.0000 | |
| 236 | T | A | -0.4775 | |
| 237 | R | A | -0.5843 | |
| 238 | F | A | -0.4087 | |
| 239 | M | A | -0.5970 | |
| 240 | K | A | -1.4195 | |
| 241 | D | A | 0.0000 | |
| 242 | L | A | -0.9938 | |
| 243 | H | A | -1.0771 | |
| 244 | F | A | -1.0232 | |
| 245 | T | A | -0.7163 | |
| 246 | G | A | -0.7432 | |
| 247 | T | A | -0.7656 | |
| 248 | N | A | -1.2094 | |
| 249 | G | A | -0.3284 | |
| 250 | V | A | 0.8259 | |
| 251 | G | A | -0.1828 | |
| 252 | E | A | -0.5263 | |
| 253 | V | A | -0.6207 | |
| 254 | G | A | 0.0000 | |
| 255 | R | A | -2.0402 | |
| 256 | G | A | 0.0000 | |
| 257 | I | A | 0.0000 | |
| 258 | A | A | 0.0000 | |
| 259 | L | A | 0.0000 | |
| 260 | T | A | 0.0000 | |
| 261 | L | A | 0.0000 | |
| 262 | F | A | 0.0000 | |
| 263 | N | A | 0.0000 | |
| 264 | L | A | 0.0000 | |
| 265 | A | A | -0.7077 | |
| 266 | D | A | -0.8904 | |
| 267 | T | A | -0.4010 | |
| 268 | L | A | -0.0775 | |
| 269 | L | A | 0.1001 | |
| 270 | G | A | -0.3980 | |
| 271 | G | A | -0.4669 | |
| 272 | L | A | -0.1618 | |
| 273 | P | A | -0.4515 | |
| 274 | T | A | -0.6615 | |
| 275 | E | A | -1.3009 | |
| 276 | L | A | 0.0000 | |
| 277 | I | A | 0.1011 | |
| 278 | S | A | -0.3680 | |
| 279 | S | A | 0.0000 | |
| 280 | A | A | 0.0000 | |
| 281 | G | A | -0.1985 | |
| 282 | G | A | 0.0000 | |
| 283 | Q | A | 0.0000 | |
| 284 | L | A | 0.0000 | |
| 285 | F | A | 0.0000 | |
| 286 | Y | A | 0.0000 | |
| 287 | S | A | 0.0000 | |
| 288 | R | A | -0.7433 | |
| 289 | P | A | 0.0000 | |
| 290 | V | A | 0.0000 | |
| 291 | V | A | -0.2619 | |
| 292 | S | A | 0.0000 | |
| 293 | A | A | -0.4978 | |
| 294 | N | A | -1.6821 | |
| 295 | G | A | -1.4814 | |
| 296 | E | A | -2.0437 | |
| 297 | P | A | -1.1010 | |
| 298 | T | A | 0.0000 | |
| 299 | V | A | 0.0000 | |
| 300 | K | A | 0.0000 | |
| 301 | L | A | 0.0000 | |
| 302 | Y | A | 0.0000 | |
| 303 | T | A | -0.9263 | |
| 304 | S | A | -1.1483 | |
| 305 | V | A | 0.0000 | |
| 306 | E | A | -2.7944 | |
| 307 | N | A | -2.6087 | |
| 308 | A | A | 0.0000 | |
| 309 | Q | A | -2.6020 | |
| 310 | Q | A | -2.6833 | |
| 311 | D | A | -2.8888 | |
| 312 | K | A | -2.9537 | |
| 313 | G | A | -1.7395 | |
| 314 | I | A | 0.0000 | |
| 315 | T | A | -1.3091 | |
| 316 | I | A | 0.0000 | |
| 317 | P | A | -1.5196 | |
| 318 | H | A | -2.6838 | |
| 319 | D | A | -3.5795 | |
| 320 | I | A | 0.0000 | |
| 321 | D | A | -2.1881 | |
| 322 | L | A | 0.0000 | |
| 323 | G | A | 0.0000 | |
| 324 | E | A | -2.9221 | |
| 325 | S | A | 0.0000 | |
| 326 | R | A | -0.9879 | |
| 327 | V | A | 0.0000 | |
| 328 | V | A | 0.0000 | |
| 329 | I | A | 0.0000 | |
| 330 | Q | A | 0.0000 | |
| 331 | D | A | -0.2012 | |
| 332 | Y | A | 0.0000 | |
| 333 | D | A | 0.0000 | |
| 334 | N | A | 0.0000 | |
| 335 | Q | A | -1.2344 | |
| 336 | H | A | -1.6911 | |
| 337 | E | A | -2.0859 | |
| 338 | Q | A | -2.1401 | |
| 339 | D | A | 0.0000 | |
| 340 | R | A | -1.3191 | |
| 341 | P | A | -1.0876 | |
| 342 | T | A | -0.6452 | |
| 343 | P | A | -0.7703 | |
| 344 | S | A | -0.6733 | |
| 345 | P | A | -0.5451 | |
| 346 | A | A | -0.4963 | |
| 347 | P | A | -0.6284 | |
| 348 | S | A | -0.7214 | |
| 349 | R | A | -0.8216 | |
| 350 | P | A | -0.8509 | |
| 351 | F | A | 0.0000 | |
| 352 | S | A | -1.2400 | |
| 353 | G | A | -1.3287 | |
| 354 | L | A | 0.0000 | |
| 355 | R | A | -2.2795 | |
| 356 | A | A | -1.5616 | |
| 357 | N | A | -1.5741 | |
| 358 | D | A | 0.0000 | |
| 359 | V | A | 0.8820 | |
| 360 | L | A | 0.0000 | |
| 361 | W | A | 1.1096 | |
| 362 | L | A | 0.0000 | |
| 363 | S | A | 0.1572 | |
| 364 | L | A | 0.0000 | |
| 365 | T | A | -0.5304 | |
| 366 | A | A | -0.7859 | |
| 367 | A | A | 0.0000 | |
| 368 | E | A | -2.1922 | |
| 369 | Y | A | -1.1506 | |
| 370 | D | A | -1.1714 | |
| 371 | Q | A | -1.3558 | |
| 372 | A | A | -0.4426 | |
| 373 | T | A | -0.2413 | |
| 374 | Y | A | -0.3256 | |
| 375 | G | A | 0.0000 | |
| 376 | S | A | -0.6838 | |
| 377 | S | A | -0.6000 | |
| 378 | T | A | -0.4248 | |
| 379 | N | A | -0.5946 | |
| 380 | P | A | 0.0000 | |
| 381 | M | A | 0.0000 | |
| 382 | Y | A | 0.0000 | |
| 383 | V | A | 0.0000 | |
| 384 | S | A | 0.0000 | |
| 385 | D | A | -1.4825 | |
| 386 | T | A | -0.7168 | |
| 387 | V | A | 0.0000 | |
| 388 | T | A | -0.1065 | |
| 389 | F | A | 0.0000 | |
| 390 | V | A | 0.6312 | |
| 391 | N | A | 0.0000 | |
| 392 | V | A | 1.9462 | |
| 393 | A | A | 0.9659 | |
| 394 | T | A | 0.1602 | |
| 395 | G | A | 0.0059 | |
| 396 | A | A | -0.5034 | |
| 397 | Q | A | -0.7328 | |
| 398 | A | A | -0.4798 | |
| 399 | V | A | -0.0714 | |
| 400 | A | A | 0.0000 | |
| 401 | R | A | -1.5795 | |
| 402 | S | A | -0.8264 | |
| 403 | L | A | -1.2036 | |
| 404 | D | A | -2.3634 | |
| 405 | W | A | 0.0000 | |
| 406 | S | A | -1.7053 | |
| 407 | K | A | -2.5299 | |
| 408 | V | A | 0.0000 | |
| 409 | T | A | -1.8736 | |
| 410 | L | A | 0.0000 | |
| 411 | D | A | -2.0829 | |
| 412 | G | A | -2.0037 | |
| 413 | R | A | -2.8039 | |
| 414 | P | A | -1.8023 | |
| 415 | L | A | 0.0000 | |
| 416 | T | A | -0.2344 | |
| 417 | T | A | -0.3341 | |
| 418 | I | A | -0.4803 | |
| 419 | Q | A | -1.4666 | |
| 420 | Q | A | -1.0356 | |
| 421 | Y | A | -0.0794 | |
| 422 | S | A | -0.5204 | |
| 423 | K | A | -0.8862 | |
| 424 | T | A | -0.9697 | |
| 425 | F | A | 0.0000 | |
| 426 | F | A | 0.0000 | |
| 427 | V | A | 0.0000 | |
| 428 | L | A | 0.0000 | |
| 429 | P | A | 0.0000 | |
| 430 | L | A | 0.0000 | |
| 431 | R | A | -1.6963 | |
| 432 | G | A | -1.2885 | |
| 433 | K | A | -1.0083 | |
| 434 | L | A | 0.0000 | |
| 435 | S | A | -0.0049 | |
| 436 | F | A | 0.0000 | |
| 437 | W | A | -0.5331 | |
| 438 | E | A | -1.0338 | |
| 439 | A | A | -0.6757 | |
| 440 | G | A | -0.7943 | |
| 441 | T | A | -0.8688 | |
| 442 | T | A | -0.9670 | |
| 443 | K | A | -1.7191 | |
| 444 | A | A | -0.7238 | |
| 445 | G | A | -0.0786 | |
| 446 | Y | A | 0.6992 | |
| 447 | P | A | 0.0000 | |
| 448 | Y | A | 0.6598 | |
| 449 | N | A | -0.3333 | |
| 450 | Y | A | 0.5271 | |
| 451 | N | A | -0.9032 | |
| 452 | T | A | -0.6375 | |
| 453 | T | A | -0.4495 | |
| 454 | A | A | -0.6318 | |
| 455 | S | A | -1.0111 | |
| 456 | D | A | -0.9360 | |
| 457 | Q | A | -0.8297 | |
| 458 | I | A | 0.0000 | |
| 459 | L | A | 0.0000 | |
| 460 | I | A | 0.0000 | |
| 461 | E | A | 0.0000 | |
| 462 | N | A | -1.5512 | |
| 463 | A | A | -0.8433 | |
| 464 | A | A | -0.6643 | |
| 465 | G | A | -1.1536 | |
| 466 | H | A | -1.5287 | |
| 467 | R | A | -1.5532 | |
| 468 | V | A | 0.0000 | |
| 469 | A | A | 0.0000 | |
| 470 | I | A | 0.0000 | |
| 471 | S | A | 0.1152 | |
| 472 | T | A | 0.0000 | |
| 473 | Y | A | 1.4146 | |
| 474 | T | A | 0.6010 | |
| 475 | T | A | -0.1084 | |
| 476 | S | A | -0.1537 | |
| 477 | L | A | 0.0000 | |
| 478 | G | A | -0.6840 | |
| 479 | A | A | -0.7420 | |
| 480 | G | A | -1.2229 | |
| 481 | P | A | -1.0105 | |
| 482 | A | A | 0.0000 | |
| 483 | S | A | -0.6504 | |
| 484 | I | A | 0.0000 | |
| 485 | S | A | 0.0000 | |
| 486 | A | A | 0.0000 | |
| 487 | V | A | 0.9965 | |
| 488 | A | A | 0.0000 | |
| 489 | V | A | -0.2465 | |
| 490 | L | A | 0.0000 | |
| 491 | A | A | 0.0000 | |
| 492 | P | A | -0.9313 | |
| 493 | H | A | -1.0014 | |
| 494 | S | A | -0.3781 | |
| 495 | A | A | -0.0483 | |
| 496 | L | A | 0.4034 | |
| 497 | A | A | 0.1966 |
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