| Chain sequence(s) |
A: MSCRSYRISPGYSVTRTFSSCSAVAPKTGSRCCISAAPYRGVSCYRGLTGFGSRSVSALGSCGPRIAVSGFRAGSCGRSFGYRSGGVGGLSPPCITTVSVNESLLTPLNLEIDPNAQCVKHEEKEQIKNLNSRFAAFIDKVRFLEQQNKLLETKWQFYQNQRCCESNLEPLFNGYIETLRREAEHVEADSGRLASELNHVQEVLEGYKKKYEEEVALRATAENEFVVLKKDVDCAYLRKSDLEANVEALVEESNFLKRLYDEEIQILNAHISDTSVIVKMDNSRDLNMDCVVAEIKAQYDDIASRSRAEAESWYRSKCEEMKATVIRHGETLRRTKEEINELNRVIQRLTAEIENAKCQRTKLEAAVAEAEQQGEAALNDARSKLAGLEEALQKAKQDMACLLKEYQEVMNSKLGLDIEIATYRRLLEGEEQRLCEGVGSVNVCVSSSRGGVACGGLTYSSTAGRQIASGPVATGGSITVLAPDSCQPRASSFSCGSSRSVRFA
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 (00:13:25)
[INFO] Main: Simulation completed successfully. (00:13:31)
|
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 | 0.9222 | |
| 2 | S | A | 0.2579 | |
| 3 | C | A | -0.0095 | |
| 4 | R | A | -1.3915 | |
| 5 | S | A | -0.5881 | |
| 6 | Y | A | 0.4181 | |
| 7 | R | A | -0.4927 | |
| 8 | I | A | 1.2143 | |
| 9 | S | A | 0.2597 | |
| 10 | P | A | 0.1637 | |
| 11 | G | A | 0.1997 | |
| 12 | Y | A | 1.3015 | |
| 13 | S | A | 0.9959 | |
| 14 | V | A | 1.4811 | |
| 15 | T | A | 0.0194 | |
| 16 | R | A | -1.0674 | |
| 17 | T | A | -0.1152 | |
| 18 | F | A | 1.3800 | |
| 19 | S | A | 0.5963 | |
| 20 | S | A | 0.4127 | |
| 21 | C | A | 0.8832 | |
| 22 | S | A | 0.5373 | |
| 23 | A | A | 0.9677 | |
| 24 | V | A | 1.6173 | |
| 25 | A | A | 0.4051 | |
| 26 | P | A | -0.6466 | |
| 27 | K | A | -1.8015 | |
| 28 | T | A | -1.2341 | |
| 29 | G | A | -1.4056 | |
| 30 | S | A | -1.3629 | |
| 31 | R | A | -1.3067 | |
| 32 | C | A | 0.5353 | |
| 33 | C | A | 1.5657 | |
| 34 | I | A | 2.2608 | |
| 35 | S | A | 0.9596 | |
| 36 | A | A | 0.6085 | |
| 37 | A | A | 0.0104 | |
| 38 | P | A | -0.1376 | |
| 39 | Y | A | 0.3900 | |
| 40 | R | A | -1.0767 | |
| 41 | G | A | -0.2644 | |
| 42 | V | A | 1.2854 | |
| 43 | S | A | 0.9980 | |
| 44 | C | A | 1.3142 | |
| 45 | Y | A | 0.6419 | |
| 46 | R | A | -1.0022 | |
| 47 | G | A | -0.5099 | |
| 48 | L | A | 0.7927 | |
| 49 | T | A | 0.7226 | |
| 50 | G | A | 0.6082 | |
| 51 | F | A | 1.2342 | |
| 52 | G | A | -0.2568 | |
| 53 | S | A | -0.9784 | |
| 54 | R | A | -1.5519 | |
| 55 | S | A | -0.3922 | |
| 56 | V | A | 1.1375 | |
| 57 | S | A | 0.8948 | |
| 58 | A | A | 0.9668 | |
| 59 | L | A | 1.2277 | |
| 60 | G | A | 0.4350 | |
| 61 | S | A | 0.1760 | |
| 62 | C | A | 0.0625 | |
| 63 | G | A | -0.6234 | |
| 64 | P | A | -0.7096 | |
| 65 | R | A | -0.7742 | |
| 66 | I | A | 1.4881 | |
| 67 | A | A | 1.2688 | |
| 68 | V | A | 2.0837 | |
| 69 | S | A | 0.9256 | |
| 70 | G | A | 0.3366 | |
| 71 | F | A | 0.9274 | |
| 72 | R | A | -1.1797 | |
| 73 | A | A | -0.5853 | |
| 74 | G | A | -0.6744 | |
| 75 | S | A | -0.6246 | |
| 76 | C | A | -0.2314 | |
| 77 | G | A | -0.9513 | |
| 78 | R | A | -1.5587 | |
| 79 | S | A | -0.1833 | |
| 80 | F | A | 1.1967 | |
| 81 | G | A | 0.3225 | |
| 82 | Y | A | 0.5968 | |
| 83 | R | A | -1.3726 | |
| 84 | S | A | -1.1681 | |
| 85 | G | A | -0.8861 | |
| 86 | G | A | -0.2218 | |
| 87 | V | A | 1.2539 | |
| 88 | G | A | 0.4186 | |
| 89 | G | A | 0.4457 | |
| 90 | L | A | 1.2136 | |
| 91 | S | A | 0.3196 | |
| 92 | P | A | 0.2255 | |
| 93 | P | A | 0.5392 | |
| 94 | C | A | 1.4768 | |
| 95 | I | A | 2.4769 | |
| 96 | T | A | 1.4922 | |
| 97 | T | A | 1.5499 | |
| 98 | V | A | 2.2471 | |
| 99 | S | A | 0.9093 | |
| 100 | V | A | 1.4521 | |
| 101 | N | A | -0.4992 | |
| 102 | E | A | -1.0870 | |
| 103 | S | A | -0.0737 | |
| 104 | L | A | 1.6685 | |
| 105 | L | A | 1.7896 | |
| 106 | T | A | 0.8935 | |
| 107 | P | A | 0.9625 | |
| 108 | L | A | 1.4367 | |
| 109 | N | A | -0.1171 | |
| 110 | L | A | 0.9323 | |
| 111 | E | A | -0.6715 | |
| 112 | I | A | 0.2706 | |
| 113 | D | A | -1.3956 | |
| 114 | P | A | -1.3483 | |
| 115 | N | A | -1.4740 | |
| 116 | A | A | -1.0766 | |
| 117 | Q | A | -1.7582 | |
| 118 | C | A | -1.3074 | |
| 119 | V | A | -0.9932 | |
| 120 | K | A | -3.1925 | |
| 121 | H | A | -3.5546 | |
| 122 | E | A | -4.1367 | |
| 123 | E | A | -4.3459 | |
| 124 | K | A | -4.2992 | |
| 125 | E | A | -4.3444 | |
| 126 | Q | A | -3.6819 | |
| 127 | I | A | -2.2720 | |
| 128 | K | A | -3.2049 | |
| 129 | N | A | -2.1040 | |
| 130 | L | A | -0.5582 | |
| 131 | N | A | -1.1181 | |
| 132 | S | A | -0.7705 | |
| 133 | R | A | -0.6414 | |
| 134 | F | A | 1.2461 | |
| 135 | A | A | 0.5885 | |
| 136 | A | A | 0.1759 | |
| 137 | F | A | 1.6477 | |
| 138 | I | A | 1.1357 | |
| 139 | D | A | -1.1189 | |
| 140 | K | A | -0.6000 | |
| 141 | V | A | -0.0541 | |
| 142 | R | A | -1.8617 | |
| 143 | F | A | -0.3561 | |
| 144 | L | A | -0.9837 | |
| 145 | E | A | -3.0689 | |
| 146 | Q | A | -2.7757 | |
| 147 | Q | A | -2.0155 | |
| 148 | N | A | -3.2718 | |
| 149 | K | A | -3.2236 | |
| 150 | L | A | -1.7211 | |
| 151 | L | A | -1.5526 | |
| 152 | E | A | -2.5243 | |
| 153 | T | A | -1.2847 | |
| 154 | K | A | -0.9437 | |
| 155 | W | A | -0.0819 | |
| 156 | Q | A | -1.0773 | |
| 157 | F | A | 0.5547 | |
| 158 | Y | A | 0.4245 | |
| 159 | Q | A | -1.4492 | |
| 160 | N | A | -1.7515 | |
| 161 | Q | A | -1.4120 | |
| 162 | R | A | -2.6224 | |
| 163 | C | A | -1.3163 | |
| 164 | C | A | -1.2890 | |
| 165 | E | A | -2.2185 | |
| 166 | S | A | -1.8223 | |
| 167 | N | A | -1.3093 | |
| 168 | L | A | -0.0938 | |
| 169 | E | A | -1.2863 | |
| 170 | P | A | -0.0905 | |
| 171 | L | A | 1.5895 | |
| 172 | F | A | 1.8144 | |
| 173 | N | A | 0.1626 | |
| 174 | G | A | 0.5068 | |
| 175 | Y | A | 1.7784 | |
| 176 | I | A | 1.3637 | |
| 177 | E | A | -1.3349 | |
| 178 | T | A | -0.9137 | |
| 179 | L | A | -0.8037 | |
| 180 | R | A | -2.3696 | |
| 181 | R | A | -2.9385 | |
| 182 | E | A | -2.9230 | |
| 183 | A | A | -2.3733 | |
| 184 | E | A | -2.6622 | |
| 185 | H | A | -2.6033 | |
| 186 | V | A | -1.4856 | |
| 187 | E | A | -2.6868 | |
| 188 | A | A | -2.3210 | |
| 189 | D | A | -2.5597 | |
| 190 | S | A | -1.8796 | |
| 191 | G | A | -1.9342 | |
| 192 | R | A | -2.4848 | |
| 193 | L | A | -0.7430 | |
| 194 | A | A | -0.6875 | |
| 195 | S | A | -1.5619 | |
| 196 | E | A | -1.8600 | |
| 197 | L | A | -0.1012 | |
| 198 | N | A | -1.6492 | |
| 199 | H | A | -1.5687 | |
| 200 | V | A | -0.0263 | |
| 201 | Q | A | -1.1098 | |
| 202 | E | A | -1.9545 | |
| 203 | V | A | 0.3427 | |
| 204 | L | A | 0.0883 | |
| 205 | E | A | -1.8679 | |
| 206 | G | A | -1.0336 | |
| 207 | Y | A | -0.6833 | |
| 208 | K | A | -2.7897 | |
| 209 | K | A | -3.6415 | |
| 210 | K | A | -3.3313 | |
| 211 | Y | A | -1.7751 | |
| 212 | E | A | -3.3149 | |
| 213 | E | A | -3.4288 | |
| 214 | E | A | -2.3680 | |
| 215 | V | A | -0.7860 | |
| 216 | A | A | -0.9404 | |
| 217 | L | A | -0.4550 | |
| 218 | R | A | -2.3269 | |
| 219 | A | A | -1.4900 | |
| 220 | T | A | -1.1535 | |
| 221 | A | A | -1.1744 | |
| 222 | E | A | -1.8675 | |
| 223 | N | A | -1.4845 | |
| 224 | E | A | -1.2067 | |
| 225 | F | A | 0.7914 | |
| 226 | V | A | 1.2337 | |
| 227 | V | A | 1.0585 | |
| 228 | L | A | 0.6393 | |
| 229 | K | A | -1.2085 | |
| 230 | K | A | -1.9862 | |
| 231 | D | A | -1.6470 | |
| 232 | V | A | -1.1247 | |
| 233 | D | A | -2.2227 | |
| 234 | C | A | -1.4618 | |
| 235 | A | A | -1.3101 | |
| 236 | Y | A | -0.0261 | |
| 237 | L | A | -0.1662 | |
| 238 | R | A | -2.0066 | |
| 239 | K | A | -2.1202 | |
| 240 | S | A | -1.4841 | |
| 241 | D | A | -2.4253 | |
| 242 | L | A | -1.0653 | |
| 243 | E | A | -2.2294 | |
| 244 | A | A | -1.6772 | |
| 245 | N | A | -1.1847 | |
| 246 | V | A | 0.3037 | |
| 247 | E | A | -1.5222 | |
| 248 | A | A | -0.7856 | |
| 249 | L | A | 0.6467 | |
| 250 | V | A | 0.5479 | |
| 251 | E | A | -1.6645 | |
| 252 | E | A | -1.5785 | |
| 253 | S | A | -0.8685 | |
| 254 | N | A | -0.9271 | |
| 255 | F | A | 0.0357 | |
| 256 | L | A | -0.5928 | |
| 257 | K | A | -2.6331 | |
| 258 | R | A | -2.6385 | |
| 259 | L | A | -1.0070 | |
| 260 | Y | A | -0.8044 | |
| 261 | D | A | -2.6211 | |
| 262 | E | A | -3.0014 | |
| 263 | E | A | -1.9201 | |
| 264 | I | A | -0.2062 | |
| 265 | Q | A | -1.0741 | |
| 266 | I | A | 0.3537 | |
| 267 | L | A | 0.5629 | |
| 268 | N | A | -0.3760 | |
| 269 | A | A | -0.2998 | |
| 270 | H | A | -0.2929 | |
| 271 | I | A | 1.0137 | |
| 272 | S | A | -0.2613 | |
| 273 | D | A | -1.4545 | |
| 274 | T | A | 0.3734 | |
| 275 | S | A | 1.1104 | |
| 276 | V | A | 2.8914 | |
| 277 | I | A | 3.3569 | |
| 278 | V | A | 2.5037 | |
| 279 | K | A | -0.2013 | |
| 280 | M | A | -0.2117 | |
| 281 | D | A | -2.5063 | |
| 282 | N | A | -2.8716 | |
| 283 | S | A | -2.4273 | |
| 284 | R | A | -3.2621 | |
| 285 | D | A | -2.5344 | |
| 286 | L | A | -0.6642 | |
| 287 | N | A | -1.0636 | |
| 288 | M | A | 0.0209 | |
| 289 | D | A | -0.8888 | |
| 290 | C | A | 0.0047 | |
| 291 | V | A | 0.4581 | |
| 292 | V | A | 0.0514 | |
| 293 | A | A | -0.6351 | |
| 294 | E | A | -1.6884 | |
| 295 | I | A | -0.8828 | |
| 296 | K | A | -1.8301 | |
| 297 | A | A | -1.8435 | |
| 298 | Q | A | -1.7244 | |
| 299 | Y | A | -0.8093 | |
| 300 | D | A | -2.5195 | |
| 301 | D | A | -2.3665 | |
| 302 | I | A | -0.6202 | |
| 303 | A | A | -1.4694 | |
| 304 | S | A | -2.4148 | |
| 305 | R | A | -3.1486 | |
| 306 | S | A | -2.7210 | |
| 307 | R | A | -3.3206 | |
| 308 | A | A | -2.5542 | |
| 309 | E | A | -3.1676 | |
| 310 | A | A | -2.1172 | |
| 311 | E | A | -2.6969 | |
| 312 | S | A | -1.7324 | |
| 313 | W | A | -0.6500 | |
| 314 | Y | A | -0.7582 | |
| 315 | R | A | -2.5536 | |
| 316 | S | A | -2.1842 | |
| 317 | K | A | -2.4191 | |
| 318 | C | A | -1.9333 | |
| 319 | E | A | -3.1592 | |
| 320 | E | A | -2.7438 | |
| 321 | M | A | -1.0555 | |
| 322 | K | A | -1.3537 | |
| 323 | A | A | -0.9294 | |
| 324 | T | A | -0.3772 | |
| 325 | V | A | 0.9070 | |
| 326 | I | A | 0.9824 | |
| 327 | R | A | -1.3768 | |
| 328 | H | A | -1.3714 | |
| 329 | G | A | -0.9594 | |
| 330 | E | A | -2.2539 | |
| 331 | T | A | -1.9801 | |
| 332 | L | A | -1.7582 | |
| 333 | R | A | -3.6598 | |
| 334 | R | A | -4.0636 | |
| 335 | T | A | -3.0116 | |
| 336 | K | A | -3.7252 | |
| 337 | E | A | -4.3553 | |
| 338 | E | A | -3.8214 | |
| 339 | I | A | -1.6790 | |
| 340 | N | A | -2.7656 | |
| 341 | E | A | -2.8201 | |
| 342 | L | A | -0.7018 | |
| 343 | N | A | -1.6013 | |
| 344 | R | A | -1.8479 | |
| 345 | V | A | 0.3720 | |
| 346 | I | A | 0.4738 | |
| 347 | Q | A | -1.3713 | |
| 348 | R | A | -1.5156 | |
| 349 | L | A | -0.1407 | |
| 350 | T | A | -0.5389 | |
| 351 | A | A | -1.6000 | |
| 352 | E | A | -2.1255 | |
| 353 | I | A | -0.6574 | |
| 354 | E | A | -2.5680 | |
| 355 | N | A | -2.7524 | |
| 356 | A | A | -2.4414 | |
| 357 | K | A | -3.0545 | |
| 358 | C | A | -2.1248 | |
| 359 | Q | A | -2.7498 | |
| 360 | R | A | -3.5696 | |
| 361 | T | A | -2.2645 | |
| 362 | K | A | -2.3568 | |
| 363 | L | A | -1.1490 | |
| 364 | E | A | -2.0163 | |
| 365 | A | A | -1.3886 | |
| 366 | A | A | -0.8848 | |
| 367 | V | A | -0.0719 | |
| 368 | A | A | -1.5580 | |
| 369 | E | A | -2.8338 | |
| 370 | A | A | -2.3471 | |
| 371 | E | A | -3.3752 | |
| 372 | Q | A | -3.5028 | |
| 373 | Q | A | -3.1404 | |
| 374 | G | A | -2.8351 | |
| 375 | E | A | -3.0848 | |
| 376 | A | A | -2.1990 | |
| 377 | A | A | -1.6021 | |
| 378 | L | A | -0.9503 | |
| 379 | N | A | -2.0975 | |
| 380 | D | A | -2.7470 | |
| 381 | A | A | -1.8582 | |
| 382 | R | A | -2.2943 | |
| 383 | S | A | -2.1329 | |
| 384 | K | A | -2.3305 | |
| 385 | L | A | -0.9486 | |
| 386 | A | A | -1.1039 | |
| 387 | G | A | -1.1668 | |
| 388 | L | A | -0.2407 | |
| 389 | E | A | -2.0225 | |
| 390 | E | A | -2.8579 | |
| 391 | A | A | -1.4307 | |
| 392 | L | A | -1.2833 | |
| 393 | Q | A | -3.3066 | |
| 394 | K | A | -3.7001 | |
| 395 | A | A | -2.6757 | |
| 396 | K | A | -3.2889 | |
| 397 | Q | A | -2.8505 | |
| 398 | D | A | -2.4094 | |
| 399 | M | A | -0.8633 | |
| 400 | A | A | -0.5553 | |
| 401 | C | A | -0.1536 | |
| 402 | L | A | 1.0037 | |
| 403 | L | A | 1.0513 | |
| 404 | K | A | -1.2696 | |
| 405 | E | A | -1.2784 | |
| 406 | Y | A | 0.4964 | |
| 407 | Q | A | -1.3302 | |
| 408 | E | A | -2.0937 | |
| 409 | V | A | 0.0150 | |
| 410 | M | A | -0.4740 | |
| 411 | N | A | -1.6019 | |
| 412 | S | A | -0.8343 | |
| 413 | K | A | -1.0659 | |
| 414 | L | A | 0.1234 | |
| 415 | G | A | 0.3093 | |
| 416 | L | A | 0.6549 | |
| 417 | D | A | -0.4236 | |
| 418 | I | A | 1.2527 | |
| 419 | E | A | -0.1793 | |
| 420 | I | A | 0.5728 | |
| 421 | A | A | -0.0579 | |
| 422 | T | A | -0.0907 | |
| 423 | Y | A | 0.3381 | |
| 424 | R | A | -1.2403 | |
| 425 | R | A | -2.2251 | |
| 426 | L | A | -0.1955 | |
| 427 | L | A | -1.0659 | |
| 428 | E | A | -3.2194 | |
| 429 | G | A | -2.6125 | |
| 430 | E | A | -3.3724 | |
| 431 | E | A | -3.6607 | |
| 432 | Q | A | -3.4851 | |
| 433 | R | A | -3.3327 | |
| 434 | L | A | -1.0071 | |
| 435 | C | A | -0.8725 | |
| 436 | E | A | -2.2060 | |
| 437 | G | A | -0.7471 | |
| 438 | V | A | 1.3670 | |
| 439 | G | A | 0.2059 | |
| 440 | S | A | 0.4827 | |
| 441 | V | A | 1.8108 | |
| 442 | N | A | 0.7445 | |
| 443 | V | A | 2.4223 | |
| 444 | C | A | 2.2510 | |
| 445 | V | A | 2.2822 | |
| 446 | S | A | 0.8790 | |
| 447 | S | A | -0.4010 | |
| 448 | S | A | -1.1794 | |
| 449 | R | A | -2.3288 | |
| 450 | G | A | -1.3143 | |
| 451 | G | A | -0.1862 | |
| 452 | V | A | 1.6322 | |
| 453 | A | A | 1.0878 | |
| 454 | C | A | 0.7993 | |
| 455 | G | A | 0.0037 | |
| 456 | G | A | 0.1876 | |
| 457 | L | A | 1.4530 | |
| 458 | T | A | 1.1025 | |
| 459 | Y | A | 1.4751 | |
| 460 | S | A | 0.4545 | |
| 461 | S | A | -0.1040 | |
| 462 | T | A | -0.3811 | |
| 463 | A | A | -0.7145 | |
| 464 | G | A | -1.6520 | |
| 465 | R | A | -2.2182 | |
| 466 | Q | A | -1.1573 | |
| 467 | I | A | 0.9474 | |
| 468 | A | A | 0.4148 | |
| 469 | S | A | -0.1045 | |
| 470 | G | A | -0.2930 | |
| 471 | P | A | 0.2920 | |
| 472 | V | A | 1.5541 | |
| 473 | A | A | 0.6296 | |
| 474 | T | A | 0.0347 | |
| 475 | G | A | -0.5626 | |
| 476 | G | A | -0.3081 | |
| 477 | S | A | 0.6003 | |
| 478 | I | A | 2.3525 | |
| 479 | T | A | 2.0690 | |
| 480 | V | A | 2.9682 | |
| 481 | L | A | 2.4028 | |
| 482 | A | A | 0.6685 | |
| 483 | P | A | -0.5101 | |
| 484 | D | A | -1.6677 | |
| 485 | S | A | -1.0667 | |
| 486 | C | A | -0.6479 | |
| 487 | Q | A | -1.4382 | |
| 488 | P | A | -1.5586 | |
| 489 | R | A | -2.2059 | |
| 490 | A | A | -0.9807 | |
| 491 | S | A | -0.3344 | |
| 492 | S | A | 0.4664 | |
| 493 | F | A | 1.8191 | |
| 494 | S | A | 0.8756 | |
| 495 | C | A | 0.7817 | |
| 496 | G | A | -0.3152 | |
| 497 | S | A | -0.8935 | |
| 498 | S | A | -1.1160 | |
| 499 | R | A | -1.9114 | |
| 500 | S | A | -0.5910 | |
| 501 | V | A | 0.7797 | |
| 502 | R | A | -0.2683 | |
| 503 | F | A | 1.4846 | |
| 504 | A | A | 0.7447 |
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