| Chain sequence(s) | GVGNASGDWHCDSTWSEGHVTTTSTRTWVLPTYNNHLYKRLGESLQSNTYNGFSTPWGYFDFNRFHCHFSPRDWQRLINNNWGMRPKAMRVKIFNIQVKEVTTSNGETTVANNLTSTVQIFADSSYELPYVMDAGQEGSLPPFPNDVFMVPQYGYCGLVTGNTSQQQTDRNAFYCLEYFPSQMLRTGNNFEITYSFEKVPFHSMYAHSQSLDRLMNPLIDQYLWGLQSTTTGTTLNAGTATTNFTKLRPTNFSNFKKNWLPGPSIKQQGFSKTANQNYKIPATGSDSLIKYETHSTLDGRWSALTPGPPMATAGPADSKFSNSQLIFAGPKQNGNTATVPGTLIFTSEEELAATNATDTDMWGNLPGGDQSNSNLPTVDRLTALGAVPGMVWQNRDIYYQGPIWAKIPHTDGHFHPSPLIGGFGLKHPPPQIFIKNTPVPANPATTFSSTPVNSFITQYSTGQVSVQIDWEIQKERSKRWNPEVQFTSNYGQQNSLLWAPDAAGKYTEPRAIGTRYLTHHLGVGNASGDWHCDSTWSEGHVTTTSTRTWVLPTYNNHLYKRLGESLQSNTYNGFSTPWGYFDFNRFHCHFSPRDWQRLINNNWGMRPKAMRVKIFNIQVKEVTTSNGETTVANNLTSTVQIFADSSYELPYVMDAGQEGSLPPFPNDVFMVPQYGYCGLVTGNTSQQQTDRNAFYCLEYFPSQMLRTGNNFEITYSFEKVPFHSMYAHSQSLDRLMNPLIDQYLWGLQSTTTGTTLNAGTATTNFTKLRPTNFSNFKKNWLPGPSIKQQGFSKTANQNYKIPATGSDSLIKYETHSTLDGRWSALTPGPPMATAGPADSKFSNSQLIFAGPKQNGNTATVPGTLIFTSEEELAATNATDTDMWGNLPGGDQSNSNLPTVDRLTALGAVPGMVWQNRDIYYQGPIWAKIPHTDGHFHPSPLIGGFGLKHPPPQIFIKNTPVPANPATTFSSTPVNSFITQYSTGQVSVQIDWEIQKERSKRWNPEVQFTSNYGQQNSLLWAPDAAGKYTEPRAIGTRYLTHHLGVGNASGDWHCDSTWSEGHVTTTSTRTWVLPTYNNHLYKRLGESLQSNTYNGFSTPWGYFDFNRFHCHFSPRDWQRLINNNWGMRPKAMRVKIFNIQVKEVTTSNGETTVANNLTSTVQIFADSSYELPYVMDAGQEGSLPPFPNDVFMVPQYGYCGLVTGNTSQQQTDRNAFYCLEYFPSQMLRTGNNFEITYSFEKVPFHSMYAHSQSLDRLMNPLIDQYLWGLQSTTTGTTLNAGTATTNFTKLRPTNFSNFKKNWLPGPSIKQQGFSKTANQNYKIPATGSDSLIKYETHSTLDGRWSALTPGPPMATAGPADSKFSNSQLIFAGPKQNGNTATVPGTLIFTSEEELAATNATDTDMWGNLPGGDQSNSNLPTVDRLTALGAVPGMVWQNRDIYYQGPIWAKIPHTDGHFHPSPLIGGFGLKHPPPQIFIKNTPVPANPATTFSSTPVNSFITQYSTGQVSVQIDWEIQKERSKRWNPEVQFTSNYGQQNSLLWAPDAAGKYTEPRAIGTRYLTHHL 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] (00:00:01)
[WARNING] runJob: Working directory already exists (possibly overwriting previous results -ow
to prevent this behavior) (00:00:01)
[INFO] runJob: Starting aggrescan3d job on: input.pdb with all chain(s) selected (00:00:01)
[INFO] runJob: Creating pdb object from: input.pdb (00:00:01)
[INFO] PDB-Info: The input structure is globular. Max score is recommended for pH analysis. (00:00:11)
[INFO] FoldX: Starting FoldX energy minimization (00:00:11)
[INFO] Analysis: Starting Aggrescan4D on folded.pdb (00:10:58)
[INFO] agg3D: Running pKa-ANI on
/STORAGE/DATA/lcbio/aggreskan/46cf3759d55298/tmp/folded.pdb (00:10:58)
[INFO] Main: Simulation completed successfully. (00:40:43)
|
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 | |
| 18 | G | A | -0.5355 | |
| 19 | V | A | 0.6387 | |
| 20 | G | A | -0.4101 | |
| 21 | N | A | -1.2809 | |
| 22 | A | A | -1.1496 | |
| 23 | S | A | -1.2697 | |
| 24 | G | A | -1.4756 | |
| 25 | D | A | -1.6828 | |
| 26 | W | A | -0.6233 | |
| 27 | H | A | -1.3670 | |
| 28 | C | A | -1.0374 | |
| 29 | D | A | -1.8552 | |
| 30 | S | A | -1.0089 | |
| 31 | T | A | -0.5651 | |
| 32 | W | A | -0.5932 | |
| 33 | S | A | -1.2179 | |
| 34 | E | A | -2.3760 | |
| 35 | G | A | -1.7408 | |
| 36 | H | A | -1.6048 | |
| 37 | V | A | 0.0000 | |
| 38 | T | A | -0.7645 | |
| 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 | 0.2616 | |
| 45 | W | A | 0.0000 | |
| 46 | V | A | 1.0196 | |
| 47 | L | A | 0.0000 | |
| 48 | P | A | 0.1408 | |
| 49 | T | A | -0.1882 | |
| 50 | Y | A | -0.0917 | |
| 51 | N | A | -0.4799 | |
| 52 | N | A | -1.0747 | |
| 53 | H | A | -0.2189 | |
| 54 | L | A | 0.6017 | |
| 55 | Y | A | 0.0785 | |
| 56 | K | A | -1.0193 | |
| 57 | R | A | -1.0911 | |
| 58 | L | A | -0.6106 | |
| 59 | G | A | -0.9694 | |
| 60 | E | A | -1.1039 | |
| 61 | S | A | -0.9789 | |
| 62 | L | A | -0.4794 | |
| 63 | Q | A | -1.2937 | |
| 64 | S | A | 0.0000 | |
| 65 | N | A | -0.6995 | |
| 66 | T | A | 0.0000 | |
| 67 | Y | A | 0.0000 | |
| 68 | N | A | 0.0000 | |
| 69 | G | A | 0.0000 | |
| 70 | F | A | -0.3076 | |
| 71 | S | A | 0.0000 | |
| 72 | T | A | 0.0000 | |
| 73 | P | A | 0.0000 | |
| 74 | W | A | 0.0000 | |
| 75 | G | A | 0.0000 | |
| 76 | Y | A | 0.0000 | |
| 77 | F | A | 0.0000 | |
| 78 | D | A | 0.0000 | |
| 79 | F | A | 0.0000 | |
| 80 | N | A | 0.0000 | |
| 81 | R | A | -0.3254 | |
| 82 | F | A | 0.0000 | |
| 83 | H | A | 0.0000 | |
| 84 | C | A | 0.0000 | |
| 85 | H | A | 0.0000 | |
| 86 | F | A | 0.0000 | |
| 87 | S | A | -1.0408 | |
| 88 | P | A | -1.2486 | |
| 89 | R | A | -2.3537 | |
| 90 | D | A | 0.0000 | |
| 91 | W | A | 0.0000 | |
| 92 | Q | A | -1.9902 | |
| 93 | R | A | -2.1114 | |
| 94 | L | A | 0.0000 | |
| 95 | I | A | 0.0000 | |
| 96 | N | A | 0.0000 | |
| 97 | N | A | -2.0701 | |
| 98 | N | A | 0.0000 | |
| 99 | W | A | -0.9393 | |
| 100 | G | A | 0.0000 | |
| 101 | M | A | 0.0000 | |
| 102 | R | A | -0.9284 | |
| 103 | P | A | 0.0000 | |
| 104 | K | A | -1.6127 | |
| 105 | A | A | -0.8588 | |
| 106 | M | A | 0.0000 | |
| 107 | R | A | -0.9698 | |
| 108 | V | A | 0.0000 | |
| 109 | K | A | -1.5535 | |
| 110 | I | A | 0.0000 | |
| 111 | F | A | 0.0000 | |
| 112 | N | A | -1.2887 | |
| 113 | I | A | 0.0000 | |
| 114 | Q | A | -0.9849 | |
| 115 | V | A | 0.0000 | |
| 116 | K | A | -0.6438 | |
| 117 | E | A | -0.2351 | |
| 118 | V | A | 0.3431 | |
| 119 | T | A | -0.1166 | |
| 120 | T | A | -0.9911 | |
| 121 | S | A | -1.6436 | |
| 122 | N | A | -2.1907 | |
| 123 | G | A | -2.0643 | |
| 124 | E | A | -2.5793 | |
| 125 | T | A | -1.0034 | |
| 126 | T | A | -0.0799 | |
| 127 | V | A | 0.7836 | |
| 128 | A | A | -0.1485 | |
| 129 | N | A | -1.1867 | |
| 130 | N | A | -0.6938 | |
| 131 | L | A | 0.2357 | |
| 132 | T | A | -0.0138 | |
| 133 | S | A | 0.0000 | |
| 134 | T | A | -0.5619 | |
| 135 | V | A | 0.0000 | |
| 136 | Q | A | -0.5424 | |
| 137 | I | A | 0.0000 | |
| 138 | F | A | 0.0000 | |
| 139 | A | A | -0.3607 | |
| 140 | D | A | 0.0000 | |
| 141 | S | A | -0.4146 | |
| 142 | S | A | -0.6699 | |
| 143 | Y | A | -0.5927 | |
| 144 | E | A | -0.8411 | |
| 145 | L | A | 0.0000 | |
| 146 | P | A | 0.0000 | |
| 147 | Y | A | 0.0000 | |
| 148 | V | A | 0.0000 | |
| 149 | M | A | 0.0000 | |
| 150 | D | A | 0.0000 | |
| 151 | A | A | -0.1169 | |
| 152 | G | A | 0.0000 | |
| 153 | Q | A | 0.0000 | |
| 154 | E | A | -1.2881 | |
| 155 | G | A | -0.4623 | |
| 156 | S | A | -0.3188 | |
| 157 | L | A | 0.0000 | |
| 158 | P | A | -0.2739 | |
| 159 | P | A | -0.4334 | |
| 160 | F | A | -0.5636 | |
| 161 | P | A | -0.7519 | |
| 162 | N | A | -1.5938 | |
| 163 | D | A | -1.5558 | |
| 164 | V | A | 0.9539 | |
| 165 | F | A | 0.9355 | |
| 166 | M | A | 1.3464 | |
| 167 | V | A | 0.0000 | |
| 168 | P | A | 0.0000 | |
| 169 | Q | A | 0.0743 | |
| 170 | Y | A | 0.0000 | |
| 171 | G | A | 0.0000 | |
| 172 | Y | A | 0.0000 | |
| 173 | C | A | 0.0000 | |
| 174 | G | A | 0.0000 | |
| 175 | L | A | 0.0000 | |
| 176 | V | A | 0.0000 | |
| 177 | T | A | -0.8598 | |
| 178 | G | A | -0.8513 | |
| 179 | N | A | -1.0089 | |
| 180 | T | A | -0.9203 | |
| 181 | S | A | -1.1031 | |
| 182 | Q | A | -1.4152 | |
| 183 | Q | A | -1.7302 | |
| 184 | Q | A | -1.5681 | |
| 185 | T | A | -1.4898 | |
| 186 | D | A | -2.0457 | |
| 187 | R | A | -1.2340 | |
| 188 | N | A | 0.0000 | |
| 189 | A | A | 0.0000 | |
| 190 | F | A | 0.2866 | |
| 191 | Y | A | 0.0000 | |
| 192 | C | A | 0.0000 | |
| 193 | L | A | 0.0000 | |
| 194 | E | A | -0.4589 | |
| 195 | Y | A | 0.8311 | |
| 196 | F | A | 0.0000 | |
| 197 | P | A | -0.3525 | |
| 198 | S | A | -0.5887 | |
| 199 | Q | A | -1.0420 | |
| 200 | M | A | -0.4879 | |
| 201 | L | A | 0.0000 | |
| 202 | R | A | -1.6246 | |
| 203 | T | A | -1.2577 | |
| 204 | G | A | -1.2450 | |
| 205 | N | A | -1.7991 | |
| 206 | N | A | -2.1260 | |
| 207 | F | A | -1.5134 | |
| 208 | E | A | -2.0982 | |
| 209 | I | A | -0.7862 | |
| 210 | T | A | -0.5430 | |
| 211 | Y | A | -0.2005 | |
| 212 | S | A | -0.8849 | |
| 213 | F | A | 0.0000 | |
| 214 | E | A | -1.8728 | |
| 215 | K | A | -2.0891 | |
| 216 | V | A | 0.0000 | |
| 217 | P | A | -0.5752 | |
| 218 | F | A | -0.1289 | |
| 219 | H | A | 0.0000 | |
| 220 | S | A | 0.0000 | |
| 221 | M | A | 0.0000 | |
| 222 | Y | A | 0.0000 | |
| 223 | A | A | 0.0000 | |
| 224 | H | A | 0.0000 | |
| 225 | S | A | 0.0000 | |
| 226 | Q | A | 0.0000 | |
| 227 | S | A | 0.0000 | |
| 228 | L | A | 0.0000 | |
| 229 | D | A | 0.0000 | |
| 230 | R | A | 0.0000 | |
| 231 | L | A | 0.2299 | |
| 232 | M | A | 0.0000 | |
| 233 | N | A | 0.0000 | |
| 234 | P | A | 0.0000 | |
| 235 | L | A | 0.3388 | |
| 236 | I | A | -0.2465 | |
| 237 | D | A | -0.9828 | |
| 238 | Q | A | 0.0000 | |
| 239 | Y | A | 0.0000 | |
| 240 | L | A | 0.0000 | |
| 241 | W | A | 0.0000 | |
| 242 | G | A | -0.2671 | |
| 243 | L | A | 0.0000 | |
| 244 | Q | A | -0.3712 | |
| 245 | S | A | 0.0000 | |
| 246 | T | A | 0.0000 | |
| 247 | T | A | 0.0000 | |
| 248 | T | A | -0.5470 | |
| 249 | G | A | -0.7431 | |
| 250 | T | A | -0.7671 | |
| 251 | T | A | -0.7703 | |
| 252 | L | A | -0.7039 | |
| 253 | N | A | -1.4748 | |
| 254 | A | A | -0.9726 | |
| 255 | G | A | -0.9624 | |
| 256 | T | A | -0.7772 | |
| 257 | A | A | -1.1034 | |
| 258 | T | A | -0.3417 | |
| 259 | T | A | 0.0000 | |
| 260 | N | A | -0.0274 | |
| 261 | F | A | 0.0000 | |
| 262 | T | A | -0.7636 | |
| 263 | K | A | -0.9734 | |
| 264 | L | A | 0.0000 | |
| 265 | R | A | -1.3286 | |
| 266 | P | A | -0.5171 | |
| 267 | T | A | -0.5069 | |
| 268 | N | A | -0.6037 | |
| 269 | F | A | 0.0000 | |
| 270 | S | A | 0.0000 | |
| 271 | N | A | -0.4109 | |
| 272 | F | A | 0.0000 | |
| 273 | K | A | 0.0000 | |
| 274 | K | A | -0.1866 | |
| 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 | S | A | 0.0000 | |
| 282 | I | A | 0.0000 | |
| 283 | K | A | 0.0000 | |
| 284 | Q | A | 0.0000 | |
| 285 | Q | A | 0.0000 | |
| 286 | G | A | 0.0000 | |
| 287 | F | A | 0.0000 | |
| 288 | S | A | -1.2467 | |
| 289 | K | A | -0.8128 | |
| 290 | T | A | -0.6859 | |
| 291 | A | A | -0.9378 | |
| 292 | N | A | -2.0624 | |
| 293 | Q | A | -2.1343 | |
| 294 | N | A | 0.0000 | |
| 295 | Y | A | -1.5855 | |
| 296 | K | A | -1.5447 | |
| 297 | I | A | 0.0000 | |
| 298 | P | A | 0.0000 | |
| 299 | A | A | -0.3459 | |
| 300 | T | A | -0.5021 | |
| 301 | G | A | -0.8415 | |
| 302 | S | A | -0.7072 | |
| 303 | D | A | -0.8967 | |
| 304 | S | A | -0.5217 | |
| 305 | L | A | 0.0000 | |
| 306 | I | A | -0.0282 | |
| 307 | K | A | -0.2991 | |
| 308 | Y | A | 0.0000 | |
| 309 | E | A | 0.0000 | |
| 310 | T | A | 0.0000 | |
| 311 | H | A | 0.0000 | |
| 312 | S | A | 0.0000 | |
| 313 | T | A | 0.0000 | |
| 314 | L | A | 0.0000 | |
| 315 | D | A | -0.7618 | |
| 316 | G | A | -0.6627 | |
| 317 | R | A | 0.0000 | |
| 318 | W | A | -0.0722 | |
| 319 | S | A | 0.0165 | |
| 320 | A | A | 0.0000 | |
| 321 | L | A | 0.0000 | |
| 322 | T | A | 0.0000 | |
| 323 | P | A | 0.0000 | |
| 324 | G | A | 0.0000 | |
| 325 | P | A | 0.0000 | |
| 326 | P | A | 0.0000 | |
| 327 | M | A | 0.0000 | |
| 328 | A | A | 0.0000 | |
| 329 | T | A | 0.0000 | |
| 330 | A | A | -0.9654 | |
| 331 | G | A | -1.0903 | |
| 332 | P | A | -0.8909 | |
| 333 | A | A | -0.9042 | |
| 334 | D | A | -1.8368 | |
| 335 | S | A | -1.4259 | |
| 336 | K | A | -1.4520 | |
| 337 | F | A | 0.0000 | |
| 338 | S | A | 0.0000 | |
| 339 | N | A | -0.1686 | |
| 340 | S | A | 0.0000 | |
| 341 | Q | A | 0.0000 | |
| 342 | L | A | 0.0000 | |
| 343 | I | A | 0.0000 | |
| 344 | F | A | 0.0000 | |
| 345 | A | A | -0.8170 | |
| 346 | G | A | -1.0529 | |
| 347 | P | A | -1.4776 | |
| 348 | K | A | -2.2630 | |
| 349 | Q | A | -1.7774 | |
| 350 | N | A | -2.2148 | |
| 351 | G | A | -1.5380 | |
| 352 | N | A | -1.5684 | |
| 353 | T | A | -0.7822 | |
| 354 | A | A | 0.0000 | |
| 355 | T | A | 0.5410 | |
| 356 | V | A | 1.3391 | |
| 357 | P | A | 0.4322 | |
| 358 | G | A | -0.2369 | |
| 359 | T | A | -0.6591 | |
| 360 | L | A | 0.0000 | |
| 361 | I | A | -0.1240 | |
| 362 | F | A | 0.0000 | |
| 363 | T | A | 0.0000 | |
| 364 | S | A | -0.5896 | |
| 365 | E | A | 0.0000 | |
| 366 | E | A | -1.1378 | |
| 367 | E | A | -0.7705 | |
| 368 | L | A | 0.0000 | |
| 369 | A | A | -0.5215 | |
| 370 | A | A | 0.0000 | |
| 371 | T | A | 0.0000 | |
| 372 | N | A | 0.0000 | |
| 373 | A | A | 0.0000 | |
| 374 | T | A | -0.4342 | |
| 375 | D | A | 0.0000 | |
| 376 | T | A | -0.6922 | |
| 377 | D | A | -1.0239 | |
| 378 | M | A | -0.4466 | |
| 379 | W | A | 0.0000 | |
| 380 | G | A | 0.0000 | |
| 381 | N | A | -0.7255 | |
| 382 | L | A | 0.0000 | |
| 383 | P | A | 0.0000 | |
| 384 | G | A | -1.0641 | |
| 385 | G | A | -1.0555 | |
| 386 | D | A | -1.8219 | |
| 387 | Q | A | 0.0000 | |
| 388 | S | A | -1.8216 | |
| 389 | N | A | -2.3955 | |
| 390 | S | A | -1.6296 | |
| 391 | N | A | -1.6939 | |
| 392 | L | A | -0.3034 | |
| 393 | P | A | 0.0000 | |
| 394 | T | A | -0.2924 | |
| 395 | V | A | -0.2209 | |
| 396 | D | A | -1.4614 | |
| 397 | R | A | -1.6622 | |
| 398 | L | A | 0.0000 | |
| 399 | T | A | -0.6115 | |
| 400 | A | A | -0.1779 | |
| 401 | L | A | 0.0000 | |
| 402 | G | A | 0.0000 | |
| 403 | A | A | 0.0000 | |
| 404 | V | A | 0.0000 | |
| 405 | P | A | 0.0000 | |
| 406 | G | A | 0.0000 | |
| 407 | M | A | 0.0000 | |
| 408 | V | A | 0.0000 | |
| 409 | W | A | 0.0000 | |
| 410 | Q | A | 0.0000 | |
| 411 | N | A | -0.3629 | |
| 412 | R | A | 0.0000 | |
| 413 | D | A | 0.0000 | |
| 414 | I | A | 0.0000 | |
| 415 | Y | A | 0.0000 | |
| 416 | Y | A | 0.0000 | |
| 417 | Q | A | 0.0000 | |
| 418 | G | A | 0.0000 | |
| 419 | P | A | 0.0000 | |
| 420 | I | A | 0.0000 | |
| 421 | W | A | 0.0000 | |
| 422 | A | A | 0.0000 | |
| 423 | K | A | 0.0000 | |
| 424 | I | A | 0.0000 | |
| 425 | P | A | 0.0000 | |
| 426 | H | A | -1.2918 | |
| 427 | T | A | -0.8159 | |
| 428 | D | A | -0.8535 | |
| 429 | G | A | 0.0000 | |
| 430 | H | A | -0.9700 | |
| 431 | F | A | 0.0000 | |
| 432 | H | A | -0.5662 | |
| 433 | P | A | -0.5703 | |
| 434 | S | A | -0.3494 | |
| 435 | P | A | 0.0000 | |
| 436 | L | A | 0.0000 | |
| 437 | I | A | 0.0000 | |
| 438 | G | A | 0.0000 | |
| 439 | G | A | -0.1288 | |
| 440 | F | A | 0.0000 | |
| 441 | G | A | -0.6976 | |
| 442 | L | A | 0.0000 | |
| 443 | K | A | -2.3748 | |
| 444 | H | A | -1.9409 | |
| 445 | P | A | 0.0000 | |
| 446 | P | A | 0.0000 | |
| 447 | P | A | 0.0000 | |
| 448 | Q | A | 0.0000 | |
| 449 | I | A | 0.0000 | |
| 450 | F | A | 0.0000 | |
| 451 | I | A | 0.0000 | |
| 452 | K | A | 0.0000 | |
| 453 | N | A | 0.0000 | |
| 454 | T | A | 0.1260 | |
| 455 | P | A | -0.0453 | |
| 456 | V | A | 0.4445 | |
| 457 | P | A | 0.0411 | |
| 458 | A | A | -0.3370 | |
| 459 | N | A | -1.2590 | |
| 460 | P | A | -0.5826 | |
| 461 | A | A | 0.0922 | |
| 462 | T | A | 0.1393 | |
| 463 | T | A | 0.7668 | |
| 464 | F | A | 1.7085 | |
| 465 | S | A | 0.6917 | |
| 466 | S | A | 0.2001 | |
| 467 | T | A | 0.0212 | |
| 468 | P | A | -0.1101 | |
| 469 | V | A | 0.4002 | |
| 470 | N | A | -0.8168 | |
| 471 | S | A | -0.5738 | |
| 472 | F | A | 0.1013 | |
| 473 | I | A | 0.6222 | |
| 474 | T | A | 0.2649 | |
| 475 | Q | A | 0.0000 | |
| 476 | Y | A | 0.2965 | |
| 477 | S | A | 0.0000 | |
| 478 | T | A | 0.1653 | |
| 479 | G | A | 0.0000 | |
| 480 | Q | A | -0.3945 | |
| 481 | V | A | 0.0000 | |
| 482 | S | A | -0.8478 | |
| 483 | V | A | 0.0000 | |
| 484 | Q | A | -0.9432 | |
| 485 | I | A | 0.0000 | |
| 486 | D | A | -1.0080 | |
| 487 | W | A | 0.0000 | |
| 488 | E | A | -1.2656 | |
| 489 | I | A | 0.0000 | |
| 490 | Q | A | -1.9868 | |
| 491 | K | A | -2.8356 | |
| 492 | E | A | -2.4491 | |
| 493 | R | A | -2.7871 | |
| 494 | S | A | -1.4302 | |
| 495 | K | A | -0.6131 | |
| 496 | R | A | -0.1245 | |
| 497 | W | A | 1.0062 | |
| 498 | N | A | -0.1068 | |
| 499 | P | A | -0.5452 | |
| 500 | E | A | -0.7204 | |
| 501 | V | A | -0.5731 | |
| 502 | Q | A | -0.7688 | |
| 503 | F | A | 0.0000 | |
| 504 | T | A | -0.8924 | |
| 505 | S | A | -0.8968 | |
| 506 | N | A | -1.4937 | |
| 507 | Y | A | -0.6651 | |
| 508 | G | A | -1.2888 | |
| 509 | Q | A | -1.8604 | |
| 510 | Q | A | -1.3984 | |
| 511 | N | A | -1.5679 | |
| 512 | S | A | -0.4261 | |
| 513 | L | A | 0.9065 | |
| 514 | L | A | 0.7174 | |
| 515 | W | A | 0.3092 | |
| 516 | A | A | 0.1594 | |
| 517 | P | A | -0.7249 | |
| 518 | D | A | -1.1636 | |
| 519 | A | A | -0.7301 | |
| 520 | A | A | -0.8776 | |
| 521 | G | A | -1.4711 | |
| 522 | K | A | -2.2386 | |
| 523 | Y | A | -1.2392 | |
| 524 | T | A | -0.8380 | |
| 525 | E | A | -0.2764 | |
| 526 | P | A | -0.5320 | |
| 527 | R | A | -0.6005 | |
| 528 | A | A | 0.0000 | |
| 529 | I | A | 0.0000 | |
| 530 | G | A | -0.0921 | |
| 531 | T | A | 0.0000 | |
| 532 | R | A | 0.0000 | |
| 533 | Y | A | -0.2787 | |
| 534 | L | A | 0.0000 | |
| 535 | T | A | 0.0000 | |
| 536 | H | A | -0.6318 | |
| 537 | H | A | 0.0000 | |
| 538 | L | A | 0.0000 | |
| 18 | G | B | -0.5429 | |
| 19 | V | B | 0.6475 | |
| 20 | G | B | -0.4121 | |
| 21 | N | B | -1.2724 | |
| 22 | A | B | -1.1185 | |
| 23 | S | B | -1.2021 | |
| 24 | G | B | -1.3989 | |
| 25 | D | B | -1.6577 | |
| 26 | W | B | -0.6112 | |
| 27 | H | B | -1.3544 | |
| 28 | C | B | -1.0394 | |
| 29 | D | B | -1.8617 | |
| 30 | S | B | -1.0773 | |
| 31 | T | B | -0.6273 | |
| 32 | W | B | -0.7314 | |
| 33 | S | B | -1.2598 | |
| 34 | E | B | -2.3840 | |
| 35 | G | B | -1.7480 | |
| 36 | H | B | -1.6557 | |
| 37 | V | B | 0.0000 | |
| 38 | T | B | -0.7599 | |
| 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 | 0.2753 | |
| 45 | W | B | 0.0000 | |
| 46 | V | B | 1.0898 | |
| 47 | L | B | 0.0000 | |
| 48 | P | B | 0.1743 | |
| 49 | T | B | -0.1892 | |
| 50 | Y | B | -0.0956 | |
| 51 | N | B | -0.4729 | |
| 52 | N | B | -1.0836 | |
| 53 | H | B | -0.2292 | |
| 54 | L | B | 0.5901 | |
| 55 | Y | B | 0.1042 | |
| 56 | K | B | -0.9279 | |
| 57 | R | B | -1.0143 | |
| 58 | L | B | -0.5710 | |
| 59 | G | B | -0.8551 | |
| 60 | E | B | -1.1460 | |
| 61 | S | B | -1.0155 | |
| 62 | L | B | -0.5238 | |
| 63 | Q | B | -1.3218 | |
| 64 | S | B | 0.0000 | |
| 65 | N | B | -0.7278 | |
| 66 | T | B | 0.0000 | |
| 67 | Y | B | 0.0000 | |
| 68 | N | B | 0.0000 | |
| 69 | G | B | 0.0000 | |
| 70 | F | B | -0.2617 | |
| 71 | S | B | 0.0000 | |
| 72 | T | B | 0.0000 | |
| 73 | P | B | 0.0000 | |
| 74 | W | B | 0.0000 | |
| 75 | G | B | 0.0000 | |
| 76 | Y | B | 0.0000 | |
| 77 | F | B | 0.0000 | |
| 78 | D | B | 0.0000 | |
| 79 | F | B | 0.0000 | |
| 80 | N | B | 0.0000 | |
| 81 | R | B | -0.3437 | |
| 82 | F | B | 0.0000 | |
| 83 | H | B | 0.0000 | |
| 84 | C | B | 0.0000 | |
| 85 | H | B | 0.0000 | |
| 86 | F | B | 0.0000 | |
| 87 | S | B | -1.1825 | |
| 88 | P | B | -1.3213 | |
| 89 | R | B | -2.4879 | |
| 90 | D | B | -1.8256 | |
| 91 | W | B | 0.0000 | |
| 92 | Q | B | -1.9805 | |
| 93 | R | B | -2.4967 | |
| 94 | L | B | 0.0000 | |
| 95 | I | B | 0.0000 | |
| 96 | N | B | -1.3273 | |
| 97 | N | B | -2.0502 | |
| 98 | N | B | 0.0000 | |
| 99 | W | B | -0.9145 | |
| 100 | G | B | 0.0000 | |
| 101 | M | B | 0.0000 | |
| 102 | R | B | -0.9267 | |
| 103 | P | B | 0.0000 | |
| 104 | K | B | -1.5469 | |
| 105 | A | B | -0.9305 | |
| 106 | M | B | 0.0000 | |
| 107 | R | B | -1.4915 | |
| 108 | V | B | 0.0000 | |
| 109 | K | B | -1.5197 | |
| 110 | I | B | 0.0000 | |
| 111 | F | B | 0.0000 | |
| 112 | N | B | -1.1941 | |
| 113 | I | B | 0.0000 | |
| 114 | Q | B | -0.9303 | |
| 115 | V | B | 0.0000 | |
| 116 | K | B | -0.6317 | |
| 117 | E | B | -0.2997 | |
| 118 | V | B | 0.3239 | |
| 119 | T | B | -0.1380 | |
| 120 | T | B | -1.0012 | |
| 121 | S | B | -1.6482 | |
| 122 | N | B | -2.1926 | |
| 123 | G | B | -2.0666 | |
| 124 | E | B | -2.5824 | |
| 125 | T | B | -1.0178 | |
| 126 | T | B | -0.0961 | |
| 127 | V | B | 0.7544 | |
| 128 | A | B | -0.1555 | |
| 129 | N | B | -1.1662 | |
| 130 | N | B | -0.6715 | |
| 131 | L | B | 0.2527 | |
| 132 | T | B | -0.0172 | |
| 133 | S | B | 0.0000 | |
| 134 | T | B | 0.0000 | |
| 135 | V | B | 0.0000 | |
| 136 | Q | B | -0.4654 | |
| 137 | I | B | 0.0000 | |
| 138 | F | B | 0.0000 | |
| 139 | A | B | -0.3488 | |
| 140 | D | B | 0.0000 | |
| 141 | S | B | -0.4070 | |
| 142 | S | B | -0.4809 | |
| 143 | Y | B | -0.5840 | |
| 144 | E | B | -0.8185 | |
| 145 | L | B | 0.0000 | |
| 146 | P | B | 0.0000 | |
| 147 | Y | B | 0.0000 | |
| 148 | V | B | 0.0000 | |
| 149 | M | B | 0.0000 | |
| 150 | D | B | 0.0000 | |
| 151 | A | B | -0.1524 | |
| 152 | G | B | 0.0000 | |
| 153 | Q | B | 0.0000 | |
| 154 | E | B | -1.4072 | |
| 155 | G | B | -0.4946 | |
| 156 | S | B | -0.3378 | |
| 157 | L | B | 0.0000 | |
| 158 | P | B | -0.2751 | |
| 159 | P | B | -0.4337 | |
| 160 | F | B | -0.5595 | |
| 161 | P | B | -0.7685 | |
| 162 | N | B | -1.6131 | |
| 163 | D | B | -1.6007 | |
| 164 | V | B | 0.9489 | |
| 165 | F | B | 0.9927 | |
| 166 | M | B | 1.5017 | |
| 167 | V | B | 0.0000 | |
| 168 | P | B | 0.0000 | |
| 169 | Q | B | 0.0953 | |
| 170 | Y | B | 0.0000 | |
| 171 | G | B | 0.0000 | |
| 172 | Y | B | 0.0000 | |
| 173 | C | B | 0.0000 | |
| 174 | G | B | 0.0000 | |
| 175 | L | B | 0.0000 | |
| 176 | V | B | 0.0000 | |
| 177 | T | B | -0.7643 | |
| 178 | G | B | -0.8524 | |
| 179 | N | B | -1.0240 | |
| 180 | T | B | -0.9428 | |
| 181 | S | B | -1.1292 | |
| 182 | Q | B | -1.3985 | |
| 183 | Q | B | -1.7097 | |
| 184 | Q | B | -1.4888 | |
| 185 | T | B | -1.3522 | |
| 186 | D | B | -1.9126 | |
| 187 | R | B | 0.0000 | |
| 188 | N | B | 0.0000 | |
| 189 | A | B | 0.0000 | |
| 190 | F | B | 0.3220 | |
| 191 | Y | B | 0.0000 | |
| 192 | C | B | 0.0000 | |
| 193 | L | B | 0.0000 | |
| 194 | E | B | -0.4712 | |
| 195 | Y | B | 0.8247 | |
| 196 | F | B | 0.0000 | |
| 197 | P | B | -0.3226 | |
| 198 | S | B | -0.5150 | |
| 199 | Q | B | -0.8667 | |
| 200 | M | B | -0.2741 | |
| 201 | L | B | 0.0000 | |
| 202 | R | B | -1.5873 | |
| 203 | T | B | -1.2145 | |
| 204 | G | B | -1.2180 | |
| 205 | N | B | -1.7248 | |
| 206 | N | B | -1.9587 | |
| 207 | F | B | -1.3789 | |
| 208 | E | B | -2.1241 | |
| 209 | I | B | -0.9152 | |
| 210 | T | B | -0.7523 | |
| 211 | Y | B | -0.3507 | |
| 212 | S | B | -0.9561 | |
| 213 | F | B | 0.0000 | |
| 214 | E | B | -1.9028 | |
| 215 | K | B | -2.1033 | |
| 216 | V | B | 0.0000 | |
| 217 | P | B | -0.5945 | |
| 218 | F | B | -0.1616 | |
| 219 | H | B | 0.0000 | |
| 220 | S | B | 0.0000 | |
| 221 | M | B | 0.0000 | |
| 222 | Y | B | 0.0000 | |
| 223 | A | B | 0.0000 | |
| 224 | H | B | 0.0000 | |
| 225 | S | B | 0.0000 | |
| 226 | Q | B | 0.0000 | |
| 227 | S | B | 0.0000 | |
| 228 | L | B | 0.0000 | |
| 229 | D | B | 0.0000 | |
| 230 | R | B | 0.0000 | |
| 231 | L | B | 0.2341 | |
| 232 | M | B | 0.0000 | |
| 233 | N | B | 0.0000 | |
| 234 | P | B | 0.0000 | |
| 235 | L | B | 0.3424 | |
| 236 | I | B | -0.2099 | |
| 237 | D | B | -0.9682 | |
| 238 | Q | B | 0.0000 | |
| 239 | Y | B | 0.0000 | |
| 240 | L | B | 0.0000 | |
| 241 | W | B | 0.0000 | |
| 242 | G | B | -0.2882 | |
| 243 | L | B | 0.0000 | |
| 244 | Q | B | -0.4470 | |
| 245 | S | B | 0.0000 | |
| 246 | T | B | 0.0000 | |
| 247 | T | B | 0.0000 | |
| 248 | T | B | -0.5287 | |
| 249 | G | B | -0.7309 | |
| 250 | T | B | -0.7586 | |
| 251 | T | B | -0.7543 | |
| 252 | L | B | -0.6718 | |
| 253 | N | B | -1.4126 | |
| 254 | A | B | -0.9404 | |
| 255 | G | B | -0.9407 | |
| 256 | T | B | -0.7603 | |
| 257 | A | B | -1.0871 | |
| 258 | T | B | -0.3461 | |
| 259 | T | B | 0.0000 | |
| 260 | N | B | -0.0386 | |
| 261 | F | B | 0.0000 | |
| 262 | T | B | -0.7972 | |
| 263 | K | B | -1.0085 | |
| 264 | L | B | 0.0000 | |
| 265 | R | B | -1.4198 | |
| 266 | P | B | -0.5646 | |
| 267 | T | B | -0.5248 | |
| 268 | N | B | -0.6405 | |
| 269 | F | B | 0.0000 | |
| 270 | S | B | 0.0000 | |
| 271 | N | B | -0.4461 | |
| 272 | F | B | 0.0000 | |
| 273 | K | B | 0.0000 | |
| 274 | K | B | -0.1866 | |
| 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 | S | B | 0.0000 | |
| 282 | I | B | 0.0000 | |
| 283 | K | B | 0.0000 | |
| 284 | Q | B | 0.0000 | |
| 285 | Q | B | 0.0000 | |
| 286 | G | B | 0.0000 | |
| 287 | F | B | 0.0000 | |
| 288 | S | B | -1.2775 | |
| 289 | K | B | -0.8364 | |
| 290 | T | B | -0.6943 | |
| 291 | A | B | -0.9349 | |
| 292 | N | B | -2.0725 | |
| 293 | Q | B | -2.2054 | |
| 294 | N | B | 0.0000 | |
| 295 | Y | B | -1.5626 | |
| 296 | K | B | -1.5407 | |
| 297 | I | B | 0.0000 | |
| 298 | P | B | 0.0000 | |
| 299 | A | B | -0.3453 | |
| 300 | T | B | -0.4960 | |
| 301 | G | B | -0.8358 | |
| 302 | S | B | -0.7000 | |
| 303 | D | B | -0.8740 | |
| 304 | S | B | -0.5278 | |
| 305 | L | B | 0.0000 | |
| 306 | I | B | -0.0881 | |
| 307 | K | B | -0.3709 | |
| 308 | Y | B | 0.0000 | |
| 309 | E | B | 0.0000 | |
| 310 | T | B | 0.0000 | |
| 311 | H | B | 0.0000 | |
| 312 | S | B | 0.0000 | |
| 313 | T | B | 0.0000 | |
| 314 | L | B | 0.0000 | |
| 315 | D | B | -0.7117 | |
| 316 | G | B | -0.6760 | |
| 317 | R | B | 0.0000 | |
| 318 | W | B | -0.1294 | |
| 319 | S | B | -0.0079 | |
| 320 | A | B | 0.0000 | |
| 321 | L | B | 0.0000 | |
| 322 | T | B | 0.0000 | |
| 323 | P | B | 0.0000 | |
| 324 | G | B | 0.0000 | |
| 325 | P | B | 0.0000 | |
| 326 | P | B | 0.0000 | |
| 327 | M | B | 0.0000 | |
| 328 | A | B | 0.0000 | |
| 329 | T | B | 0.0000 | |
| 330 | A | B | -1.1718 | |
| 331 | G | B | -1.2889 | |
| 332 | P | B | -0.9779 | |
| 333 | A | B | -0.9090 | |
| 334 | D | B | -1.8650 | |
| 335 | S | B | -1.4647 | |
| 336 | K | B | -1.6169 | |
| 337 | F | B | 0.0000 | |
| 338 | S | B | 0.0000 | |
| 339 | N | B | -0.1706 | |
| 340 | S | B | 0.0000 | |
| 341 | Q | B | 0.0000 | |
| 342 | L | B | 0.0000 | |
| 343 | I | B | 0.0000 | |
| 344 | F | B | 0.0000 | |
| 345 | A | B | -0.8248 | |
| 346 | G | B | -1.0173 | |
| 347 | P | B | -1.4284 | |
| 348 | K | B | -2.2904 | |
| 349 | Q | B | -1.8126 | |
| 350 | N | B | -2.2625 | |
| 351 | G | B | -1.8185 | |
| 352 | N | B | -1.7715 | |
| 353 | T | B | -0.8993 | |
| 354 | A | B | 0.0000 | |
| 355 | T | B | 0.4790 | |
| 356 | V | B | 1.2647 | |
| 357 | P | B | 0.3985 | |
| 358 | G | B | -0.2593 | |
| 359 | T | B | -0.6695 | |
| 360 | L | B | 0.0000 | |
| 361 | I | B | -0.0946 | |
| 362 | F | B | 0.0000 | |
| 363 | T | B | 0.0000 | |
| 364 | S | B | -0.7855 | |
| 365 | E | B | 0.0000 | |
| 366 | E | B | -1.7910 | |
| 367 | E | B | -1.1207 | |
| 368 | L | B | 0.0000 | |
| 369 | A | B | -0.7230 | |
| 370 | A | B | 0.0000 | |
| 371 | T | B | 0.0000 | |
| 372 | N | B | 0.0000 | |
| 373 | A | B | 0.0000 | |
| 374 | T | B | -0.5361 | |
| 375 | D | B | 0.0000 | |
| 376 | T | B | 0.0000 | |
| 377 | D | B | -1.0862 | |
| 378 | M | B | -0.6895 | |
| 379 | W | B | 0.0000 | |
| 380 | G | B | 0.0000 | |
| 381 | N | B | -1.0562 | |
| 382 | L | B | 0.0000 | |
| 383 | P | B | 0.0000 | |
| 384 | G | B | -1.3545 | |
| 385 | G | B | -1.2590 | |
| 386 | D | B | -2.0956 | |
| 387 | Q | B | 0.0000 | |
| 388 | S | B | -1.8272 | |
| 389 | N | B | -2.2745 | |
| 390 | S | B | -1.4352 | |
| 391 | N | B | -1.7054 | |
| 392 | L | B | -0.3134 | |
| 393 | P | B | 0.0000 | |
| 394 | T | B | -0.4325 | |
| 395 | V | B | -0.5531 | |
| 396 | D | B | -2.0858 | |
| 397 | R | B | -2.5017 | |
| 398 | L | B | 0.0000 | |
| 399 | T | B | -0.9748 | |
| 400 | A | B | -0.2853 | |
| 401 | L | B | 0.0000 | |
| 402 | G | B | 0.0000 | |
| 403 | A | B | 0.0000 | |
| 404 | V | B | 0.0000 | |
| 405 | P | B | 0.0000 | |
| 406 | G | B | 0.0000 | |
| 407 | M | B | 0.0000 | |
| 408 | V | B | 0.0000 | |
| 409 | W | B | 0.0000 | |
| 410 | Q | B | 0.0000 | |
| 411 | N | B | -0.3619 | |
| 412 | R | B | 0.0000 | |
| 413 | D | B | 0.0000 | |
| 414 | I | B | 0.0000 | |
| 415 | Y | B | 0.0000 | |
| 416 | Y | B | 0.0000 | |
| 417 | Q | B | 0.0000 | |
| 418 | G | B | 0.0000 | |
| 419 | P | B | 0.0000 | |
| 420 | I | B | 0.0000 | |
| 421 | W | B | 0.0000 | |
| 422 | A | B | 0.0000 | |
| 423 | K | B | -1.0221 | |
| 424 | I | B | 0.0000 | |
| 425 | P | B | 0.0000 | |
| 426 | H | B | -1.3908 | |
| 427 | T | B | -0.8635 | |
| 428 | D | B | -0.8976 | |
| 429 | G | B | 0.0000 | |
| 430 | H | B | -0.9820 | |
| 431 | F | B | 0.0000 | |
| 432 | H | B | -0.5358 | |
| 433 | P | B | -0.5824 | |
| 434 | S | B | -0.3605 | |
| 435 | P | B | 0.0000 | |
| 436 | L | B | 0.0000 | |
| 437 | I | B | 0.0000 | |
| 438 | G | B | 0.0000 | |
| 439 | G | B | -0.1311 | |
| 440 | F | B | 0.0000 | |
| 441 | G | B | -0.7375 | |
| 442 | L | B | 0.0000 | |
| 443 | K | B | -2.4387 | |
| 444 | H | B | -1.9844 | |
| 445 | P | B | 0.0000 | |
| 446 | P | B | 0.0000 | |
| 447 | P | B | 0.0000 | |
| 448 | Q | B | 0.0000 | |
| 449 | I | B | 0.0000 | |
| 450 | F | B | 0.0000 | |
| 451 | I | B | 0.0000 | |
| 452 | K | B | 0.0000 | |
| 453 | N | B | 0.0000 | |
| 454 | T | B | 0.1505 | |
| 455 | P | B | -0.0566 | |
| 456 | V | B | 0.4268 | |
| 457 | P | B | 0.0231 | |
| 458 | A | B | -0.3557 | |
| 459 | N | B | -1.2649 | |
| 460 | P | B | -0.5837 | |
| 461 | A | B | 0.0919 | |
| 462 | T | B | 0.1394 | |
| 463 | T | B | 0.7684 | |
| 464 | F | B | 1.7083 | |
| 465 | S | B | 0.6892 | |
| 466 | S | B | 0.1985 | |
| 467 | T | B | 0.0181 | |
| 468 | P | B | -0.1165 | |
| 469 | V | B | 0.3863 | |
| 470 | N | B | -0.8274 | |
| 471 | S | B | -0.5907 | |
| 472 | F | B | 0.0703 | |
| 473 | I | B | 0.5773 | |
| 474 | T | B | 0.2389 | |
| 475 | Q | B | 0.0000 | |
| 476 | Y | B | 0.3080 | |
| 477 | S | B | 0.0000 | |
| 478 | T | B | 0.2229 | |
| 479 | G | B | 0.0000 | |
| 480 | Q | B | -0.3360 | |
| 481 | V | B | 0.0000 | |
| 482 | S | B | -0.8785 | |
| 483 | V | B | 0.0000 | |
| 484 | Q | B | -1.0451 | |
| 485 | I | B | 0.0000 | |
| 486 | D | B | -1.0407 | |
| 487 | W | B | 0.0000 | |
| 488 | E | B | -1.2537 | |
| 489 | I | B | 0.0000 | |
| 490 | Q | B | -1.9297 | |
| 491 | K | B | -2.7200 | |
| 492 | E | B | -2.3891 | |
| 493 | R | B | -2.7537 | |
| 494 | S | B | -1.4247 | |
| 495 | K | B | -0.6139 | |
| 496 | R | B | -0.1250 | |
| 497 | W | B | 1.0058 | |
| 498 | N | B | -0.1438 | |
| 499 | P | B | -0.5666 | |
| 500 | E | B | -0.7749 | |
| 501 | V | B | -0.6276 | |
| 502 | Q | B | -0.6178 | |
| 503 | F | B | 0.0000 | |
| 504 | T | B | -0.8193 | |
| 505 | S | B | -0.8767 | |
| 506 | N | B | -1.5354 | |
| 507 | Y | B | -0.8005 | |
| 508 | G | B | -1.3760 | |
| 509 | Q | B | -1.9643 | |
| 510 | Q | B | -1.5969 | |
| 511 | N | B | -1.6407 | |
| 512 | S | B | -0.4614 | |
| 513 | L | B | 0.8464 | |
| 514 | L | B | 0.6536 | |
| 515 | W | B | 0.3096 | |
| 516 | A | B | 0.1836 | |
| 517 | P | B | -0.6445 | |
| 518 | D | B | -0.9857 | |
| 519 | A | B | -0.6430 | |
| 520 | A | B | -0.8181 | |
| 521 | G | B | -1.4053 | |
| 522 | K | B | -2.1693 | |
| 523 | Y | B | -1.1844 | |
| 524 | T | B | -0.7770 | |
| 525 | E | B | -0.2359 | |
| 526 | P | B | -0.4913 | |
| 527 | R | B | -0.5232 | |
| 528 | A | B | 0.0000 | |
| 529 | I | B | 0.0000 | |
| 530 | G | B | -0.0885 | |
| 531 | T | B | 0.0000 | |
| 532 | R | B | 0.0000 | |
| 533 | Y | B | -0.3237 | |
| 534 | L | B | 0.0000 | |
| 535 | T | B | 0.0000 | |
| 536 | H | B | -0.6417 | |
| 537 | H | B | 0.0000 | |
| 538 | L | B | 0.0000 | |
| 18 | G | C | -0.5390 | |
| 19 | V | C | 0.6239 | |
| 20 | G | C | -0.4129 | |
| 21 | N | C | -1.2807 | |
| 22 | A | C | -1.1360 | |
| 23 | S | C | -1.2407 | |
| 24 | G | C | -1.4300 | |
| 25 | D | C | -1.6356 | |
| 26 | W | C | -0.5409 | |
| 27 | H | C | -1.2228 | |
| 28 | C | C | -0.9752 | |
| 29 | D | C | -1.8160 | |
| 30 | S | C | -0.9919 | |
| 31 | T | C | -0.5721 | |
| 32 | W | C | -0.6192 | |
| 33 | S | C | -1.2270 | |
| 34 | E | C | -2.3537 | |
| 35 | G | C | -1.7121 | |
| 36 | H | C | -1.6159 | |
| 37 | V | C | 0.0000 | |
| 38 | T | C | -0.7645 | |
| 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 | 0.1616 | |
| 45 | W | C | 0.0000 | |
| 46 | V | C | 0.9254 | |
| 47 | L | C | 0.0000 | |
| 48 | P | C | 0.1320 | |
| 49 | T | C | -0.2293 | |
| 50 | Y | C | -0.1623 | |
| 51 | N | C | -0.6373 | |
| 52 | N | C | -1.1817 | |
| 53 | H | C | -0.3898 | |
| 54 | L | C | 0.2872 | |
| 55 | Y | C | -0.1255 | |
| 56 | K | C | -1.2107 | |
| 57 | R | C | -1.1704 | |
| 58 | L | C | -0.6218 | |
| 59 | G | C | -0.8519 | |
| 60 | E | C | -1.1088 | |
| 61 | S | C | -0.9925 | |
| 62 | L | C | -0.5075 | |
| 63 | Q | C | -1.3081 | |
| 64 | S | C | 0.0000 | |
| 65 | N | C | -0.7089 | |
| 66 | T | C | 0.0000 | |
| 67 | Y | C | 0.0000 | |
| 68 | N | C | 0.0000 | |
| 69 | G | C | 0.0000 | |
| 70 | F | C | -0.3441 | |
| 71 | S | C | 0.0000 | |
| 72 | T | C | 0.0000 | |
| 73 | P | C | 0.0000 | |
| 74 | W | C | 0.0000 | |
| 75 | G | C | 0.0000 | |
| 76 | Y | C | 0.0000 | |
| 77 | F | C | 0.0000 | |
| 78 | D | C | 0.0000 | |
| 79 | F | C | 0.0000 | |
| 80 | N | C | 0.0000 | |
| 81 | R | C | -0.3350 | |
| 82 | F | C | 0.0000 | |
| 83 | H | C | 0.0000 | |
| 84 | C | C | 0.0000 | |
| 85 | H | C | 0.0000 | |
| 86 | F | C | 0.0000 | |
| 87 | S | C | -1.0452 | |
| 88 | P | C | -1.2575 | |
| 89 | R | C | -2.3757 | |
| 90 | D | C | 0.0000 | |
| 91 | W | C | 0.0000 | |
| 92 | Q | C | -2.0306 | |
| 93 | R | C | -2.3497 | |
| 94 | L | C | 0.0000 | |
| 95 | I | C | 0.0000 | |
| 96 | N | C | -1.4193 | |
| 97 | N | C | -2.1710 | |
| 98 | N | C | 0.0000 | |
| 99 | W | C | 0.0000 | |
| 100 | G | C | 0.0000 | |
| 101 | M | C | 0.0000 | |
| 102 | R | C | -0.9441 | |
| 103 | P | C | 0.0000 | |
| 104 | K | C | -1.6493 | |
| 105 | A | C | -1.0248 | |
| 106 | M | C | 0.0000 | |
| 107 | R | C | -1.7022 | |
| 108 | V | C | 0.0000 | |
| 109 | K | C | -1.6725 | |
| 110 | I | C | 0.0000 | |
| 111 | F | C | 0.0000 | |
| 112 | N | C | -1.2210 | |
| 113 | I | C | 0.0000 | |
| 114 | Q | C | -0.9818 | |
| 115 | V | C | 0.0000 | |
| 116 | K | C | -0.6205 | |
| 117 | E | C | -0.3167 | |
| 118 | V | C | 0.3450 | |
| 119 | T | C | -0.1172 | |
| 120 | T | C | -0.9889 | |
| 121 | S | C | -1.6471 | |
| 122 | N | C | -2.1938 | |
| 123 | G | C | -2.0662 | |
| 124 | E | C | -2.5815 | |
| 125 | T | C | -1.0010 | |
| 126 | T | C | -0.0649 | |
| 127 | V | C | 0.8154 | |
| 128 | A | C | -0.1445 | |
| 129 | N | C | -1.1945 | |
| 130 | N | C | -0.7392 | |
| 131 | L | C | 0.1396 | |
| 132 | T | C | -0.0776 | |
| 133 | S | C | -0.4698 | |
| 134 | T | C | -0.5920 | |
| 135 | V | C | 0.0000 | |
| 136 | Q | C | -0.5373 | |
| 137 | I | C | 0.0000 | |
| 138 | F | C | 0.0000 | |
| 139 | A | C | -0.3581 | |
| 140 | D | C | 0.0000 | |
| 141 | S | C | -0.4180 | |
| 142 | S | C | -0.4948 | |
| 143 | Y | C | -0.5864 | |
| 144 | E | C | -0.8506 | |
| 145 | L | C | 0.0000 | |
| 146 | P | C | 0.0000 | |
| 147 | Y | C | 0.0000 | |
| 148 | V | C | 0.0000 | |
| 149 | M | C | 0.0000 | |
| 150 | D | C | 0.0000 | |
| 151 | A | C | -0.1084 | |
| 152 | G | C | 0.0000 | |
| 153 | Q | C | 0.0000 | |
| 154 | E | C | -1.2280 | |
| 155 | G | C | -0.4595 | |
| 156 | S | C | -0.3312 | |
| 157 | L | C | 0.0000 | |
| 158 | P | C | -0.3201 | |
| 159 | P | C | -0.4092 | |
| 160 | F | C | -0.5344 | |
| 161 | P | C | -0.7402 | |
| 162 | N | C | -1.6126 | |
| 163 | D | C | -1.6046 | |
| 164 | V | C | 0.6912 | |
| 165 | F | C | 0.0000 | |
| 166 | M | C | 1.1942 | |
| 167 | V | C | 0.0000 | |
| 168 | P | C | 0.0000 | |
| 169 | Q | C | 0.0777 | |
| 170 | Y | C | 0.0000 | |
| 171 | G | C | 0.0000 | |
| 172 | Y | C | 0.0000 | |
| 173 | C | C | 0.0000 | |
| 174 | G | C | 0.0000 | |
| 175 | L | C | 0.0000 | |
| 176 | V | C | 0.0000 | |
| 177 | T | C | -0.8792 | |
| 178 | G | C | -0.8645 | |
| 179 | N | C | -1.0297 | |
| 180 | T | C | -0.9337 | |
| 181 | S | C | -1.1139 | |
| 182 | Q | C | -1.4247 | |
| 183 | Q | C | -1.7395 | |
| 184 | Q | C | -1.5842 | |
| 185 | T | C | -1.4615 | |
| 186 | D | C | -2.0445 | |
| 187 | R | C | -1.2269 | |
| 188 | N | C | 0.0000 | |
| 189 | A | C | 0.0000 | |
| 190 | F | C | 0.3018 | |
| 191 | Y | C | 0.0000 | |
| 192 | C | C | 0.0000 | |
| 193 | L | C | 0.0000 | |
| 194 | E | C | -0.5811 | |
| 195 | Y | C | 0.7718 | |
| 196 | F | C | 0.0000 | |
| 197 | P | C | -0.3645 | |
| 198 | S | C | -0.5820 | |
| 199 | Q | C | -0.9757 | |
| 200 | M | C | -0.4576 | |
| 201 | L | C | 0.0000 | |
| 202 | R | C | -1.6429 | |
| 203 | T | C | -1.2579 | |
| 204 | G | C | -1.2397 | |
| 205 | N | C | -1.7656 | |
| 206 | N | C | -2.0287 | |
| 207 | F | C | -1.4833 | |
| 208 | E | C | -2.2231 | |
| 209 | I | C | -1.0234 | |
| 210 | T | C | -0.8526 | |
| 211 | Y | C | -0.4180 | |
| 212 | S | C | -1.0052 | |
| 213 | F | C | 0.0000 | |
| 214 | E | C | -1.8862 | |
| 215 | K | C | -2.1027 | |
| 216 | V | C | 0.0000 | |
| 217 | P | C | -0.5692 | |
| 218 | F | C | -0.1434 | |
| 219 | H | C | 0.0000 | |
| 220 | S | C | 0.0000 | |
| 221 | M | C | 0.0000 | |
| 222 | Y | C | 0.0000 | |
| 223 | A | C | 0.0000 | |
| 224 | H | C | 0.0000 | |
| 225 | S | C | 0.0000 | |
| 226 | Q | C | 0.0000 | |
| 227 | S | C | 0.0000 | |
| 228 | L | C | 0.0000 | |
| 229 | D | C | 0.0000 | |
| 230 | R | C | 0.0000 | |
| 231 | L | C | 0.2271 | |
| 232 | M | C | 0.0000 | |
| 233 | N | C | 0.0000 | |
| 234 | P | C | 0.0000 | |
| 235 | L | C | 0.3077 | |
| 236 | I | C | -0.2552 | |
| 237 | D | C | -1.0043 | |
| 238 | Q | C | 0.0000 | |
| 239 | Y | C | 0.0000 | |
| 240 | L | C | 0.0000 | |
| 241 | W | C | 0.0000 | |
| 242 | G | C | -0.2680 | |
| 243 | L | C | 0.0000 | |
| 244 | Q | C | -0.3570 | |
| 245 | S | C | 0.0000 | |
| 246 | T | C | 0.0000 | |
| 247 | T | C | 0.0000 | |
| 248 | T | C | -0.5477 | |
| 249 | G | C | -0.7434 | |
| 250 | T | C | -0.7744 | |
| 251 | T | C | -0.7808 | |
| 252 | L | C | -0.7196 | |
| 253 | N | C | -1.4820 | |
| 254 | A | C | -0.9732 | |
| 255 | G | C | -0.9627 | |
| 256 | T | C | -0.7777 | |
| 257 | A | C | -1.1101 | |
| 258 | T | C | -0.3371 | |
| 259 | T | C | 0.0000 | |
| 260 | N | C | -0.0139 | |
| 261 | F | C | 0.0000 | |
| 262 | T | C | -0.7245 | |
| 263 | K | C | -0.9534 | |
| 264 | L | C | 0.0000 | |
| 265 | R | C | -1.4610 | |
| 266 | P | C | -0.6091 | |
| 267 | T | C | -0.5334 | |
| 268 | N | C | -0.6376 | |
| 269 | F | C | 0.0000 | |
| 270 | S | C | 0.0000 | |
| 271 | N | C | -0.4160 | |
| 272 | F | C | 0.0000 | |
| 273 | K | C | 0.0000 | |
| 274 | K | C | -0.1871 | |
| 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 | S | C | 0.0000 | |
| 282 | I | C | 0.0000 | |
| 283 | K | C | 0.0000 | |
| 284 | Q | C | 0.0000 | |
| 285 | Q | C | 0.0000 | |
| 286 | G | C | -0.8831 | |
| 287 | F | C | 0.0000 | |
| 288 | S | C | -1.3916 | |
| 289 | K | C | -0.9157 | |
| 290 | T | C | -0.7839 | |
| 291 | A | C | -0.9632 | |
| 292 | N | C | -2.0916 | |
| 293 | Q | C | -2.3496 | |
| 294 | N | C | 0.0000 | |
| 295 | Y | C | -1.4976 | |
| 296 | K | C | -1.4222 | |
| 297 | I | C | 0.0000 | |
| 298 | P | C | 0.0000 | |
| 299 | A | C | -0.3722 | |
| 300 | T | C | -0.5106 | |
| 301 | G | C | -0.8367 | |
| 302 | S | C | -0.7014 | |
| 303 | D | C | -0.8826 | |
| 304 | S | C | -0.5289 | |
| 305 | L | C | 0.0000 | |
| 306 | I | C | -0.0604 | |
| 307 | K | C | -0.3100 | |
| 308 | Y | C | 0.0000 | |
| 309 | E | C | 0.0000 | |
| 310 | T | C | 0.0000 | |
| 311 | H | C | 0.0000 | |
| 312 | S | C | 0.0000 | |
| 313 | T | C | 0.0000 | |
| 314 | L | C | 0.0000 | |
| 315 | D | C | -0.7866 | |
| 316 | G | C | -0.6840 | |
| 317 | R | C | 0.0000 | |
| 318 | W | C | -0.0774 | |
| 319 | S | C | 0.0181 | |
| 320 | A | C | 0.0000 | |
| 321 | L | C | 0.0000 | |
| 322 | T | C | 0.0000 | |
| 323 | P | C | 0.0000 | |
| 324 | G | C | 0.0000 | |
| 325 | P | C | 0.0000 | |
| 326 | P | C | 0.0000 | |
| 327 | M | C | 0.0000 | |
| 328 | A | C | 0.0000 | |
| 329 | T | C | 0.0000 | |
| 330 | A | C | -1.1907 | |
| 331 | G | C | -1.2794 | |
| 332 | P | C | -0.9778 | |
| 333 | A | C | -0.9292 | |
| 334 | D | C | -1.9179 | |
| 335 | S | C | -1.5743 | |
| 336 | K | C | -1.8236 | |
| 337 | F | C | 0.0000 | |
| 338 | S | C | 0.0000 | |
| 339 | N | C | -0.1814 | |
| 340 | S | C | 0.0000 | |
| 341 | Q | C | 0.0000 | |
| 342 | L | C | 0.0000 | |
| 343 | I | C | 0.0000 | |
| 344 | F | C | 0.0000 | |
| 345 | A | C | -0.8323 | |
| 346 | G | C | -1.0322 | |
| 347 | P | C | -1.4615 | |
| 348 | K | C | -2.3075 | |
| 349 | Q | C | -1.8224 | |
| 350 | N | C | -2.2689 | |
| 351 | G | C | -1.8208 | |
| 352 | N | C | -1.7905 | |
| 353 | T | C | -0.9065 | |
| 354 | A | C | 0.0000 | |
| 355 | T | C | 0.4826 | |
| 356 | V | C | 1.2826 | |
| 357 | P | C | 0.4056 | |
| 358 | G | C | -0.2554 | |
| 359 | T | C | -0.6744 | |
| 360 | L | C | 0.0000 | |
| 361 | I | C | -0.0930 | |
| 362 | F | C | 0.0000 | |
| 363 | T | C | 0.0000 | |
| 364 | S | C | -0.7476 | |
| 365 | E | C | 0.0000 | |
| 366 | E | C | -1.6809 | |
| 367 | E | C | -1.0442 | |
| 368 | L | C | 0.0000 | |
| 369 | A | C | -0.6811 | |
| 370 | A | C | 0.0000 | |
| 371 | T | C | 0.0000 | |
| 372 | N | C | 0.0000 | |
| 373 | A | C | 0.0000 | |
| 374 | T | C | -0.5109 | |
| 375 | D | C | 0.0000 | |
| 376 | T | C | -0.7387 | |
| 377 | D | C | -1.0920 | |
| 378 | M | C | -0.6367 | |
| 379 | W | C | 0.0000 | |
| 380 | G | C | 0.0000 | |
| 381 | N | C | 0.0000 | |
| 382 | L | C | 0.0000 | |
| 383 | P | C | 0.0000 | |
| 384 | G | C | -0.7887 | |
| 385 | G | C | -1.0610 | |
| 386 | D | C | -2.0403 | |
| 387 | Q | C | 0.0000 | |
| 388 | S | C | -1.8521 | |
| 389 | N | C | -2.3901 | |
| 390 | S | C | -1.4955 | |
| 391 | N | C | -1.7357 | |
| 392 | L | C | -0.3403 | |
| 393 | P | C | 0.0000 | |
| 394 | T | C | -0.1891 | |
| 395 | V | C | -0.0752 | |
| 396 | D | C | -1.0676 | |
| 397 | R | C | -1.9806 | |
| 398 | L | C | 0.0000 | |
| 399 | T | C | -0.8659 | |
| 400 | A | C | -0.2794 | |
| 401 | L | C | 0.0000 | |
| 402 | G | C | 0.0000 | |
| 403 | A | C | 0.0000 | |
| 404 | V | C | 0.0000 | |
| 405 | P | C | 0.0000 | |
| 406 | G | C | 0.0000 | |
| 407 | M | C | 0.0000 | |
| 408 | V | C | 0.0000 | |
| 409 | W | C | 0.0000 | |
| 410 | Q | C | 0.0000 | |
| 411 | N | C | -0.3600 | |
| 412 | R | C | 0.0000 | |
| 413 | D | C | 0.0000 | |
| 414 | I | C | 0.0000 | |
| 415 | Y | C | 0.0000 | |
| 416 | Y | C | 0.0000 | |
| 417 | Q | C | 0.0000 | |
| 418 | G | C | 0.0000 | |
| 419 | P | C | 0.0000 | |
| 420 | I | C | 0.0000 | |
| 421 | W | C | 0.0000 | |
| 422 | A | C | 0.0000 | |
| 423 | K | C | 0.0000 | |
| 424 | I | C | 0.0000 | |
| 425 | P | C | 0.0000 | |
| 426 | H | C | -1.2121 | |
| 427 | T | C | -0.7862 | |
| 428 | D | C | -0.8587 | |
| 429 | G | C | 0.0000 | |
| 430 | H | C | -0.8620 | |
| 431 | F | C | -0.2716 | |
| 432 | H | C | -0.4558 | |
| 433 | P | C | -0.4941 | |
| 434 | S | C | -0.3108 | |
| 435 | P | C | 0.0000 | |
| 436 | L | C | 0.0000 | |
| 437 | I | C | 0.0000 | |
| 438 | G | C | 0.0000 | |
| 439 | G | C | -0.1308 | |
| 440 | F | C | 0.0000 | |
| 441 | G | C | -0.6717 | |
| 442 | L | C | 0.0000 | |
| 443 | K | C | -2.3115 | |
| 444 | H | C | -1.9197 | |
| 445 | P | C | 0.0000 | |
| 446 | P | C | 0.0000 | |
| 447 | P | C | 0.0000 | |
| 448 | Q | C | 0.0000 | |
| 449 | I | C | 0.0000 | |
| 450 | F | C | 0.0000 | |
| 451 | I | C | 0.0000 | |
| 452 | K | C | 0.0000 | |
| 453 | N | C | 0.0000 | |
| 454 | T | C | 0.0915 | |
| 455 | P | C | -0.1214 | |
| 456 | V | C | 0.3103 | |
| 457 | P | C | -0.0487 | |
| 458 | A | C | -0.3880 | |
| 459 | N | C | -1.2817 | |
| 460 | P | C | -0.5842 | |
| 461 | A | C | 0.0961 | |
| 462 | T | C | 0.1382 | |
| 463 | T | C | 0.7672 | |
| 464 | F | C | 1.7082 | |
| 465 | S | C | 0.6987 | |
| 466 | S | C | 0.2071 | |
| 467 | T | C | 0.0325 | |
| 468 | P | C | -0.0904 | |
| 469 | V | C | 0.4293 | |
| 470 | N | C | -0.8398 | |
| 471 | S | C | -0.5997 | |
| 472 | F | C | 0.0327 | |
| 473 | I | C | 0.5476 | |
| 474 | T | C | 0.2322 | |
| 475 | Q | C | 0.0000 | |
| 476 | Y | C | 0.3128 | |
| 477 | S | C | 0.0000 | |
| 478 | T | C | 0.1481 | |
| 479 | G | C | 0.0000 | |
| 480 | Q | C | -0.3890 | |
| 481 | V | C | 0.0000 | |
| 482 | S | C | -0.9078 | |
| 483 | V | C | 0.0000 | |
| 484 | Q | C | -1.0804 | |
| 485 | I | C | 0.0000 | |
| 486 | D | C | -1.1383 | |
| 487 | W | C | 0.0000 | |
| 488 | E | C | -1.3008 | |
| 489 | I | C | 0.0000 | |
| 490 | Q | C | -1.8543 | |
| 491 | K | C | -2.6063 | |
| 492 | E | C | -2.1584 | |
| 493 | R | C | -2.5288 | |
| 494 | S | C | -1.3328 | |
| 495 | K | C | -0.5718 | |
| 496 | R | C | -0.1242 | |
| 497 | W | C | 0.9868 | |
| 498 | N | C | -0.1491 | |
| 499 | P | C | -0.5650 | |
| 500 | E | C | -0.7703 | |
| 501 | V | C | -0.6250 | |
| 502 | Q | C | -0.6699 | |
| 503 | F | C | 0.0000 | |
| 504 | T | C | -0.8515 | |
| 505 | S | C | -0.8782 | |
| 506 | N | C | -1.5300 | |
| 507 | Y | C | -0.7812 | |
| 508 | G | C | -1.3831 | |
| 509 | Q | C | -1.9902 | |
| 510 | Q | C | -1.6316 | |
| 511 | N | C | -1.7228 | |
| 512 | S | C | -0.6150 | |
| 513 | L | C | 0.7850 | |
| 514 | L | C | 0.6713 | |
| 515 | W | C | 0.2962 | |
| 516 | A | C | 0.0809 | |
| 517 | P | C | -0.8984 | |
| 518 | D | C | -1.5065 | |
| 519 | A | C | -0.9041 | |
| 520 | A | C | -0.9943 | |
| 521 | G | C | -1.6002 | |
| 522 | K | C | -2.3588 | |
| 523 | Y | C | -1.3526 | |
| 524 | T | C | -0.8825 | |
| 525 | E | C | -0.2516 | |
| 526 | P | C | -0.4457 | |
| 527 | R | C | -0.4865 | |
| 528 | A | C | 0.0000 | |
| 529 | I | C | 0.0000 | |
| 530 | G | C | -0.0848 | |
| 531 | T | C | 0.0000 | |
| 532 | R | C | 0.0000 | |
| 533 | Y | C | -0.3677 | |
| 534 | L | C | 0.0000 | |
| 535 | T | C | 0.0000 | |
| 536 | H | C | -0.6432 | |
| 537 | H | C | 0.0000 | |
| 538 | 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 | -0.2433 | 3.9407 | View | CSV | PDB |
| 4.5 | -0.2682 | 3.9407 | View | CSV | PDB |
| 5.0 | -0.2982 | 3.9407 | View | CSV | PDB |
| 5.5 | -0.3277 | 3.9407 | View | CSV | PDB |
| 6.0 | -0.3507 | 3.9407 | View | CSV | PDB |
| 6.5 | -0.3639 | 3.9407 | View | CSV | PDB |
| 7.0 | -0.3682 | 3.9407 | View | CSV | PDB |
| 7.5 | -0.3673 | 3.9407 | View | CSV | PDB |
| 8.0 | -0.3633 | 3.9407 | View | CSV | PDB |
| 8.5 | -0.3563 | 3.9407 | View | CSV | PDB |
| 9.0 | -0.3455 | 3.9407 | View | CSV | PDB |