| Chain sequence(s) |
A: LRVAPTVVTYNTLIDGLCKAGKLDEALKLFEEMVEKGIKPDVVTYNTLIDGLCKAGKLDEALKLFEEMVEKGIKPDVVTYNTLIDGLCKAGKLDEALKLFEEMVEKGIKPDVVTYNTLIDGLCKAGKLDEALKLFEEMVEKGIKPDVVTYSTLIDGLCKAGKLDEALKLFEEMVEKGIKPNVVTYSTLIDGLCKAGKLDEALKLFEMKGIKPNVVTYNTLIDGLCKAGKLDEALKLFEEMKGIKPDVVTYNTLIDGLCKAGKLDEALKLFEEMVEKGIKPDVVTYNTLIDGLCKAGKLDEALKLFEEMVEKGIKPDVVTYNTLIDGLCKAGLDEALKLFEEMVEKGIKPDELTYRRVVEY |
| Distance of aggregation | 10 Å |
| Dynamic mode | No |
| Mutated residues | LA42A, VA47R, VA52Y, VA87Y, VA122Y, VA157Y, VA192Y, VA262Y, VA332Y, VA367Y, VA408Y |
| Energy difference between WT (input) and mutated protein (by FoldX) | -4.78139 kcal/mol
Changes in protein stability upon mutation are calculated using the FoldX forcefield. Computational prediction of protein stability is used with the intention of preventing the experimental characterization of proteins bearing mutations that significantly destabilize their structure. Mutations resulting in a predicted reduction in protein stability ≥ 1 kcal/mol are considered disruptive. |
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 | |
| 42 | A | A | -1.2359 | mutated: LA42A |
| 43 | R | A | -2.4460 | |
| 47 | R | A | -2.4557 | mutated: VA47R |
| 48 | A | A | -1.2358 | |
| 49 | P | A | -0.6675 | |
| 50 | T | A | 0.2218 | |
| 51 | V | A | 0.8772 | |
| 52 | Y | A | 1.7003 | mutated: VA52Y |
| 53 | T | A | 0.8944 | |
| 54 | Y | A | 0.0000 | |
| 55 | N | A | 0.0000 | |
| 56 | T | A | 0.5465 | |
| 57 | L | A | 0.7255 | |
| 58 | I | A | 0.0000 | |
| 59 | D | A | -1.3794 | |
| 60 | G | A | -1.2810 | |
| 61 | L | A | -1.8594 | |
| 62 | C | A | -2.3572 | |
| 63 | K | A | -2.7081 | |
| 64 | A | A | -2.1173 | |
| 65 | G | A | -2.5646 | |
| 66 | K | A | -3.2037 | |
| 67 | L | A | -2.9241 | |
| 68 | D | A | -3.4023 | |
| 69 | E | A | -3.4289 | |
| 70 | A | A | 0.0000 | |
| 71 | L | A | -2.0491 | |
| 72 | K | A | -3.0805 | |
| 73 | L | A | -1.6435 | |
| 74 | F | A | -1.2980 | |
| 75 | E | A | -2.5507 | |
| 76 | E | A | -2.2115 | |
| 77 | M | A | 0.0000 | |
| 78 | V | A | -1.1458 | |
| 79 | E | A | -2.7739 | |
| 80 | K | A | -2.8412 | |
| 81 | G | A | -1.7277 | |
| 82 | I | A | -1.3615 | |
| 83 | K | A | -1.7516 | |
| 84 | P | A | 0.0000 | |
| 85 | D | A | -0.6496 | |
| 86 | V | A | 0.3376 | |
| 87 | Y | A | 1.1417 | mutated: VA87Y |
| 88 | T | A | 0.0000 | |
| 89 | Y | A | 0.0000 | |
| 90 | N | A | 0.2097 | |
| 91 | T | A | 0.0000 | |
| 92 | L | A | 0.0000 | |
| 93 | I | A | 0.0000 | |
| 94 | D | A | -1.4936 | |
| 95 | G | A | 0.0000 | |
| 96 | L | A | 0.0000 | |
| 97 | C | A | -2.2054 | |
| 98 | K | A | -2.6508 | |
| 99 | A | A | -1.7836 | |
| 100 | G | A | -2.2825 | |
| 101 | K | A | -2.7492 | |
| 102 | L | A | 0.0000 | |
| 103 | D | A | -3.2701 | |
| 104 | E | A | -3.4121 | |
| 105 | A | A | 0.0000 | |
| 106 | L | A | -2.1921 | |
| 107 | K | A | -3.2191 | |
| 108 | L | A | 0.0000 | |
| 109 | F | A | -1.6826 | |
| 110 | E | A | -2.6520 | |
| 111 | E | A | -2.3155 | |
| 112 | M | A | 0.0000 | |
| 113 | V | A | -1.2412 | |
| 114 | E | A | -2.8486 | |
| 115 | K | A | -2.9643 | |
| 116 | G | A | -1.8936 | |
| 117 | I | A | 0.0000 | |
| 118 | K | A | -1.9315 | |
| 119 | P | A | 0.0000 | |
| 120 | D | A | -0.5157 | |
| 121 | V | A | 0.4396 | |
| 122 | Y | A | 1.5988 | mutated: VA122Y |
| 123 | T | A | 0.0000 | |
| 124 | Y | A | 0.0000 | |
| 125 | N | A | 0.0000 | |
| 126 | T | A | 0.0000 | |
| 127 | L | A | 0.0000 | |
| 128 | I | A | 0.0000 | |
| 129 | D | A | -0.9773 | |
| 130 | G | A | -1.5005 | |
| 131 | L | A | 0.0000 | |
| 132 | C | A | -1.8314 | |
| 133 | K | A | -2.4122 | |
| 134 | A | A | -1.6242 | |
| 135 | G | A | -1.9066 | |
| 136 | K | A | -2.3147 | |
| 137 | L | A | -2.2408 | |
| 138 | D | A | -3.1262 | |
| 139 | E | A | -3.3707 | |
| 140 | A | A | 0.0000 | |
| 141 | L | A | -2.1096 | |
| 142 | K | A | -3.1995 | |
| 143 | L | A | 0.0000 | |
| 144 | F | A | -1.5378 | |
| 145 | E | A | -2.3631 | |
| 146 | E | A | -1.8711 | |
| 147 | M | A | 0.0000 | |
| 148 | V | A | -0.6160 | |
| 149 | E | A | -2.3286 | |
| 150 | K | A | -2.2409 | |
| 151 | G | A | -1.3772 | |
| 152 | I | A | -0.9109 | |
| 153 | K | A | -1.6837 | |
| 154 | P | A | 0.0000 | |
| 155 | D | A | -0.1394 | |
| 156 | V | A | 0.4171 | |
| 157 | Y | A | 1.5235 | mutated: VA157Y |
| 158 | T | A | 0.0000 | |
| 159 | Y | A | 0.0000 | |
| 160 | N | A | 0.5069 | |
| 161 | T | A | 0.3039 | |
| 162 | L | A | 0.0000 | |
| 163 | I | A | 0.0000 | |
| 164 | D | A | 0.0000 | |
| 165 | G | A | 0.0000 | |
| 166 | L | A | 0.0000 | |
| 167 | C | A | -1.5486 | |
| 168 | K | A | -1.8583 | |
| 169 | A | A | -1.3059 | |
| 170 | G | A | -1.8491 | |
| 171 | K | A | -2.2776 | |
| 172 | L | A | -2.1680 | |
| 173 | D | A | -2.8645 | |
| 174 | E | A | -2.9323 | |
| 175 | A | A | 0.0000 | |
| 176 | L | A | -1.8486 | |
| 177 | K | A | -2.7851 | |
| 178 | L | A | 0.0000 | |
| 179 | F | A | -1.3387 | |
| 180 | E | A | -2.5249 | |
| 181 | E | A | -1.8530 | |
| 182 | M | A | 0.0000 | |
| 183 | V | A | -0.6766 | |
| 184 | E | A | -2.2753 | |
| 185 | K | A | -1.8800 | |
| 186 | G | A | -1.3551 | |
| 187 | I | A | -0.8351 | |
| 188 | K | A | -1.6494 | |
| 189 | P | A | -0.6032 | |
| 190 | D | A | -0.4305 | |
| 191 | V | A | -0.1389 | |
| 192 | Y | A | 0.8649 | mutated: VA192Y |
| 193 | T | A | 0.0000 | |
| 194 | Y | A | 0.0000 | |
| 195 | S | A | 0.0000 | |
| 196 | T | A | 0.0000 | |
| 197 | L | A | 0.0000 | |
| 198 | I | A | 0.0000 | |
| 199 | D | A | 0.0000 | |
| 200 | G | A | 0.0000 | |
| 201 | L | A | 0.0000 | |
| 202 | C | A | -1.8477 | |
| 203 | K | A | -2.3860 | |
| 204 | A | A | -1.5365 | |
| 205 | G | A | -1.9960 | |
| 206 | K | A | -2.2674 | |
| 207 | L | A | -2.1054 | |
| 208 | D | A | -2.9448 | |
| 209 | E | A | -3.1577 | |
| 210 | A | A | 0.0000 | |
| 211 | L | A | -1.9192 | |
| 212 | K | A | -3.1396 | |
| 213 | L | A | -1.8195 | |
| 214 | F | A | -1.9975 | |
| 215 | E | A | -3.1847 | |
| 216 | E | A | -2.9127 | |
| 217 | M | A | 0.0000 | |
| 218 | V | A | -2.1230 | |
| 219 | E | A | -3.3364 | |
| 220 | K | A | -3.2276 | |
| 221 | G | A | -2.3307 | |
| 222 | I | A | -1.6429 | |
| 223 | K | A | -2.0049 | |
| 224 | P | A | 0.0000 | |
| 225 | N | A | -0.7759 | |
| 226 | V | A | -0.1632 | |
| 227 | V | A | 0.0000 | |
| 228 | T | A | 0.0000 | |
| 229 | Y | A | 0.2471 | |
| 230 | S | A | 0.0000 | |
| 231 | T | A | 0.0000 | |
| 232 | L | A | 0.0000 | |
| 233 | I | A | 0.0000 | |
| 234 | D | A | -1.1241 | |
| 235 | G | A | 0.0000 | |
| 236 | L | A | 0.0000 | |
| 237 | C | A | 0.0000 | |
| 238 | K | A | -2.7643 | |
| 239 | A | A | -1.5705 | |
| 240 | G | A | -1.9991 | |
| 241 | K | A | -2.3273 | |
| 242 | L | A | -2.0871 | |
| 243 | D | A | -2.9028 | |
| 244 | E | A | -2.7510 | |
| 245 | A | A | 0.0000 | |
| 246 | L | A | -1.8220 | |
| 247 | K | A | -2.8092 | |
| 248 | L | A | -1.4861 | |
| 249 | F | A | 0.0000 | |
| 250 | E | A | -2.3529 | |
| 252 | M | A | -1.5212 | |
| 255 | K | A | -2.2551 | |
| 256 | G | A | -1.8266 | |
| 257 | I | A | -1.4467 | |
| 258 | K | A | -1.9533 | |
| 259 | P | A | -1.1052 | |
| 260 | N | A | -0.7473 | |
| 261 | V | A | 0.0257 | |
| 262 | Y | A | 0.7067 | mutated: VA262Y |
| 263 | T | A | 0.0000 | |
| 264 | Y | A | 0.0000 | |
| 265 | N | A | 0.0000 | |
| 266 | T | A | 0.0000 | |
| 267 | L | A | 0.0000 | |
| 268 | I | A | 0.0000 | |
| 269 | D | A | -2.4053 | |
| 270 | G | A | 0.0000 | |
| 271 | L | A | 0.0000 | |
| 272 | C | A | 0.0000 | |
| 273 | K | A | -3.0463 | |
| 274 | A | A | -1.8334 | |
| 275 | G | A | -2.1981 | |
| 276 | K | A | -2.6773 | |
| 277 | L | A | 0.0000 | |
| 278 | D | A | -3.1794 | |
| 279 | E | A | -3.5225 | |
| 280 | A | A | 0.0000 | |
| 281 | L | A | -2.0309 | |
| 282 | K | A | -2.8245 | |
| 283 | L | A | 0.0000 | |
| 284 | F | A | -1.5725 | |
| 285 | E | A | -2.3989 | |
| 286 | E | A | -1.4601 | |
| 287 | M | A | -0.1597 | |
| 290 | K | A | -2.1913 | |
| 291 | G | A | -1.5682 | |
| 292 | I | A | -1.5156 | |
| 293 | K | A | -2.3768 | |
| 294 | P | A | -1.5733 | |
| 295 | D | A | -1.8869 | |
| 296 | V | A | -0.1669 | |
| 297 | V | A | 1.1283 | |
| 298 | T | A | 0.0000 | |
| 299 | Y | A | 0.0000 | |
| 300 | N | A | -0.0547 | |
| 301 | T | A | -0.5090 | |
| 302 | L | A | 0.0000 | |
| 303 | I | A | 0.0000 | |
| 304 | D | A | -2.2356 | |
| 305 | G | A | 0.0000 | |
| 306 | L | A | 0.0000 | |
| 307 | C | A | 0.0000 | |
| 308 | K | A | -2.8161 | |
| 309 | A | A | -1.7142 | |
| 310 | G | A | -2.0686 | |
| 311 | K | A | -2.3786 | |
| 312 | L | A | -2.1833 | |
| 313 | D | A | -2.8829 | |
| 314 | E | A | -2.8587 | |
| 315 | A | A | 0.0000 | |
| 316 | L | A | -1.8990 | |
| 317 | K | A | -3.1299 | |
| 318 | L | A | 0.0000 | |
| 319 | F | A | -1.7851 | |
| 320 | E | A | -2.8962 | |
| 321 | E | A | -2.5987 | |
| 322 | M | A | 0.0000 | |
| 323 | V | A | -1.1495 | |
| 324 | E | A | -2.7361 | |
| 325 | K | A | -2.7710 | |
| 326 | G | A | -1.8476 | |
| 327 | I | A | 0.0000 | |
| 328 | K | A | -2.1692 | |
| 329 | P | A | 0.0000 | |
| 330 | D | A | -1.0399 | |
| 331 | V | A | -0.1972 | |
| 332 | Y | A | 1.2584 | mutated: VA332Y |
| 333 | T | A | 0.0000 | |
| 334 | Y | A | 0.0000 | |
| 335 | N | A | 0.0000 | |
| 336 | T | A | -0.2167 | |
| 337 | L | A | 0.0000 | |
| 338 | I | A | 0.0000 | |
| 339 | D | A | -1.0928 | |
| 340 | G | A | -1.6350 | |
| 341 | L | A | 0.0000 | |
| 342 | C | A | 0.0000 | |
| 343 | K | A | -2.3803 | |
| 344 | A | A | -1.5786 | |
| 345 | G | A | -2.0241 | |
| 346 | K | A | -2.4071 | |
| 347 | L | A | -2.0526 | |
| 348 | D | A | -2.8721 | |
| 349 | E | A | -2.7941 | |
| 350 | A | A | 0.0000 | |
| 351 | L | A | -2.0884 | |
| 352 | K | A | -3.0227 | |
| 353 | L | A | 0.0000 | |
| 354 | F | A | 0.0000 | |
| 355 | E | A | -2.7141 | |
| 356 | E | A | -2.2799 | |
| 357 | M | A | 0.0000 | |
| 358 | V | A | -0.8423 | |
| 359 | E | A | -2.5551 | |
| 360 | K | A | -2.4599 | |
| 361 | G | A | -1.5304 | |
| 362 | I | A | -1.3065 | |
| 363 | K | A | -1.9027 | |
| 364 | P | A | 0.0000 | |
| 365 | D | A | -0.2955 | |
| 366 | V | A | 0.3194 | |
| 367 | Y | A | 1.2039 | mutated: VA367Y |
| 368 | T | A | 0.0000 | |
| 369 | Y | A | 0.0000 | |
| 370 | N | A | 0.1146 | |
| 371 | T | A | 0.0000 | |
| 372 | L | A | 0.0000 | |
| 373 | I | A | 0.0000 | |
| 374 | D | A | -0.9165 | |
| 375 | G | A | 0.0000 | |
| 376 | L | A | 0.0000 | |
| 377 | C | A | -1.1820 | |
| 378 | K | A | -1.9933 | |
| 379 | A | A | -1.2358 | |
| 380 | G | A | -1.0172 | |
| 382 | L | A | -0.8206 | |
| 383 | D | A | -2.1335 | |
| 384 | E | A | -2.2660 | |
| 385 | A | A | 0.0000 | |
| 386 | L | A | -1.3891 | |
| 387 | K | A | -2.9147 | |
| 388 | L | A | 0.0000 | |
| 389 | F | A | -1.2633 | |
| 390 | E | A | -2.4500 | |
| 391 | E | A | -1.9212 | |
| 392 | M | A | 0.0000 | |
| 393 | V | A | -0.7044 | |
| 394 | E | A | -2.2918 | |
| 395 | K | A | -2.1212 | |
| 396 | G | A | -1.3519 | |
| 397 | I | A | -1.1369 | |
| 398 | K | A | -1.7156 | |
| 399 | P | A | -0.7638 | |
| 400 | D | A | -1.4869 | |
| 401 | E | A | -2.1401 | |
| 402 | L | A | -0.7491 | |
| 403 | T | A | 0.0000 | |
| 404 | Y | A | -0.9361 | |
| 405 | R | A | -2.2378 | |
| 406 | R | A | -1.3754 | |
| 407 | V | A | 0.0000 | |
| 408 | Y | A | 0.3947 | mutated: VA408Y |
| 409 | E | A | -1.3656 | |
| 411 | Y | A | 1.0859 |
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