| Chain sequence(s) |
A: ATEVYTFKNMSDADLADIEALLKAWSAYFGDVNHRPGQVVDGSNTGGFNPGPFDGSQYALKSTASDAAFIAGGDLHYTLFSNPSHTLWGKLDSIALGDTLTGGASSGGYALDSQEVSFSNLGLDSPIAQGRDGTVHKVVYGLMSGDSSALIAAIKNSTGELTITRADGTVITTINYSPEELAAILAKVEALLKAWSAYFGDVNHRPGQVVDGSNTGGFNPGPFDGSQYALKSTASDAAFIAGGDLHYTLFSNPSHTLWGKLDSIALGDTLTGGASSGGYALDSQEVSFSNLGLDSPIAQGRDGTVHKVVYGLMSGDSSALIAAIKEKLATPGSTLTITVK
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 (00:03:05)
[INFO] Main: Simulation completed successfully. (00:03:07)
|
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 | -0.3943 | |
| 2 | T | A | -0.7421 | |
| 3 | E | A | -0.2592 | |
| 4 | V | A | 1.2548 | |
| 5 | Y | A | 0.9554 | |
| 6 | T | A | 0.2196 | |
| 7 | F | A | 0.0000 | |
| 8 | K | A | -1.1274 | |
| 9 | N | A | -1.1080 | |
| 10 | M | A | -1.0259 | |
| 11 | S | A | -1.4214 | |
| 12 | D | A | -2.1199 | |
| 13 | A | A | -1.4008 | |
| 14 | D | A | -1.4072 | |
| 15 | L | A | -1.2556 | |
| 16 | A | A | -1.1717 | |
| 17 | D | A | -1.8084 | |
| 18 | I | A | 0.0000 | |
| 19 | E | A | -1.2900 | |
| 20 | A | A | -1.1229 | |
| 21 | L | A | -0.9520 | |
| 22 | L | A | 0.0000 | |
| 23 | K | A | -1.9503 | |
| 24 | A | A | -0.5373 | |
| 25 | W | A | 0.0000 | |
| 26 | S | A | -0.7079 | |
| 27 | A | A | -0.2065 | |
| 28 | Y | A | 0.3450 | |
| 29 | F | A | 0.0000 | |
| 30 | G | A | -0.2677 | |
| 31 | D | A | -1.0571 | |
| 32 | V | A | 0.0000 | |
| 33 | N | A | -0.7044 | |
| 34 | H | A | -0.6148 | |
| 35 | R | A | -1.5451 | |
| 36 | P | A | -1.0329 | |
| 37 | G | A | -0.8219 | |
| 38 | Q | A | -0.9725 | |
| 39 | V | A | 0.6683 | |
| 40 | V | A | 0.6810 | |
| 41 | D | A | -1.2949 | |
| 42 | G | A | -1.1663 | |
| 43 | S | A | -0.8530 | |
| 44 | N | A | -1.5744 | |
| 45 | T | A | -0.9571 | |
| 46 | G | A | -0.6631 | |
| 47 | G | A | -0.5363 | |
| 48 | F | A | 0.0000 | |
| 49 | N | A | -0.8002 | |
| 50 | P | A | -0.7705 | |
| 51 | G | A | -0.6178 | |
| 52 | P | A | -0.2844 | |
| 53 | F | A | 0.1532 | |
| 54 | D | A | -1.3773 | |
| 55 | G | A | -1.3695 | |
| 56 | S | A | -1.5585 | |
| 57 | Q | A | -0.9764 | |
| 58 | Y | A | 0.0000 | |
| 59 | A | A | 0.0000 | |
| 60 | L | A | 0.0000 | |
| 61 | K | A | -1.1085 | |
| 62 | S | A | 0.0000 | |
| 63 | T | A | -0.7922 | |
| 64 | A | A | -0.3864 | |
| 65 | S | A | -0.9199 | |
| 66 | D | A | -1.9325 | |
| 67 | A | A | 0.0000 | |
| 68 | A | A | 0.0000 | |
| 69 | F | A | 0.0000 | |
| 70 | I | A | 0.0885 | |
| 71 | A | A | 0.0000 | |
| 72 | G | A | -0.9957 | |
| 73 | G | A | -1.9798 | |
| 74 | D | A | -2.8721 | |
| 75 | L | A | 0.0000 | |
| 76 | H | A | -0.8955 | |
| 77 | Y | A | 0.3316 | |
| 78 | T | A | 0.3637 | |
| 79 | L | A | 0.9837 | |
| 80 | F | A | 1.5965 | |
| 81 | S | A | 0.1315 | |
| 82 | N | A | -0.9478 | |
| 83 | P | A | -1.0520 | |
| 84 | S | A | -0.3816 | |
| 85 | H | A | -0.4873 | |
| 86 | T | A | 0.0000 | |
| 87 | L | A | 0.0000 | |
| 88 | W | A | -1.4171 | |
| 89 | G | A | -1.6723 | |
| 90 | K | A | -2.6251 | |
| 91 | L | A | 0.0000 | |
| 92 | D | A | -1.8657 | |
| 93 | S | A | -0.8243 | |
| 94 | I | A | 0.0000 | |
| 95 | A | A | -0.5318 | |
| 96 | L | A | 0.0000 | |
| 97 | G | A | 0.0000 | |
| 98 | D | A | -2.1859 | |
| 99 | T | A | -1.6212 | |
| 100 | L | A | -0.9722 | |
| 101 | T | A | -0.6346 | |
| 102 | G | A | -0.7821 | |
| 103 | G | A | -0.5550 | |
| 104 | A | A | -0.5927 | |
| 105 | S | A | -0.5823 | |
| 106 | S | A | -0.7311 | |
| 107 | G | A | -0.7818 | |
| 108 | G | A | -0.5796 | |
| 109 | Y | A | -0.2111 | |
| 110 | A | A | -0.7127 | |
| 111 | L | A | 0.0000 | |
| 112 | D | A | -2.4292 | |
| 113 | S | A | -2.2610 | |
| 114 | Q | A | -2.6421 | |
| 115 | E | A | -2.4546 | |
| 116 | V | A | 0.0000 | |
| 117 | S | A | -0.4203 | |
| 118 | F | A | 0.0000 | |
| 119 | S | A | -1.1729 | |
| 120 | N | A | -2.0248 | |
| 121 | L | A | 0.0000 | |
| 122 | G | A | -1.8391 | |
| 123 | L | A | -1.4950 | |
| 124 | D | A | -2.4522 | |
| 125 | S | A | 0.0000 | |
| 126 | P | A | -0.8475 | |
| 127 | I | A | -0.7449 | |
| 128 | A | A | -0.9549 | |
| 129 | Q | A | -2.0725 | |
| 130 | G | A | -2.3272 | |
| 131 | R | A | -3.2280 | |
| 132 | D | A | -3.2531 | |
| 133 | G | A | 0.0000 | |
| 134 | T | A | -1.6880 | |
| 135 | V | A | 0.0000 | |
| 136 | H | A | 0.0000 | |
| 137 | K | A | -1.8953 | |
| 138 | V | A | 0.0000 | |
| 139 | V | A | 0.0000 | |
| 140 | Y | A | -0.5637 | |
| 141 | G | A | -0.8423 | |
| 142 | L | A | 0.0000 | |
| 143 | M | A | 0.0000 | |
| 144 | S | A | 0.0000 | |
| 145 | G | A | -1.0100 | |
| 146 | D | A | -1.6570 | |
| 147 | S | A | 0.0000 | |
| 148 | S | A | -0.9730 | |
| 149 | A | A | -0.6862 | |
| 150 | L | A | 0.0000 | |
| 151 | I | A | 0.0000 | |
| 152 | A | A | -0.9167 | |
| 153 | A | A | 0.0000 | |
| 154 | I | A | 0.0000 | |
| 155 | K | A | -2.1874 | |
| 156 | N | A | -2.1432 | |
| 157 | S | A | 0.0000 | |
| 158 | T | A | -1.5238 | |
| 159 | G | A | -1.5905 | |
| 160 | E | A | -2.3696 | |
| 161 | L | A | 0.0000 | |
| 162 | T | A | -0.3323 | |
| 163 | I | A | 0.0000 | |
| 164 | T | A | -0.2083 | |
| 165 | R | A | -1.1477 | |
| 166 | A | A | -1.7611 | |
| 167 | D | A | -2.1969 | |
| 168 | G | A | -1.0989 | |
| 169 | T | A | -0.0214 | |
| 170 | V | A | 1.4004 | |
| 171 | I | A | 0.8752 | |
| 172 | T | A | -0.1558 | |
| 173 | T | A | 0.0000 | |
| 174 | I | A | -0.9968 | |
| 175 | N | A | -1.4000 | |
| 176 | Y | A | -1.2175 | |
| 177 | S | A | -1.4503 | |
| 178 | P | A | -1.6621 | |
| 179 | E | A | -2.5478 | |
| 180 | E | A | -2.3471 | |
| 181 | L | A | -1.0212 | |
| 182 | A | A | -0.9265 | |
| 183 | A | A | -0.9719 | |
| 184 | I | A | 0.0000 | |
| 185 | L | A | -0.3843 | |
| 186 | A | A | -0.3077 | |
| 187 | K | A | -0.6405 | |
| 188 | V | A | 0.0000 | |
| 189 | E | A | -0.9793 | |
| 190 | A | A | -0.8101 | |
| 191 | L | A | -0.6063 | |
| 192 | L | A | 0.0000 | |
| 193 | K | A | -1.8395 | |
| 194 | A | A | -0.5340 | |
| 195 | W | A | 0.0000 | |
| 196 | S | A | -0.7227 | |
| 197 | A | A | -0.2482 | |
| 198 | Y | A | 0.1770 | |
| 199 | F | A | 0.0000 | |
| 200 | G | A | -0.3282 | |
| 201 | D | A | -0.9549 | |
| 202 | V | A | 0.0000 | |
| 203 | N | A | -0.6696 | |
| 204 | H | A | -0.4085 | |
| 205 | R | A | -1.3751 | |
| 206 | P | A | -0.9906 | |
| 207 | G | A | -0.7875 | |
| 208 | Q | A | -0.9149 | |
| 209 | V | A | 0.8954 | |
| 210 | V | A | 0.9025 | |
| 211 | D | A | -1.1596 | |
| 212 | G | A | -1.1130 | |
| 213 | S | A | -0.8581 | |
| 214 | N | A | -1.7083 | |
| 215 | T | A | -0.9245 | |
| 216 | G | A | -0.6232 | |
| 217 | G | A | -0.6018 | |
| 218 | F | A | 0.0000 | |
| 219 | N | A | -0.9104 | |
| 220 | P | A | -0.9405 | |
| 221 | G | A | -0.8403 | |
| 222 | P | A | -0.4607 | |
| 223 | F | A | -0.0668 | |
| 224 | D | A | -1.7475 | |
| 225 | G | A | -1.5567 | |
| 226 | S | A | -1.6045 | |
| 227 | Q | A | -1.0215 | |
| 228 | Y | A | -0.5235 | |
| 229 | A | A | 0.0000 | |
| 230 | L | A | 0.0000 | |
| 231 | K | A | -1.1058 | |
| 232 | S | A | 0.0000 | |
| 233 | T | A | -0.7874 | |
| 234 | A | A | -0.3763 | |
| 235 | S | A | -0.8286 | |
| 236 | D | A | -1.8469 | |
| 237 | A | A | 0.0000 | |
| 238 | A | A | 0.0000 | |
| 239 | F | A | 0.0000 | |
| 240 | I | A | 0.0000 | |
| 241 | A | A | 0.0000 | |
| 242 | G | A | -0.8842 | |
| 243 | G | A | -1.9352 | |
| 244 | D | A | -2.8797 | |
| 245 | L | A | 0.0000 | |
| 246 | H | A | -1.0518 | |
| 247 | Y | A | 0.2090 | |
| 248 | T | A | 0.3320 | |
| 249 | L | A | 1.0454 | |
| 250 | F | A | 1.6071 | |
| 251 | S | A | 0.1318 | |
| 252 | N | A | -0.9059 | |
| 253 | P | A | -1.0082 | |
| 254 | S | A | -0.3213 | |
| 255 | H | A | -0.4486 | |
| 256 | T | A | 0.0000 | |
| 257 | L | A | 0.0000 | |
| 258 | W | A | -1.5135 | |
| 259 | G | A | -1.7187 | |
| 260 | K | A | -2.6036 | |
| 261 | L | A | 0.0000 | |
| 262 | D | A | -1.7870 | |
| 263 | S | A | -0.8011 | |
| 264 | I | A | 0.0000 | |
| 265 | A | A | -0.3549 | |
| 266 | L | A | 0.0000 | |
| 267 | G | A | 0.0000 | |
| 268 | D | A | -1.8755 | |
| 269 | T | A | -1.5288 | |
| 270 | L | A | -0.9453 | |
| 271 | T | A | -0.6711 | |
| 272 | G | A | -0.7963 | |
| 273 | G | A | -0.5433 | |
| 274 | A | A | -0.6273 | |
| 275 | S | A | -0.5796 | |
| 276 | S | A | -0.7041 | |
| 277 | G | A | -0.7804 | |
| 278 | G | A | -0.5955 | |
| 279 | Y | A | -0.4065 | |
| 280 | A | A | -0.6691 | |
| 281 | L | A | 0.0000 | |
| 282 | D | A | -2.2107 | |
| 283 | S | A | -2.0509 | |
| 284 | Q | A | -1.9821 | |
| 285 | E | A | -1.8505 | |
| 286 | V | A | 0.0000 | |
| 287 | S | A | -0.3669 | |
| 288 | F | A | 0.0000 | |
| 289 | S | A | -0.7905 | |
| 290 | N | A | -1.3325 | |
| 291 | L | A | 0.0000 | |
| 292 | G | A | -1.4958 | |
| 293 | L | A | 0.0000 | |
| 294 | D | A | -2.4918 | |
| 295 | S | A | 0.0000 | |
| 296 | P | A | -0.7918 | |
| 297 | I | A | -0.6948 | |
| 298 | A | A | -0.9014 | |
| 299 | Q | A | -1.9532 | |
| 300 | G | A | 0.0000 | |
| 301 | R | A | -3.3487 | |
| 302 | D | A | -3.3541 | |
| 303 | G | A | 0.0000 | |
| 304 | T | A | -1.9590 | |
| 305 | V | A | 0.0000 | |
| 306 | H | A | 0.0000 | |
| 307 | K | A | -2.6109 | |
| 308 | V | A | 0.0000 | |
| 309 | V | A | 0.0000 | |
| 310 | Y | A | -1.0418 | |
| 311 | G | A | -1.1836 | |
| 312 | L | A | 0.0000 | |
| 313 | M | A | 0.0000 | |
| 314 | S | A | 0.0000 | |
| 315 | G | A | -1.0593 | |
| 316 | D | A | -1.7092 | |
| 317 | S | A | 0.0000 | |
| 318 | S | A | -0.9435 | |
| 319 | A | A | 0.0000 | |
| 320 | L | A | 0.0000 | |
| 321 | I | A | -0.7441 | |
| 322 | A | A | -0.7366 | |
| 323 | A | A | 0.0000 | |
| 324 | I | A | 0.0000 | |
| 325 | K | A | -1.7141 | |
| 326 | E | A | -2.3095 | |
| 327 | K | A | -1.6510 | |
| 328 | L | A | -0.9993 | |
| 329 | A | A | -0.9463 | |
| 330 | T | A | -1.1713 | |
| 331 | P | A | -1.2461 | |
| 332 | G | A | -1.0813 | |
| 333 | S | A | -0.9405 | |
| 334 | T | A | -0.7744 | |
| 335 | L | A | 0.0000 | |
| 336 | T | A | 0.0129 | |
| 337 | I | A | 0.0000 | |
| 338 | T | A | -0.0950 | |
| 339 | V | A | 0.0000 | |
| 340 | K | A | -2.0407 |
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