| Chain sequence(s) | DGVGNASGNWHCDSTWLGDRVITTSTRTWALPTYNNHLYKQISSASTGASNDNHYFGYSTPWGYFDFNRFHCHFSPRDWQRLINNNWGFRPKRLNFKLFNIQVKEVTTNDGVTTIANNLTSTVQVFSDSEYQLPYVLGSAHQGCLPPFPADVFMIPQYGYLTLNNGSQAVGRSSFYCLEYFPSQMLRTGNNFTFSYTFEEVPFHSSYAHSQSLDRLMNPLIDQYLYYLNRTQNQSGSAQNKDLLFSRGSPAGMSVQPKNWLPGPCYRQQRVSKTKTDNNNSNFTWTGASKYNLNGRESIINPGTAMASHKDDEDKFFPMSGVMIFGKESAGASNTALDNVMITDEEEIKATNPVATERFGTVAVNFQSSSTDPATGDVHAMGALPGMVWQDRDVYLQGPIWAKIPHTDGHFHPSPLMGGFGLKNPPPQILIKNTPVPANPPAEFSATKFASFITQYSTGQVSVEIEWELQKENSKRWNPEVQYTSNYAKSANVDFTVDNNGLYTEPRPIGTRYLTRPLDGVGNASGNWHCDSTWLGDRVITTSTRTWALPTYNNHLYKQISSASTGASNDNHYFGYSTPWGYFDFNRFHCHFSPRDWQRLINNNWGFRPKRLNFKLFNIQVKEVTTNDGVTTIANNLTSTVQVFSDSEYQLPYVLGSAHQGCLPPFPADVFMIPQYGYLTLNNGSQAVGRSSFYCLEYFPSQMLRTGNNFTFSYTFEEVPFHSSYAHSQSLDRLMNPLIDQYLYYLNRTQNQSGSAQNKDLLFSRGSPAGMSVQPKNWLPGPCYRQQRVSKTKTDNNNSNFTWTGASKYNLNGRESIINPGTAMASHKDDEDKFFPMSGVMIFGKESAGASNTALDNVMITDEEEIKATNPVATERFGTVAVNFQSSSTDPATGDVHAMGALPGMVWQDRDVYLQGPIWAKIPHTDGHFHPSPLMGGFGLKNPPPQILIKNTPVPANPPAEFSATKFASFITQYSTGQVSVEIEWELQKENSKRWNPEVQYTSNYAKSANVDFTVDNNGLYTEPRPIGTRYLTRPLDGVGNASGNWHCDSTWLGDRVITTSTRTWALPTYNNHLYKQISSASTGASNDNHYFGYSTPWGYFDFNRFHCHFSPRDWQRLINNNWGFRPKRLNFKLFNIQVKEVTTNDGVTTIANNLTSTVQVFSDSEYQLPYVLGSAHQGCLPPFPADVFMIPQYGYLTLNNGSQAVGRSSFYCLEYFPSQMLRTGNNFTFSYTFEEVPFHSSYAHSQSLDRLMNPLIDQYLYYLNRTQNQSGSAQNKDLLFSRGSPAGMSVQPKNWLPGPCYRQQRVSKTKTDNNNSNFTWTGASKYNLNGRESIINPGTAMASHKDDEDKFFPMSGVMIFGKESAGASNTALDNVMITDEEEIKATNPVATERFGTVAVNFQSSSTDPATGDVHAMGALPGMVWQDRDVYLQGPIWAKIPHTDGHFHPSPLMGGFGLKNPPPQILIKNTPVPANPPAEFSATKFASFITQYSTGQVSVEIEWELQKENSKRWNPEVQYTSNYAKSANVDFTVDNNGLYTEPRPIGTRYLTRPL input PDB |
| Selected Chain(s) | A,B,C |
| Distance of aggregation | 10 Å |
| FoldX usage | Yes |
| pH calculations | 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] PDB-Info: The input structure is globular. Max score is recommended for pH analysis. (00:00:06)
[INFO] FoldX: Starting FoldX energy minimization (00:00:06)
[INFO] Analysis: Starting Aggrescan4D on folded.pdb (00:07:31)
[INFO] agg3D: Running pKa-ANI on
/STORAGE/DATA/lcbio/aggreskan/3bfa6fdac6a506/tmp/folded.pdb (00:07:31)
[INFO] Main: Simulation completed successfully. (00:21:51)
|
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 | |
| 17 | D | A | -2.5350 | |
| 18 | G | A | -1.2506 | |
| 19 | V | A | 0.3595 | |
| 20 | G | A | -0.6305 | |
| 21 | N | A | -1.7235 | |
| 22 | A | A | -1.3065 | |
| 23 | S | A | 0.0000 | |
| 24 | G | A | -1.3414 | |
| 25 | N | A | -1.0990 | |
| 26 | W | A | -0.2710 | |
| 27 | H | A | -1.1775 | |
| 28 | C | A | -0.9381 | |
| 29 | D | A | -1.7803 | |
| 30 | S | A | -0.8685 | |
| 31 | T | A | -0.2697 | |
| 32 | W | A | -0.2564 | |
| 33 | L | A | -0.3092 | |
| 34 | G | A | -1.3976 | |
| 35 | D | A | -2.5085 | |
| 36 | R | A | -1.6111 | |
| 37 | V | A | 0.0000 | |
| 38 | I | A | -0.3625 | |
| 39 | T | A | 0.0000 | |
| 40 | T | A | 0.0000 | |
| 41 | S | A | 0.0000 | |
| 42 | T | A | 0.0000 | |
| 43 | R | A | 0.0000 | |
| 44 | T | A | 0.4113 | |
| 45 | W | A | 0.0000 | |
| 46 | A | A | 0.7074 | |
| 47 | L | A | 0.0000 | |
| 48 | P | A | 0.1227 | |
| 49 | T | A | -0.2079 | |
| 50 | Y | A | -0.1697 | |
| 51 | N | A | -0.6654 | |
| 52 | N | A | -1.0692 | |
| 53 | H | A | -0.3214 | |
| 54 | L | A | 0.0985 | |
| 55 | Y | A | -0.2021 | |
| 56 | K | A | -1.1379 | |
| 57 | Q | A | -1.2339 | |
| 58 | I | A | -0.3157 | |
| 59 | S | A | -0.3894 | |
| 60 | S | A | 0.0000 | |
| 61 | A | A | -0.3654 | |
| 62 | S | A | -0.3181 | |
| 63 | T | A | -0.4369 | |
| 64 | G | A | -0.7763 | |
| 65 | A | A | -0.7985 | |
| 66 | S | A | -1.0979 | |
| 67 | N | A | -1.7524 | |
| 68 | D | A | -1.1548 | |
| 69 | N | A | -0.9032 | |
| 70 | H | A | -0.9981 | |
| 71 | Y | A | -0.3256 | |
| 72 | F | A | -0.1847 | |
| 73 | G | A | 0.0000 | |
| 74 | Y | A | -0.2875 | |
| 75 | S | A | 0.0000 | |
| 76 | T | A | 0.0000 | |
| 77 | P | A | 0.0000 | |
| 78 | W | A | 0.0000 | |
| 79 | G | A | 0.0000 | |
| 80 | Y | A | 0.0000 | |
| 81 | F | A | 0.0000 | |
| 82 | D | A | 0.0000 | |
| 83 | F | A | 0.0000 | |
| 84 | N | A | 0.0000 | |
| 85 | R | A | -0.2321 | |
| 86 | F | A | 0.0000 | |
| 87 | H | A | 0.0000 | |
| 88 | C | A | 0.0000 | |
| 89 | H | A | 0.0000 | |
| 90 | F | A | 0.0000 | |
| 91 | S | A | -1.1253 | |
| 92 | P | A | -1.4552 | |
| 93 | R | A | -2.5477 | |
| 94 | D | A | -1.8390 | |
| 95 | W | A | 0.0000 | |
| 96 | Q | A | -2.0984 | |
| 97 | R | A | -2.6047 | |
| 98 | L | A | 0.0000 | |
| 99 | I | A | 0.0000 | |
| 100 | N | A | -1.3154 | |
| 101 | N | A | -1.9154 | |
| 102 | N | A | 0.0000 | |
| 103 | W | A | -0.9296 | |
| 104 | G | A | 0.0000 | |
| 105 | F | A | 0.0000 | |
| 106 | R | A | -0.8943 | |
| 107 | P | A | 0.0000 | |
| 108 | K | A | -1.8630 | |
| 109 | R | A | -2.1951 | |
| 110 | L | A | 0.0000 | |
| 111 | N | A | -1.4853 | |
| 112 | F | A | 0.0000 | |
| 113 | K | A | -1.0789 | |
| 114 | L | A | 0.0000 | |
| 115 | F | A | 0.0000 | |
| 116 | N | A | -1.2594 | |
| 117 | I | A | 0.0000 | |
| 118 | Q | A | -0.9975 | |
| 119 | V | A | 0.0000 | |
| 120 | K | A | -0.3733 | |
| 121 | E | A | 0.0496 | |
| 122 | V | A | 0.6723 | |
| 123 | T | A | 0.3381 | |
| 124 | T | A | -0.4235 | |
| 125 | N | A | -1.7792 | |
| 126 | D | A | -2.0941 | |
| 127 | G | A | -0.9316 | |
| 128 | V | A | 0.4973 | |
| 129 | T | A | 0.5043 | |
| 130 | T | A | 0.8947 | |
| 131 | I | A | 1.3662 | |
| 132 | A | A | 0.1760 | |
| 133 | N | A | -1.0020 | |
| 134 | N | A | -0.5569 | |
| 135 | L | A | 0.2563 | |
| 136 | T | A | -0.0059 | |
| 137 | S | A | 0.0000 | |
| 138 | T | A | -0.5609 | |
| 139 | V | A | 0.0000 | |
| 140 | Q | A | -0.5307 | |
| 141 | V | A | 0.0000 | |
| 142 | F | A | 0.0000 | |
| 143 | S | A | -0.4394 | |
| 144 | D | A | 0.0000 | |
| 145 | S | A | -1.1433 | |
| 146 | E | A | -2.1791 | |
| 147 | Y | A | -1.3084 | |
| 148 | Q | A | -0.9429 | |
| 149 | L | A | 0.0000 | |
| 150 | P | A | 0.0000 | |
| 151 | Y | A | 0.0000 | |
| 152 | V | A | 0.0000 | |
| 153 | L | A | 0.0000 | |
| 154 | G | A | -0.1369 | |
| 155 | S | A | -0.1843 | |
| 156 | A | A | 0.0000 | |
| 157 | H | A | 0.0000 | |
| 158 | Q | A | -0.6371 | |
| 159 | G | A | -0.1426 | |
| 160 | C | A | -0.0269 | |
| 161 | L | A | 0.0000 | |
| 162 | P | A | 0.0608 | |
| 163 | P | A | -0.0978 | |
| 164 | F | A | 0.5428 | |
| 165 | P | A | 0.0015 | |
| 166 | A | A | -0.2322 | |
| 167 | D | A | -0.6876 | |
| 168 | V | A | 1.1803 | |
| 169 | F | A | 0.0000 | |
| 170 | M | A | 1.3871 | |
| 171 | I | A | 0.0000 | |
| 172 | P | A | 0.0000 | |
| 173 | Q | A | 0.1484 | |
| 174 | Y | A | 0.0000 | |
| 175 | G | A | 0.0000 | |
| 176 | Y | A | 0.0000 | |
| 177 | L | A | 0.0000 | |
| 178 | T | A | 0.0000 | |
| 179 | L | A | 0.0000 | |
| 180 | N | A | 0.0000 | |
| 181 | N | A | -1.2443 | |
| 182 | G | A | -1.1151 | |
| 183 | S | A | -0.9447 | |
| 184 | Q | A | -1.2113 | |
| 185 | A | A | -0.5428 | |
| 186 | V | A | -0.1772 | |
| 187 | G | A | -0.3804 | |
| 188 | R | A | -0.4475 | |
| 189 | S | A | 0.0000 | |
| 190 | S | A | 0.0000 | |
| 191 | F | A | 0.3766 | |
| 192 | Y | A | 0.0000 | |
| 193 | C | A | 0.4768 | |
| 194 | L | A | 0.0000 | |
| 195 | E | A | -0.5716 | |
| 196 | Y | A | 0.9152 | |
| 197 | F | A | 0.1131 | |
| 198 | P | A | -0.3076 | |
| 199 | S | A | -0.5712 | |
| 200 | Q | A | -1.1740 | |
| 201 | M | A | -0.2943 | |
| 202 | L | A | 0.0000 | |
| 203 | R | A | -1.8401 | |
| 204 | T | A | -1.3873 | |
| 205 | G | A | 0.0000 | |
| 206 | N | A | -2.0903 | |
| 207 | N | A | -1.7893 | |
| 208 | F | A | 0.0000 | |
| 209 | T | A | -0.5613 | |
| 210 | F | A | -0.2523 | |
| 211 | S | A | -0.7975 | |
| 212 | Y | A | -0.8430 | |
| 213 | T | A | -1.4000 | |
| 214 | F | A | 0.0000 | |
| 215 | E | A | -2.0562 | |
| 216 | E | A | -2.1498 | |
| 217 | V | A | 0.0000 | |
| 218 | P | A | -0.5761 | |
| 219 | F | A | -0.1069 | |
| 220 | H | A | 0.0000 | |
| 221 | S | A | 0.0000 | |
| 222 | S | A | 0.0000 | |
| 223 | Y | A | 0.0000 | |
| 224 | A | A | 0.0000 | |
| 225 | H | A | 0.0000 | |
| 226 | S | A | 0.0000 | |
| 227 | Q | A | 0.0000 | |
| 228 | S | A | 0.0000 | |
| 229 | L | A | 0.0000 | |
| 230 | D | A | 0.0000 | |
| 231 | R | A | 0.0000 | |
| 232 | L | A | 0.1767 | |
| 233 | M | A | 0.0000 | |
| 234 | N | A | 0.0000 | |
| 235 | P | A | 0.0000 | |
| 236 | L | A | 0.4816 | |
| 237 | I | A | 0.0603 | |
| 238 | D | A | -0.5411 | |
| 239 | Q | A | 0.0000 | |
| 240 | Y | A | 0.0000 | |
| 241 | L | A | 0.0000 | |
| 242 | Y | A | 0.0000 | |
| 243 | Y | A | -0.0535 | |
| 244 | L | A | 0.0000 | |
| 245 | N | A | -0.5867 | |
| 246 | R | A | -1.1633 | |
| 247 | T | A | 0.0000 | |
| 248 | Q | A | -2.3182 | |
| 249 | N | A | -2.4647 | |
| 250 | Q | A | -2.3111 | |
| 251 | S | A | -1.6314 | |
| 252 | G | A | -1.5022 | |
| 253 | S | A | -1.1264 | |
| 254 | A | A | -1.5681 | |
| 255 | Q | A | -2.6597 | |
| 256 | N | A | -2.8873 | |
| 257 | K | A | -2.3755 | |
| 258 | D | A | -1.8273 | |
| 259 | L | A | 0.0000 | |
| 260 | L | A | -0.7425 | |
| 261 | F | A | 0.0000 | |
| 262 | S | A | 0.0000 | |
| 263 | R | A | -0.6143 | |
| 264 | G | A | 0.0000 | |
| 265 | S | A | -0.2709 | |
| 266 | P | A | -0.0685 | |
| 267 | A | A | -0.0832 | |
| 268 | G | A | -0.1868 | |
| 269 | M | A | 0.0000 | |
| 270 | S | A | 0.0000 | |
| 271 | V | A | 0.0684 | |
| 272 | Q | A | 0.0000 | |
| 273 | P | A | 0.0000 | |
| 274 | K | A | -0.1286 | |
| 275 | N | A | 0.0000 | |
| 276 | W | A | 0.0000 | |
| 277 | L | A | 0.0000 | |
| 278 | P | A | 0.0000 | |
| 279 | G | A | 0.0000 | |
| 280 | P | A | 0.0000 | |
| 281 | C | A | 0.0000 | |
| 282 | Y | A | 0.0000 | |
| 283 | R | A | 0.0000 | |
| 284 | Q | A | 0.0000 | |
| 285 | Q | A | 0.0000 | |
| 286 | R | A | -0.0731 | |
| 287 | V | A | 0.0000 | |
| 288 | S | A | 0.0000 | |
| 289 | K | A | -1.6710 | |
| 290 | T | A | -1.2896 | |
| 291 | K | A | -1.8127 | |
| 292 | T | A | -1.2743 | |
| 293 | D | A | -1.3017 | |
| 294 | N | A | 0.0000 | |
| 295 | N | A | 0.0000 | |
| 296 | N | A | -2.2038 | |
| 297 | S | A | -1.6984 | |
| 298 | N | A | -1.5246 | |
| 299 | F | A | 0.0000 | |
| 300 | T | A | 0.0000 | |
| 301 | W | A | 0.1329 | |
| 302 | T | A | -0.0098 | |
| 303 | G | A | 0.0000 | |
| 304 | A | A | 0.0000 | |
| 305 | S | A | 0.0000 | |
| 306 | K | A | 0.0000 | |
| 307 | Y | A | 0.0000 | |
| 308 | N | A | 0.0000 | |
| 309 | L | A | 0.0000 | |
| 310 | N | A | -0.7567 | |
| 311 | G | A | -0.7784 | |
| 312 | R | A | 0.0000 | |
| 313 | E | A | -0.5251 | |
| 314 | S | A | 0.0000 | |
| 315 | I | A | 0.0000 | |
| 316 | I | A | 0.0000 | |
| 317 | N | A | 0.0000 | |
| 318 | P | A | 0.0000 | |
| 319 | G | A | 0.0000 | |
| 320 | T | A | 0.0000 | |
| 321 | A | A | -0.0743 | |
| 322 | M | A | 0.0000 | |
| 323 | A | A | 0.0000 | |
| 324 | S | A | 0.0000 | |
| 325 | H | A | 0.0000 | |
| 326 | K | A | -1.8196 | |
| 327 | D | A | -2.1453 | |
| 328 | D | A | -2.9230 | |
| 329 | E | A | -2.6280 | |
| 330 | D | A | -3.4036 | |
| 331 | K | A | -2.5671 | |
| 332 | F | A | 0.0000 | |
| 333 | F | A | 0.0000 | |
| 334 | P | A | 0.0000 | |
| 335 | M | A | 0.0000 | |
| 336 | S | A | 0.0000 | |
| 337 | G | A | 0.0000 | |
| 338 | V | A | 0.0000 | |
| 339 | M | A | 0.0000 | |
| 340 | I | A | 0.0000 | |
| 341 | F | A | 0.0000 | |
| 342 | G | A | -1.3613 | |
| 343 | K | A | -2.3049 | |
| 344 | E | A | -2.3116 | |
| 345 | S | A | -1.7111 | |
| 346 | A | A | 0.0000 | |
| 347 | G | A | -0.9110 | |
| 348 | A | A | -0.5218 | |
| 349 | S | A | -0.5367 | |
| 350 | N | A | -0.7366 | |
| 351 | T | A | 0.0000 | |
| 352 | A | A | -0.6225 | |
| 353 | L | A | -0.8159 | |
| 354 | D | A | -1.8991 | |
| 355 | N | A | -1.7562 | |
| 356 | V | A | 0.0000 | |
| 357 | M | A | 0.0000 | |
| 358 | I | A | -0.2394 | |
| 359 | T | A | 0.0000 | |
| 360 | D | A | -1.3269 | |
| 361 | E | A | 0.0000 | |
| 362 | E | A | -1.5137 | |
| 363 | E | A | -0.8372 | |
| 364 | I | A | 0.0000 | |
| 365 | K | A | -0.7260 | |
| 366 | A | A | 0.0000 | |
| 367 | T | A | 0.0000 | |
| 368 | N | A | 0.0000 | |
| 369 | P | A | 0.0000 | |
| 370 | V | A | 0.0000 | |
| 371 | A | A | 0.0000 | |
| 372 | T | A | 0.0000 | |
| 373 | E | A | -0.6015 | |
| 374 | R | A | -0.9590 | |
| 375 | F | A | 0.0000 | |
| 376 | G | A | 0.0000 | |
| 377 | T | A | 0.0000 | |
| 378 | V | A | 0.0000 | |
| 379 | A | A | 0.0000 | |
| 380 | V | A | -0.1180 | |
| 381 | N | A | -0.3245 | |
| 382 | F | A | 0.0929 | |
| 383 | Q | A | 0.0000 | |
| 384 | S | A | -0.9848 | |
| 385 | S | A | -1.2266 | |
| 386 | S | A | -0.9485 | |
| 387 | T | A | -1.1250 | |
| 388 | D | A | -2.0158 | |
| 389 | P | A | -0.9172 | |
| 390 | A | A | -0.3491 | |
| 391 | T | A | -0.3854 | |
| 392 | G | A | -0.9258 | |
| 393 | D | A | -1.9010 | |
| 394 | V | A | 0.0000 | |
| 395 | H | A | -0.7095 | |
| 396 | A | A | -0.2812 | |
| 397 | M | A | 0.0000 | |
| 398 | G | A | 0.0000 | |
| 399 | A | A | 0.0000 | |
| 400 | L | A | 0.0000 | |
| 401 | P | A | 0.0000 | |
| 402 | G | A | 0.0000 | |
| 403 | M | A | 0.0000 | |
| 404 | V | A | 0.0000 | |
| 405 | W | A | 0.0000 | |
| 406 | Q | A | 0.0000 | |
| 407 | D | A | -0.4379 | |
| 408 | R | A | 0.0000 | |
| 409 | D | A | 0.0000 | |
| 410 | V | A | 0.0000 | |
| 411 | Y | A | 0.0000 | |
| 412 | L | A | 0.0000 | |
| 413 | Q | A | 0.0000 | |
| 414 | G | A | 0.0000 | |
| 415 | P | A | 0.0000 | |
| 416 | I | A | 0.0000 | |
| 417 | W | A | 0.0000 | |
| 418 | A | A | 0.0000 | |
| 419 | K | A | -0.8198 | |
| 420 | I | A | 0.0000 | |
| 421 | P | A | 0.0000 | |
| 422 | H | A | -0.6725 | |
| 423 | T | A | -0.4682 | |
| 424 | D | A | -0.6644 | |
| 425 | G | A | 0.0000 | |
| 426 | H | A | -0.6506 | |
| 427 | F | A | 0.0000 | |
| 428 | H | A | -0.4875 | |
| 429 | P | A | -0.4713 | |
| 430 | S | A | -0.3538 | |
| 431 | P | A | 0.0000 | |
| 432 | L | A | 0.0000 | |
| 433 | M | A | 0.0000 | |
| 434 | G | A | 0.0000 | |
| 435 | G | A | -0.1358 | |
| 436 | F | A | 0.0000 | |
| 437 | G | A | -0.6652 | |
| 438 | L | A | 0.0000 | |
| 439 | K | A | -1.9360 | |
| 440 | N | A | -2.0026 | |
| 441 | P | A | 0.0000 | |
| 442 | P | A | 0.0000 | |
| 443 | P | A | 0.0000 | |
| 444 | Q | A | 0.0000 | |
| 445 | I | A | 0.0000 | |
| 446 | L | A | 0.0000 | |
| 447 | I | A | 0.0000 | |
| 448 | K | A | 0.0000 | |
| 449 | N | A | 0.0000 | |
| 450 | T | A | 0.1634 | |
| 451 | P | A | 0.0343 | |
| 452 | V | A | 0.3604 | |
| 453 | P | A | 0.0749 | |
| 454 | A | A | -0.3057 | |
| 455 | N | A | -1.3257 | |
| 456 | P | A | -0.9181 | |
| 457 | P | A | -0.8464 | |
| 458 | A | A | -0.7528 | |
| 459 | E | A | -1.0178 | |
| 460 | F | A | 0.8800 | |
| 461 | S | A | 0.0242 | |
| 462 | A | A | 0.0289 | |
| 463 | T | A | -0.5243 | |
| 464 | K | A | -1.4687 | |
| 465 | F | A | -0.2950 | |
| 466 | A | A | -0.2599 | |
| 467 | S | A | -0.3128 | |
| 468 | F | A | 0.2772 | |
| 469 | I | A | 0.6530 | |
| 470 | T | A | 0.1934 | |
| 471 | Q | A | 0.0000 | |
| 472 | Y | A | 0.4036 | |
| 473 | S | A | 0.0000 | |
| 474 | T | A | 0.0530 | |
| 475 | G | A | 0.0000 | |
| 476 | Q | A | -0.2954 | |
| 477 | V | A | 0.0000 | |
| 478 | S | A | -0.6986 | |
| 479 | V | A | 0.0000 | |
| 480 | E | A | -1.3563 | |
| 481 | I | A | 0.0000 | |
| 482 | E | A | 0.0000 | |
| 483 | W | A | 0.0000 | |
| 484 | E | A | -1.5086 | |
| 485 | L | A | 0.0000 | |
| 486 | Q | A | -1.9285 | |
| 487 | K | A | -2.4192 | |
| 488 | E | A | -2.2670 | |
| 489 | N | A | -2.0265 | |
| 490 | S | A | -1.1436 | |
| 491 | K | A | -0.3135 | |
| 492 | R | A | 0.0000 | |
| 493 | W | A | 1.1351 | |
| 494 | N | A | 0.0359 | |
| 495 | P | A | -0.3497 | |
| 496 | E | A | -0.4267 | |
| 497 | V | A | -0.1789 | |
| 498 | Q | A | -0.7677 | |
| 499 | Y | A | -0.5758 | |
| 500 | T | A | -0.6065 | |
| 501 | S | A | -0.6918 | |
| 502 | N | A | -0.8865 | |
| 503 | Y | A | 0.2957 | |
| 504 | A | A | -0.3913 | |
| 505 | K | A | -1.6148 | |
| 506 | S | A | -1.0940 | |
| 507 | A | A | -0.8039 | |
| 508 | N | A | -1.0228 | |
| 509 | V | A | 0.4297 | |
| 510 | D | A | -0.5401 | |
| 511 | F | A | -0.1669 | |
| 512 | T | A | 0.4331 | |
| 513 | V | A | 0.3694 | |
| 514 | D | A | -1.1593 | |
| 515 | N | A | -2.1181 | |
| 516 | N | A | -1.8711 | |
| 517 | G | A | -1.1174 | |
| 518 | L | A | -0.2307 | |
| 519 | Y | A | -0.0823 | |
| 520 | T | A | -0.3261 | |
| 521 | E | A | -0.9574 | |
| 522 | P | A | -0.8965 | |
| 523 | R | A | -1.0751 | |
| 524 | P | A | -0.6367 | |
| 525 | I | A | 0.0000 | |
| 526 | G | A | -0.3090 | |
| 527 | T | A | 0.0000 | |
| 528 | R | A | 0.0000 | |
| 529 | Y | A | -0.1501 | |
| 530 | L | A | 0.0000 | |
| 531 | T | A | 0.0000 | |
| 532 | R | A | -0.6203 | |
| 533 | P | A | 0.0000 | |
| 534 | L | A | 0.0000 | |
| 17 | D | B | -2.5461 | |
| 18 | G | B | -1.2865 | |
| 19 | V | B | 0.3461 | |
| 20 | G | B | -0.6417 | |
| 21 | N | B | -1.7334 | |
| 22 | A | B | -1.3085 | |
| 23 | S | B | 0.0000 | |
| 24 | G | B | -1.3603 | |
| 25 | N | B | -1.1346 | |
| 26 | W | B | -0.3428 | |
| 27 | H | B | -1.2470 | |
| 28 | C | B | -1.0042 | |
| 29 | D | B | -1.8014 | |
| 30 | S | B | -0.8517 | |
| 31 | T | B | -0.3273 | |
| 32 | W | B | -0.2206 | |
| 33 | L | B | -0.1928 | |
| 34 | G | B | -1.2840 | |
| 35 | D | B | -2.3650 | |
| 36 | R | B | -2.1916 | |
| 37 | V | B | 0.0000 | |
| 38 | I | B | -0.5872 | |
| 39 | T | B | 0.0000 | |
| 40 | T | B | 0.0000 | |
| 41 | S | B | 0.0000 | |
| 42 | T | B | 0.0000 | |
| 43 | R | B | 0.0000 | |
| 44 | T | B | 0.4145 | |
| 45 | W | B | 0.0000 | |
| 46 | A | B | 0.7020 | |
| 47 | L | B | 0.0000 | |
| 48 | P | B | 0.1191 | |
| 49 | T | B | -0.2214 | |
| 50 | Y | B | -0.1813 | |
| 51 | N | B | -0.6849 | |
| 52 | N | B | -1.0970 | |
| 53 | H | B | -0.3568 | |
| 54 | L | B | 0.0500 | |
| 55 | Y | B | -0.2272 | |
| 56 | K | B | -1.1471 | |
| 57 | Q | B | -1.2399 | |
| 58 | I | B | -0.3202 | |
| 59 | S | B | -0.3973 | |
| 60 | S | B | 0.0000 | |
| 61 | A | B | -0.3702 | |
| 62 | S | B | -0.3179 | |
| 63 | T | B | -0.4378 | |
| 64 | G | B | -0.7765 | |
| 65 | A | B | -0.7982 | |
| 66 | S | B | -1.0895 | |
| 67 | N | B | -1.7525 | |
| 68 | D | B | -1.1492 | |
| 69 | N | B | -0.9118 | |
| 70 | H | B | -1.0113 | |
| 71 | Y | B | -0.3388 | |
| 72 | F | B | -0.1842 | |
| 73 | G | B | 0.0000 | |
| 74 | Y | B | -0.2995 | |
| 75 | S | B | 0.0000 | |
| 76 | T | B | 0.0000 | |
| 77 | P | B | 0.0000 | |
| 78 | W | B | 0.0000 | |
| 79 | G | B | 0.0000 | |
| 80 | Y | B | 0.0000 | |
| 81 | F | B | 0.0000 | |
| 82 | D | B | 0.0000 | |
| 83 | F | B | 0.0000 | |
| 84 | N | B | 0.0000 | |
| 85 | R | B | -0.2305 | |
| 86 | F | B | 0.0000 | |
| 87 | H | B | 0.0000 | |
| 88 | C | B | 0.0000 | |
| 89 | H | B | 0.0000 | |
| 90 | F | B | 0.0000 | |
| 91 | S | B | -1.0525 | |
| 92 | P | B | -1.4198 | |
| 93 | R | B | -2.5034 | |
| 94 | D | B | -1.7556 | |
| 95 | W | B | 0.0000 | |
| 96 | Q | B | -2.0474 | |
| 97 | R | B | -2.4015 | |
| 98 | L | B | 0.0000 | |
| 99 | I | B | 0.0000 | |
| 100 | N | B | 0.0000 | |
| 101 | N | B | -1.8248 | |
| 102 | N | B | 0.0000 | |
| 103 | W | B | -0.9133 | |
| 104 | G | B | 0.0000 | |
| 105 | F | B | 0.0000 | |
| 106 | R | B | -1.0479 | |
| 107 | P | B | 0.0000 | |
| 108 | K | B | -2.1916 | |
| 109 | R | B | -2.5413 | |
| 110 | L | B | 0.0000 | |
| 111 | N | B | -1.5823 | |
| 112 | F | B | 0.0000 | |
| 113 | K | B | -1.1367 | |
| 114 | L | B | 0.0000 | |
| 115 | F | B | 0.0000 | |
| 116 | N | B | -1.2594 | |
| 117 | I | B | 0.0000 | |
| 118 | Q | B | -0.9865 | |
| 119 | V | B | 0.0000 | |
| 120 | K | B | -0.4157 | |
| 121 | E | B | -0.0866 | |
| 122 | V | B | 0.6172 | |
| 123 | T | B | 0.3010 | |
| 124 | T | B | -0.4325 | |
| 125 | N | B | -1.7792 | |
| 126 | D | B | -2.0944 | |
| 127 | G | B | -0.9312 | |
| 128 | V | B | 0.4965 | |
| 129 | T | B | 0.4799 | |
| 130 | T | B | 0.8304 | |
| 131 | I | B | 1.2297 | |
| 132 | A | B | 0.1055 | |
| 133 | N | B | -1.0299 | |
| 134 | N | B | -0.5664 | |
| 135 | L | B | 0.2709 | |
| 136 | T | B | 0.0101 | |
| 137 | S | B | 0.0000 | |
| 138 | T | B | -0.5287 | |
| 139 | V | B | 0.0000 | |
| 140 | Q | B | -0.5200 | |
| 141 | V | B | 0.0000 | |
| 142 | F | B | 0.0000 | |
| 143 | S | B | -0.4718 | |
| 144 | D | B | 0.0000 | |
| 145 | S | B | -1.2027 | |
| 146 | E | B | -2.2325 | |
| 147 | Y | B | -1.4103 | |
| 148 | Q | B | -0.9564 | |
| 149 | L | B | 0.0000 | |
| 150 | P | B | 0.0000 | |
| 151 | Y | B | 0.0000 | |
| 152 | V | B | 0.0000 | |
| 153 | L | B | 0.0000 | |
| 154 | G | B | -0.1394 | |
| 155 | S | B | -0.1418 | |
| 156 | A | B | 0.0000 | |
| 157 | H | B | 0.0000 | |
| 158 | Q | B | -0.4665 | |
| 159 | G | B | -0.0605 | |
| 160 | C | B | -0.0076 | |
| 161 | L | B | 0.0000 | |
| 162 | P | B | 0.1182 | |
| 163 | P | B | -0.0338 | |
| 164 | F | B | 0.6730 | |
| 165 | P | B | 0.0728 | |
| 166 | A | B | -0.1594 | |
| 167 | D | B | -0.5564 | |
| 168 | V | B | 1.2297 | |
| 169 | F | B | 0.0000 | |
| 170 | M | B | 1.3851 | |
| 171 | I | B | 0.0000 | |
| 172 | P | B | 0.0000 | |
| 173 | Q | B | 0.1475 | |
| 174 | Y | B | 0.0000 | |
| 175 | G | B | 0.0000 | |
| 176 | Y | B | 0.0000 | |
| 177 | L | B | 0.0000 | |
| 178 | T | B | 0.0000 | |
| 179 | L | B | 0.0000 | |
| 180 | N | B | 0.0000 | |
| 181 | N | B | -1.2321 | |
| 182 | G | B | -1.0824 | |
| 183 | S | B | -0.9596 | |
| 184 | Q | B | -1.1881 | |
| 185 | A | B | -0.4689 | |
| 186 | V | B | -0.0304 | |
| 187 | G | B | -0.2702 | |
| 188 | R | B | -0.3190 | |
| 189 | S | B | 0.0000 | |
| 190 | S | B | 0.0000 | |
| 191 | F | B | 0.3878 | |
| 192 | Y | B | 0.0000 | |
| 193 | C | B | 0.3864 | |
| 194 | L | B | 0.0000 | |
| 195 | E | B | -0.8178 | |
| 196 | Y | B | 0.7340 | |
| 197 | F | B | 0.0000 | |
| 198 | P | B | -0.4342 | |
| 199 | S | B | -0.6512 | |
| 200 | Q | B | -1.1674 | |
| 201 | M | B | -0.2377 | |
| 202 | L | B | 0.0000 | |
| 203 | R | B | -1.7995 | |
| 204 | T | B | -1.3702 | |
| 205 | G | B | 0.0000 | |
| 206 | N | B | -2.0654 | |
| 207 | N | B | -1.7720 | |
| 208 | F | B | 0.0000 | |
| 209 | T | B | -0.5855 | |
| 210 | F | B | -0.2809 | |
| 211 | S | B | -0.8524 | |
| 212 | Y | B | -0.9383 | |
| 213 | T | B | -1.5551 | |
| 214 | F | B | 0.0000 | |
| 215 | E | B | -2.1459 | |
| 216 | E | B | -2.1195 | |
| 217 | V | B | 0.0000 | |
| 218 | P | B | -0.5553 | |
| 219 | F | B | -0.0934 | |
| 220 | H | B | 0.0000 | |
| 221 | S | B | 0.0000 | |
| 222 | S | B | 0.0000 | |
| 223 | Y | B | 0.0000 | |
| 224 | A | B | 0.0000 | |
| 225 | H | B | 0.0000 | |
| 226 | S | B | 0.0000 | |
| 227 | Q | B | 0.0000 | |
| 228 | S | B | 0.0000 | |
| 229 | L | B | 0.0000 | |
| 230 | D | B | 0.0000 | |
| 231 | R | B | 0.0000 | |
| 232 | L | B | 0.1751 | |
| 233 | M | B | 0.0000 | |
| 234 | N | B | 0.0000 | |
| 235 | P | B | 0.0000 | |
| 236 | L | B | 0.4461 | |
| 237 | I | B | -0.0200 | |
| 238 | D | B | -0.6782 | |
| 239 | Q | B | 0.0000 | |
| 240 | Y | B | 0.0000 | |
| 241 | L | B | 0.0000 | |
| 242 | Y | B | 0.0000 | |
| 243 | Y | B | -0.0421 | |
| 244 | L | B | 0.0000 | |
| 245 | N | B | -0.5649 | |
| 246 | R | B | -1.1085 | |
| 247 | T | B | 0.0000 | |
| 248 | Q | B | -2.2436 | |
| 249 | N | B | -2.2829 | |
| 250 | Q | B | -2.2145 | |
| 251 | S | B | -1.5441 | |
| 252 | G | B | -1.4489 | |
| 253 | S | B | -1.0758 | |
| 254 | A | B | -1.4750 | |
| 255 | Q | B | -2.5264 | |
| 256 | N | B | -2.6390 | |
| 257 | K | B | -2.2333 | |
| 258 | D | B | -1.8324 | |
| 259 | L | B | 0.0000 | |
| 260 | L | B | -0.7214 | |
| 261 | F | B | 0.0000 | |
| 262 | S | B | 0.0000 | |
| 263 | R | B | -0.6303 | |
| 264 | G | B | 0.0000 | |
| 265 | S | B | -0.3177 | |
| 266 | P | B | -0.1009 | |
| 267 | A | B | -0.0958 | |
| 268 | G | B | -0.1841 | |
| 269 | M | B | 0.0000 | |
| 270 | S | B | 0.0000 | |
| 271 | V | B | 0.0676 | |
| 272 | Q | B | 0.0000 | |
| 273 | P | B | 0.0000 | |
| 274 | K | B | -0.1234 | |
| 275 | N | B | 0.0000 | |
| 276 | W | B | 0.0000 | |
| 277 | L | B | 0.0000 | |
| 278 | P | B | 0.0000 | |
| 279 | G | B | 0.0000 | |
| 280 | P | B | 0.0000 | |
| 281 | C | B | 0.0000 | |
| 282 | Y | B | 0.0000 | |
| 283 | R | B | 0.0000 | |
| 284 | Q | B | 0.0000 | |
| 285 | Q | B | 0.0000 | |
| 286 | R | B | -0.1035 | |
| 287 | V | B | 0.0000 | |
| 288 | S | B | 0.0000 | |
| 289 | K | B | -1.5740 | |
| 290 | T | B | -1.2121 | |
| 291 | K | B | -1.7497 | |
| 292 | T | B | -1.2678 | |
| 293 | D | B | -1.2938 | |
| 294 | N | B | 0.0000 | |
| 295 | N | B | 0.0000 | |
| 296 | N | B | -2.2987 | |
| 297 | S | B | -1.6950 | |
| 298 | N | B | -1.4069 | |
| 299 | F | B | 0.0000 | |
| 300 | T | B | 0.0000 | |
| 301 | W | B | 0.1676 | |
| 302 | T | B | 0.0268 | |
| 303 | G | B | 0.0000 | |
| 304 | A | B | 0.0000 | |
| 305 | S | B | 0.0000 | |
| 306 | K | B | 0.0000 | |
| 307 | Y | B | 0.0000 | |
| 308 | N | B | 0.0000 | |
| 309 | L | B | 0.0000 | |
| 310 | N | B | -0.7543 | |
| 311 | G | B | -0.7857 | |
| 312 | R | B | 0.0000 | |
| 313 | E | B | -0.5279 | |
| 314 | S | B | 0.0000 | |
| 315 | I | B | 0.0000 | |
| 316 | I | B | 0.0000 | |
| 317 | N | B | 0.0000 | |
| 318 | P | B | 0.0000 | |
| 319 | G | B | 0.0000 | |
| 320 | T | B | 0.0000 | |
| 321 | A | B | -0.0739 | |
| 322 | M | B | 0.0000 | |
| 323 | A | B | 0.0000 | |
| 324 | S | B | 0.0000 | |
| 325 | H | B | 0.0000 | |
| 326 | K | B | -1.7828 | |
| 327 | D | B | -2.2424 | |
| 328 | D | B | -2.9108 | |
| 329 | E | B | -2.4834 | |
| 330 | D | B | -3.2960 | |
| 331 | K | B | -2.3863 | |
| 332 | F | B | -1.5530 | |
| 333 | F | B | 0.0000 | |
| 334 | P | B | 0.0000 | |
| 335 | M | B | 0.0000 | |
| 336 | S | B | 0.0000 | |
| 337 | G | B | 0.0000 | |
| 338 | V | B | 0.0000 | |
| 339 | M | B | 0.0000 | |
| 340 | I | B | 0.0000 | |
| 341 | F | B | 0.0000 | |
| 342 | G | B | -1.3930 | |
| 343 | K | B | -2.3404 | |
| 344 | E | B | -2.2937 | |
| 345 | S | B | -1.7103 | |
| 346 | A | B | 0.0000 | |
| 347 | G | B | -0.9084 | |
| 348 | A | B | -0.4794 | |
| 349 | S | B | -0.5523 | |
| 350 | N | B | -0.7737 | |
| 351 | T | B | 0.0000 | |
| 352 | A | B | -0.6370 | |
| 353 | L | B | -0.8389 | |
| 354 | D | B | -1.9097 | |
| 355 | N | B | -1.7630 | |
| 356 | V | B | 0.0000 | |
| 357 | M | B | 0.0000 | |
| 358 | I | B | -0.2884 | |
| 359 | T | B | 0.0000 | |
| 360 | D | B | -1.4017 | |
| 361 | E | B | 0.0000 | |
| 362 | E | B | -1.6567 | |
| 363 | E | B | -0.9180 | |
| 364 | I | B | 0.0000 | |
| 365 | K | B | -0.7042 | |
| 366 | A | B | 0.0000 | |
| 367 | T | B | 0.0000 | |
| 368 | N | B | 0.0000 | |
| 369 | P | B | 0.0000 | |
| 370 | V | B | 0.0000 | |
| 371 | A | B | 0.0000 | |
| 372 | T | B | 0.0000 | |
| 373 | E | B | -0.6541 | |
| 374 | R | B | -0.8542 | |
| 375 | F | B | 0.0000 | |
| 376 | G | B | 0.0000 | |
| 377 | T | B | 0.0000 | |
| 378 | V | B | 0.0000 | |
| 379 | A | B | 0.0000 | |
| 380 | V | B | -0.0751 | |
| 381 | N | B | -0.3074 | |
| 382 | F | B | 0.1477 | |
| 383 | Q | B | 0.0000 | |
| 384 | S | B | -0.9481 | |
| 385 | S | B | -1.1859 | |
| 386 | S | B | -0.9328 | |
| 387 | T | B | -1.1012 | |
| 388 | D | B | -1.9923 | |
| 389 | P | B | -0.9058 | |
| 390 | A | B | -0.3416 | |
| 391 | T | B | -0.3145 | |
| 392 | G | B | -0.7670 | |
| 393 | D | B | -1.5712 | |
| 394 | V | B | 0.0000 | |
| 395 | H | B | -0.6377 | |
| 396 | A | B | -0.2424 | |
| 397 | M | B | 0.0000 | |
| 398 | G | B | 0.0000 | |
| 399 | A | B | 0.0000 | |
| 400 | L | B | 0.0000 | |
| 401 | P | B | 0.0000 | |
| 402 | G | B | 0.0000 | |
| 403 | M | B | 0.0000 | |
| 404 | V | B | 0.0000 | |
| 405 | W | B | 0.0000 | |
| 406 | Q | B | 0.0000 | |
| 407 | D | B | -0.4325 | |
| 408 | R | B | 0.0000 | |
| 409 | D | B | 0.0000 | |
| 410 | V | B | 0.0000 | |
| 411 | Y | B | 0.0000 | |
| 412 | L | B | 0.0000 | |
| 413 | Q | B | 0.0000 | |
| 414 | G | B | 0.0000 | |
| 415 | P | B | 0.0000 | |
| 416 | I | B | 0.0000 | |
| 417 | W | B | 0.0000 | |
| 418 | A | B | 0.0000 | |
| 419 | K | B | -1.0819 | |
| 420 | I | B | 0.0000 | |
| 421 | P | B | 0.0000 | |
| 422 | H | B | -1.2877 | |
| 423 | T | B | -0.7551 | |
| 424 | D | B | -0.8111 | |
| 425 | G | B | 0.0000 | |
| 426 | H | B | -0.7680 | |
| 427 | F | B | 0.0000 | |
| 428 | H | B | -0.4972 | |
| 429 | P | B | -0.5336 | |
| 430 | S | B | -0.3583 | |
| 431 | P | B | 0.0000 | |
| 432 | L | B | 0.0000 | |
| 433 | M | B | 0.0000 | |
| 434 | G | B | 0.0000 | |
| 435 | G | B | -0.1315 | |
| 436 | F | B | 0.0000 | |
| 437 | G | B | -0.7860 | |
| 438 | L | B | 0.0000 | |
| 439 | K | B | -2.5669 | |
| 440 | N | B | -2.4702 | |
| 441 | P | B | 0.0000 | |
| 442 | P | B | 0.0000 | |
| 443 | P | B | 0.0000 | |
| 444 | Q | B | 0.0000 | |
| 445 | I | B | 0.0000 | |
| 446 | L | B | 0.0000 | |
| 447 | I | B | 0.0000 | |
| 448 | K | B | 0.0000 | |
| 449 | N | B | 0.0000 | |
| 450 | T | B | 0.1727 | |
| 451 | P | B | 0.0104 | |
| 452 | V | B | 0.3946 | |
| 453 | P | B | 0.0703 | |
| 454 | A | B | -0.3300 | |
| 455 | N | B | -1.3353 | |
| 456 | P | B | -0.9182 | |
| 457 | P | B | -0.8481 | |
| 458 | A | B | -0.7537 | |
| 459 | E | B | -1.0183 | |
| 460 | F | B | 0.8804 | |
| 461 | S | B | 0.0285 | |
| 462 | A | B | 0.0332 | |
| 463 | T | B | -0.5167 | |
| 464 | K | B | -1.4578 | |
| 465 | F | B | -0.2747 | |
| 466 | A | B | -0.2603 | |
| 467 | S | B | -0.3332 | |
| 468 | F | B | 0.2215 | |
| 469 | I | B | 0.5663 | |
| 470 | T | B | 0.1462 | |
| 471 | Q | B | 0.0000 | |
| 472 | Y | B | 0.3713 | |
| 473 | S | B | 0.0000 | |
| 474 | T | B | 0.0507 | |
| 475 | G | B | 0.0000 | |
| 476 | Q | B | -0.3291 | |
| 477 | V | B | 0.0000 | |
| 478 | S | B | 0.0000 | |
| 479 | V | B | 0.0000 | |
| 480 | E | B | -1.4601 | |
| 481 | I | B | 0.0000 | |
| 482 | E | B | -1.5349 | |
| 483 | W | B | 0.0000 | |
| 484 | E | B | -1.7713 | |
| 485 | L | B | 0.0000 | |
| 486 | Q | B | -1.9781 | |
| 487 | K | B | -2.5141 | |
| 488 | E | B | -2.2990 | |
| 489 | N | B | -2.0363 | |
| 490 | S | B | -1.1209 | |
| 491 | K | B | -0.2973 | |
| 492 | R | B | 0.0000 | |
| 493 | W | B | 1.1306 | |
| 494 | N | B | 0.0358 | |
| 495 | P | B | -0.3465 | |
| 496 | E | B | -0.3979 | |
| 497 | V | B | -0.0975 | |
| 498 | Q | B | -0.7586 | |
| 499 | Y | B | -0.5374 | |
| 500 | T | B | -0.6083 | |
| 501 | S | B | -0.7106 | |
| 502 | N | B | -0.8872 | |
| 503 | Y | B | 0.2958 | |
| 504 | A | B | -0.3896 | |
| 505 | K | B | -1.6145 | |
| 506 | S | B | -1.0938 | |
| 507 | A | B | -0.7986 | |
| 508 | N | B | -1.0116 | |
| 509 | V | B | 0.4364 | |
| 510 | D | B | -0.5655 | |
| 511 | F | B | -0.1859 | |
| 512 | T | B | 0.4793 | |
| 513 | V | B | 0.4706 | |
| 514 | D | B | -1.0644 | |
| 515 | N | B | -2.0694 | |
| 516 | N | B | -1.8168 | |
| 517 | G | B | -1.0263 | |
| 518 | L | B | -0.0700 | |
| 519 | Y | B | 0.0276 | |
| 520 | T | B | -0.2996 | |
| 521 | E | B | -1.0182 | |
| 522 | P | B | -1.0094 | |
| 523 | R | B | -1.3100 | |
| 524 | P | B | -0.7552 | |
| 525 | I | B | 0.0000 | |
| 526 | G | B | -0.3411 | |
| 527 | T | B | 0.0000 | |
| 528 | R | B | 0.0000 | |
| 529 | Y | B | -0.1282 | |
| 530 | L | B | 0.0000 | |
| 531 | T | B | 0.0000 | |
| 532 | R | B | 0.0000 | |
| 533 | P | B | 0.0000 | |
| 534 | L | B | 0.0000 | |
| 17 | D | C | -2.5068 | |
| 18 | G | C | -1.2055 | |
| 19 | V | C | 0.3824 | |
| 20 | G | C | -0.6172 | |
| 21 | N | C | -1.7093 | |
| 22 | A | C | -1.2975 | |
| 23 | S | C | 0.0000 | |
| 24 | G | C | -1.3501 | |
| 25 | N | C | -1.1014 | |
| 26 | W | C | -0.2743 | |
| 27 | H | C | -1.1443 | |
| 28 | C | C | -0.9159 | |
| 29 | D | C | -1.7615 | |
| 30 | S | C | -0.7867 | |
| 31 | T | C | -0.2379 | |
| 32 | W | C | -0.1531 | |
| 33 | L | C | -0.1911 | |
| 34 | G | C | -1.3698 | |
| 35 | D | C | -2.5605 | |
| 36 | R | C | -1.8725 | |
| 37 | V | C | 0.0000 | |
| 38 | I | C | -0.4003 | |
| 39 | T | C | 0.0000 | |
| 40 | T | C | 0.0000 | |
| 41 | S | C | 0.0000 | |
| 42 | T | C | 0.0000 | |
| 43 | R | C | 0.0000 | |
| 44 | T | C | 0.3899 | |
| 45 | W | C | 0.0000 | |
| 46 | A | C | 0.6532 | |
| 47 | L | C | 0.0000 | |
| 48 | P | C | 0.0470 | |
| 49 | T | C | -0.2490 | |
| 50 | Y | C | -0.2385 | |
| 51 | N | C | -0.7307 | |
| 52 | N | C | -1.0851 | |
| 53 | H | C | -0.3162 | |
| 54 | L | C | 0.1582 | |
| 55 | Y | C | -0.2326 | |
| 56 | K | C | -1.2084 | |
| 57 | Q | C | -1.2664 | |
| 58 | I | C | -0.3380 | |
| 59 | S | C | -0.3950 | |
| 60 | S | C | 0.0000 | |
| 61 | A | C | -0.3657 | |
| 62 | S | C | -0.3175 | |
| 63 | T | C | -0.4374 | |
| 64 | G | C | -0.7767 | |
| 65 | A | C | -0.7987 | |
| 66 | S | C | -1.0961 | |
| 67 | N | C | -1.7650 | |
| 68 | D | C | -1.1744 | |
| 69 | N | C | -0.9133 | |
| 70 | H | C | -1.0044 | |
| 71 | Y | C | -0.2934 | |
| 72 | F | C | -0.1018 | |
| 73 | G | C | 0.0000 | |
| 74 | Y | C | -0.3226 | |
| 75 | S | C | 0.0000 | |
| 76 | T | C | 0.0000 | |
| 77 | P | C | 0.0000 | |
| 78 | W | C | 0.0000 | |
| 79 | G | C | 0.0000 | |
| 80 | Y | C | 0.0000 | |
| 81 | F | C | 0.0000 | |
| 82 | D | C | 0.0000 | |
| 83 | F | C | 0.0000 | |
| 84 | N | C | 0.0000 | |
| 85 | R | C | -0.2304 | |
| 86 | F | C | 0.0000 | |
| 87 | H | C | 0.0000 | |
| 88 | C | C | 0.0000 | |
| 89 | H | C | 0.0000 | |
| 90 | F | C | 0.0000 | |
| 91 | S | C | -0.9918 | |
| 92 | P | C | -1.3559 | |
| 93 | R | C | -2.3579 | |
| 94 | D | C | 0.0000 | |
| 95 | W | C | 0.0000 | |
| 96 | Q | C | -1.8601 | |
| 97 | R | C | -2.0993 | |
| 98 | L | C | 0.0000 | |
| 99 | I | C | 0.0000 | |
| 100 | N | C | 0.0000 | |
| 101 | N | C | -1.7721 | |
| 102 | N | C | 0.0000 | |
| 103 | W | C | 0.0000 | |
| 104 | G | C | 0.0000 | |
| 105 | F | C | 0.0000 | |
| 106 | R | C | -0.9679 | |
| 107 | P | C | 0.0000 | |
| 108 | K | C | -2.1210 | |
| 109 | R | C | -1.8165 | |
| 110 | L | C | 0.0000 | |
| 111 | N | C | -0.8952 | |
| 112 | F | C | 0.0000 | |
| 113 | K | C | -1.0262 | |
| 114 | L | C | 0.0000 | |
| 115 | F | C | 0.0000 | |
| 116 | N | C | -1.2470 | |
| 117 | I | C | 0.0000 | |
| 118 | Q | C | -0.9841 | |
| 119 | V | C | 0.0000 | |
| 120 | K | C | -0.3882 | |
| 121 | E | C | -0.0237 | |
| 122 | V | C | 0.6726 | |
| 123 | T | C | 0.3400 | |
| 124 | T | C | -0.4142 | |
| 125 | N | C | -1.7795 | |
| 126 | D | C | -2.0948 | |
| 127 | G | C | -0.9298 | |
| 128 | V | C | 0.4989 | |
| 129 | T | C | 0.5213 | |
| 130 | T | C | 0.9223 | |
| 131 | I | C | 1.4263 | |
| 132 | A | C | 0.1940 | |
| 133 | N | C | -1.0076 | |
| 134 | N | C | -0.5605 | |
| 135 | L | C | 0.2326 | |
| 136 | T | C | -0.0391 | |
| 137 | S | C | 0.0000 | |
| 138 | T | C | -0.5164 | |
| 139 | V | C | 0.0000 | |
| 140 | Q | C | -0.5112 | |
| 141 | V | C | 0.0000 | |
| 142 | F | C | 0.0000 | |
| 143 | S | C | -0.4649 | |
| 144 | D | C | 0.0000 | |
| 145 | S | C | -1.1943 | |
| 146 | E | C | -2.2350 | |
| 147 | Y | C | -1.4075 | |
| 148 | Q | C | -0.9349 | |
| 149 | L | C | 0.0000 | |
| 150 | P | C | 0.0000 | |
| 151 | Y | C | 0.0000 | |
| 152 | V | C | 0.0000 | |
| 153 | L | C | 0.0000 | |
| 154 | G | C | -0.1403 | |
| 155 | S | C | -0.1553 | |
| 156 | A | C | 0.0000 | |
| 157 | H | C | 0.0000 | |
| 158 | Q | C | -0.4806 | |
| 159 | G | C | -0.0960 | |
| 160 | C | C | -0.0141 | |
| 161 | L | C | 0.0000 | |
| 162 | P | C | 0.0696 | |
| 163 | P | C | -0.0750 | |
| 164 | F | C | 0.5844 | |
| 165 | P | C | 0.0208 | |
| 166 | A | C | -0.2189 | |
| 167 | D | C | -0.6780 | |
| 168 | V | C | 1.1560 | |
| 169 | F | C | 0.0000 | |
| 170 | M | C | 1.2458 | |
| 171 | I | C | 0.0000 | |
| 172 | P | C | 0.0000 | |
| 173 | Q | C | 0.0995 | |
| 174 | Y | C | 0.0000 | |
| 175 | G | C | 0.0000 | |
| 176 | Y | C | 0.0000 | |
| 177 | L | C | 0.0000 | |
| 178 | T | C | 0.0000 | |
| 179 | L | C | 0.0958 | |
| 180 | N | C | 0.0000 | |
| 181 | N | C | -1.1684 | |
| 182 | G | C | -1.0441 | |
| 183 | S | C | -0.9270 | |
| 184 | Q | C | -1.1128 | |
| 185 | A | C | -0.3293 | |
| 186 | V | C | 0.1914 | |
| 187 | G | C | -0.2056 | |
| 188 | R | C | -0.1994 | |
| 189 | S | C | 0.0000 | |
| 190 | S | C | 0.0000 | |
| 191 | F | C | 0.3756 | |
| 192 | Y | C | 0.0000 | |
| 193 | C | C | 0.4269 | |
| 194 | L | C | 0.0000 | |
| 195 | E | C | -0.6717 | |
| 196 | Y | C | 0.8046 | |
| 197 | F | C | 0.0000 | |
| 198 | P | C | -0.4057 | |
| 199 | S | C | -0.6255 | |
| 200 | Q | C | -1.1778 | |
| 201 | M | C | -0.2592 | |
| 202 | L | C | 0.0000 | |
| 203 | R | C | -1.7380 | |
| 204 | T | C | -1.3369 | |
| 205 | G | C | 0.0000 | |
| 206 | N | C | -2.0534 | |
| 207 | N | C | -1.7963 | |
| 208 | F | C | 0.0000 | |
| 209 | T | C | -0.5052 | |
| 210 | F | C | -0.1431 | |
| 211 | S | C | -0.5257 | |
| 212 | Y | C | -0.6842 | |
| 213 | T | C | -1.2887 | |
| 214 | F | C | 0.0000 | |
| 215 | E | C | -2.1845 | |
| 216 | E | C | -2.2217 | |
| 217 | V | C | 0.0000 | |
| 218 | P | C | -0.5729 | |
| 219 | F | C | -0.1260 | |
| 220 | H | C | 0.0000 | |
| 221 | S | C | 0.0000 | |
| 222 | S | C | 0.0000 | |
| 223 | Y | C | 0.0000 | |
| 224 | A | C | 0.0000 | |
| 225 | H | C | 0.0000 | |
| 226 | S | C | 0.0000 | |
| 227 | Q | C | 0.0000 | |
| 228 | S | C | 0.0000 | |
| 229 | L | C | 0.0000 | |
| 230 | D | C | 0.0000 | |
| 231 | R | C | 0.0000 | |
| 232 | L | C | 0.1951 | |
| 233 | M | C | 0.0000 | |
| 234 | N | C | 0.0000 | |
| 235 | P | C | 0.0000 | |
| 236 | L | C | 0.4177 | |
| 237 | I | C | -0.1247 | |
| 238 | D | C | -0.9160 | |
| 239 | Q | C | 0.0000 | |
| 240 | Y | C | 0.0000 | |
| 241 | L | C | 0.0000 | |
| 242 | Y | C | 0.0000 | |
| 243 | Y | C | -0.0410 | |
| 244 | L | C | 0.0000 | |
| 245 | N | C | -0.5728 | |
| 246 | R | C | -1.1103 | |
| 247 | T | C | 0.0000 | |
| 248 | Q | C | -2.2442 | |
| 249 | N | C | -2.3730 | |
| 250 | Q | C | -2.2644 | |
| 251 | S | C | -1.5750 | |
| 252 | G | C | -1.4520 | |
| 253 | S | C | -1.1051 | |
| 254 | A | C | -1.5401 | |
| 255 | Q | C | -2.6249 | |
| 256 | N | C | -2.8487 | |
| 257 | K | C | -2.3274 | |
| 258 | D | C | -1.7810 | |
| 259 | L | C | 0.0000 | |
| 260 | L | C | -0.6836 | |
| 261 | F | C | 0.0000 | |
| 262 | S | C | 0.0000 | |
| 263 | R | C | -0.6748 | |
| 264 | G | C | 0.0000 | |
| 265 | S | C | -0.3993 | |
| 266 | P | C | -0.1457 | |
| 267 | A | C | -0.1203 | |
| 268 | G | C | -0.1838 | |
| 269 | M | C | 0.0000 | |
| 270 | S | C | 0.0000 | |
| 271 | V | C | 0.0667 | |
| 272 | Q | C | 0.0000 | |
| 273 | P | C | 0.0000 | |
| 274 | K | C | -0.1264 | |
| 275 | N | C | 0.0000 | |
| 276 | W | C | 0.0000 | |
| 277 | L | C | 0.0000 | |
| 278 | P | C | 0.0000 | |
| 279 | G | C | 0.0000 | |
| 280 | P | C | 0.0000 | |
| 281 | C | C | 0.0000 | |
| 282 | Y | C | 0.0000 | |
| 283 | R | C | 0.0000 | |
| 284 | Q | C | 0.0000 | |
| 285 | Q | C | 0.0000 | |
| 286 | R | C | -0.0999 | |
| 287 | V | C | 0.0000 | |
| 288 | S | C | 0.0000 | |
| 289 | K | C | -1.6804 | |
| 290 | T | C | -1.2447 | |
| 291 | K | C | -1.7014 | |
| 292 | T | C | -1.2161 | |
| 293 | D | C | -1.2675 | |
| 294 | N | C | 0.0000 | |
| 295 | N | C | 0.0000 | |
| 296 | N | C | -2.1558 | |
| 297 | S | C | -1.6197 | |
| 298 | N | C | -1.3610 | |
| 299 | F | C | 0.0000 | |
| 300 | T | C | 0.0000 | |
| 301 | W | C | 0.1653 | |
| 302 | T | C | 0.0219 | |
| 303 | G | C | 0.0000 | |
| 304 | A | C | 0.0000 | |
| 305 | S | C | 0.0000 | |
| 306 | K | C | 0.0000 | |
| 307 | Y | C | 0.0000 | |
| 308 | N | C | 0.0000 | |
| 309 | L | C | 0.0000 | |
| 310 | N | C | -0.8378 | |
| 311 | G | C | -1.0782 | |
| 312 | R | C | 0.0000 | |
| 313 | E | C | -0.5536 | |
| 314 | S | C | 0.0000 | |
| 315 | I | C | 0.0000 | |
| 316 | I | C | 0.0000 | |
| 317 | N | C | 0.0000 | |
| 318 | P | C | 0.0000 | |
| 319 | G | C | 0.0000 | |
| 320 | T | C | 0.0000 | |
| 321 | A | C | -0.0727 | |
| 322 | M | C | 0.0000 | |
| 323 | A | C | 0.0000 | |
| 324 | S | C | 0.0000 | |
| 325 | H | C | 0.0000 | |
| 326 | K | C | -1.7905 | |
| 327 | D | C | -2.1048 | |
| 328 | D | C | -2.8538 | |
| 329 | E | C | -2.4886 | |
| 330 | D | C | -3.3468 | |
| 331 | K | C | -2.4935 | |
| 332 | F | C | -1.6353 | |
| 333 | F | C | 0.0000 | |
| 334 | P | C | 0.0000 | |
| 335 | M | C | 0.0000 | |
| 336 | S | C | 0.0000 | |
| 337 | G | C | 0.0000 | |
| 338 | V | C | 0.0000 | |
| 339 | M | C | 0.0000 | |
| 340 | I | C | 0.0000 | |
| 341 | F | C | 0.0000 | |
| 342 | G | C | -1.3646 | |
| 343 | K | C | -2.3057 | |
| 344 | E | C | -2.3119 | |
| 345 | S | C | -1.7085 | |
| 346 | A | C | 0.0000 | |
| 347 | G | C | -0.9061 | |
| 348 | A | C | -0.4907 | |
| 349 | S | C | -0.5333 | |
| 350 | N | C | -0.7330 | |
| 351 | T | C | 0.0000 | |
| 352 | A | C | -0.6412 | |
| 353 | L | C | -0.8425 | |
| 354 | D | C | -1.8959 | |
| 355 | N | C | -1.7534 | |
| 356 | V | C | 0.0000 | |
| 357 | M | C | 0.0000 | |
| 358 | I | C | -0.2671 | |
| 359 | T | C | 0.0000 | |
| 360 | D | C | -1.4352 | |
| 361 | E | C | 0.0000 | |
| 362 | E | C | -1.7126 | |
| 363 | E | C | -1.0096 | |
| 364 | I | C | 0.0000 | |
| 365 | K | C | -0.7267 | |
| 366 | A | C | 0.0000 | |
| 367 | T | C | 0.0000 | |
| 368 | N | C | 0.0000 | |
| 369 | P | C | 0.0000 | |
| 370 | V | C | 0.0000 | |
| 371 | A | C | 0.0000 | |
| 372 | T | C | 0.0000 | |
| 373 | E | C | -0.6582 | |
| 374 | R | C | -0.8728 | |
| 375 | F | C | 0.0000 | |
| 376 | G | C | 0.0000 | |
| 377 | T | C | 0.0000 | |
| 378 | V | C | 0.0000 | |
| 379 | A | C | 0.0000 | |
| 380 | V | C | -0.0912 | |
| 381 | N | C | -0.2536 | |
| 382 | F | C | 0.3271 | |
| 383 | Q | C | 0.0000 | |
| 384 | S | C | -0.8939 | |
| 385 | S | C | -1.1883 | |
| 386 | S | C | -0.9214 | |
| 387 | T | C | -1.0612 | |
| 388 | D | C | -1.9593 | |
| 389 | P | C | -0.8827 | |
| 390 | A | C | -0.3200 | |
| 391 | T | C | -0.3030 | |
| 392 | G | C | -0.7427 | |
| 393 | D | C | -1.5228 | |
| 394 | V | C | 0.0000 | |
| 395 | H | C | -0.6341 | |
| 396 | A | C | -0.2401 | |
| 397 | M | C | 0.0000 | |
| 398 | G | C | 0.0000 | |
| 399 | A | C | 0.0000 | |
| 400 | L | C | 0.0000 | |
| 401 | P | C | 0.0000 | |
| 402 | G | C | 0.0000 | |
| 403 | M | C | 0.0000 | |
| 404 | V | C | 0.0000 | |
| 405 | W | C | 0.0000 | |
| 406 | Q | C | 0.0000 | |
| 407 | D | C | -0.4268 | |
| 408 | R | C | 0.0000 | |
| 409 | D | C | 0.0000 | |
| 410 | V | C | 0.0000 | |
| 411 | Y | C | 0.0000 | |
| 412 | L | C | 0.0000 | |
| 413 | Q | C | 0.0000 | |
| 414 | G | C | 0.0000 | |
| 415 | P | C | 0.0000 | |
| 416 | I | C | 0.0000 | |
| 417 | W | C | 0.0000 | |
| 418 | A | C | 0.0000 | |
| 419 | K | C | -1.1049 | |
| 420 | I | C | 0.0000 | |
| 421 | P | C | 0.0000 | |
| 422 | H | C | -1.3735 | |
| 423 | T | C | -0.8011 | |
| 424 | D | C | -0.8150 | |
| 425 | G | C | 0.0000 | |
| 426 | H | C | -0.7676 | |
| 427 | F | C | 0.0000 | |
| 428 | H | C | -0.4890 | |
| 429 | P | C | -0.5314 | |
| 430 | S | C | -0.3552 | |
| 431 | P | C | 0.0000 | |
| 432 | L | C | 0.0000 | |
| 433 | M | C | 0.0000 | |
| 434 | G | C | 0.0000 | |
| 435 | G | C | -0.1307 | |
| 436 | F | C | 0.0000 | |
| 437 | G | C | -0.7927 | |
| 438 | L | C | 0.0000 | |
| 439 | K | C | -2.5998 | |
| 440 | N | C | -2.4847 | |
| 441 | P | C | 0.0000 | |
| 442 | P | C | 0.0000 | |
| 443 | P | C | 0.0000 | |
| 444 | Q | C | 0.0000 | |
| 445 | I | C | 0.0000 | |
| 446 | L | C | 0.0000 | |
| 447 | I | C | 0.0000 | |
| 448 | K | C | 0.0000 | |
| 449 | N | C | 0.0000 | |
| 450 | T | C | 0.1707 | |
| 451 | P | C | 0.0329 | |
| 452 | V | C | 0.4091 | |
| 453 | P | C | 0.0704 | |
| 454 | A | C | -0.3193 | |
| 455 | N | C | -1.3313 | |
| 456 | P | C | -0.9234 | |
| 457 | P | C | -0.8485 | |
| 458 | A | C | -0.7534 | |
| 459 | E | C | -1.0189 | |
| 460 | F | C | 0.8785 | |
| 461 | S | C | 0.0192 | |
| 462 | A | C | 0.0257 | |
| 463 | T | C | -0.5280 | |
| 464 | K | C | -1.4744 | |
| 465 | F | C | -0.3071 | |
| 466 | A | C | -0.2492 | |
| 467 | S | C | -0.3189 | |
| 468 | F | C | 0.2570 | |
| 469 | I | C | 0.6094 | |
| 470 | T | C | 0.1594 | |
| 471 | Q | C | 0.0000 | |
| 472 | Y | C | 0.3830 | |
| 473 | S | C | 0.0000 | |
| 474 | T | C | 0.0340 | |
| 475 | G | C | 0.0000 | |
| 476 | Q | C | -0.3176 | |
| 477 | V | C | 0.0000 | |
| 478 | S | C | -0.6133 | |
| 479 | V | C | 0.0000 | |
| 480 | E | C | -0.9934 | |
| 481 | I | C | 0.0000 | |
| 482 | E | C | 0.0000 | |
| 483 | W | C | 0.0000 | |
| 484 | E | C | -1.6535 | |
| 485 | L | C | 0.0000 | |
| 486 | Q | C | -2.0418 | |
| 487 | K | C | -2.6601 | |
| 488 | E | C | -2.3688 | |
| 489 | N | C | -2.1196 | |
| 490 | S | C | -1.2074 | |
| 491 | K | C | -0.2987 | |
| 492 | R | C | 0.0000 | |
| 493 | W | C | 1.1333 | |
| 494 | N | C | 0.0328 | |
| 495 | P | C | -0.3494 | |
| 496 | E | C | -0.4110 | |
| 497 | V | C | -0.1384 | |
| 498 | Q | C | -0.6971 | |
| 499 | Y | C | -0.4979 | |
| 500 | T | C | -0.5956 | |
| 501 | S | C | -0.7107 | |
| 502 | N | C | -0.8949 | |
| 503 | Y | C | 0.2960 | |
| 504 | A | C | -0.3923 | |
| 505 | K | C | -1.6149 | |
| 506 | S | C | -1.1024 | |
| 507 | A | C | -0.8047 | |
| 508 | N | C | -1.0247 | |
| 509 | V | C | 0.4115 | |
| 510 | D | C | -0.5915 | |
| 511 | F | C | -0.1778 | |
| 512 | T | C | 0.4390 | |
| 513 | V | C | 0.4025 | |
| 514 | D | C | -1.1115 | |
| 515 | N | C | -2.0935 | |
| 516 | N | C | -1.8577 | |
| 517 | G | C | -1.1024 | |
| 518 | L | C | -0.2211 | |
| 519 | Y | C | -0.0583 | |
| 520 | T | C | -0.3168 | |
| 521 | E | C | -0.9676 | |
| 522 | P | C | -0.9198 | |
| 523 | R | C | -1.1045 | |
| 524 | P | C | -0.6532 | |
| 525 | I | C | 0.0000 | |
| 526 | G | C | -0.3281 | |
| 527 | T | C | 0.0000 | |
| 528 | R | C | 0.0000 | |
| 529 | Y | C | -0.1481 | |
| 530 | L | C | 0.0000 | |
| 531 | T | C | 0.0000 | |
| 532 | R | C | -0.6809 | |
| 533 | P | C | -0.2096 | |
| 534 | L | C | 0.0000 |
Calculations for various pH values
This page contains details and comparisons for all models calculated at different pH points.
pH |
Average A3D Score |
Max A3D Score |
|||
| 4.0 | -0.1756 | 4.2819 | View | CSV | PDB |
| 4.5 | -0.2113 | 4.1571 | View | CSV | PDB |
| 5.0 | -0.254 | 3.9783 | View | CSV | PDB |
| 5.5 | -0.2975 | 3.971 | View | CSV | PDB |
| 6.0 | -0.3357 | 3.9689 | View | CSV | PDB |
| 6.5 | -0.3644 | 3.9741 | View | CSV | PDB |
| 7.0 | -0.3836 | 3.9872 | View | CSV | PDB |
| 7.5 | -0.3959 | 4.0052 | View | CSV | PDB |
| 8.0 | -0.4037 | 4.0248 | View | CSV | PDB |
| 8.5 | -0.4063 | 4.0449 | View | CSV | PDB |
| 9.0 | -0.4025 | 4.0642 | View | CSV | PDB |
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