| Chain sequence(s) |
A: AGEGDQQDAAHNMGNHLPLLPAESEEEDEMEVEDQDSKEAKKPNIINFDTSLPTSHTYLGADMEEFHGRTLHDDDSCQVIPVLPQVMMILIPGQTLPLQLFHPQEVSMVRNLIQKDRTFAVLAYSNVQEREAQFGTTAEIYAYREEQAFVDAEAIEIVKVKAIGRQRFKVLELRTQSDGIQQAKVQILPECVLPSTMSAVQLESLNKCQIFPSKPVSREDQCSYKWWQKYQKRKFHCANLTSWPRWLYSLYDAETLMDRIKKQLREWDENLKDDSLPSNPIDFSYRVAACLPIDDVLRIQLLKIGSAIQRLRCELDIMNKCTSLCCKQCQETEITTKNEIFSLSLCGPMAAYVNPHGYVHETLTVYKACNLNLIGRPSTEHSWFPGYAWTVAQCKICASHIGWKFTATKKDMSPQKFWGLTRSALLPTIPDTEDEISPDKVILCL
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 (00:10:30)
[INFO] Main: Simulation completed successfully. (00:10:34)
|
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 | -0.6679 | |
| 2 | G | A | -1.6889 | |
| 3 | E | A | -2.8517 | |
| 4 | G | A | -2.9700 | |
| 5 | D | A | -3.8594 | |
| 6 | Q | A | -3.4603 | |
| 7 | Q | A | -3.3975 | |
| 8 | D | A | -3.4746 | |
| 9 | A | A | -2.1245 | |
| 10 | A | A | -1.9478 | |
| 11 | H | A | -2.3623 | |
| 12 | N | A | -1.4881 | |
| 13 | M | A | 0.0000 | |
| 14 | G | A | -0.4721 | |
| 15 | N | A | -1.0293 | |
| 16 | H | A | -1.0416 | |
| 17 | L | A | 0.6941 | |
| 18 | P | A | 1.0020 | |
| 19 | L | A | 2.2397 | |
| 20 | L | A | 1.9336 | |
| 21 | P | A | 0.3660 | |
| 22 | A | A | -0.6328 | |
| 23 | E | A | -2.2945 | |
| 24 | S | A | -2.6717 | |
| 25 | E | A | -3.8591 | |
| 26 | E | A | -4.5157 | |
| 27 | E | A | -4.4344 | |
| 28 | D | A | -4.1430 | |
| 29 | E | A | -3.2890 | |
| 30 | M | A | -1.5080 | |
| 31 | E | A | -2.1081 | |
| 32 | V | A | -1.0501 | |
| 33 | E | A | -2.7831 | |
| 34 | D | A | -2.6671 | |
| 35 | Q | A | -2.6303 | |
| 36 | D | A | -2.3214 | |
| 37 | S | A | -2.5027 | |
| 38 | K | A | -3.2179 | |
| 39 | E | A | -3.3005 | |
| 40 | A | A | -2.4398 | |
| 41 | K | A | -2.9455 | |
| 42 | K | A | -1.6916 | |
| 43 | P | A | -0.9003 | |
| 44 | N | A | -1.1352 | |
| 45 | I | A | 0.8218 | |
| 46 | I | A | -0.0285 | |
| 47 | N | A | -1.2967 | |
| 48 | F | A | 0.0000 | |
| 49 | D | A | -1.5947 | |
| 50 | T | A | -0.3235 | |
| 51 | S | A | 0.0790 | |
| 52 | L | A | 0.1709 | |
| 53 | P | A | 0.0000 | |
| 54 | T | A | 0.4503 | |
| 55 | S | A | 0.1057 | |
| 56 | H | A | 0.0000 | |
| 57 | T | A | -0.2478 | |
| 58 | Y | A | -0.2114 | |
| 59 | L | A | 0.0000 | |
| 60 | G | A | -0.8277 | |
| 61 | A | A | -1.2463 | |
| 62 | D | A | -2.6509 | |
| 63 | M | A | -2.5571 | |
| 64 | E | A | -3.2821 | |
| 65 | E | A | -3.1073 | |
| 66 | F | A | -1.7690 | |
| 67 | H | A | -1.8935 | |
| 68 | G | A | -2.0427 | |
| 69 | R | A | -2.2925 | |
| 70 | T | A | -1.2304 | |
| 71 | L | A | -0.7392 | |
| 72 | H | A | -1.4613 | |
| 73 | D | A | -2.9979 | |
| 74 | D | A | -3.4967 | |
| 75 | D | A | -3.0909 | |
| 76 | S | A | -1.8442 | |
| 77 | C | A | -0.1723 | |
| 78 | Q | A | 0.2772 | |
| 79 | V | A | 1.2054 | |
| 80 | I | A | 0.0000 | |
| 81 | P | A | -0.2262 | |
| 82 | V | A | 0.0000 | |
| 83 | L | A | 0.0000 | |
| 84 | P | A | -0.9062 | |
| 85 | Q | A | -1.0864 | |
| 86 | V | A | 0.0000 | |
| 87 | M | A | 0.0910 | |
| 88 | M | A | 0.0000 | |
| 89 | I | A | 0.0000 | |
| 90 | L | A | 0.0000 | |
| 91 | I | A | 0.0000 | |
| 92 | P | A | 0.0000 | |
| 93 | G | A | -0.8379 | |
| 94 | Q | A | 0.0000 | |
| 95 | T | A | 0.0534 | |
| 96 | L | A | 0.0000 | |
| 97 | P | A | 0.0000 | |
| 98 | L | A | 0.0000 | |
| 99 | Q | A | 0.0000 | |
| 100 | L | A | 0.0000 | |
| 101 | F | A | 0.1580 | |
| 102 | H | A | -0.8952 | |
| 103 | P | A | -0.7873 | |
| 104 | Q | A | -1.0488 | |
| 105 | E | A | 0.0000 | |
| 106 | V | A | 0.0000 | |
| 107 | S | A | -0.8702 | |
| 108 | M | A | 0.0000 | |
| 109 | V | A | 0.0000 | |
| 110 | R | A | -1.5522 | |
| 111 | N | A | -2.1028 | |
| 112 | L | A | 0.0000 | |
| 113 | I | A | -1.3822 | |
| 114 | Q | A | -2.4739 | |
| 115 | K | A | -2.8754 | |
| 116 | D | A | -2.2201 | |
| 117 | R | A | -1.5989 | |
| 118 | T | A | 0.0000 | |
| 119 | F | A | 0.0000 | |
| 120 | A | A | 0.0000 | |
| 121 | V | A | 0.0000 | |
| 122 | L | A | 0.0000 | |
| 123 | A | A | 0.0000 | |
| 124 | Y | A | 0.0000 | |
| 125 | S | A | -1.1193 | |
| 126 | N | A | -1.9456 | |
| 127 | V | A | -1.3388 | |
| 128 | Q | A | -2.5650 | |
| 129 | E | A | -3.5959 | |
| 130 | R | A | -3.5315 | |
| 131 | E | A | -3.0929 | |
| 132 | A | A | -1.4004 | |
| 133 | Q | A | -0.9027 | |
| 134 | F | A | -0.4298 | |
| 135 | G | A | 0.0000 | |
| 136 | T | A | 0.0000 | |
| 137 | T | A | 0.0000 | |
| 138 | A | A | 0.0000 | |
| 139 | E | A | 0.0000 | |
| 140 | I | A | 0.0000 | |
| 141 | Y | A | -0.9286 | |
| 142 | A | A | 0.0000 | |
| 143 | Y | A | 0.0000 | |
| 144 | R | A | -2.5338 | |
| 145 | E | A | -2.4519 | |
| 146 | E | A | -2.2355 | |
| 147 | Q | A | -1.7373 | |
| 148 | A | A | -0.1927 | |
| 149 | F | A | 1.2342 | |
| 150 | V | A | 0.9548 | |
| 151 | D | A | -1.1023 | |
| 152 | A | A | -0.5618 | |
| 153 | E | A | -1.4025 | |
| 154 | A | A | -0.5031 | |
| 155 | I | A | -0.4017 | |
| 156 | E | A | -1.6849 | |
| 157 | I | A | -1.1815 | |
| 158 | V | A | 0.0000 | |
| 159 | K | A | -0.8881 | |
| 160 | V | A | 0.0000 | |
| 161 | K | A | -0.3648 | |
| 162 | A | A | 0.0000 | |
| 163 | I | A | 0.2389 | |
| 164 | G | A | 0.0000 | |
| 165 | R | A | -0.7587 | |
| 166 | Q | A | -0.7676 | |
| 167 | R | A | 0.0000 | |
| 168 | F | A | 0.0000 | |
| 169 | K | A | -0.9038 | |
| 170 | V | A | -0.2122 | |
| 171 | L | A | 0.2659 | |
| 172 | E | A | -0.8259 | |
| 173 | L | A | -0.8001 | |
| 174 | R | A | -2.1127 | |
| 175 | T | A | -1.6807 | |
| 176 | Q | A | -1.8305 | |
| 177 | S | A | -1.4505 | |
| 178 | D | A | -1.8053 | |
| 179 | G | A | -1.5692 | |
| 180 | I | A | 0.0000 | |
| 181 | Q | A | -1.4357 | |
| 182 | Q | A | -1.0293 | |
| 183 | A | A | 0.0000 | |
| 184 | K | A | -0.4009 | |
| 185 | V | A | 0.0000 | |
| 186 | Q | A | -1.0561 | |
| 187 | I | A | 0.0000 | |
| 188 | L | A | -1.3530 | |
| 189 | P | A | -1.3167 | |
| 190 | E | A | 0.0804 | |
| 191 | C | A | 1.4822 | |
| 192 | V | A | 2.5951 | |
| 193 | L | A | 2.3292 | |
| 194 | P | A | 0.8293 | |
| 195 | S | A | 0.3203 | |
| 196 | T | A | 0.2763 | |
| 197 | M | A | 0.0000 | |
| 198 | S | A | -0.0773 | |
| 199 | A | A | 0.2000 | |
| 200 | V | A | 0.4840 | |
| 201 | Q | A | -0.2823 | |
| 202 | L | A | -0.4456 | |
| 203 | E | A | -2.0825 | |
| 204 | S | A | -1.3557 | |
| 205 | L | A | -1.3850 | |
| 206 | N | A | -2.1153 | |
| 207 | K | A | -1.8625 | |
| 208 | C | A | -0.6603 | |
| 209 | Q | A | -0.2303 | |
| 210 | I | A | 1.3556 | |
| 211 | F | A | 0.6389 | |
| 212 | P | A | 0.0443 | |
| 213 | S | A | -0.0909 | |
| 214 | K | A | -0.3606 | |
| 215 | P | A | -0.1558 | |
| 216 | V | A | 0.7599 | |
| 217 | S | A | -1.2625 | |
| 218 | R | A | -2.9505 | |
| 219 | E | A | -3.4770 | |
| 220 | D | A | -3.5002 | |
| 221 | Q | A | -2.6074 | |
| 222 | C | A | -1.7098 | |
| 223 | S | A | -1.6343 | |
| 224 | Y | A | -0.7671 | |
| 225 | K | A | -1.8444 | |
| 226 | W | A | -1.3575 | |
| 227 | W | A | -1.0026 | |
| 228 | Q | A | -1.6619 | |
| 229 | K | A | -1.9108 | |
| 230 | Y | A | 0.0000 | |
| 231 | Q | A | -1.6643 | |
| 232 | K | A | -2.5441 | |
| 233 | R | A | -1.7034 | |
| 234 | K | A | -1.1811 | |
| 235 | F | A | 0.0000 | |
| 236 | H | A | -1.6290 | |
| 237 | C | A | 0.0000 | |
| 238 | A | A | 0.0000 | |
| 239 | N | A | -0.6517 | |
| 240 | L | A | 1.1070 | |
| 241 | T | A | 0.5748 | |
| 242 | S | A | 0.4055 | |
| 243 | W | A | 1.0937 | |
| 244 | P | A | 0.3160 | |
| 245 | R | A | -0.6532 | |
| 246 | W | A | 1.0077 | |
| 247 | L | A | 1.2282 | |
| 248 | Y | A | 0.9396 | |
| 249 | S | A | 0.0000 | |
| 250 | L | A | 1.0157 | |
| 251 | Y | A | 1.1581 | |
| 252 | D | A | 0.0000 | |
| 253 | A | A | -0.3270 | |
| 254 | E | A | -1.2271 | |
| 255 | T | A | -0.7510 | |
| 256 | L | A | 0.0000 | |
| 257 | M | A | -1.1993 | |
| 258 | D | A | -1.6668 | |
| 259 | R | A | -2.3389 | |
| 260 | I | A | 0.0000 | |
| 261 | K | A | -2.0061 | |
| 262 | K | A | -2.6336 | |
| 263 | Q | A | -2.1171 | |
| 264 | L | A | 0.0000 | |
| 265 | R | A | -3.0811 | |
| 266 | E | A | -3.3106 | |
| 267 | W | A | 0.0000 | |
| 268 | D | A | -2.5289 | |
| 269 | E | A | -3.4111 | |
| 270 | N | A | -2.7268 | |
| 271 | L | A | -2.6289 | |
| 272 | K | A | -3.2607 | |
| 273 | D | A | -2.6086 | |
| 274 | D | A | -2.7108 | |
| 275 | S | A | -1.3812 | |
| 276 | L | A | -1.2732 | |
| 277 | P | A | -1.2289 | |
| 278 | S | A | -1.2884 | |
| 279 | N | A | -1.3285 | |
| 280 | P | A | -0.6869 | |
| 281 | I | A | -0.3917 | |
| 282 | D | A | -1.6988 | |
| 283 | F | A | 0.0000 | |
| 284 | S | A | 0.0000 | |
| 285 | Y | A | 0.0000 | |
| 286 | R | A | -0.8855 | |
| 287 | V | A | 0.0000 | |
| 288 | A | A | 0.0000 | |
| 289 | A | A | -0.2042 | |
| 290 | C | A | 0.0000 | |
| 291 | L | A | 0.0000 | |
| 292 | P | A | 0.0000 | |
| 293 | I | A | 0.0000 | |
| 294 | D | A | -0.1999 | |
| 295 | D | A | -0.2667 | |
| 296 | V | A | 1.1371 | |
| 297 | L | A | 0.0000 | |
| 298 | R | A | 0.0000 | |
| 299 | I | A | 0.0001 | |
| 300 | Q | A | -0.3871 | |
| 301 | L | A | 0.0000 | |
| 302 | L | A | 0.0000 | |
| 303 | K | A | -1.2878 | |
| 304 | I | A | 0.0000 | |
| 305 | G | A | -0.1646 | |
| 306 | S | A | 0.0000 | |
| 307 | A | A | 0.0000 | |
| 308 | I | A | 0.7256 | |
| 309 | Q | A | -0.1856 | |
| 310 | R | A | 0.0000 | |
| 311 | L | A | 0.0000 | |
| 312 | R | A | -0.0331 | |
| 313 | C | A | 0.0000 | |
| 314 | E | A | 0.0000 | |
| 315 | L | A | -0.7223 | |
| 316 | D | A | -0.3180 | |
| 317 | I | A | 0.0000 | |
| 318 | M | A | 0.0000 | |
| 319 | N | A | -1.6499 | |
| 320 | K | A | -1.0299 | |
| 321 | C | A | -0.5397 | |
| 322 | T | A | -0.6821 | |
| 323 | S | A | -0.6826 | |
| 324 | L | A | 0.0000 | |
| 325 | C | A | 0.0000 | |
| 326 | C | A | 0.0000 | |
| 327 | K | A | -2.1173 | |
| 328 | Q | A | -1.8534 | |
| 329 | C | A | -1.4294 | |
| 330 | Q | A | -2.7639 | |
| 331 | E | A | -2.6598 | |
| 332 | T | A | 0.0000 | |
| 333 | E | A | -1.7645 | |
| 334 | I | A | 0.0000 | |
| 335 | T | A | 0.0000 | |
| 336 | T | A | -0.7781 | |
| 337 | K | A | -1.2417 | |
| 338 | N | A | -1.8109 | |
| 339 | E | A | -1.1789 | |
| 340 | I | A | 0.0000 | |
| 341 | F | A | 0.0000 | |
| 342 | S | A | 0.0000 | |
| 343 | L | A | 0.0000 | |
| 344 | S | A | 0.0000 | |
| 345 | L | A | 1.3857 | |
| 346 | C | A | 0.8149 | |
| 347 | G | A | 0.4433 | |
| 348 | P | A | 0.0000 | |
| 349 | M | A | 0.0000 | |
| 350 | A | A | 0.2363 | |
| 351 | A | A | 0.0000 | |
| 352 | Y | A | 0.0000 | |
| 353 | V | A | 0.0000 | |
| 354 | N | A | 0.0000 | |
| 355 | P | A | -0.7119 | |
| 356 | H | A | -0.7104 | |
| 357 | G | A | -0.0956 | |
| 358 | Y | A | 0.4299 | |
| 359 | V | A | 0.4086 | |
| 360 | H | A | 0.0000 | |
| 361 | E | A | 0.0000 | |
| 362 | T | A | 0.0000 | |
| 363 | L | A | 0.0000 | |
| 364 | T | A | 0.0000 | |
| 365 | V | A | 0.0000 | |
| 366 | Y | A | -0.9090 | |
| 367 | K | A | -1.0282 | |
| 368 | A | A | 0.0000 | |
| 369 | C | A | -1.0530 | |
| 370 | N | A | -1.2694 | |
| 371 | L | A | 0.0000 | |
| 372 | N | A | -1.5196 | |
| 373 | L | A | 0.0000 | |
| 374 | I | A | -0.5882 | |
| 375 | G | A | -1.4547 | |
| 376 | R | A | -1.9640 | |
| 377 | P | A | -1.2469 | |
| 378 | S | A | -1.2521 | |
| 379 | T | A | -0.8511 | |
| 380 | E | A | -1.6684 | |
| 381 | H | A | -0.9925 | |
| 382 | S | A | -0.5855 | |
| 383 | W | A | 0.0000 | |
| 384 | F | A | 0.0000 | |
| 385 | P | A | -0.3888 | |
| 386 | G | A | -0.5086 | |
| 387 | Y | A | 0.0000 | |
| 388 | A | A | 0.0000 | |
| 389 | W | A | 0.0000 | |
| 390 | T | A | 0.0000 | |
| 391 | V | A | 0.0000 | |
| 392 | A | A | 0.0000 | |
| 393 | Q | A | -0.3399 | |
| 394 | C | A | 0.0000 | |
| 395 | K | A | -0.9796 | |
| 396 | I | A | 0.9421 | |
| 397 | C | A | 0.6949 | |
| 398 | A | A | 0.3121 | |
| 399 | S | A | -0.0220 | |
| 400 | H | A | -0.4421 | |
| 401 | I | A | 0.0000 | |
| 402 | G | A | 0.0000 | |
| 403 | W | A | 0.0000 | |
| 404 | K | A | -0.4396 | |
| 405 | F | A | 0.0000 | |
| 406 | T | A | -1.1808 | |
| 407 | A | A | -1.8227 | |
| 408 | T | A | -1.7421 | |
| 409 | K | A | -3.2124 | |
| 410 | K | A | -3.5244 | |
| 411 | D | A | -3.3962 | |
| 412 | M | A | -2.2024 | |
| 413 | S | A | -1.3718 | |
| 414 | P | A | 0.0000 | |
| 415 | Q | A | -2.1794 | |
| 416 | K | A | -1.5520 | |
| 417 | F | A | 0.0000 | |
| 418 | W | A | 0.0000 | |
| 419 | G | A | 0.0000 | |
| 420 | L | A | 0.0000 | |
| 421 | T | A | 0.0000 | |
| 422 | R | A | 0.0000 | |
| 423 | S | A | -0.6714 | |
| 424 | A | A | 0.0000 | |
| 425 | L | A | 0.0000 | |
| 426 | L | A | -1.0070 | |
| 427 | P | A | 0.0000 | |
| 428 | T | A | -1.1105 | |
| 429 | I | A | -0.9963 | |
| 430 | P | A | -1.3451 | |
| 431 | D | A | -3.1015 | |
| 432 | T | A | -2.5910 | |
| 433 | E | A | -3.4167 | |
| 434 | D | A | -3.3071 | |
| 435 | E | A | -2.7735 | |
| 436 | I | A | 0.0171 | |
| 437 | S | A | -0.9340 | |
| 438 | P | A | -1.9912 | |
| 439 | D | A | -2.5045 | |
| 440 | K | A | -1.8601 | |
| 441 | V | A | 0.0269 | |
| 442 | I | A | 1.5521 | |
| 443 | L | A | 1.2886 | |
| 444 | C | A | 1.4400 | |
| 445 | L | A | 0.9606 |
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