| Chain sequence(s) |
A: TSLTITEPDVDDDSTSDMEAFMAGVLVRYRKTLIEKTKYHLGYPFNLDLDYGPLAELQHFAINNLGDPFIESNYGVHSRQFEVGVLDWFARLWEIEQKEYWGYITNGGTEGNLHGILIGREVFPDGIFYTSRESHYSIFKAARMYRMECVKVGTLINGEIDCADFKAKLLSNKDKPAIINLNIGTTVKGAVDDIDLVIQTLEECGFSHDRFYIHCDGALFGFMMPFLNRGPKITFKKPIGSVSVSGHKFMGCPTPCGVQITRLEHINALSRNVEYLASRDATITGSRNGHSPIILWYALNRKGFKGFQKEVQKCLRNAHYLKDRLREAGISAMLNELSSTVVFERPLDEEFVRRWQLACEGNMAHVIVMPNVTIEKLDEFLNELVQKRANWYNDGKAGPPCLAPDIGSENCDCDLHKLKH
B: TSLTITEPDVDDDSTSDMEAFMAGVLVRYRKTLIEKTKYHLGYPFNLDLDYGPLAELQHFAINNLGDPFIESNYGVHSRQFEVGVLDWFARLWEIEQKEYWGYITNGGTEGNLHGILIGREVFPDGIFYTSRESHYSIFKAARMYRMECVKVGTLINGEIDCADFKAKLLSNKDKPAIINLNIGTTVKGAVDDIDLVIQTLEECGFSHDRFYIHCDGALFGFMMPFLNRGPKITFKKPIGSVSVSGHKFMGCPTPCGVQITRLEHINALSRNVEYLASRDATITGSRNGHSPIILWYALNRKGFKGFQKEVQKCLRNAHYLKDRLREAGISAMLNELSSTVVFERPLDEEFVRRWQLACEGNMAHVIVMPNVTIEKLDEFLNELVQKRANWYNDGKAGPPCLAPDIGSENCDCDLHKLKH 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] (00:00:00)
[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 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 (00:16:37)
[INFO] Main: Simulation completed successfully. (00:16:47)
|
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 | T | A | -0.1100 | |
| 2 | S | A | -0.1246 | |
| 3 | L | A | 0.0885 | |
| 4 | T | A | -0.0656 | |
| 5 | I | A | -0.1402 | |
| 6 | T | A | -0.5275 | |
| 7 | E | A | -1.2924 | |
| 8 | P | A | -2.1357 | |
| 9 | D | A | -2.5874 | |
| 10 | V | A | -0.9325 | |
| 11 | D | A | -2.7540 | |
| 12 | D | A | -3.7879 | |
| 13 | D | A | -3.4088 | |
| 14 | S | A | -2.9122 | |
| 15 | T | A | -2.4406 | |
| 16 | S | A | -1.9933 | |
| 17 | D | A | -2.7153 | |
| 18 | M | A | -2.1563 | |
| 19 | E | A | -2.3323 | |
| 20 | A | A | -1.1864 | |
| 21 | F | A | -0.2311 | |
| 22 | M | A | 0.0000 | |
| 23 | A | A | -0.4062 | |
| 24 | G | A | -0.1225 | |
| 25 | V | A | -0.1382 | |
| 26 | L | A | 0.0000 | |
| 27 | V | A | -0.5282 | |
| 28 | R | A | -2.0387 | |
| 29 | Y | A | 0.0000 | |
| 30 | R | A | -1.7986 | |
| 31 | K | A | -2.3830 | |
| 32 | T | A | -1.7030 | |
| 33 | L | A | 0.0000 | |
| 34 | I | A | -0.7132 | |
| 35 | E | A | -2.5236 | |
| 36 | K | A | -2.1010 | |
| 37 | T | A | -1.5248 | |
| 38 | K | A | -2.2110 | |
| 39 | Y | A | -1.5973 | |
| 40 | H | A | 0.0000 | |
| 41 | L | A | 0.0000 | |
| 42 | G | A | 0.0000 | |
| 43 | Y | A | 0.0000 | |
| 44 | P | A | -0.1036 | |
| 45 | F | A | 0.0000 | |
| 46 | N | A | 0.0000 | |
| 47 | L | A | 0.0000 | |
| 48 | D | A | -2.4334 | |
| 49 | L | A | 0.0000 | |
| 50 | D | A | -2.5161 | |
| 51 | Y | A | 0.0000 | |
| 52 | G | A | -1.3289 | |
| 53 | P | A | -1.1370 | |
| 54 | L | A | 0.0000 | |
| 55 | A | A | -1.5212 | |
| 56 | E | A | -2.0564 | |
| 57 | L | A | 0.0000 | |
| 58 | Q | A | -1.3924 | |
| 59 | H | A | -1.8320 | |
| 60 | F | A | -0.6667 | |
| 61 | A | A | 0.0000 | |
| 62 | I | A | 0.0000 | |
| 63 | N | A | 0.0000 | |
| 64 | N | A | 0.0000 | |
| 65 | L | A | -0.1632 | |
| 66 | G | A | 0.0000 | |
| 67 | D | A | 0.0000 | |
| 68 | P | A | 0.0000 | |
| 69 | F | A | 0.4257 | |
| 70 | I | A | 0.2522 | |
| 71 | E | A | -1.3388 | |
| 72 | S | A | -0.8785 | |
| 73 | N | A | 0.0000 | |
| 74 | Y | A | 0.0000 | |
| 75 | G | A | -1.2458 | |
| 76 | V | A | 0.0000 | |
| 77 | H | A | -0.4853 | |
| 78 | S | A | 0.0000 | |
| 79 | R | A | -0.4999 | |
| 80 | Q | A | -0.5201 | |
| 81 | F | A | 0.0000 | |
| 82 | E | A | 0.0000 | |
| 83 | V | A | 0.0000 | |
| 84 | G | A | 0.0000 | |
| 85 | V | A | 0.0000 | |
| 86 | L | A | 0.0000 | |
| 87 | D | A | -1.1649 | |
| 88 | W | A | 0.0000 | |
| 89 | F | A | 0.0000 | |
| 90 | A | A | 0.0000 | |
| 91 | R | A | -2.5921 | |
| 92 | L | A | -0.8963 | |
| 93 | W | A | 0.0000 | |
| 94 | E | A | -2.1983 | |
| 95 | I | A | 0.0000 | |
| 96 | E | A | -3.8286 | |
| 97 | Q | A | -3.6170 | |
| 98 | K | A | -3.4225 | |
| 99 | E | A | -3.3798 | |
| 100 | Y | A | 0.0000 | |
| 101 | W | A | 0.0000 | |
| 102 | G | A | 0.0000 | |
| 103 | Y | A | 0.0000 | |
| 104 | I | A | 0.0000 | |
| 105 | T | A | 0.0000 | |
| 106 | N | A | 0.0000 | |
| 107 | G | A | 0.0000 | |
| 108 | G | A | -0.0848 | |
| 109 | T | A | 0.0000 | |
| 110 | E | A | 0.0000 | |
| 111 | G | A | 0.0000 | |
| 112 | N | A | 0.0000 | |
| 113 | L | A | 0.0000 | |
| 114 | H | A | 0.0000 | |
| 115 | G | A | 0.0000 | |
| 116 | I | A | 0.0000 | |
| 117 | L | A | 0.0000 | |
| 118 | I | A | 0.0000 | |
| 119 | G | A | 0.0000 | |
| 120 | R | A | 0.0000 | |
| 121 | E | A | -0.5416 | |
| 122 | V | A | -0.5189 | |
| 123 | F | A | -0.7022 | |
| 124 | P | A | -0.9515 | |
| 125 | D | A | -2.2224 | |
| 126 | G | A | 0.0000 | |
| 127 | I | A | 0.0000 | |
| 128 | F | A | 0.0000 | |
| 129 | Y | A | 0.0000 | |
| 130 | T | A | 0.0000 | |
| 131 | S | A | 0.0000 | |
| 132 | R | A | -2.2624 | |
| 133 | E | A | -1.3854 | |
| 134 | S | A | 0.0000 | |
| 135 | H | A | -0.3213 | |
| 136 | Y | A | -0.3479 | |
| 137 | S | A | 0.0000 | |
| 138 | I | A | 0.0000 | |
| 139 | F | A | -0.3414 | |
| 140 | K | A | -0.6092 | |
| 141 | A | A | 0.0000 | |
| 142 | A | A | 0.0000 | |
| 143 | R | A | -1.2982 | |
| 144 | M | A | 0.0000 | |
| 145 | Y | A | 0.0000 | |
| 146 | R | A | -1.4448 | |
| 147 | M | A | -1.5995 | |
| 148 | E | A | -2.2920 | |
| 149 | C | A | -1.1090 | |
| 150 | V | A | -1.1911 | |
| 151 | K | A | -2.4018 | |
| 152 | V | A | 0.0000 | |
| 153 | G | A | -0.9529 | |
| 154 | T | A | -0.3005 | |
| 155 | L | A | 1.0182 | |
| 156 | I | A | 1.2287 | |
| 157 | N | A | 0.2318 | |
| 158 | G | A | 0.0000 | |
| 159 | E | A | -0.4819 | |
| 160 | I | A | 0.0000 | |
| 161 | D | A | -0.3579 | |
| 162 | C | A | -0.5398 | |
| 163 | A | A | -0.5854 | |
| 164 | D | A | -1.1021 | |
| 165 | F | A | 0.0000 | |
| 166 | K | A | -1.4757 | |
| 167 | A | A | -0.8557 | |
| 168 | K | A | -1.2821 | |
| 169 | L | A | 0.0000 | |
| 170 | L | A | -0.9728 | |
| 171 | S | A | -1.1022 | |
| 172 | N | A | -1.7749 | |
| 173 | K | A | -2.7782 | |
| 174 | D | A | -3.0240 | |
| 175 | K | A | -2.6204 | |
| 176 | P | A | -1.9701 | |
| 177 | A | A | 0.0000 | |
| 178 | I | A | 0.0000 | |
| 179 | I | A | 0.0000 | |
| 180 | N | A | 0.0000 | |
| 181 | L | A | 0.0000 | |
| 182 | N | A | 0.0000 | |
| 183 | I | A | 0.0000 | |
| 184 | G | A | -0.0579 | |
| 185 | T | A | 0.0000 | |
| 186 | T | A | -0.0770 | |
| 187 | V | A | 0.0000 | |
| 188 | K | A | 0.0000 | |
| 189 | G | A | 0.0000 | |
| 190 | A | A | 0.0000 | |
| 191 | V | A | -0.5192 | |
| 192 | D | A | 0.0000 | |
| 193 | D | A | -1.6274 | |
| 194 | I | A | 0.0000 | |
| 195 | D | A | -1.8835 | |
| 196 | L | A | -0.4836 | |
| 197 | V | A | 0.0000 | |
| 198 | I | A | 0.0000 | |
| 199 | Q | A | -1.8939 | |
| 200 | T | A | 0.0000 | |
| 201 | L | A | 0.0000 | |
| 202 | E | A | -2.5211 | |
| 203 | E | A | -2.7855 | |
| 204 | C | A | -1.8829 | |
| 205 | G | A | -2.0768 | |
| 206 | F | A | 0.0000 | |
| 207 | S | A | -2.0415 | |
| 208 | H | A | -2.3598 | |
| 209 | D | A | -2.5030 | |
| 210 | R | A | -2.0109 | |
| 211 | F | A | 0.0000 | |
| 212 | Y | A | 0.0000 | |
| 213 | I | A | 0.0000 | |
| 214 | H | A | 0.0000 | |
| 215 | C | A | 0.0000 | |
| 216 | D | A | 0.0000 | |
| 217 | G | A | 0.0000 | |
| 218 | A | A | -0.0875 | |
| 219 | L | A | 0.0000 | |
| 220 | F | A | 0.0000 | |
| 221 | G | A | 0.0000 | |
| 222 | F | A | 0.0000 | |
| 223 | M | A | 0.0000 | |
| 224 | M | A | 0.0000 | |
| 225 | P | A | -0.8433 | |
| 226 | F | A | 0.0000 | |
| 227 | L | A | -1.5789 | |
| 228 | N | A | -2.3665 | |
| 229 | R | A | -3.0603 | |
| 230 | G | A | -2.3598 | |
| 231 | P | A | -1.9823 | |
| 232 | K | A | -2.7368 | |
| 233 | I | A | 0.0000 | |
| 234 | T | A | 0.0000 | |
| 235 | F | A | 0.0000 | |
| 236 | K | A | -2.1271 | |
| 237 | K | A | -1.6012 | |
| 238 | P | A | -1.1735 | |
| 239 | I | A | 0.0000 | |
| 240 | G | A | 0.0000 | |
| 241 | S | A | 0.0000 | |
| 242 | V | A | 0.0000 | |
| 243 | S | A | 0.0000 | |
| 244 | V | A | 0.0000 | |
| 245 | S | A | 0.0000 | |
| 246 | G | A | 0.0000 | |
| 247 | H | A | 0.0000 | |
| 248 | K | A | -0.2482 | |
| 249 | F | A | 0.0000 | |
| 250 | M | A | 0.0000 | |
| 251 | G | A | 0.0000 | |
| 252 | C | A | 0.0000 | |
| 253 | P | A | 0.0000 | |
| 254 | T | A | -0.0407 | |
| 255 | P | A | 0.0000 | |
| 256 | C | A | 0.0000 | |
| 257 | G | A | 0.0000 | |
| 258 | V | A | 0.0000 | |
| 259 | Q | A | 0.0000 | |
| 260 | I | A | 0.0000 | |
| 261 | T | A | 0.0000 | |
| 262 | R | A | -1.5323 | |
| 263 | L | A | -1.6275 | |
| 264 | E | A | -2.2409 | |
| 265 | H | A | -1.2863 | |
| 266 | I | A | 0.0000 | |
| 267 | N | A | -1.7780 | |
| 268 | A | A | -0.9124 | |
| 269 | L | A | 0.0000 | |
| 270 | S | A | -1.1922 | |
| 271 | R | A | -1.7067 | |
| 272 | N | A | -2.1782 | |
| 273 | V | A | 0.0000 | |
| 274 | E | A | -2.3890 | |
| 275 | Y | A | -1.0784 | |
| 276 | L | A | 0.0000 | |
| 277 | A | A | -1.1562 | |
| 278 | S | A | 0.0000 | |
| 279 | R | A | -1.4851 | |
| 280 | D | A | -1.0333 | |
| 281 | A | A | 0.0000 | |
| 282 | T | A | 0.0000 | |
| 283 | I | A | 0.0000 | |
| 284 | T | A | 0.0000 | |
| 285 | G | A | -0.0819 | |
| 286 | S | A | -0.0158 | |
| 287 | R | A | 0.0000 | |
| 288 | N | A | 0.0000 | |
| 289 | G | A | 0.0000 | |
| 290 | H | A | 0.0000 | |
| 291 | S | A | 0.0000 | |
| 292 | P | A | 0.0000 | |
| 293 | I | A | 0.0000 | |
| 294 | I | A | 0.0000 | |
| 295 | L | A | 0.0000 | |
| 296 | W | A | 0.0000 | |
| 297 | Y | A | 0.0000 | |
| 298 | A | A | 0.0000 | |
| 299 | L | A | 0.0000 | |
| 300 | N | A | 0.0000 | |
| 301 | R | A | -1.1913 | |
| 302 | K | A | -1.4485 | |
| 303 | G | A | 0.0000 | |
| 304 | F | A | -0.3103 | |
| 305 | K | A | -1.2292 | |
| 306 | G | A | -1.2340 | |
| 307 | F | A | 0.0000 | |
| 308 | Q | A | -1.8620 | |
| 309 | K | A | -2.8247 | |
| 310 | E | A | -2.3165 | |
| 311 | V | A | 0.0000 | |
| 312 | Q | A | -2.7459 | |
| 313 | K | A | -2.5339 | |
| 314 | C | A | 0.0000 | |
| 315 | L | A | 0.0000 | |
| 316 | R | A | -2.3754 | |
| 317 | N | A | 0.0000 | |
| 318 | A | A | 0.0000 | |
| 319 | H | A | -1.8348 | |
| 320 | Y | A | -1.1832 | |
| 321 | L | A | 0.0000 | |
| 322 | K | A | -1.8056 | |
| 323 | D | A | -2.5911 | |
| 324 | R | A | -2.2307 | |
| 325 | L | A | 0.0000 | |
| 326 | R | A | -2.1025 | |
| 327 | E | A | -2.7015 | |
| 328 | A | A | -1.4431 | |
| 329 | G | A | -1.2723 | |
| 330 | I | A | 0.0000 | |
| 331 | S | A | 0.0000 | |
| 332 | A | A | 0.0000 | |
| 333 | M | A | 0.0000 | |
| 334 | L | A | -0.7279 | |
| 335 | N | A | -1.0149 | |
| 336 | E | A | -2.0761 | |
| 337 | L | A | -1.1620 | |
| 338 | S | A | 0.0000 | |
| 339 | S | A | 0.0000 | |
| 340 | T | A | 0.0000 | |
| 341 | V | A | 0.0000 | |
| 342 | V | A | 0.0000 | |
| 343 | F | A | 0.0000 | |
| 344 | E | A | 0.0000 | |
| 345 | R | A | -1.2936 | |
| 346 | P | A | 0.0000 | |
| 347 | L | A | -0.0578 | |
| 348 | D | A | -1.7279 | |
| 349 | E | A | -2.9299 | |
| 350 | E | A | -3.1115 | |
| 351 | F | A | 0.0000 | |
| 352 | V | A | 0.0000 | |
| 353 | R | A | -2.2640 | |
| 354 | R | A | -2.3514 | |
| 355 | W | A | 0.0000 | |
| 356 | Q | A | 0.0000 | |
| 357 | L | A | 0.0000 | |
| 358 | A | A | 0.0000 | |
| 359 | C | A | 0.0000 | |
| 360 | E | A | -1.4648 | |
| 361 | G | A | -1.7078 | |
| 362 | N | A | -1.7000 | |
| 363 | M | A | 0.0000 | |
| 364 | A | A | 0.0000 | |
| 365 | H | A | 0.0000 | |
| 366 | V | A | 0.0000 | |
| 367 | I | A | 0.0000 | |
| 368 | V | A | 0.0000 | |
| 369 | M | A | 0.0000 | |
| 370 | P | A | 0.0000 | |
| 371 | N | A | -1.1797 | |
| 372 | V | A | 0.0000 | |
| 373 | T | A | -0.9237 | |
| 374 | I | A | -1.0355 | |
| 375 | E | A | -2.3584 | |
| 376 | K | A | -2.1549 | |
| 377 | L | A | 0.0000 | |
| 378 | D | A | -2.4472 | |
| 379 | E | A | -3.0024 | |
| 380 | F | A | 0.0000 | |
| 381 | L | A | 0.0000 | |
| 382 | N | A | -2.3654 | |
| 383 | E | A | -1.8648 | |
| 384 | L | A | 0.0000 | |
| 385 | V | A | -0.7267 | |
| 386 | Q | A | -1.8434 | |
| 387 | K | A | -1.5576 | |
| 388 | R | A | -1.1320 | |
| 389 | A | A | -1.4785 | |
| 390 | N | A | -2.1721 | |
| 391 | W | A | -1.3999 | |
| 392 | Y | A | -1.8779 | |
| 393 | N | A | -2.9940 | |
| 394 | D | A | -3.3828 | |
| 395 | G | A | -2.5714 | |
| 396 | K | A | -2.7520 | |
| 397 | A | A | -1.6413 | |
| 398 | G | A | -1.5864 | |
| 399 | P | A | -0.4778 | |
| 400 | P | A | -0.4827 | |
| 401 | C | A | -0.2094 | |
| 402 | L | A | 0.0000 | |
| 403 | A | A | -0.4629 | |
| 404 | P | A | -0.3793 | |
| 405 | D | A | -0.7240 | |
| 406 | I | A | 0.0000 | |
| 407 | G | A | -0.6541 | |
| 408 | S | A | -1.1694 | |
| 409 | E | A | -2.1372 | |
| 410 | N | A | 0.0000 | |
| 411 | C | A | 0.0000 | |
| 412 | D | A | -1.5129 | |
| 413 | C | A | 0.0000 | |
| 414 | D | A | -1.6851 | |
| 415 | L | A | 0.1108 | |
| 416 | H | A | -1.3797 | |
| 417 | K | A | -2.6586 | |
| 418 | L | A | -1.7939 | |
| 419 | K | A | -2.4012 | |
| 420 | H | A | -1.9039 | |
| 1 | T | B | -0.1041 | |
| 2 | S | B | -0.1168 | |
| 3 | L | B | 0.0854 | |
| 4 | T | B | -0.0620 | |
| 5 | I | B | -0.1147 | |
| 6 | T | B | -0.4707 | |
| 7 | E | B | -1.1483 | |
| 8 | P | B | -2.0653 | |
| 9 | D | B | -2.5318 | |
| 10 | V | B | -0.8828 | |
| 11 | D | B | -2.7414 | |
| 12 | D | B | -3.7866 | |
| 13 | D | B | -3.4118 | |
| 14 | S | B | -2.8657 | |
| 15 | T | B | -2.3226 | |
| 16 | S | B | -1.8372 | |
| 17 | D | B | -2.5680 | |
| 18 | M | B | -1.8907 | |
| 19 | E | B | -1.8514 | |
| 20 | A | B | -0.9464 | |
| 21 | F | B | -0.0627 | |
| 22 | M | B | 0.0000 | |
| 23 | A | B | -0.2525 | |
| 24 | G | B | -0.0205 | |
| 25 | V | B | -0.0555 | |
| 26 | L | B | 0.0000 | |
| 27 | V | B | -0.4722 | |
| 28 | R | B | -1.9858 | |
| 29 | Y | B | 0.0000 | |
| 30 | R | B | -1.5659 | |
| 31 | K | B | -2.2096 | |
| 32 | T | B | -1.7372 | |
| 33 | L | B | 0.0000 | |
| 34 | I | B | -0.3911 | |
| 35 | E | B | -2.4310 | |
| 36 | K | B | -2.2265 | |
| 37 | T | B | -1.4169 | |
| 38 | K | B | -2.1762 | |
| 39 | Y | B | -1.8693 | |
| 40 | H | B | 0.0000 | |
| 41 | L | B | 0.0000 | |
| 42 | G | B | 0.0000 | |
| 43 | Y | B | 0.0000 | |
| 44 | P | B | -0.0863 | |
| 45 | F | B | 0.0000 | |
| 46 | N | B | 0.0000 | |
| 47 | L | B | -1.3108 | |
| 48 | D | B | -2.2940 | |
| 49 | L | B | 0.0000 | |
| 50 | D | B | -2.5106 | |
| 51 | Y | B | 0.0000 | |
| 52 | G | B | -1.3720 | |
| 53 | P | B | -1.2440 | |
| 54 | L | B | 0.0000 | |
| 55 | A | B | -1.5376 | |
| 56 | E | B | -2.0856 | |
| 57 | L | B | 0.0000 | |
| 58 | Q | B | -1.3750 | |
| 59 | H | B | -1.8365 | |
| 60 | F | B | -0.7536 | |
| 61 | A | B | 0.0000 | |
| 62 | I | B | 0.0000 | |
| 63 | N | B | 0.0000 | |
| 64 | N | B | 0.0000 | |
| 65 | L | B | 0.0000 | |
| 66 | G | B | 0.0000 | |
| 67 | D | B | 0.0000 | |
| 68 | P | B | 0.0000 | |
| 69 | F | B | 0.5369 | |
| 70 | I | B | 0.4861 | |
| 71 | E | B | -0.8312 | |
| 72 | S | B | 0.0000 | |
| 73 | N | B | 0.0000 | |
| 74 | Y | B | 0.0000 | |
| 75 | G | B | -0.9261 | |
| 76 | V | B | 0.0000 | |
| 77 | H | B | -0.4474 | |
| 78 | S | B | 0.0000 | |
| 79 | R | B | -0.4408 | |
| 80 | Q | B | -0.4598 | |
| 81 | F | B | 0.0000 | |
| 82 | E | B | 0.0000 | |
| 83 | V | B | 0.0000 | |
| 84 | G | B | 0.0000 | |
| 85 | V | B | 0.0000 | |
| 86 | L | B | 0.0000 | |
| 87 | D | B | -1.2025 | |
| 88 | W | B | 0.0000 | |
| 89 | F | B | 0.0000 | |
| 90 | A | B | 0.0000 | |
| 91 | R | B | -2.6561 | |
| 92 | L | B | -0.8992 | |
| 93 | W | B | 0.0000 | |
| 94 | E | B | -2.3468 | |
| 95 | I | B | 0.0000 | |
| 96 | E | B | -3.9987 | |
| 97 | Q | B | -3.6884 | |
| 98 | K | B | -3.4366 | |
| 99 | E | B | -3.3541 | |
| 100 | Y | B | 0.0000 | |
| 101 | W | B | 0.0000 | |
| 102 | G | B | 0.0000 | |
| 103 | Y | B | 0.0000 | |
| 104 | I | B | 0.0000 | |
| 105 | T | B | 0.0000 | |
| 106 | N | B | 0.0000 | |
| 107 | G | B | 0.0000 | |
| 108 | G | B | -0.1087 | |
| 109 | T | B | 0.0000 | |
| 110 | E | B | 0.0000 | |
| 111 | G | B | 0.0000 | |
| 112 | N | B | 0.0000 | |
| 113 | L | B | 0.0000 | |
| 114 | H | B | 0.0000 | |
| 115 | G | B | 0.0000 | |
| 116 | I | B | 0.0000 | |
| 117 | L | B | 0.0000 | |
| 118 | I | B | 0.0000 | |
| 119 | G | B | 0.0000 | |
| 120 | R | B | 0.0000 | |
| 121 | E | B | -0.4876 | |
| 122 | V | B | -0.4534 | |
| 123 | F | B | -0.7327 | |
| 124 | P | B | -1.0668 | |
| 125 | D | B | -2.3012 | |
| 126 | G | B | 0.0000 | |
| 127 | I | B | 0.0000 | |
| 128 | F | B | 0.0000 | |
| 129 | Y | B | 0.0000 | |
| 130 | T | B | 0.0000 | |
| 131 | S | B | 0.0000 | |
| 132 | R | B | -2.6116 | |
| 133 | E | B | -1.5827 | |
| 134 | S | B | 0.0000 | |
| 135 | H | B | -0.3253 | |
| 136 | Y | B | -0.0965 | |
| 137 | S | B | 0.0000 | |
| 138 | I | B | 0.0000 | |
| 139 | F | B | -0.3111 | |
| 140 | K | B | 0.0000 | |
| 141 | A | B | 0.0000 | |
| 142 | A | B | 0.0000 | |
| 143 | R | B | -1.5751 | |
| 144 | M | B | 0.0000 | |
| 145 | Y | B | 0.0000 | |
| 146 | R | B | -1.7907 | |
| 147 | M | B | 0.0000 | |
| 148 | E | B | -2.4433 | |
| 149 | C | B | -1.2026 | |
| 150 | V | B | -1.2203 | |
| 151 | K | B | -2.4992 | |
| 152 | V | B | 0.0000 | |
| 153 | G | B | -1.0557 | |
| 154 | T | B | -0.3979 | |
| 155 | L | B | 1.0326 | |
| 156 | I | B | 1.2409 | |
| 157 | N | B | 0.2022 | |
| 158 | G | B | 0.0000 | |
| 159 | E | B | -0.5820 | |
| 160 | I | B | 0.0000 | |
| 161 | D | B | -0.4097 | |
| 162 | C | B | -0.5901 | |
| 163 | A | B | -0.5677 | |
| 164 | D | B | -1.0530 | |
| 165 | F | B | 0.0000 | |
| 166 | K | B | -1.3468 | |
| 167 | A | B | -0.7278 | |
| 168 | K | B | -1.0725 | |
| 169 | L | B | 0.0000 | |
| 170 | L | B | -0.7682 | |
| 171 | S | B | -0.9556 | |
| 172 | N | B | -1.6069 | |
| 173 | K | B | -2.3080 | |
| 174 | D | B | -2.9162 | |
| 175 | K | B | -2.7967 | |
| 176 | P | B | -2.0552 | |
| 177 | A | B | 0.0000 | |
| 178 | I | B | 0.0000 | |
| 179 | I | B | 0.0000 | |
| 180 | N | B | 0.0000 | |
| 181 | L | B | 0.0000 | |
| 182 | N | B | 0.0000 | |
| 183 | I | B | 0.0000 | |
| 184 | G | B | -0.1303 | |
| 185 | T | B | 0.0000 | |
| 186 | T | B | -0.0759 | |
| 187 | V | B | 0.0000 | |
| 188 | K | B | 0.0000 | |
| 189 | G | B | 0.0000 | |
| 190 | A | B | 0.0000 | |
| 191 | V | B | 0.0000 | |
| 192 | D | B | 0.0000 | |
| 193 | D | B | -1.3229 | |
| 194 | I | B | 0.0000 | |
| 195 | D | B | -1.1828 | |
| 196 | L | B | -0.2630 | |
| 197 | V | B | 0.0000 | |
| 198 | I | B | 0.0000 | |
| 199 | Q | B | -2.0617 | |
| 200 | T | B | 0.0000 | |
| 201 | L | B | 0.0000 | |
| 202 | E | B | -3.1338 | |
| 203 | E | B | -3.1358 | |
| 204 | C | B | 0.0000 | |
| 205 | G | B | -2.2298 | |
| 206 | F | B | 0.0000 | |
| 207 | S | B | -2.2242 | |
| 208 | H | B | -2.4901 | |
| 209 | D | B | -2.5658 | |
| 210 | R | B | -2.1922 | |
| 211 | F | B | 0.0000 | |
| 212 | Y | B | 0.0000 | |
| 213 | I | B | 0.0000 | |
| 214 | H | B | 0.0000 | |
| 215 | C | B | 0.0000 | |
| 216 | D | B | 0.0000 | |
| 217 | G | B | 0.0000 | |
| 218 | A | B | -0.0906 | |
| 219 | L | B | 0.0000 | |
| 220 | F | B | 0.0000 | |
| 221 | G | B | 0.0000 | |
| 222 | F | B | 0.0000 | |
| 223 | M | B | 0.0000 | |
| 224 | M | B | 0.0000 | |
| 225 | P | B | -0.8421 | |
| 226 | F | B | 0.0000 | |
| 227 | L | B | -1.5626 | |
| 228 | N | B | -2.3635 | |
| 229 | R | B | -3.0734 | |
| 230 | G | B | -2.3879 | |
| 231 | P | B | -1.8652 | |
| 232 | K | B | -2.7275 | |
| 233 | I | B | 0.0000 | |
| 234 | T | B | 0.0000 | |
| 235 | F | B | 0.0000 | |
| 236 | K | B | -2.3375 | |
| 237 | K | B | -1.8656 | |
| 238 | P | B | -1.2728 | |
| 239 | I | B | 0.0000 | |
| 240 | G | B | 0.0000 | |
| 241 | S | B | 0.0000 | |
| 242 | V | B | 0.0000 | |
| 243 | S | B | 0.0000 | |
| 244 | V | B | 0.0000 | |
| 245 | S | B | 0.0000 | |
| 246 | G | B | 0.0000 | |
| 247 | H | B | 0.0000 | |
| 248 | K | B | -0.2252 | |
| 249 | F | B | 0.0000 | |
| 250 | M | B | 0.0000 | |
| 251 | G | B | 0.0000 | |
| 252 | C | B | 0.0000 | |
| 253 | P | B | 0.0000 | |
| 254 | T | B | -0.0429 | |
| 255 | P | B | 0.0000 | |
| 256 | C | B | 0.0000 | |
| 257 | G | B | 0.0000 | |
| 258 | V | B | 0.0000 | |
| 259 | Q | B | 0.0000 | |
| 260 | I | B | 0.0000 | |
| 261 | T | B | 0.0000 | |
| 262 | R | B | -1.5700 | |
| 263 | L | B | -1.6490 | |
| 264 | E | B | -2.2397 | |
| 265 | H | B | -1.2677 | |
| 266 | I | B | 0.0000 | |
| 267 | N | B | -1.9776 | |
| 268 | A | B | -1.0643 | |
| 269 | L | B | 0.0000 | |
| 270 | S | B | -1.7976 | |
| 271 | R | B | -3.0273 | |
| 272 | N | B | -2.8219 | |
| 273 | V | B | 0.0000 | |
| 274 | E | B | -2.4949 | |
| 275 | Y | B | -1.0411 | |
| 276 | L | B | 0.0000 | |
| 277 | A | B | -1.0271 | |
| 278 | S | B | 0.0000 | |
| 279 | R | B | -1.8289 | |
| 280 | D | B | 0.0000 | |
| 281 | A | B | 0.0000 | |
| 282 | T | B | 0.0000 | |
| 283 | I | B | 0.0000 | |
| 284 | T | B | 0.0000 | |
| 285 | G | B | -0.0957 | |
| 286 | S | B | -0.0628 | |
| 287 | R | B | 0.0000 | |
| 288 | N | B | 0.0000 | |
| 289 | G | B | 0.0000 | |
| 290 | H | B | 0.0000 | |
| 291 | S | B | 0.0000 | |
| 292 | P | B | 0.0000 | |
| 293 | I | B | 0.0000 | |
| 294 | I | B | 0.0000 | |
| 295 | L | B | 0.0000 | |
| 296 | W | B | 0.0000 | |
| 297 | Y | B | 0.0000 | |
| 298 | A | B | 0.0000 | |
| 299 | L | B | 0.0000 | |
| 300 | N | B | 0.0000 | |
| 301 | R | B | -1.3151 | |
| 302 | K | B | -1.3542 | |
| 303 | G | B | 0.0000 | |
| 304 | F | B | -0.3407 | |
| 305 | K | B | -1.3183 | |
| 306 | G | B | -1.2610 | |
| 307 | F | B | 0.0000 | |
| 308 | Q | B | -1.8507 | |
| 309 | K | B | -2.8158 | |
| 310 | E | B | -2.3005 | |
| 311 | V | B | 0.0000 | |
| 312 | Q | B | -2.7256 | |
| 313 | K | B | -2.4763 | |
| 314 | C | B | 0.0000 | |
| 315 | L | B | 0.0000 | |
| 316 | R | B | -2.5113 | |
| 317 | N | B | 0.0000 | |
| 318 | A | B | 0.0000 | |
| 319 | H | B | -2.0844 | |
| 320 | Y | B | -1.4882 | |
| 321 | L | B | 0.0000 | |
| 322 | K | B | -2.1209 | |
| 323 | D | B | -2.9885 | |
| 324 | R | B | -2.7302 | |
| 325 | L | B | 0.0000 | |
| 326 | R | B | -2.2625 | |
| 327 | E | B | -2.8506 | |
| 328 | A | B | -1.4994 | |
| 329 | G | B | -1.1307 | |
| 330 | I | B | 0.0000 | |
| 331 | S | B | 0.0000 | |
| 332 | A | B | 0.0000 | |
| 333 | M | B | 0.0000 | |
| 334 | L | B | -0.7861 | |
| 335 | N | B | -1.0545 | |
| 336 | E | B | -2.1159 | |
| 337 | L | B | -1.2043 | |
| 338 | S | B | 0.0000 | |
| 339 | S | B | 0.0000 | |
| 340 | T | B | 0.0000 | |
| 341 | V | B | 0.0000 | |
| 342 | V | B | 0.0000 | |
| 343 | F | B | 0.0000 | |
| 344 | E | B | 0.0000 | |
| 345 | R | B | -1.3640 | |
| 346 | P | B | 0.0000 | |
| 347 | L | B | -0.3828 | |
| 348 | D | B | -2.0525 | |
| 349 | E | B | -3.3647 | |
| 350 | E | B | -3.6668 | |
| 351 | F | B | 0.0000 | |
| 352 | V | B | 0.0000 | |
| 353 | R | B | -3.5842 | |
| 354 | R | B | -3.3810 | |
| 355 | W | B | 0.0000 | |
| 356 | Q | B | 0.0000 | |
| 357 | L | B | 0.0000 | |
| 358 | A | B | 0.0000 | |
| 359 | C | B | 0.0000 | |
| 360 | E | B | -1.5647 | |
| 361 | G | B | -1.6565 | |
| 362 | N | B | -1.7015 | |
| 363 | M | B | 0.0000 | |
| 364 | A | B | 0.0000 | |
| 365 | H | B | 0.0000 | |
| 366 | V | B | 0.0000 | |
| 367 | I | B | 0.0000 | |
| 368 | V | B | 0.0000 | |
| 369 | M | B | 0.0000 | |
| 370 | P | B | 0.0000 | |
| 371 | N | B | -0.9406 | |
| 372 | V | B | 0.0000 | |
| 373 | T | B | -0.8730 | |
| 374 | I | B | -1.0845 | |
| 375 | E | B | -2.3878 | |
| 376 | K | B | -2.1724 | |
| 377 | L | B | 0.0000 | |
| 378 | D | B | -2.5703 | |
| 379 | E | B | -3.0935 | |
| 380 | F | B | 0.0000 | |
| 381 | L | B | -1.8165 | |
| 382 | N | B | -2.3744 | |
| 383 | E | B | -1.9463 | |
| 384 | L | B | 0.0000 | |
| 385 | V | B | -0.6788 | |
| 386 | Q | B | -1.8542 | |
| 387 | K | B | -1.6361 | |
| 388 | R | B | -1.1923 | |
| 389 | A | B | -1.4816 | |
| 390 | N | B | -2.2110 | |
| 391 | W | B | -1.4646 | |
| 392 | Y | B | -1.8974 | |
| 393 | N | B | -2.9848 | |
| 394 | D | B | -3.3791 | |
| 395 | G | B | -2.5635 | |
| 396 | K | B | -2.7449 | |
| 397 | A | B | -1.6182 | |
| 398 | G | B | -1.5286 | |
| 399 | P | B | -0.4370 | |
| 400 | P | B | -0.4386 | |
| 401 | C | B | -0.1477 | |
| 402 | L | B | 0.0000 | |
| 403 | A | B | -0.4405 | |
| 404 | P | B | -0.3648 | |
| 405 | D | B | -0.6692 | |
| 406 | I | B | 0.0000 | |
| 407 | G | B | -0.6776 | |
| 408 | S | B | -1.0873 | |
| 409 | E | B | -2.1360 | |
| 410 | N | B | -1.5061 | |
| 411 | C | B | 0.0000 | |
| 412 | D | B | 0.0000 | |
| 413 | C | B | 0.0000 | |
| 414 | D | B | -1.5365 | |
| 415 | L | B | 0.2523 | |
| 416 | H | B | -1.1570 | |
| 417 | K | B | -2.2981 | |
| 418 | L | B | -1.4766 | |
| 419 | K | B | -2.2490 | |
| 420 | H | B | -1.8099 |
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