| Chain sequence(s) |
A: TSLEITEPDVDDDSTSDMEAYMASVLTRYRKTLQERTKHHLGYPFNLDLDYGELAQLQHFAINNLGDPFIESNYGVHSRQFEQAVLDWFARLWEIDKDEYWGYITNGGTEGNLHGILLGREVFPDGIFYTSEESHYSIFKAARMYRMECVKVATLENGEIDCDDFKAKLLKNKDKPAIIVLNIGTTVKGAVDDLDLVIQTLEECGFSHDRFYIHCDGALFGFMLPFLKRGPKITFKKPIGSVSVSGHKFMGCPTPCGVVITRKEHINALSRNVEYLGSRDATITGSRNGHAPIILWYALNRKGYKGFQKEVQKCLRNAHYLKDRLREAGIPAMLNELSITVVFERPLDEEFVRRWQLACEGNIAHVIVMPNVTIEKLDEFLNELVQKRANWYNDGKAGPPCLAPDIGSENCDCDLHKLKH
B: TSLEITEPDVDDDSTSDMEAYMASVLTRYRKTLQERTKHHLGYPFNLDLDYGELAQLQHFAINNLGDPFIESNYGVHSRQFEQAVLDWFARLWEIDKDEYWGYITNGGTEGNLHGILLGREVFPDGIFYTSEESHYSIFKAARMYRMECVKVATLENGEIDCDDFKAKLLKNKDKPAIIVLNIGTTVKGAVDDLDLVIQTLEECGFSHDRFYIHCDGALFGFMLPFLKRGPKITFKKPIGSVSVSGHKFMGCPTPCGVVITRKEHINALSRNVEYLGSRDATITGSRNGHAPIILWYALNRKGYKGFQKEVQKCLRNAHYLKDRLREAGIPAMLNELSITVVFERPLDEEFVRRWQLACEGNIAHVIVMPNVTIEKLDEFLNELVQKRANWYNDGKAGPPCLAPDIGSENCDCDLHKLKH 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 (00:00:00)
[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 (00:14:21)
[INFO] Main: Simulation completed successfully. (00:14:29)
|
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 | -0.3803 | |
| 2 | S | A | -0.5727 | |
| 3 | L | A | -0.7998 | |
| 4 | E | A | -1.8032 | |
| 5 | I | A | -0.9574 | |
| 6 | T | A | -1.0934 | |
| 7 | E | A | -1.5748 | |
| 8 | P | A | -2.4187 | |
| 9 | D | A | -2.7325 | |
| 10 | V | A | -1.0255 | |
| 11 | D | A | -3.1876 | |
| 12 | D | A | -3.7338 | |
| 13 | D | A | -3.8578 | |
| 14 | S | A | -3.4183 | |
| 15 | T | A | -2.9967 | |
| 16 | S | A | -2.8869 | |
| 17 | D | A | -3.4144 | |
| 18 | M | A | -2.5474 | |
| 19 | E | A | -2.4203 | |
| 20 | A | A | -1.2935 | |
| 21 | Y | A | -0.6051 | |
| 22 | M | A | 0.0000 | |
| 23 | A | A | -0.9830 | |
| 24 | S | A | -0.7088 | |
| 25 | V | A | 0.0000 | |
| 26 | L | A | 0.0000 | |
| 27 | T | A | -1.7026 | |
| 28 | R | A | -2.7558 | |
| 29 | Y | A | 0.0000 | |
| 30 | R | A | -2.9326 | |
| 31 | K | A | -3.6136 | |
| 32 | T | A | -2.6553 | |
| 33 | L | A | 0.0000 | |
| 34 | Q | A | -3.1171 | |
| 35 | E | A | -3.7255 | |
| 36 | R | A | -2.7510 | |
| 37 | T | A | -2.0443 | |
| 38 | K | A | -2.8168 | |
| 39 | H | A | -2.2567 | |
| 40 | H | A | 0.0000 | |
| 41 | L | A | 0.0000 | |
| 42 | G | A | 0.0000 | |
| 43 | Y | A | 0.0000 | |
| 44 | P | A | -0.0931 | |
| 45 | F | A | 0.0000 | |
| 46 | N | A | 0.0000 | |
| 47 | L | A | -1.2293 | |
| 48 | D | A | -2.1833 | |
| 49 | L | A | 0.0000 | |
| 50 | D | A | -2.3339 | |
| 51 | Y | A | -1.4965 | |
| 52 | G | A | -1.4488 | |
| 53 | E | A | -1.5171 | |
| 54 | L | A | 0.0000 | |
| 55 | A | A | -1.0024 | |
| 56 | Q | A | -1.1191 | |
| 57 | L | A | 0.0000 | |
| 58 | Q | A | -1.1336 | |
| 59 | H | A | -1.5040 | |
| 60 | F | A | -0.7824 | |
| 61 | A | A | 0.0000 | |
| 62 | I | A | 0.0000 | |
| 63 | N | A | 0.0000 | |
| 64 | N | A | 0.0000 | |
| 65 | L | A | 0.0000 | |
| 66 | G | A | 0.0000 | |
| 67 | D | A | 0.0000 | |
| 68 | P | A | 0.0000 | |
| 69 | F | A | 0.4183 | |
| 70 | I | A | -0.0960 | |
| 71 | E | A | -1.5957 | |
| 72 | S | A | 0.0000 | |
| 73 | N | A | -1.6665 | |
| 74 | Y | A | 0.0000 | |
| 75 | G | A | -1.4501 | |
| 76 | V | A | 0.0000 | |
| 77 | H | A | 0.0000 | |
| 78 | S | A | 0.0000 | |
| 79 | R | A | 0.0000 | |
| 80 | Q | A | -0.8372 | |
| 81 | F | A | 0.0000 | |
| 82 | E | A | 0.0000 | |
| 83 | Q | A | -0.4896 | |
| 84 | A | A | 0.0000 | |
| 85 | V | A | 0.0000 | |
| 86 | L | A | 0.0000 | |
| 87 | D | A | -1.4798 | |
| 88 | W | A | -1.1240 | |
| 89 | F | A | 0.0000 | |
| 90 | A | A | 0.0000 | |
| 91 | R | A | -2.9417 | |
| 92 | L | A | -1.1033 | |
| 93 | W | A | 0.0000 | |
| 94 | E | A | -3.0851 | |
| 95 | I | A | 0.0000 | |
| 96 | D | A | -4.2473 | |
| 97 | K | A | -4.3281 | |
| 98 | D | A | -3.8210 | |
| 99 | E | A | -3.6564 | |
| 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 | -0.0842 | |
| 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 | L | A | 0.0000 | |
| 119 | G | A | 0.0000 | |
| 120 | R | A | 0.0000 | |
| 121 | E | A | -0.4614 | |
| 122 | V | A | -0.5177 | |
| 123 | F | A | -0.7511 | |
| 124 | P | A | -1.0477 | |
| 125 | D | A | -2.2419 | |
| 126 | G | A | -1.7101 | |
| 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 | E | A | -2.1973 | |
| 133 | E | A | -1.2972 | |
| 134 | S | A | 0.0000 | |
| 135 | H | A | -0.4356 | |
| 136 | Y | A | 0.0000 | |
| 137 | S | A | 0.0000 | |
| 138 | I | A | 0.0000 | |
| 139 | F | A | -0.5406 | |
| 140 | K | A | -0.8051 | |
| 141 | A | A | 0.0000 | |
| 142 | A | A | 0.0000 | |
| 143 | R | A | -2.0401 | |
| 144 | M | A | 0.0000 | |
| 145 | Y | A | 0.0000 | |
| 146 | R | A | -2.1978 | |
| 147 | M | A | -1.9880 | |
| 148 | E | A | -2.4781 | |
| 149 | C | A | -1.2639 | |
| 150 | V | A | -1.1128 | |
| 151 | K | A | -2.2928 | |
| 152 | V | A | 0.0000 | |
| 153 | A | A | -1.3800 | |
| 154 | T | A | -1.2345 | |
| 155 | L | A | -0.5675 | |
| 156 | E | A | -1.8734 | |
| 157 | N | A | -1.2833 | |
| 158 | G | A | 0.0000 | |
| 159 | E | A | -0.9681 | |
| 160 | I | A | 0.0000 | |
| 161 | D | A | -1.3183 | |
| 162 | C | A | -1.2555 | |
| 163 | D | A | -2.3429 | |
| 164 | D | A | -1.8132 | |
| 165 | F | A | 0.0000 | |
| 166 | K | A | -1.7108 | |
| 167 | A | A | -1.1057 | |
| 168 | K | A | -1.4862 | |
| 169 | L | A | 0.0000 | |
| 170 | L | A | -0.8494 | |
| 171 | K | A | -2.0772 | |
| 172 | N | A | -2.0490 | |
| 173 | K | A | -2.4757 | |
| 174 | D | A | -2.9126 | |
| 175 | K | A | -2.6996 | |
| 176 | P | A | -1.9211 | |
| 177 | A | A | 0.0000 | |
| 178 | I | A | 0.0000 | |
| 179 | I | A | 0.0000 | |
| 180 | V | A | 0.0000 | |
| 181 | L | A | 0.0000 | |
| 182 | N | A | 0.0000 | |
| 183 | I | A | 0.0000 | |
| 184 | G | A | -0.1058 | |
| 185 | T | A | 0.0000 | |
| 186 | T | A | -0.1290 | |
| 187 | V | A | 0.0000 | |
| 188 | K | A | 0.0000 | |
| 189 | G | A | 0.0000 | |
| 190 | A | A | 0.0000 | |
| 191 | V | A | -0.5067 | |
| 192 | D | A | 0.0000 | |
| 193 | D | A | -1.2443 | |
| 194 | L | A | 0.0000 | |
| 195 | D | A | -1.7447 | |
| 196 | L | A | -0.4184 | |
| 197 | V | A | 0.0000 | |
| 198 | I | A | 0.0000 | |
| 199 | Q | A | -1.8636 | |
| 200 | T | A | 0.0000 | |
| 201 | L | A | 0.0000 | |
| 202 | E | A | -2.6733 | |
| 203 | E | A | -2.7974 | |
| 204 | C | A | 0.0000 | |
| 205 | G | A | -1.9843 | |
| 206 | F | A | 0.0000 | |
| 207 | S | A | -2.0385 | |
| 208 | H | A | -2.2792 | |
| 209 | D | A | -2.4641 | |
| 210 | R | A | -2.1301 | |
| 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 | -0.0936 | |
| 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 | L | A | 0.0000 | |
| 225 | P | A | -0.8675 | |
| 226 | F | A | 0.0000 | |
| 227 | L | A | -1.7899 | |
| 228 | K | A | -2.8235 | |
| 229 | R | A | -3.2645 | |
| 230 | G | A | -2.4429 | |
| 231 | P | A | -1.8812 | |
| 232 | K | A | -2.5231 | |
| 233 | I | A | 0.0000 | |
| 234 | T | A | 0.0000 | |
| 235 | F | A | 0.0000 | |
| 236 | K | A | -2.2004 | |
| 237 | K | A | 0.0000 | |
| 238 | P | A | -1.0414 | |
| 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 | -0.2487 | |
| 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 | -0.1560 | |
| 255 | P | A | 0.0000 | |
| 256 | C | A | 0.0000 | |
| 257 | G | A | 0.0000 | |
| 258 | V | A | 0.0000 | |
| 259 | V | A | 0.0000 | |
| 260 | I | A | 0.0000 | |
| 261 | T | A | 0.0000 | |
| 262 | R | A | -2.1876 | |
| 263 | K | A | -3.1566 | |
| 264 | E | A | -2.9495 | |
| 265 | H | A | -1.8283 | |
| 266 | I | A | 0.0000 | |
| 267 | N | A | -2.1653 | |
| 268 | A | A | -1.1869 | |
| 269 | L | A | 0.0000 | |
| 270 | S | A | -1.6300 | |
| 271 | R | A | -2.4564 | |
| 272 | N | A | -2.8313 | |
| 273 | V | A | 0.0000 | |
| 274 | E | A | -2.7312 | |
| 275 | Y | A | -1.3463 | |
| 276 | L | A | 0.0000 | |
| 277 | G | A | -1.9799 | |
| 278 | S | A | 0.0000 | |
| 279 | R | A | -2.5061 | |
| 280 | D | A | 0.0000 | |
| 281 | A | A | 0.0000 | |
| 282 | T | A | 0.0000 | |
| 283 | I | A | 0.0000 | |
| 284 | T | A | 0.0000 | |
| 285 | G | A | 0.0000 | |
| 286 | S | A | -0.0385 | |
| 287 | R | A | 0.0000 | |
| 288 | N | A | 0.0000 | |
| 289 | G | A | 0.0000 | |
| 290 | H | A | 0.0000 | |
| 291 | A | 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 | -1.6542 | |
| 302 | K | A | -1.5767 | |
| 303 | G | A | 0.0000 | |
| 304 | Y | A | -0.8899 | |
| 305 | K | A | -2.0040 | |
| 306 | G | A | -1.6131 | |
| 307 | F | A | 0.0000 | |
| 308 | Q | A | -2.3447 | |
| 309 | K | A | -3.0040 | |
| 310 | E | A | -2.2973 | |
| 311 | V | A | 0.0000 | |
| 312 | Q | A | -2.7712 | |
| 313 | K | A | -2.5353 | |
| 314 | C | A | 0.0000 | |
| 315 | L | A | 0.0000 | |
| 316 | R | A | -2.4785 | |
| 317 | N | A | 0.0000 | |
| 318 | A | A | 0.0000 | |
| 319 | H | A | -1.8798 | |
| 320 | Y | A | -1.2969 | |
| 321 | L | A | 0.0000 | |
| 322 | K | A | -1.9817 | |
| 323 | D | A | -2.8959 | |
| 324 | R | A | -2.6221 | |
| 325 | L | A | 0.0000 | |
| 326 | R | A | -2.5393 | |
| 327 | E | A | -2.9429 | |
| 328 | A | A | -1.6168 | |
| 329 | G | A | -1.4688 | |
| 330 | I | A | 0.0000 | |
| 331 | P | A | 0.0000 | |
| 332 | A | A | 0.0000 | |
| 333 | M | A | 0.0000 | |
| 334 | L | A | -0.7101 | |
| 335 | N | A | -1.0737 | |
| 336 | E | A | -2.1587 | |
| 337 | L | A | 0.0000 | |
| 338 | S | A | 0.0000 | |
| 339 | I | 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 | -1.0373 | |
| 346 | P | A | 0.0000 | |
| 347 | L | A | 0.1692 | |
| 348 | D | A | -1.5820 | |
| 349 | E | A | -2.8958 | |
| 350 | E | A | -3.1644 | |
| 351 | F | A | 0.0000 | |
| 352 | V | A | 0.0000 | |
| 353 | R | A | -2.4298 | |
| 354 | R | A | -2.8657 | |
| 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 | -1.4504 | |
| 361 | G | A | -1.3831 | |
| 362 | N | A | -1.3336 | |
| 363 | I | 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 | -0.9723 | |
| 372 | V | A | 0.0000 | |
| 373 | T | A | -0.8755 | |
| 374 | I | A | -1.0653 | |
| 375 | E | A | -2.4013 | |
| 376 | K | A | -2.2133 | |
| 377 | L | A | 0.0000 | |
| 378 | D | A | -2.6885 | |
| 379 | E | A | -3.2176 | |
| 380 | F | A | 0.0000 | |
| 381 | L | A | 0.0000 | |
| 382 | N | A | -2.4682 | |
| 383 | E | A | -1.9890 | |
| 384 | L | A | 0.0000 | |
| 385 | V | A | -0.7113 | |
| 386 | Q | A | -1.8151 | |
| 387 | K | A | -1.4685 | |
| 388 | R | A | -1.0678 | |
| 389 | A | A | -1.2250 | |
| 390 | N | A | -2.1041 | |
| 391 | W | A | -1.2060 | |
| 392 | Y | A | -1.7765 | |
| 393 | N | A | -2.9868 | |
| 394 | D | A | -3.3444 | |
| 395 | G | A | -2.5711 | |
| 396 | K | A | -2.7233 | |
| 397 | A | A | -1.5949 | |
| 398 | G | A | -1.4520 | |
| 399 | P | A | -0.5536 | |
| 400 | P | A | -0.6044 | |
| 401 | C | A | -0.1751 | |
| 402 | L | A | 0.0000 | |
| 403 | A | A | -0.7617 | |
| 404 | P | A | -0.8697 | |
| 405 | D | A | -1.1942 | |
| 406 | I | A | 0.0000 | |
| 407 | G | A | -1.4191 | |
| 408 | S | A | -1.3531 | |
| 409 | E | A | -2.0348 | |
| 410 | N | A | -1.3491 | |
| 411 | C | A | 0.0000 | |
| 412 | D | A | -1.5131 | |
| 413 | C | A | -0.9845 | |
| 414 | D | A | -1.7034 | |
| 415 | L | A | 0.2889 | |
| 416 | H | A | -1.0623 | |
| 417 | K | A | -2.2582 | |
| 418 | L | A | -0.9243 | |
| 419 | K | A | -2.1743 | |
| 420 | H | A | -1.6144 | |
| 1 | T | B | -0.4339 | |
| 2 | S | B | -0.6722 | |
| 3 | L | B | -0.8147 | |
| 4 | E | B | -1.8202 | |
| 5 | I | B | -0.9832 | |
| 6 | T | B | -1.0942 | |
| 7 | E | B | -1.6232 | |
| 8 | P | B | -2.4258 | |
| 9 | D | B | -2.7439 | |
| 10 | V | B | -1.0141 | |
| 11 | D | B | -3.1878 | |
| 12 | D | B | -3.7312 | |
| 13 | D | B | -4.0192 | |
| 14 | S | B | -3.3926 | |
| 15 | T | B | -2.9887 | |
| 16 | S | B | -3.0127 | |
| 17 | D | B | -3.3540 | |
| 18 | M | B | -2.5109 | |
| 19 | E | B | -2.4655 | |
| 20 | A | B | -1.2067 | |
| 21 | Y | B | -0.5404 | |
| 22 | M | B | 0.0000 | |
| 23 | A | B | -0.9066 | |
| 24 | S | B | -0.6885 | |
| 25 | V | B | 0.0000 | |
| 26 | L | B | 0.0000 | |
| 27 | T | B | -1.7254 | |
| 28 | R | B | -2.7260 | |
| 29 | Y | B | 0.0000 | |
| 30 | R | B | -3.0104 | |
| 31 | K | B | -3.6333 | |
| 32 | T | B | -2.6872 | |
| 33 | L | B | 0.0000 | |
| 34 | Q | B | -3.1817 | |
| 35 | E | B | -3.7492 | |
| 36 | R | B | -3.3347 | |
| 37 | T | B | -2.2071 | |
| 38 | K | B | -2.9805 | |
| 39 | H | B | -2.6921 | |
| 40 | H | B | 0.0000 | |
| 41 | L | B | 0.0000 | |
| 42 | G | B | 0.0000 | |
| 43 | Y | B | 0.0000 | |
| 44 | P | B | -0.0935 | |
| 45 | F | B | 0.0000 | |
| 46 | N | B | 0.0000 | |
| 47 | L | B | -1.2584 | |
| 48 | D | B | -2.2128 | |
| 49 | L | B | 0.0000 | |
| 50 | D | B | -2.4883 | |
| 51 | Y | B | -1.6522 | |
| 52 | G | B | -1.6449 | |
| 53 | E | B | -1.6761 | |
| 54 | L | B | 0.0000 | |
| 55 | A | B | -0.9785 | |
| 56 | Q | B | -1.0071 | |
| 57 | L | B | 0.0000 | |
| 58 | Q | B | -0.7871 | |
| 59 | H | B | -1.1919 | |
| 60 | F | B | -0.6220 | |
| 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 | 0.3692 | |
| 70 | I | B | -0.3734 | |
| 71 | E | B | -1.6876 | |
| 72 | S | B | 0.0000 | |
| 73 | N | B | -1.1018 | |
| 74 | Y | B | 0.0000 | |
| 75 | G | B | -1.0063 | |
| 76 | V | B | 0.0000 | |
| 77 | H | B | 0.0000 | |
| 78 | S | B | 0.0000 | |
| 79 | R | B | 0.0000 | |
| 80 | Q | B | -0.6131 | |
| 81 | F | B | 0.0000 | |
| 82 | E | B | 0.0000 | |
| 83 | Q | B | -0.3514 | |
| 84 | A | B | 0.0000 | |
| 85 | V | B | 0.0000 | |
| 86 | L | B | 0.0000 | |
| 87 | D | B | -1.5054 | |
| 88 | W | B | -1.1216 | |
| 89 | F | B | 0.0000 | |
| 90 | A | B | 0.0000 | |
| 91 | R | B | -2.8788 | |
| 92 | L | B | -1.0834 | |
| 93 | W | B | 0.0000 | |
| 94 | E | B | -2.8645 | |
| 95 | I | B | 0.0000 | |
| 96 | D | B | -4.5408 | |
| 97 | K | B | -4.6038 | |
| 98 | D | B | -4.2957 | |
| 99 | E | B | -4.6118 | |
| 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 | -0.0845 | |
| 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 | L | B | 0.0000 | |
| 119 | G | B | 0.0000 | |
| 120 | R | B | 0.0000 | |
| 121 | E | B | -0.4219 | |
| 122 | V | B | -0.4997 | |
| 123 | F | B | -0.7309 | |
| 124 | P | B | -1.0228 | |
| 125 | D | B | -2.2188 | |
| 126 | G | B | -1.6623 | |
| 127 | I | B | -1.2494 | |
| 128 | F | B | 0.0000 | |
| 129 | Y | B | 0.0000 | |
| 130 | T | B | 0.0000 | |
| 131 | S | B | 0.0000 | |
| 132 | E | B | -2.2444 | |
| 133 | E | B | -1.3781 | |
| 134 | S | B | 0.0000 | |
| 135 | H | B | -0.4480 | |
| 136 | Y | B | 0.0000 | |
| 137 | S | B | 0.0000 | |
| 138 | I | B | 0.0000 | |
| 139 | F | B | -0.5110 | |
| 140 | K | B | -0.7877 | |
| 141 | A | B | 0.0000 | |
| 142 | A | B | 0.0000 | |
| 143 | R | B | -1.9810 | |
| 144 | M | B | 0.0000 | |
| 145 | Y | B | 0.0000 | |
| 146 | R | B | -2.2022 | |
| 147 | M | B | -1.9427 | |
| 148 | E | B | -2.4054 | |
| 149 | C | B | -1.1819 | |
| 150 | V | B | -1.0428 | |
| 151 | K | B | -2.2858 | |
| 152 | V | B | 0.0000 | |
| 153 | A | B | -1.3945 | |
| 154 | T | B | -1.2493 | |
| 155 | L | B | -0.5034 | |
| 156 | E | B | -1.8248 | |
| 157 | N | B | -1.2989 | |
| 158 | G | B | 0.0000 | |
| 159 | E | B | -1.1005 | |
| 160 | I | B | 0.0000 | |
| 161 | D | B | -1.3650 | |
| 162 | C | B | -1.2987 | |
| 163 | D | B | -2.3802 | |
| 164 | D | B | -1.8300 | |
| 165 | F | B | 0.0000 | |
| 166 | K | B | -1.8379 | |
| 167 | A | B | -1.2188 | |
| 168 | K | B | -1.5939 | |
| 169 | L | B | 0.0000 | |
| 170 | L | B | -0.9179 | |
| 171 | K | B | -2.2520 | |
| 172 | N | B | -2.2301 | |
| 173 | K | B | -2.6007 | |
| 174 | D | B | -3.0036 | |
| 175 | K | B | -2.7897 | |
| 176 | P | B | -1.9428 | |
| 177 | A | B | 0.0000 | |
| 178 | I | B | 0.0000 | |
| 179 | I | B | 0.0000 | |
| 180 | V | B | 0.0000 | |
| 181 | L | B | 0.0000 | |
| 182 | N | B | 0.0000 | |
| 183 | I | B | 0.0000 | |
| 184 | G | B | -0.1530 | |
| 185 | T | B | 0.0000 | |
| 186 | T | B | -0.0512 | |
| 187 | V | B | 0.0413 | |
| 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 | -1.3398 | |
| 194 | L | B | 0.0000 | |
| 195 | D | B | -1.7782 | |
| 196 | L | B | -0.4451 | |
| 197 | V | B | 0.0000 | |
| 198 | I | B | 0.0000 | |
| 199 | Q | B | -1.9076 | |
| 200 | T | B | 0.0000 | |
| 201 | L | B | 0.0000 | |
| 202 | E | B | -2.7318 | |
| 203 | E | B | -2.9357 | |
| 204 | C | B | 0.0000 | |
| 205 | G | B | -2.0091 | |
| 206 | F | B | 0.0000 | |
| 207 | S | B | -2.0496 | |
| 208 | H | B | -2.3204 | |
| 209 | D | B | -2.4795 | |
| 210 | R | B | -2.2912 | |
| 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 | -0.0957 | |
| 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 | L | B | 0.0000 | |
| 225 | P | B | -0.8704 | |
| 226 | F | B | 0.0000 | |
| 227 | L | B | -1.8039 | |
| 228 | K | B | -2.8243 | |
| 229 | R | B | -3.2472 | |
| 230 | G | B | -2.4288 | |
| 231 | P | B | -1.8309 | |
| 232 | K | B | -2.3546 | |
| 233 | I | B | 0.0000 | |
| 234 | T | B | 0.0000 | |
| 235 | F | B | 0.0000 | |
| 236 | K | B | -2.2251 | |
| 237 | K | B | -1.6886 | |
| 238 | P | B | -1.1516 | |
| 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 | -0.2502 | |
| 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 | -0.1752 | |
| 255 | P | B | 0.0000 | |
| 256 | C | B | 0.0000 | |
| 257 | G | B | 0.0000 | |
| 258 | V | B | 0.0000 | |
| 259 | V | B | 0.0000 | |
| 260 | I | B | 0.0000 | |
| 261 | T | B | 0.0000 | |
| 262 | R | B | -2.4692 | |
| 263 | K | B | -3.3941 | |
| 264 | E | B | -3.0861 | |
| 265 | H | B | -1.7703 | |
| 266 | I | B | 0.0000 | |
| 267 | N | B | -2.1469 | |
| 268 | A | B | -1.1590 | |
| 269 | L | B | 0.0000 | |
| 270 | S | B | -1.6809 | |
| 271 | R | B | -2.4775 | |
| 272 | N | B | -2.8336 | |
| 273 | V | B | 0.0000 | |
| 274 | E | B | -2.4776 | |
| 275 | Y | B | -1.2446 | |
| 276 | L | B | 0.0000 | |
| 277 | G | B | -1.7138 | |
| 278 | S | B | 0.0000 | |
| 279 | R | B | -2.7119 | |
| 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 | 0.0000 | |
| 286 | S | B | -0.0671 | |
| 287 | R | B | 0.0000 | |
| 288 | N | B | -0.1751 | |
| 289 | G | B | 0.0000 | |
| 290 | H | B | -0.1710 | |
| 291 | A | 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 | -1.4899 | |
| 302 | K | B | -1.5958 | |
| 303 | G | B | 0.0000 | |
| 304 | Y | B | -1.2053 | |
| 305 | K | B | -2.4265 | |
| 306 | G | B | -1.8235 | |
| 307 | F | B | 0.0000 | |
| 308 | Q | B | -2.6374 | |
| 309 | K | B | -3.1824 | |
| 310 | E | B | -2.4152 | |
| 311 | V | B | 0.0000 | |
| 312 | Q | B | -2.8283 | |
| 313 | K | B | -2.6084 | |
| 314 | C | B | 0.0000 | |
| 315 | L | B | 0.0000 | |
| 316 | R | B | -2.5375 | |
| 317 | N | B | 0.0000 | |
| 318 | A | B | 0.0000 | |
| 319 | H | B | -1.9406 | |
| 320 | Y | B | -1.3253 | |
| 321 | L | B | 0.0000 | |
| 322 | K | B | -1.9489 | |
| 323 | D | B | -2.7589 | |
| 324 | R | B | -2.6710 | |
| 325 | L | B | 0.0000 | |
| 326 | R | B | -2.8003 | |
| 327 | E | B | -2.9645 | |
| 328 | A | B | -1.6249 | |
| 329 | G | B | -1.6810 | |
| 330 | I | B | 0.0000 | |
| 331 | P | B | 0.0000 | |
| 332 | A | B | 0.0000 | |
| 333 | M | B | 0.0000 | |
| 334 | L | B | -0.6865 | |
| 335 | N | B | -1.1202 | |
| 336 | E | B | -2.1972 | |
| 337 | L | B | 0.0000 | |
| 338 | S | B | 0.0000 | |
| 339 | I | 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 | -1.0126 | |
| 346 | P | B | 0.0000 | |
| 347 | L | B | 0.1728 | |
| 348 | D | B | -1.8325 | |
| 349 | E | B | -3.3302 | |
| 350 | E | B | -3.8025 | |
| 351 | F | B | 0.0000 | |
| 352 | V | B | 0.0000 | |
| 353 | R | B | -4.1703 | |
| 354 | R | B | -4.1677 | |
| 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 | -1.4464 | |
| 361 | G | B | -1.3982 | |
| 362 | N | B | -1.3095 | |
| 363 | I | 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 | -0.9807 | |
| 372 | V | B | 0.0000 | |
| 373 | T | B | -0.8850 | |
| 374 | I | B | -1.0637 | |
| 375 | E | B | -2.4039 | |
| 376 | K | B | -2.2412 | |
| 377 | L | B | 0.0000 | |
| 378 | D | B | -2.6963 | |
| 379 | E | B | -3.2052 | |
| 380 | F | B | 0.0000 | |
| 381 | L | B | 0.0000 | |
| 382 | N | B | -2.4325 | |
| 383 | E | B | -1.9201 | |
| 384 | L | B | 0.0000 | |
| 385 | V | B | -0.6763 | |
| 386 | Q | B | -1.7687 | |
| 387 | K | B | -1.3955 | |
| 388 | R | B | -1.0154 | |
| 389 | A | B | -1.1861 | |
| 390 | N | B | -2.0695 | |
| 391 | W | B | -1.1847 | |
| 392 | Y | B | -1.7485 | |
| 393 | N | B | -2.9745 | |
| 394 | D | B | -3.3403 | |
| 395 | G | B | -2.5620 | |
| 396 | K | B | -2.7193 | |
| 397 | A | B | -1.5954 | |
| 398 | G | B | -1.4576 | |
| 399 | P | B | -0.6964 | |
| 400 | P | B | -0.7636 | |
| 401 | C | B | -0.4476 | |
| 402 | L | B | 0.0000 | |
| 403 | A | B | -0.9323 | |
| 404 | P | B | -0.8545 | |
| 405 | D | B | -1.1656 | |
| 406 | I | B | 0.0000 | |
| 407 | G | B | 0.0000 | |
| 408 | S | B | -1.4764 | |
| 409 | E | B | -2.1818 | |
| 410 | N | B | -1.6356 | |
| 411 | C | B | 0.0000 | |
| 412 | D | B | -2.5950 | |
| 413 | C | B | -1.4820 | |
| 414 | D | B | -1.8960 | |
| 415 | L | B | 0.1385 | |
| 416 | H | B | -1.3317 | |
| 417 | K | B | -2.4230 | |
| 418 | L | B | -1.0208 | |
| 419 | K | B | -2.2125 | |
| 420 | H | B | -1.5611 |
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