| Chain sequence(s) |
A: QVQLVQSGAEVKKPGASVKVSCKASGLTIEDYYMHWVRQAPGQGLEWMGWIDPENGDTEYGPKFQGRVTMTRDTSINTAYMELSRLRSDDTAVYYCAVHNAHYGTWFAYWGQGTLVTVSSASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKKVEPKSCEAAAKEAAAKGLPTSNPAQELEARQLGRTTRDDLINGNSASCADVIFIYARGSTETGNLGTLGPSIASNLESAFGKDGVWIQGVGGAYRATLGDNALPRGTSSAAIREMLGLFQQANTKCPDATLIAGGYSQGAALAAASIEDLDSAIRDKIAGTVLFGYTKNLQNRGRIPNYPADRTKVFCNTGDLVCTGSLIVAAPHLAYGPDARGPAPEFLIEKVRAVRGSA
B: DVVMTQSPLSLPVTLGQPASISCRSSQSLLHSSGNTYLEWYQQRPGQSPRPLIYKISTRFSGVPDRFSGSGSGTDFTLKISRVEAEDVGVYYCFQGSHVPYTFGGGTKVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGEC input PDB |
| Selected Chain(s) | A,B |
| 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 all 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 (00:10:52)
[INFO] Main: Simulation completed successfully. (00:10:58)
|
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 | Q | A | -1.5495 | |
| 2 | V | A | -1.0672 | |
| 3 | Q | A | -1.4401 | |
| 4 | L | A | 0.0000 | |
| 5 | V | A | 0.1751 | |
| 6 | Q | A | 0.0000 | |
| 7 | S | A | -0.5385 | |
| 8 | G | A | -0.9583 | |
| 9 | A | A | -0.9576 | |
| 10 | E | A | -1.5513 | |
| 11 | V | A | -0.8876 | |
| 12 | K | A | -1.6518 | |
| 13 | K | A | -2.5324 | |
| 14 | P | A | -2.3509 | |
| 15 | G | A | -1.9685 | |
| 16 | A | A | -1.5940 | |
| 17 | S | A | -1.6754 | |
| 18 | V | A | 0.0000 | |
| 19 | K | A | -1.9880 | |
| 20 | V | A | 0.0000 | |
| 21 | S | A | -0.5145 | |
| 22 | C | A | 0.0000 | |
| 23 | K | A | -0.4854 | |
| 24 | A | A | 0.0000 | |
| 25 | S | A | -0.7714 | |
| 26 | G | A | -1.0717 | |
| 27 | L | A | -0.8573 | |
| 28 | T | A | -0.8570 | |
| 29 | I | A | 0.0000 | |
| 30 | E | A | -2.7699 | |
| 31 | D | A | -2.4263 | |
| 32 | Y | A | -1.1586 | |
| 33 | Y | A | -0.4693 | |
| 34 | M | A | 0.0000 | |
| 35 | H | A | 0.0000 | |
| 36 | W | A | 0.0000 | |
| 37 | V | A | 0.0000 | |
| 38 | R | A | 0.0000 | |
| 39 | Q | A | -0.5845 | |
| 40 | A | A | -0.9869 | |
| 41 | P | A | -0.9972 | |
| 42 | G | A | -1.2131 | |
| 43 | Q | A | -1.7340 | |
| 44 | G | A | -1.0911 | |
| 45 | L | A | 0.0000 | |
| 46 | E | A | -0.6665 | |
| 47 | W | A | 0.0000 | |
| 48 | M | A | 0.0000 | |
| 49 | G | A | 0.0000 | |
| 50 | W | A | -0.2560 | |
| 51 | I | A | 0.0000 | |
| 52 | D | A | -2.1117 | |
| 53 | P | A | 0.0000 | |
| 54 | E | A | -3.5300 | |
| 55 | N | A | -3.0061 | |
| 56 | G | A | -2.4517 | |
| 57 | D | A | -2.6466 | |
| 58 | T | A | -1.2737 | |
| 59 | E | A | -0.8510 | |
| 60 | Y | A | -0.6659 | |
| 61 | G | A | 0.0000 | |
| 62 | P | A | -1.5758 | |
| 63 | K | A | -2.2358 | |
| 64 | F | A | 0.0000 | |
| 65 | Q | A | -2.1007 | |
| 66 | G | A | -1.6282 | |
| 67 | R | A | -1.6272 | |
| 68 | V | A | 0.0000 | |
| 69 | T | A | -0.7389 | |
| 70 | M | A | 0.0000 | |
| 71 | T | A | -0.7527 | |
| 72 | R | A | -1.3641 | |
| 73 | D | A | -0.8625 | |
| 74 | T | A | -0.7358 | |
| 75 | S | A | 0.3296 | |
| 76 | I | A | 1.2933 | |
| 77 | N | A | -0.0637 | |
| 78 | T | A | 0.0000 | |
| 79 | A | A | 0.0000 | |
| 80 | Y | A | -0.6552 | |
| 81 | M | A | 0.0000 | |
| 82 | E | A | -1.2462 | |
| 83 | L | A | 0.0000 | |
| 84 | S | A | -1.7663 | |
| 85 | R | A | -2.6887 | |
| 86 | L | A | 0.0000 | |
| 87 | R | A | -3.2065 | |
| 88 | S | A | -2.2323 | |
| 89 | D | A | -2.4758 | |
| 90 | D | A | 0.0000 | |
| 91 | T | A | -0.9362 | |
| 92 | A | A | 0.0000 | |
| 93 | V | A | 0.2308 | |
| 94 | Y | A | 0.0000 | |
| 95 | Y | A | 0.0000 | |
| 96 | C | A | 0.0000 | |
| 97 | A | A | 0.0000 | |
| 98 | V | A | 0.0000 | |
| 99 | H | A | 0.1174 | |
| 100 | N | A | 0.0000 | |
| 101 | A | A | -0.1494 | |
| 102 | H | A | -0.5376 | |
| 103 | Y | A | 0.7516 | |
| 104 | G | A | 0.1625 | |
| 105 | T | A | 0.0000 | |
| 106 | W | A | 0.4060 | |
| 107 | F | A | 0.0000 | |
| 108 | A | A | 0.0796 | |
| 109 | Y | A | -0.1848 | |
| 110 | W | A | -0.4010 | |
| 111 | G | A | 0.0000 | |
| 112 | Q | A | -1.3040 | |
| 113 | G | A | -0.5218 | |
| 114 | T | A | 0.0000 | |
| 115 | L | A | -0.1478 | |
| 116 | V | A | 0.0000 | |
| 117 | T | A | -0.9671 | |
| 118 | V | A | 0.0000 | |
| 119 | S | A | -1.1578 | |
| 120 | S | A | -0.9471 | |
| 121 | A | A | -0.5947 | |
| 122 | S | A | -0.6698 | |
| 123 | T | A | -0.7250 | |
| 124 | K | A | -1.1502 | |
| 125 | G | A | -1.3612 | |
| 126 | P | A | 0.0000 | |
| 127 | S | A | -0.4123 | |
| 128 | V | A | 0.0000 | |
| 129 | F | A | 0.0000 | |
| 130 | P | A | -1.2251 | |
| 131 | L | A | 0.0000 | |
| 132 | A | A | -1.1235 | |
| 133 | P | A | 0.0000 | |
| 134 | S | A | -0.9542 | |
| 135 | S | A | -0.6880 | |
| 136 | K | A | -1.2512 | |
| 137 | S | A | 0.0000 | |
| 138 | T | A | -0.7371 | |
| 139 | S | A | -0.7153 | |
| 140 | G | A | -0.7805 | |
| 141 | G | A | -0.8200 | |
| 142 | T | A | -0.5721 | |
| 143 | A | A | 0.0000 | |
| 144 | A | A | 0.0000 | |
| 145 | L | A | 0.0000 | |
| 146 | G | A | 0.0000 | |
| 147 | C | A | 0.0000 | |
| 148 | L | A | 0.0000 | |
| 149 | V | A | 0.0000 | |
| 150 | K | A | 0.0000 | |
| 151 | D | A | -0.3609 | |
| 152 | Y | A | 0.0000 | |
| 153 | F | A | 0.0000 | |
| 154 | P | A | 0.0000 | |
| 155 | E | A | -0.4605 | |
| 156 | P | A | -0.7760 | |
| 157 | V | A | -0.7895 | |
| 158 | T | A | -0.7529 | |
| 159 | V | A | -0.2704 | |
| 160 | S | A | -0.3941 | |
| 161 | W | A | 0.0000 | |
| 162 | N | A | -0.6095 | |
| 163 | S | A | -0.5722 | |
| 164 | G | A | -0.4692 | |
| 165 | A | A | -0.2142 | |
| 166 | L | A | 0.0443 | |
| 167 | T | A | -0.1436 | |
| 168 | S | A | -0.1545 | |
| 169 | G | A | -0.1684 | |
| 170 | V | A | 0.2055 | |
| 171 | H | A | -0.1972 | |
| 172 | T | A | 0.0147 | |
| 173 | F | A | 0.0000 | |
| 174 | P | A | -0.3039 | |
| 175 | A | A | 0.1966 | |
| 176 | V | A | 0.4502 | |
| 177 | L | A | 1.1997 | |
| 178 | Q | A | 0.3039 | |
| 179 | S | A | -0.0585 | |
| 180 | S | A | -0.2068 | |
| 181 | G | A | 0.0392 | |
| 182 | L | A | 0.1621 | |
| 183 | Y | A | 0.5001 | |
| 184 | S | A | 0.0000 | |
| 185 | L | A | 0.0000 | |
| 186 | S | A | 0.0000 | |
| 187 | S | A | 0.0000 | |
| 188 | V | A | 0.0000 | |
| 189 | V | A | 0.0000 | |
| 190 | T | A | -0.1126 | |
| 191 | V | A | 0.0000 | |
| 192 | P | A | -0.5533 | |
| 193 | S | A | -0.1904 | |
| 194 | S | A | 0.3580 | |
| 195 | S | A | -0.1677 | |
| 196 | L | A | -0.4480 | |
| 197 | G | A | -0.1973 | |
| 198 | T | A | -0.1403 | |
| 199 | Q | A | -1.1223 | |
| 200 | T | A | -1.0019 | |
| 201 | Y | A | 0.0000 | |
| 202 | I | A | -0.9476 | |
| 203 | C | A | 0.0000 | |
| 204 | N | A | -1.3635 | |
| 205 | V | A | 0.0000 | |
| 206 | N | A | -2.4197 | |
| 207 | H | A | 0.0000 | |
| 208 | K | A | -3.0634 | |
| 209 | P | A | -1.8916 | |
| 210 | S | A | -1.9585 | |
| 211 | N | A | -2.6542 | |
| 212 | T | A | -2.2066 | |
| 213 | K | A | -2.8176 | |
| 214 | V | A | -1.4635 | |
| 215 | D | A | -2.0134 | |
| 216 | K | A | -1.7352 | |
| 217 | K | A | -2.0641 | |
| 218 | V | A | 0.0000 | |
| 219 | E | A | -2.6778 | |
| 220 | P | A | -1.6642 | |
| 221 | K | A | -2.0053 | |
| 222 | S | A | -1.2186 | |
| 223 | C | A | -0.8581 | |
| 224 | E | A | -2.1657 | |
| 225 | A | A | -1.8030 | |
| 226 | A | A | -1.9062 | |
| 227 | A | A | -1.8274 | |
| 228 | K | A | -3.0479 | |
| 229 | E | A | -3.2264 | |
| 230 | A | A | -1.8842 | |
| 231 | A | A | -1.5061 | |
| 232 | A | A | -1.7505 | |
| 233 | K | A | -2.1139 | |
| 234 | G | A | -0.7808 | |
| 235 | L | A | 0.4843 | |
| 236 | P | A | -0.1508 | |
| 237 | T | A | -0.3369 | |
| 238 | S | A | -1.0745 | |
| 239 | N | A | -1.5095 | |
| 240 | P | A | -1.4267 | |
| 241 | A | A | -1.1649 | |
| 242 | Q | A | -1.8581 | |
| 243 | E | A | -2.2927 | |
| 244 | L | A | -0.8984 | |
| 245 | E | A | -2.1921 | |
| 246 | A | A | -1.9038 | |
| 247 | R | A | -2.7375 | |
| 248 | Q | A | -2.3634 | |
| 249 | L | A | -1.0914 | |
| 250 | G | A | -2.0136 | |
| 251 | R | A | -2.7462 | |
| 252 | T | A | 0.0000 | |
| 253 | T | A | -1.1206 | |
| 254 | R | A | -0.9921 | |
| 255 | D | A | -0.6739 | |
| 256 | D | A | -0.8811 | |
| 257 | L | A | 0.0000 | |
| 258 | I | A | 0.5465 | |
| 259 | N | A | -1.0485 | |
| 260 | G | A | -1.0183 | |
| 261 | N | A | -1.5201 | |
| 262 | S | A | -1.0793 | |
| 263 | A | A | -0.5474 | |
| 264 | S | A | -1.0098 | |
| 265 | C | A | -1.2489 | |
| 266 | A | A | 0.0000 | |
| 267 | D | A | -2.2259 | |
| 268 | V | A | 0.0000 | |
| 269 | I | A | 0.0000 | |
| 270 | F | A | 0.0000 | |
| 271 | I | A | 0.0000 | |
| 272 | Y | A | 0.0000 | |
| 273 | A | A | 0.0000 | |
| 274 | R | A | 0.0000 | |
| 275 | G | A | 0.0000 | |
| 276 | S | A | -0.0992 | |
| 277 | T | A | -0.4270 | |
| 278 | E | A | -0.7719 | |
| 279 | T | A | -0.3537 | |
| 280 | G | A | -0.5341 | |
| 281 | N | A | 0.0000 | |
| 282 | L | A | 0.0000 | |
| 283 | G | A | 0.0000 | |
| 284 | T | A | -0.0156 | |
| 285 | L | A | 0.0000 | |
| 286 | G | A | 0.0000 | |
| 287 | P | A | -1.0922 | |
| 288 | S | A | -1.1096 | |
| 289 | I | A | 0.0000 | |
| 290 | A | A | 0.0000 | |
| 291 | S | A | -1.1959 | |
| 292 | N | A | -1.2181 | |
| 293 | L | A | 0.0000 | |
| 294 | E | A | 0.0000 | |
| 295 | S | A | -0.6948 | |
| 296 | A | A | -0.4868 | |
| 297 | F | A | -0.8674 | |
| 298 | G | A | -1.5302 | |
| 299 | K | A | -2.6401 | |
| 300 | D | A | -2.8735 | |
| 301 | G | A | -1.8608 | |
| 302 | V | A | 0.0000 | |
| 303 | W | A | -0.9436 | |
| 304 | I | A | 0.0000 | |
| 305 | Q | A | 0.0000 | |
| 306 | G | A | 0.0000 | |
| 307 | V | A | 0.0000 | |
| 308 | G | A | -0.9747 | |
| 309 | G | A | -1.0130 | |
| 310 | A | A | -1.2179 | |
| 311 | Y | A | 0.0000 | |
| 312 | R | A | -1.8579 | |
| 313 | A | A | 0.0000 | |
| 314 | T | A | -0.1589 | |
| 315 | L | A | 0.8807 | |
| 316 | G | A | 0.2133 | |
| 317 | D | A | -0.2603 | |
| 318 | N | A | 0.2711 | |
| 319 | A | A | 0.3236 | |
| 320 | L | A | 0.1113 | |
| 321 | P | A | -0.3200 | |
| 322 | R | A | -0.7083 | |
| 323 | G | A | 0.0000 | |
| 324 | T | A | 0.0000 | |
| 325 | S | A | -0.7966 | |
| 326 | S | A | -0.8189 | |
| 327 | A | A | -1.0855 | |
| 328 | A | A | 0.0000 | |
| 329 | I | A | 0.0000 | |
| 330 | R | A | -2.2643 | |
| 331 | E | A | -1.6675 | |
| 332 | M | A | 0.0000 | |
| 333 | L | A | -1.4894 | |
| 334 | G | A | -1.3525 | |
| 335 | L | A | 0.0000 | |
| 336 | F | A | 0.0000 | |
| 337 | Q | A | -1.6769 | |
| 338 | Q | A | -0.8690 | |
| 339 | A | A | 0.0000 | |
| 340 | N | A | -1.3376 | |
| 341 | T | A | -1.0497 | |
| 342 | K | A | -1.0338 | |
| 343 | C | A | 0.0000 | |
| 344 | P | A | -1.6706 | |
| 345 | D | A | -2.3377 | |
| 346 | A | A | 0.0000 | |
| 347 | T | A | 0.0000 | |
| 348 | L | A | 0.0000 | |
| 349 | I | A | 0.0000 | |
| 350 | A | A | 0.0000 | |
| 351 | G | A | 0.0000 | |
| 352 | G | A | 0.0000 | |
| 353 | Y | A | 0.0000 | |
| 354 | S | A | 0.0000 | |
| 355 | Q | A | 0.0000 | |
| 356 | G | A | 0.0000 | |
| 357 | A | A | 0.0000 | |
| 358 | A | A | 0.0000 | |
| 359 | L | A | 0.0000 | |
| 360 | A | A | 0.0000 | |
| 361 | A | A | 0.0000 | |
| 362 | A | A | 0.0000 | |
| 363 | S | A | 0.0000 | |
| 364 | I | A | 0.0000 | |
| 365 | E | A | -1.9301 | |
| 366 | D | A | -2.4073 | |
| 367 | L | A | 0.0000 | |
| 368 | D | A | -2.6069 | |
| 369 | S | A | -2.0472 | |
| 370 | A | A | -1.2990 | |
| 371 | I | A | 0.0000 | |
| 372 | R | A | 0.0000 | |
| 373 | D | A | -2.3215 | |
| 374 | K | A | -1.4331 | |
| 375 | I | A | 0.0000 | |
| 376 | A | A | 0.0000 | |
| 377 | G | A | 0.0000 | |
| 378 | T | A | 0.0000 | |
| 379 | V | A | 0.0000 | |
| 380 | L | A | 0.0000 | |
| 381 | F | A | 0.0000 | |
| 382 | G | A | 0.0000 | |
| 383 | Y | A | 0.0000 | |
| 384 | T | A | 0.0000 | |
| 385 | K | A | -1.1180 | |
| 386 | N | A | -1.1890 | |
| 387 | L | A | -0.8923 | |
| 388 | Q | A | -1.6878 | |
| 389 | N | A | -2.0063 | |
| 390 | R | A | -2.5760 | |
| 391 | G | A | -1.7794 | |
| 392 | R | A | -2.7197 | |
| 393 | I | A | 0.0000 | |
| 394 | P | A | -1.7558 | |
| 395 | N | A | -1.9506 | |
| 396 | Y | A | 0.0000 | |
| 397 | P | A | -1.5460 | |
| 398 | A | A | -1.6383 | |
| 399 | D | A | -2.3051 | |
| 400 | R | A | -1.5867 | |
| 401 | T | A | 0.0000 | |
| 402 | K | A | -0.9257 | |
| 403 | V | A | -0.1534 | |
| 404 | F | A | 0.0000 | |
| 405 | C | A | 0.0652 | |
| 406 | N | A | -0.0889 | |
| 407 | T | A | -0.3118 | |
| 408 | G | A | -0.2360 | |
| 409 | D | A | 0.0000 | |
| 410 | L | A | 1.1094 | |
| 411 | V | A | 0.0000 | |
| 412 | C | A | 0.0000 | |
| 413 | T | A | 0.0328 | |
| 414 | G | A | 0.0651 | |
| 415 | S | A | 0.9614 | |
| 416 | L | A | 1.5792 | |
| 417 | I | A | 1.8912 | |
| 418 | V | A | 2.1621 | |
| 419 | A | A | 1.1848 | |
| 420 | A | A | 0.6748 | |
| 421 | P | A | 0.5758 | |
| 422 | H | A | 0.0000 | |
| 423 | L | A | 1.7197 | |
| 424 | A | A | 0.6326 | |
| 425 | Y | A | 0.0000 | |
| 426 | G | A | -0.4875 | |
| 427 | P | A | -1.0673 | |
| 428 | D | A | -1.2516 | |
| 429 | A | A | 0.0000 | |
| 430 | R | A | -2.4653 | |
| 431 | G | A | -1.7021 | |
| 432 | P | A | -1.2700 | |
| 433 | A | A | 0.0000 | |
| 434 | P | A | 0.0000 | |
| 435 | E | A | -2.5634 | |
| 436 | F | A | -1.5916 | |
| 437 | L | A | 0.0000 | |
| 438 | I | A | -1.6489 | |
| 439 | E | A | -2.5315 | |
| 440 | K | A | -1.7380 | |
| 441 | V | A | 0.0000 | |
| 442 | R | A | -1.6667 | |
| 443 | A | A | -0.6175 | |
| 444 | V | A | 0.5502 | |
| 445 | R | A | -0.7096 | |
| 446 | G | A | -0.8762 | |
| 447 | S | A | -0.8745 | |
| 448 | A | A | -0.4489 | |
| 1 | D | B | -1.2734 | |
| 2 | V | B | 0.0000 | |
| 3 | V | B | 0.7161 | |
| 4 | M | B | 0.0000 | |
| 5 | T | B | -0.4024 | |
| 6 | Q | B | 0.0000 | |
| 7 | S | B | -0.1549 | |
| 8 | P | B | 0.4175 | |
| 9 | L | B | 1.2217 | |
| 10 | S | B | 0.3588 | |
| 11 | L | B | 0.0616 | |
| 12 | P | B | -0.5753 | |
| 13 | V | B | 0.0000 | |
| 14 | T | B | -1.0499 | |
| 15 | L | B | -0.6533 | |
| 16 | G | B | -1.2634 | |
| 17 | Q | B | -1.7337 | |
| 18 | P | B | -1.8630 | |
| 19 | A | B | 0.0000 | |
| 20 | S | B | -0.8421 | |
| 21 | I | B | 0.0000 | |
| 22 | S | B | -0.9297 | |
| 23 | C | B | 0.0000 | |
| 24 | R | B | -2.2696 | |
| 25 | S | B | 0.0000 | |
| 26 | S | B | -0.8789 | |
| 27 | Q | B | -1.1959 | |
| 28 | S | B | -0.6586 | |
| 29 | L | B | 0.0000 | |
| 30 | L | B | 0.8455 | |
| 31 | H | B | -0.1012 | |
| 32 | S | B | -0.3642 | |
| 33 | S | B | -0.5058 | |
| 34 | G | B | -0.5116 | |
| 35 | N | B | -0.4381 | |
| 36 | T | B | 0.0000 | |
| 37 | Y | B | 0.0505 | |
| 38 | L | B | 0.0000 | |
| 39 | E | B | 0.0000 | |
| 40 | W | B | 0.0000 | |
| 41 | Y | B | 0.0000 | |
| 42 | Q | B | 0.0000 | |
| 43 | Q | B | 0.0000 | |
| 44 | R | B | -1.9524 | |
| 45 | P | B | -1.3418 | |
| 46 | G | B | -1.5749 | |
| 47 | Q | B | -2.2605 | |
| 48 | S | B | -1.6156 | |
| 49 | P | B | 0.0000 | |
| 50 | R | B | -2.0371 | |
| 51 | P | B | 0.0000 | |
| 52 | L | B | 0.0000 | |
| 53 | I | B | 0.0000 | |
| 54 | Y | B | -0.1723 | |
| 55 | K | B | -0.5665 | |
| 56 | I | B | -0.4407 | |
| 57 | S | B | -0.6344 | |
| 58 | T | B | -0.5920 | |
| 59 | R | B | -1.4784 | |
| 60 | F | B | 0.0000 | |
| 61 | S | B | -0.6397 | |
| 62 | G | B | -0.8863 | |
| 63 | V | B | -1.1071 | |
| 64 | P | B | -1.2796 | |
| 65 | D | B | -2.3766 | |
| 66 | R | B | -2.1273 | |
| 67 | F | B | 0.0000 | |
| 68 | S | B | -1.3784 | |
| 69 | G | B | 0.0000 | |
| 70 | S | B | -0.8789 | |
| 71 | G | B | -0.9921 | |
| 72 | S | B | -0.6489 | |
| 73 | G | B | -0.5835 | |
| 74 | T | B | -1.3634 | |
| 75 | D | B | -2.0834 | |
| 76 | F | B | 0.0000 | |
| 77 | T | B | -1.1195 | |
| 78 | L | B | 0.0000 | |
| 79 | K | B | -2.0379 | |
| 80 | I | B | 0.0000 | |
| 81 | S | B | -2.3236 | |
| 82 | R | B | -2.9664 | |
| 83 | V | B | 0.0000 | |
| 84 | E | B | -2.2439 | |
| 85 | A | B | -1.9656 | |
| 86 | E | B | -2.2390 | |
| 87 | D | B | 0.0000 | |
| 88 | V | B | 0.0000 | |
| 89 | G | B | 0.0000 | |
| 90 | V | B | 0.0044 | |
| 91 | Y | B | 0.0000 | |
| 92 | Y | B | 0.0000 | |
| 93 | C | B | 0.0000 | |
| 94 | F | B | 0.0000 | |
| 95 | Q | B | 0.0000 | |
| 96 | G | B | 0.0000 | |
| 97 | S | B | 0.0000 | |
| 98 | H | B | 0.0474 | |
| 99 | V | B | 0.7343 | |
| 100 | P | B | -0.1125 | |
| 101 | Y | B | 0.0000 | |
| 102 | T | B | 0.0526 | |
| 103 | F | B | 0.0000 | |
| 104 | G | B | 0.0000 | |
| 105 | G | B | -0.3287 | |
| 106 | G | B | 0.0000 | |
| 107 | T | B | 0.0000 | |
| 108 | K | B | -0.2075 | |
| 109 | V | B | 0.0000 | |
| 110 | E | B | -0.8193 | |
| 111 | I | B | 0.0000 | |
| 112 | K | B | -1.2528 | |
| 113 | R | B | -1.0054 | |
| 114 | T | B | -0.1705 | |
| 115 | V | B | 0.3159 | |
| 116 | A | B | -0.0208 | |
| 117 | A | B | -0.1216 | |
| 118 | P | B | 0.0000 | |
| 119 | S | B | -0.1984 | |
| 120 | V | B | 0.0000 | |
| 121 | F | B | 0.0000 | |
| 122 | I | B | 0.0000 | |
| 123 | F | B | 0.0000 | |
| 124 | P | B | -0.6034 | |
| 125 | P | B | 0.0000 | |
| 126 | S | B | -1.8428 | |
| 127 | D | B | -3.1797 | |
| 128 | E | B | -3.2186 | |
| 129 | Q | B | 0.0000 | |
| 130 | L | B | -2.3892 | |
| 131 | K | B | -2.9511 | |
| 132 | S | B | -1.8242 | |
| 133 | G | B | -1.2849 | |
| 134 | T | B | -0.9876 | |
| 135 | A | B | 0.0000 | |
| 136 | S | B | 0.0000 | |
| 137 | V | B | 0.0000 | |
| 138 | V | B | 0.0000 | |
| 139 | C | B | 0.0000 | |
| 140 | L | B | 0.0000 | |
| 141 | L | B | 0.0000 | |
| 142 | N | B | 0.0000 | |
| 143 | N | B | -0.8312 | |
| 144 | F | B | 0.0000 | |
| 145 | Y | B | 0.0000 | |
| 146 | P | B | -1.3940 | |
| 147 | R | B | -2.1744 | |
| 148 | E | B | -2.8691 | |
| 149 | A | B | -2.1471 | |
| 150 | K | B | -2.4498 | |
| 151 | V | B | -1.2828 | |
| 152 | Q | B | -0.9156 | |
| 153 | W | B | 0.0000 | |
| 154 | K | B | -0.5806 | |
| 155 | V | B | 0.0000 | |
| 156 | D | B | -1.8967 | |
| 157 | N | B | -1.5158 | |
| 158 | A | B | -0.2736 | |
| 159 | L | B | 0.6210 | |
| 160 | Q | B | -0.1799 | |
| 161 | S | B | -0.4489 | |
| 162 | G | B | -0.8826 | |
| 163 | N | B | -0.7749 | |
| 164 | S | B | -1.1562 | |
| 165 | Q | B | -1.4360 | |
| 166 | E | B | -1.9999 | |
| 167 | S | B | -0.9778 | |
| 168 | V | B | -0.5500 | |
| 169 | T | B | -0.6260 | |
| 170 | E | B | -1.3018 | |
| 171 | Q | B | 0.0000 | |
| 172 | D | B | -1.7782 | |
| 173 | S | B | -2.2023 | |
| 174 | K | B | -2.6935 | |
| 175 | D | B | -2.0163 | |
| 176 | S | B | 0.0000 | |
| 177 | T | B | 0.0000 | |
| 178 | Y | B | 0.0000 | |
| 179 | S | B | 0.0000 | |
| 180 | L | B | 0.0000 | |
| 181 | S | B | 0.0000 | |
| 182 | S | B | 0.0000 | |
| 183 | T | B | -0.6731 | |
| 184 | L | B | 0.0000 | |
| 185 | T | B | -0.3684 | |
| 186 | L | B | -0.5435 | |
| 187 | S | B | -0.9144 | |
| 188 | K | B | -1.9318 | |
| 189 | A | B | -1.7147 | |
| 190 | D | B | -2.1988 | |
| 191 | Y | B | 0.0000 | |
| 192 | E | B | -3.4602 | |
| 193 | K | B | -3.5261 | |
| 194 | H | B | -2.9165 | |
| 195 | K | B | -3.2284 | |
| 196 | V | B | -1.3953 | |
| 197 | Y | B | 0.0000 | |
| 198 | A | B | 0.0000 | |
| 199 | C | B | 0.0000 | |
| 200 | E | B | -0.8879 | |
| 201 | V | B | 0.0000 | |
| 202 | T | B | -1.2664 | |
| 203 | H | B | 0.0000 | |
| 204 | Q | B | -1.6951 | |
| 205 | G | B | -0.4397 | |
| 206 | L | B | -0.2370 | |
| 207 | S | B | -0.4520 | |
| 208 | S | B | -0.4178 | |
| 209 | P | B | -0.5998 | |
| 210 | V | B | 0.0955 | |
| 211 | T | B | -0.3724 | |
| 212 | K | B | -0.7237 | |
| 213 | S | B | -0.6445 | |
| 214 | F | B | 0.0000 | |
| 215 | N | B | -1.7510 | |
| 216 | R | B | -2.4153 | |
| 217 | G | B | -1.8734 | |
| 218 | E | B | -2.0473 | |
| 219 | C | B | -0.7986 |
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