| 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 (00:12:12)
[INFO] agg3D: Running pKa-ANI on
/STORAGE/DATA/lcbio/aggreskan/f0746fe9875f56/tmp/folded.pdb (00:12:12)
[INFO] Main: Simulation completed successfully. (00:39:33)
|
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 | -0.5485 | |
| 19 | V | A | 0.6315 | |
| 20 | G | A | -0.3879 | |
| 21 | N | A | -1.2800 | |
| 22 | A | A | -1.1113 | |
| 23 | S | A | -1.1505 | |
| 24 | G | A | -1.4717 | |
| 25 | D | A | -1.7848 | |
| 26 | W | A | -0.8244 | |
| 27 | H | A | -1.4489 | |
| 28 | C | A | -1.0907 | |
| 29 | D | A | -1.8736 | |
| 30 | S | A | -1.0405 | |
| 31 | T | A | -0.5684 | |
| 32 | W | A | -0.6318 | |
| 33 | S | A | -1.2435 | |
| 34 | E | A | -2.3940 | |
| 35 | G | A | -1.7684 | |
| 36 | H | A | -1.6544 | |
| 37 | V | A | 0.0000 | |
| 38 | T | A | -0.8425 | |
| 39 | T | A | 0.0000 | |
| 40 | T | A | -1.0423 | |
| 41 | S | A | 0.0000 | |
| 42 | T | A | 0.0000 | |
| 43 | R | A | 0.0000 | |
| 44 | T | A | 0.1777 | |
| 45 | W | A | 0.0000 | |
| 46 | V | A | 0.9392 | |
| 47 | L | A | 0.0000 | |
| 48 | P | A | 0.1494 | |
| 49 | T | A | -0.2224 | |
| 50 | Y | A | -0.1754 | |
| 51 | N | A | -0.7881 | |
| 52 | N | A | -1.1662 | |
| 53 | H | A | -0.3473 | |
| 54 | L | A | 0.4264 | |
| 55 | Y | A | -0.1437 | |
| 56 | K | A | -1.4091 | |
| 57 | R | A | -0.9368 | |
| 58 | L | A | -0.5562 | |
| 59 | G | A | -0.8266 | |
| 60 | E | A | -1.2124 | |
| 61 | S | A | -1.0641 | |
| 62 | L | A | -0.5965 | |
| 63 | Q | A | -1.3551 | |
| 64 | S | A | 0.0000 | |
| 65 | N | A | -0.7815 | |
| 66 | T | A | 0.0000 | |
| 67 | Y | A | 0.0000 | |
| 68 | N | A | 0.0000 | |
| 69 | G | A | 0.0000 | |
| 70 | F | A | -0.2747 | |
| 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 | -0.3664 | |
| 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 | -1.0501 | |
| 88 | P | A | -1.2744 | |
| 89 | R | A | -2.3861 | |
| 90 | D | A | 0.0000 | |
| 91 | W | A | 0.0000 | |
| 92 | Q | A | -2.0814 | |
| 93 | R | A | -2.2990 | |
| 94 | L | A | 0.0000 | |
| 95 | I | A | 0.0000 | |
| 96 | N | A | -1.4027 | |
| 97 | N | A | -2.0840 | |
| 98 | N | A | 0.0000 | |
| 99 | W | A | -0.9771 | |
| 100 | G | A | 0.0000 | |
| 101 | M | A | 0.0000 | |
| 102 | R | A | -1.0377 | |
| 103 | P | A | 0.0000 | |
| 104 | K | A | -1.8137 | |
| 105 | A | A | -1.1352 | |
| 106 | M | A | 0.0000 | |
| 107 | R | A | -1.4908 | |
| 108 | V | A | 0.0000 | |
| 109 | K | A | -1.0944 | |
| 110 | I | A | 0.0000 | |
| 111 | F | A | 0.0000 | |
| 112 | N | A | -1.2051 | |
| 113 | I | A | 0.0000 | |
| 114 | Q | A | -0.9550 | |
| 115 | V | A | 0.0000 | |
| 116 | K | A | -0.6120 | |
| 117 | E | A | -0.2321 | |
| 118 | V | A | 0.3833 | |
| 119 | T | A | -0.0504 | |
| 120 | T | A | -0.9591 | |
| 121 | S | A | -1.6257 | |
| 122 | N | A | -2.1953 | |
| 123 | G | A | -2.0737 | |
| 124 | E | A | -2.5857 | |
| 125 | T | A | -1.0041 | |
| 126 | T | A | -0.0373 | |
| 127 | V | A | 0.8466 | |
| 128 | A | A | -0.1047 | |
| 129 | N | A | -1.1633 | |
| 130 | N | A | -0.6698 | |
| 131 | L | A | 0.2665 | |
| 132 | T | A | -0.0021 | |
| 133 | S | A | 0.0000 | |
| 134 | T | A | -0.5419 | |
| 135 | V | A | 0.0000 | |
| 136 | Q | A | -0.5151 | |
| 137 | I | A | 0.0000 | |
| 138 | F | A | 0.0000 | |
| 139 | A | A | -0.2687 | |
| 140 | D | A | 0.0000 | |
| 141 | S | A | -0.4125 | |
| 142 | S | A | -0.4891 | |
| 143 | Y | A | -0.5445 | |
| 144 | E | A | -0.8128 | |
| 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 | -0.1160 | |
| 152 | G | A | 0.0000 | |
| 153 | Q | A | 0.0000 | |
| 154 | E | A | -1.2659 | |
| 155 | G | A | -0.4691 | |
| 156 | S | A | -0.3237 | |
| 157 | L | A | 0.0000 | |
| 158 | P | A | -0.3201 | |
| 159 | P | A | -0.4151 | |
| 160 | F | A | -0.3684 | |
| 161 | P | A | -0.7503 | |
| 162 | N | A | -1.6116 | |
| 163 | D | A | -1.5909 | |
| 164 | V | A | 0.7556 | |
| 165 | F | A | 0.0000 | |
| 166 | M | A | 1.3883 | |
| 167 | V | A | 0.0000 | |
| 168 | P | A | 0.0000 | |
| 169 | Q | A | 0.0811 | |
| 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 | -0.6656 | |
| 178 | G | A | -0.8703 | |
| 179 | N | A | -1.0278 | |
| 180 | T | A | -0.9972 | |
| 181 | S | A | -1.1764 | |
| 182 | Q | A | -1.4664 | |
| 183 | Q | A | -1.7821 | |
| 184 | Q | A | -1.6060 | |
| 185 | T | A | -1.4552 | |
| 186 | D | A | -1.9552 | |
| 187 | R | A | 0.0000 | |
| 188 | N | A | 0.0000 | |
| 189 | A | A | -0.2673 | |
| 190 | F | A | 0.3663 | |
| 191 | Y | A | 0.0000 | |
| 192 | C | A | 0.3124 | |
| 193 | L | A | 0.0000 | |
| 194 | E | A | -0.6457 | |
| 195 | Y | A | 0.7406 | |
| 196 | F | A | 0.0000 | |
| 197 | P | A | -0.4022 | |
| 198 | S | A | -0.6387 | |
| 199 | Q | A | -1.0424 | |
| 200 | M | A | -0.3275 | |
| 201 | L | A | 0.0000 | |
| 202 | R | A | -1.5338 | |
| 203 | T | A | -1.2039 | |
| 204 | G | A | -1.1796 | |
| 205 | N | A | -1.7464 | |
| 206 | N | A | -1.5837 | |
| 207 | F | A | -0.9016 | |
| 208 | E | A | -1.1373 | |
| 209 | I | A | -0.4881 | |
| 210 | T | A | -0.6113 | |
| 211 | Y | A | -0.4011 | |
| 212 | S | A | -1.0434 | |
| 213 | F | A | 0.0000 | |
| 214 | E | A | -1.8546 | |
| 215 | K | A | -2.1500 | |
| 216 | V | A | 0.0000 | |
| 217 | P | A | -0.5700 | |
| 218 | F | A | -0.2074 | |
| 219 | H | A | -0.1808 | |
| 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 | 0.2429 | |
| 232 | M | A | 0.0000 | |
| 233 | N | A | 0.0000 | |
| 234 | P | A | 0.0000 | |
| 235 | L | A | 0.2338 | |
| 236 | I | A | -0.5422 | |
| 237 | D | A | -1.5200 | |
| 238 | Q | A | 0.0000 | |
| 239 | Y | A | 0.0000 | |
| 240 | L | A | 0.0000 | |
| 241 | W | A | 0.0000 | |
| 242 | G | A | 0.0000 | |
| 243 | L | A | 0.0000 | |
| 244 | Q | A | -0.5226 | |
| 245 | S | A | 0.0000 | |
| 246 | T | A | 0.0000 | |
| 247 | T | A | 0.0000 | |
| 248 | T | A | -0.6628 | |
| 249 | G | A | -0.7390 | |
| 250 | T | A | -0.7669 | |
| 251 | T | A | -0.7385 | |
| 252 | L | A | -0.6093 | |
| 253 | N | A | -1.3378 | |
| 254 | A | A | -0.9356 | |
| 255 | G | A | -0.9418 | |
| 256 | T | A | -0.7653 | |
| 257 | A | A | -1.1247 | |
| 258 | T | A | -0.3855 | |
| 259 | T | A | 0.0000 | |
| 260 | N | A | -0.1033 | |
| 261 | F | A | 0.0000 | |
| 262 | T | A | -0.9310 | |
| 263 | K | A | -1.3267 | |
| 264 | L | A | 0.0000 | |
| 265 | R | A | -2.2810 | |
| 266 | P | A | -1.0322 | |
| 267 | T | A | -0.7621 | |
| 268 | N | A | -0.9604 | |
| 269 | F | A | 0.0000 | |
| 270 | S | A | 0.0000 | |
| 271 | N | A | -0.5762 | |
| 272 | F | A | 0.0000 | |
| 273 | K | A | 0.0000 | |
| 274 | K | A | -0.2009 | |
| 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 | -0.8718 | |
| 287 | F | A | 0.0000 | |
| 288 | S | A | -1.4163 | |
| 289 | K | A | -0.9437 | |
| 290 | T | A | -0.7758 | |
| 291 | A | A | -1.0070 | |
| 292 | N | A | -2.1432 | |
| 293 | Q | A | -2.2806 | |
| 294 | N | A | 0.0000 | |
| 295 | Y | A | 0.0000 | |
| 296 | K | A | -1.4803 | |
| 297 | I | A | 0.0000 | |
| 298 | P | A | 0.0000 | |
| 299 | A | A | -0.4216 | |
| 300 | T | A | -0.5631 | |
| 301 | G | A | -0.8580 | |
| 302 | S | A | -0.7242 | |
| 303 | D | A | -0.9002 | |
| 304 | S | A | -0.5987 | |
| 305 | L | A | 0.0000 | |
| 306 | I | A | -0.0803 | |
| 307 | K | A | -0.3494 | |
| 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 | -0.7331 | |
| 316 | G | A | -0.6878 | |
| 317 | R | A | 0.0000 | |
| 318 | W | A | -0.1136 | |
| 319 | S | A | 0.0219 | |
| 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 | -1.1040 | |
| 331 | G | A | -1.2042 | |
| 332 | P | A | -0.9755 | |
| 333 | A | A | -1.0458 | |
| 334 | D | A | -2.0046 | |
| 335 | S | A | -1.6594 | |
| 336 | K | A | -1.7502 | |
| 337 | F | A | 0.0000 | |
| 338 | S | A | 0.0000 | |
| 339 | N | A | -0.1708 | |
| 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 | -0.8866 | |
| 346 | G | A | -1.0696 | |
| 347 | P | A | -1.5017 | |
| 348 | K | A | -2.2903 | |
| 349 | Q | A | -1.8384 | |
| 350 | N | A | -2.3313 | |
| 351 | G | A | -1.7984 | |
| 352 | N | A | -2.0685 | |
| 353 | T | A | -1.0335 | |
| 354 | A | A | 0.0000 | |
| 355 | T | A | 0.5758 | |
| 356 | V | A | 1.4226 | |
| 357 | P | A | 0.4566 | |
| 358 | G | A | -0.1880 | |
| 359 | T | A | -0.5885 | |
| 360 | L | A | 0.0000 | |
| 361 | I | A | -0.1389 | |
| 362 | F | A | 0.0000 | |
| 363 | T | A | 0.0000 | |
| 364 | S | A | -0.6393 | |
| 365 | E | A | 0.0000 | |
| 366 | E | A | -1.2740 | |
| 367 | E | A | -0.8035 | |
| 368 | L | A | 0.0000 | |
| 369 | A | A | -0.5676 | |
| 370 | A | A | 0.0000 | |
| 371 | T | A | 0.0000 | |
| 372 | N | A | 0.0000 | |
| 373 | A | A | 0.0000 | |
| 374 | T | A | -0.4893 | |
| 375 | D | A | 0.0000 | |
| 376 | T | A | -0.7907 | |
| 377 | D | A | -1.1080 | |
| 378 | M | A | -0.4683 | |
| 379 | W | A | 0.0000 | |
| 380 | G | A | 0.0000 | |
| 381 | N | A | -0.5979 | |
| 382 | L | A | 0.0000 | |
| 383 | P | A | 0.0000 | |
| 384 | G | A | -0.8511 | |
| 385 | G | A | -1.0169 | |
| 386 | D | A | -1.9476 | |
| 387 | Q | A | 0.0000 | |
| 388 | S | A | -1.7570 | |
| 389 | N | A | -2.3364 | |
| 390 | S | A | -1.4572 | |
| 391 | N | A | -1.3219 | |
| 392 | L | A | 0.0720 | |
| 393 | P | A | 0.0000 | |
| 394 | T | A | -0.0576 | |
| 395 | V | A | -0.1112 | |
| 396 | D | A | -1.1335 | |
| 397 | R | A | -1.4380 | |
| 398 | L | A | 0.0000 | |
| 399 | T | A | -0.5605 | |
| 400 | A | A | -0.1692 | |
| 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 | -0.3779 | |
| 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 | -0.7187 | |
| 427 | T | A | -0.5365 | |
| 428 | D | A | -0.6988 | |
| 429 | G | A | 0.0000 | |
| 430 | H | A | -0.6693 | |
| 431 | F | A | -0.1828 | |
| 432 | H | A | -0.3840 | |
| 433 | P | A | -0.4219 | |
| 434 | S | A | -0.2976 | |
| 435 | P | A | 0.0000 | |
| 436 | L | A | 0.0000 | |
| 437 | I | A | 0.0000 | |
| 438 | G | A | 0.0000 | |
| 439 | G | A | -0.2076 | |
| 440 | F | A | 0.0000 | |
| 441 | G | A | -0.6143 | |
| 442 | L | A | 0.0000 | |
| 443 | K | A | -1.9185 | |
| 444 | H | A | -1.7502 | |
| 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 | 0.1529 | |
| 455 | P | A | 0.0662 | |
| 456 | V | A | 0.4108 | |
| 457 | P | A | 0.0364 | |
| 458 | A | A | -0.3453 | |
| 459 | N | A | -1.2646 | |
| 460 | P | A | -0.5796 | |
| 461 | A | A | -0.0438 | |
| 462 | T | A | 0.1462 | |
| 463 | T | A | 0.7711 | |
| 464 | F | A | 1.7086 | |
| 465 | S | A | 0.7071 | |
| 466 | S | A | 0.2162 | |
| 467 | T | A | 0.0477 | |
| 468 | P | A | -0.0599 | |
| 469 | V | A | 0.4915 | |
| 470 | N | A | -0.7575 | |
| 471 | S | A | -0.5529 | |
| 472 | F | A | 0.1141 | |
| 473 | I | A | 0.5938 | |
| 474 | T | A | 0.2640 | |
| 475 | Q | A | 0.0000 | |
| 476 | Y | A | 0.3062 | |
| 477 | S | A | 0.0000 | |
| 478 | T | A | 0.1322 | |
| 479 | G | A | 0.0000 | |
| 480 | Q | A | -0.3856 | |
| 481 | V | A | 0.0000 | |
| 482 | S | A | 0.0000 | |
| 483 | V | A | 0.0000 | |
| 484 | Q | A | -1.2159 | |
| 485 | I | A | 0.0000 | |
| 486 | D | A | -1.3102 | |
| 487 | W | A | 0.0000 | |
| 488 | E | A | -1.3884 | |
| 489 | I | A | 0.0000 | |
| 490 | Q | A | -1.9024 | |
| 491 | K | A | -2.6954 | |
| 492 | E | A | -2.3737 | |
| 493 | R | A | -2.6885 | |
| 494 | S | A | -1.2955 | |
| 495 | K | A | -0.3226 | |
| 496 | R | A | 0.0000 | |
| 497 | W | A | 1.1096 | |
| 498 | N | A | -0.1513 | |
| 499 | P | A | -0.5799 | |
| 500 | E | A | -0.7558 | |
| 501 | V | A | -0.6101 | |
| 502 | Q | A | -0.8139 | |
| 503 | F | A | 0.0000 | |
| 504 | T | A | -0.9047 | |
| 505 | S | A | -0.9101 | |
| 506 | N | A | -1.5015 | |
| 507 | Y | A | -0.7065 | |
| 508 | G | A | -1.3197 | |
| 509 | Q | A | -1.9199 | |
| 510 | Q | A | -1.5209 | |
| 511 | N | A | -1.6223 | |
| 512 | S | A | -0.4722 | |
| 513 | L | A | 0.8617 | |
| 514 | L | A | 0.6926 | |
| 515 | W | A | 0.3209 | |
| 516 | A | A | 0.1565 | |
| 517 | P | A | -0.7184 | |
| 518 | D | A | -1.1410 | |
| 519 | A | A | -0.7287 | |
| 520 | A | A | -0.8712 | |
| 521 | G | A | -1.4735 | |
| 522 | K | A | -2.2455 | |
| 523 | Y | A | -1.1855 | |
| 524 | T | A | -0.8315 | |
| 525 | E | A | -0.4338 | |
| 526 | P | A | -0.5475 | |
| 527 | R | A | -0.5996 | |
| 528 | A | A | -0.3258 | |
| 529 | I | A | 0.0000 | |
| 530 | G | A | -0.0853 | |
| 531 | T | A | 0.0000 | |
| 532 | R | A | 0.0000 | |
| 533 | Y | A | -0.3133 | |
| 534 | L | A | 0.0000 | |
| 535 | T | A | 0.0000 | |
| 536 | H | A | -0.5632 | |
| 537 | H | A | -0.2546 | |
| 538 | L | A | 0.0000 | |
| 18 | G | B | -0.5310 | |
| 19 | V | B | 0.6413 | |
| 20 | G | B | -0.3863 | |
| 21 | N | B | -1.2659 | |
| 22 | A | B | -1.0998 | |
| 23 | S | B | -1.1481 | |
| 24 | G | B | -1.4846 | |
| 25 | D | B | -1.7855 | |
| 26 | W | B | -0.8280 | |
| 27 | H | B | -1.4424 | |
| 28 | C | B | -1.0725 | |
| 29 | D | B | -1.8953 | |
| 30 | S | B | -1.0985 | |
| 31 | T | B | -0.6154 | |
| 32 | W | B | -0.7240 | |
| 33 | S | B | -1.2668 | |
| 34 | E | B | -2.3929 | |
| 35 | G | B | -1.7628 | |
| 36 | H | B | -1.6650 | |
| 37 | V | B | 0.0000 | |
| 38 | T | B | -0.8520 | |
| 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 | 0.2511 | |
| 45 | W | B | 0.0000 | |
| 46 | V | B | 1.0514 | |
| 47 | L | B | 0.0000 | |
| 48 | P | B | 0.1558 | |
| 49 | T | B | -0.2313 | |
| 50 | Y | B | -0.1851 | |
| 51 | N | B | -0.7961 | |
| 52 | N | B | -1.1799 | |
| 53 | H | B | -0.3599 | |
| 54 | L | B | 0.4237 | |
| 55 | Y | B | -0.1494 | |
| 56 | K | B | -1.4374 | |
| 57 | R | B | -0.9699 | |
| 58 | L | B | -0.5808 | |
| 59 | G | B | -0.8443 | |
| 60 | E | B | -1.2457 | |
| 61 | S | B | -1.0937 | |
| 62 | L | B | -0.6535 | |
| 63 | Q | B | -1.3810 | |
| 64 | S | B | 0.0000 | |
| 65 | N | B | -0.8085 | |
| 66 | T | B | 0.0000 | |
| 67 | Y | B | 0.0000 | |
| 68 | N | B | 0.0000 | |
| 69 | G | B | 0.0000 | |
| 70 | F | B | -0.2985 | |
| 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 | -0.3747 | |
| 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 | -1.1956 | |
| 88 | P | B | -1.3434 | |
| 89 | R | B | -2.4811 | |
| 90 | D | B | -1.9964 | |
| 91 | W | B | 0.0000 | |
| 92 | Q | B | -2.0060 | |
| 93 | R | B | -2.4329 | |
| 94 | L | B | 0.0000 | |
| 95 | I | B | 0.0000 | |
| 96 | N | B | -1.3837 | |
| 97 | N | B | -2.0241 | |
| 98 | N | B | 0.0000 | |
| 99 | W | B | -0.9308 | |
| 100 | G | B | 0.0000 | |
| 101 | M | B | 0.0000 | |
| 102 | R | B | -1.0423 | |
| 103 | P | B | 0.0000 | |
| 104 | K | B | -1.8456 | |
| 105 | A | B | -1.1484 | |
| 106 | M | B | 0.0000 | |
| 107 | R | B | -1.4798 | |
| 108 | V | B | 0.0000 | |
| 109 | K | B | -1.1791 | |
| 110 | I | B | 0.0000 | |
| 111 | F | B | 0.0000 | |
| 112 | N | B | -1.2069 | |
| 113 | I | B | 0.0000 | |
| 114 | Q | B | -0.9485 | |
| 115 | V | B | 0.0000 | |
| 116 | K | B | -0.6052 | |
| 117 | E | B | -0.2157 | |
| 118 | V | B | 0.3888 | |
| 119 | T | B | -0.0493 | |
| 120 | T | B | -0.9620 | |
| 121 | S | B | -1.6318 | |
| 122 | N | B | -2.1977 | |
| 123 | G | B | -2.0759 | |
| 124 | E | B | -2.5887 | |
| 125 | T | B | -1.0081 | |
| 126 | T | B | -0.0412 | |
| 127 | V | B | 0.8438 | |
| 128 | A | B | -0.1057 | |
| 129 | N | B | -1.1648 | |
| 130 | N | B | -0.6824 | |
| 131 | L | B | 0.2419 | |
| 132 | T | B | -0.0237 | |
| 133 | S | B | 0.0000 | |
| 134 | T | B | -0.5243 | |
| 135 | V | B | 0.0000 | |
| 136 | Q | B | -0.5316 | |
| 137 | I | B | 0.0000 | |
| 138 | F | B | 0.0000 | |
| 139 | A | B | -0.2693 | |
| 140 | D | B | 0.0000 | |
| 141 | S | B | -0.4450 | |
| 142 | S | B | -0.4832 | |
| 143 | Y | B | -0.5749 | |
| 144 | E | B | -0.7538 | |
| 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 | -0.2029 | |
| 152 | G | B | 0.0000 | |
| 153 | Q | B | 0.0000 | |
| 154 | E | B | -1.7255 | |
| 155 | G | B | -0.6050 | |
| 156 | S | B | -0.3710 | |
| 157 | L | B | 0.0000 | |
| 158 | P | B | -0.3153 | |
| 159 | P | B | -0.4548 | |
| 160 | F | B | -0.4164 | |
| 161 | P | B | -0.7802 | |
| 162 | N | B | -1.6297 | |
| 163 | D | B | -1.6230 | |
| 164 | V | B | 0.9062 | |
| 165 | F | B | 1.0095 | |
| 166 | M | B | 1.5829 | |
| 167 | V | B | 0.0000 | |
| 168 | P | B | 0.0000 | |
| 169 | Q | B | 0.0950 | |
| 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 | -0.6522 | |
| 178 | G | B | -0.8722 | |
| 179 | N | B | -1.0377 | |
| 180 | T | B | -1.0104 | |
| 181 | S | B | -1.1776 | |
| 182 | Q | B | -1.4586 | |
| 183 | Q | B | -1.7456 | |
| 184 | Q | B | -1.5271 | |
| 185 | T | B | -1.4181 | |
| 186 | D | B | -1.9435 | |
| 187 | R | B | 0.0000 | |
| 188 | N | B | 0.0000 | |
| 189 | A | B | -0.1682 | |
| 190 | F | B | 0.5199 | |
| 191 | Y | B | 0.0000 | |
| 192 | C | B | 0.3307 | |
| 193 | L | B | 0.0000 | |
| 194 | E | B | -0.8592 | |
| 195 | Y | B | 0.6946 | |
| 196 | F | B | 0.0000 | |
| 197 | P | B | -0.4371 | |
| 198 | S | B | -0.6563 | |
| 199 | Q | B | -1.0251 | |
| 200 | M | B | -0.2612 | |
| 201 | L | B | 0.0000 | |
| 202 | R | B | -1.5256 | |
| 203 | T | B | -1.1891 | |
| 204 | G | B | -1.1333 | |
| 205 | N | B | -1.6887 | |
| 206 | N | B | -1.6582 | |
| 207 | F | B | 0.0000 | |
| 208 | E | B | -1.2935 | |
| 209 | I | B | -0.5354 | |
| 210 | T | B | -0.6223 | |
| 211 | Y | B | -0.4128 | |
| 212 | S | B | -1.0497 | |
| 213 | F | B | 0.0000 | |
| 214 | E | B | -1.8694 | |
| 215 | K | B | -2.1265 | |
| 216 | V | B | 0.0000 | |
| 217 | P | B | -0.5657 | |
| 218 | F | B | -0.1947 | |
| 219 | H | B | -0.1731 | |
| 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 | 0.2512 | |
| 232 | M | B | 0.0000 | |
| 233 | N | B | 0.0000 | |
| 234 | P | B | 0.0000 | |
| 235 | L | B | 0.3828 | |
| 236 | I | B | -0.1982 | |
| 237 | D | B | -0.9514 | |
| 238 | Q | B | 0.0000 | |
| 239 | Y | B | 0.0000 | |
| 240 | L | B | 0.0000 | |
| 241 | W | B | 0.0000 | |
| 242 | G | B | 0.0000 | |
| 243 | L | B | 0.0000 | |
| 244 | Q | B | -0.4301 | |
| 245 | S | B | 0.0000 | |
| 246 | T | B | 0.0000 | |
| 247 | T | B | 0.0000 | |
| 248 | T | B | -0.6775 | |
| 249 | G | B | -0.7443 | |
| 250 | T | B | -0.7868 | |
| 251 | T | B | -0.7814 | |
| 252 | L | B | -0.7658 | |
| 253 | N | B | -1.5423 | |
| 254 | A | B | -0.9925 | |
| 255 | G | B | -0.9668 | |
| 256 | T | B | -0.7756 | |
| 257 | A | B | -1.1329 | |
| 258 | T | B | -0.3827 | |
| 259 | T | B | 0.0000 | |
| 260 | N | B | -0.0801 | |
| 261 | F | B | 0.0000 | |
| 262 | T | B | -0.6926 | |
| 263 | K | B | -0.9317 | |
| 264 | L | B | 0.0000 | |
| 265 | R | B | -1.4192 | |
| 266 | P | B | -0.7226 | |
| 267 | T | B | -0.6006 | |
| 268 | N | B | -0.7495 | |
| 269 | F | B | 0.0000 | |
| 270 | S | B | 0.0000 | |
| 271 | N | B | -0.4732 | |
| 272 | F | B | 0.0000 | |
| 273 | K | B | 0.0000 | |
| 274 | K | B | -0.1983 | |
| 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 | -0.9038 | |
| 287 | F | B | 0.0000 | |
| 288 | S | B | -1.4689 | |
| 289 | K | B | -0.9845 | |
| 290 | T | B | -0.7996 | |
| 291 | A | B | -1.0191 | |
| 292 | N | B | -2.1480 | |
| 293 | Q | B | -2.2599 | |
| 294 | N | B | 0.0000 | |
| 295 | Y | B | 0.0000 | |
| 296 | K | B | -1.4628 | |
| 297 | I | B | 0.0000 | |
| 298 | P | B | 0.0000 | |
| 299 | A | B | -0.4474 | |
| 300 | T | B | -0.5680 | |
| 301 | G | B | -0.8503 | |
| 302 | S | B | -0.7156 | |
| 303 | D | B | -0.8900 | |
| 304 | S | B | -0.6054 | |
| 305 | L | B | 0.0000 | |
| 306 | I | B | -0.1137 | |
| 307 | K | B | -0.3544 | |
| 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 | -0.7640 | |
| 316 | G | B | -0.6984 | |
| 317 | R | B | 0.0000 | |
| 318 | W | B | -0.1346 | |
| 319 | S | B | -0.0245 | |
| 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 | -1.1344 | |
| 331 | G | B | -1.2231 | |
| 332 | P | B | -0.9941 | |
| 333 | A | B | -1.0708 | |
| 334 | D | B | -2.0586 | |
| 335 | S | B | -1.7301 | |
| 336 | K | B | -1.8922 | |
| 337 | F | B | 0.0000 | |
| 338 | S | B | 0.0000 | |
| 339 | N | B | -0.1672 | |
| 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 | -0.8347 | |
| 346 | G | B | -1.0403 | |
| 347 | P | B | -1.4901 | |
| 348 | K | B | -2.2612 | |
| 349 | Q | B | -1.7559 | |
| 350 | N | B | -2.2195 | |
| 351 | G | B | -1.5898 | |
| 352 | N | B | -1.7234 | |
| 353 | T | B | -0.8488 | |
| 354 | A | B | 0.0000 | |
| 355 | T | B | 0.5537 | |
| 356 | V | B | 1.3708 | |
| 357 | P | B | 0.4336 | |
| 358 | G | B | -0.2161 | |
| 359 | T | B | -0.5909 | |
| 360 | L | B | 0.0000 | |
| 361 | I | B | -0.1342 | |
| 362 | F | B | 0.0000 | |
| 363 | T | B | 0.0000 | |
| 364 | S | B | -0.6271 | |
| 365 | E | B | 0.0000 | |
| 366 | E | B | -1.2301 | |
| 367 | E | B | -0.7664 | |
| 368 | L | B | 0.0000 | |
| 369 | A | B | -0.5535 | |
| 370 | A | B | 0.0000 | |
| 371 | T | B | 0.0000 | |
| 372 | N | B | 0.0000 | |
| 373 | A | B | 0.0000 | |
| 374 | T | B | -0.5019 | |
| 375 | D | B | 0.0000 | |
| 376 | T | B | 0.0000 | |
| 377 | D | B | -1.1451 | |
| 378 | M | B | -0.5152 | |
| 379 | W | B | 0.0000 | |
| 380 | G | B | 0.0000 | |
| 381 | N | B | -0.7149 | |
| 382 | L | B | 0.0000 | |
| 383 | P | B | 0.0000 | |
| 384 | G | B | -1.0655 | |
| 385 | G | B | -1.1825 | |
| 386 | D | B | -2.0554 | |
| 387 | Q | B | 0.0000 | |
| 388 | S | B | -1.9238 | |
| 389 | N | B | -2.4714 | |
| 390 | S | B | -1.5262 | |
| 391 | N | B | -1.6708 | |
| 392 | L | B | -0.5952 | |
| 393 | P | B | 0.0000 | |
| 394 | T | B | -0.3408 | |
| 395 | V | B | -0.3446 | |
| 396 | D | B | -1.5366 | |
| 397 | R | B | -1.6297 | |
| 398 | L | B | 0.0000 | |
| 399 | T | B | -0.6722 | |
| 400 | A | B | -0.1778 | |
| 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 | -0.3777 | |
| 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 | -0.9948 | |
| 424 | I | B | 0.0000 | |
| 425 | P | B | 0.0000 | |
| 426 | H | B | -0.9961 | |
| 427 | T | B | -0.6448 | |
| 428 | D | B | -0.7744 | |
| 429 | G | B | 0.0000 | |
| 430 | H | B | -0.7573 | |
| 431 | F | B | -0.2206 | |
| 432 | H | B | -0.4124 | |
| 433 | P | B | -0.5088 | |
| 434 | S | B | -0.3321 | |
| 435 | P | B | 0.0000 | |
| 436 | L | B | 0.0000 | |
| 437 | I | B | 0.0000 | |
| 438 | G | B | 0.0000 | |
| 439 | G | B | -0.2078 | |
| 440 | F | B | 0.0000 | |
| 441 | G | B | -0.7527 | |
| 442 | L | B | 0.0000 | |
| 443 | K | B | -2.3733 | |
| 444 | H | B | -1.9841 | |
| 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 | 0.1617 | |
| 455 | P | B | 0.0466 | |
| 456 | V | B | 0.3836 | |
| 457 | P | B | 0.0064 | |
| 458 | A | B | -0.3725 | |
| 459 | N | B | -1.2773 | |
| 460 | P | B | -0.5805 | |
| 461 | A | B | -0.0434 | |
| 462 | T | B | 0.1467 | |
| 463 | T | B | 0.7703 | |
| 464 | F | B | 1.7084 | |
| 465 | S | B | 0.7122 | |
| 466 | S | B | 0.2205 | |
| 467 | T | B | 0.0558 | |
| 468 | P | B | -0.0462 | |
| 469 | V | B | 0.5102 | |
| 470 | N | B | -0.7563 | |
| 471 | S | B | -0.5750 | |
| 472 | F | B | 0.0529 | |
| 473 | I | B | 0.5505 | |
| 474 | T | B | 0.2449 | |
| 475 | Q | B | 0.0000 | |
| 476 | Y | B | 0.3057 | |
| 477 | S | B | 0.0000 | |
| 478 | T | B | 0.1826 | |
| 479 | G | B | 0.0000 | |
| 480 | Q | B | -0.3650 | |
| 481 | V | B | 0.0000 | |
| 482 | S | B | 0.0000 | |
| 483 | V | B | 0.0000 | |
| 484 | Q | B | -1.1848 | |
| 485 | I | B | 0.0000 | |
| 486 | D | B | -1.3209 | |
| 487 | W | B | 0.0000 | |
| 488 | E | B | -1.3895 | |
| 489 | I | B | 0.0000 | |
| 490 | Q | B | -1.8406 | |
| 491 | K | B | -2.5987 | |
| 492 | E | B | -2.3007 | |
| 493 | R | B | -2.6497 | |
| 494 | S | B | -1.2607 | |
| 495 | K | B | -0.2866 | |
| 496 | R | B | 0.0000 | |
| 497 | W | B | 1.1290 | |
| 498 | N | B | -0.1371 | |
| 499 | P | B | -0.5980 | |
| 500 | E | B | -0.8002 | |
| 501 | V | B | -0.6987 | |
| 502 | Q | B | -0.9289 | |
| 503 | F | B | 0.0000 | |
| 504 | T | B | -0.8944 | |
| 505 | S | B | -0.8973 | |
| 506 | N | B | -1.5031 | |
| 507 | Y | B | -0.7177 | |
| 508 | G | B | -1.3257 | |
| 509 | Q | B | -1.9242 | |
| 510 | Q | B | -1.5278 | |
| 511 | N | B | -1.6354 | |
| 512 | S | B | -0.5020 | |
| 513 | L | B | 0.8395 | |
| 514 | L | B | 0.6700 | |
| 515 | W | B | 0.2924 | |
| 516 | A | B | 0.1322 | |
| 517 | P | B | -0.7518 | |
| 518 | D | B | -1.2094 | |
| 519 | A | B | -0.7629 | |
| 520 | A | B | -0.8925 | |
| 521 | G | B | -1.4965 | |
| 522 | K | B | -2.2732 | |
| 523 | Y | B | -1.2150 | |
| 524 | T | B | -0.8228 | |
| 525 | E | B | -0.4220 | |
| 526 | P | B | -0.5324 | |
| 527 | R | B | -0.5914 | |
| 528 | A | B | -0.3258 | |
| 529 | I | B | 0.0000 | |
| 530 | G | B | -0.0843 | |
| 531 | T | B | 0.0000 | |
| 532 | R | B | 0.0000 | |
| 533 | Y | B | -0.3537 | |
| 534 | L | B | 0.0000 | |
| 535 | T | B | 0.0000 | |
| 536 | H | B | -0.5031 | |
| 537 | H | B | 0.0000 | |
| 538 | L | B | 0.0000 | |
| 18 | G | C | -0.5540 | |
| 19 | V | C | 0.6232 | |
| 20 | G | C | -0.3884 | |
| 21 | N | C | -1.2799 | |
| 22 | A | C | -1.1330 | |
| 23 | S | C | -1.2019 | |
| 24 | G | C | -1.5024 | |
| 25 | D | C | -1.7768 | |
| 26 | W | C | -0.8081 | |
| 27 | H | C | -1.4185 | |
| 28 | C | C | -1.0253 | |
| 29 | D | C | -1.8783 | |
| 30 | S | C | -1.0991 | |
| 31 | T | C | -0.6265 | |
| 32 | W | C | -0.7385 | |
| 33 | S | C | -1.2734 | |
| 34 | E | C | -2.3206 | |
| 35 | G | C | -1.6731 | |
| 36 | H | C | -1.6397 | |
| 37 | V | C | 0.0000 | |
| 38 | T | C | -0.8676 | |
| 39 | T | C | 0.0000 | |
| 40 | T | C | -1.0202 | |
| 41 | S | C | 0.0000 | |
| 42 | T | C | 0.0000 | |
| 43 | R | C | 0.0000 | |
| 44 | T | C | 0.1824 | |
| 45 | W | C | 0.0000 | |
| 46 | V | C | 0.9682 | |
| 47 | L | C | 0.0000 | |
| 48 | P | C | 0.1214 | |
| 49 | T | C | -0.2560 | |
| 50 | Y | C | -0.2238 | |
| 51 | N | C | -0.8126 | |
| 52 | N | C | -1.1934 | |
| 53 | H | C | -0.3765 | |
| 54 | L | C | 0.3997 | |
| 55 | Y | C | -0.1817 | |
| 56 | K | C | -1.4385 | |
| 57 | R | C | -1.0272 | |
| 58 | L | C | -0.5988 | |
| 59 | G | C | -0.8824 | |
| 60 | E | C | -1.2749 | |
| 61 | S | C | -1.1082 | |
| 62 | L | C | -0.6558 | |
| 63 | Q | C | -1.3849 | |
| 64 | S | C | 0.0000 | |
| 65 | N | C | -0.8150 | |
| 66 | T | C | 0.0000 | |
| 67 | Y | C | 0.0000 | |
| 68 | N | C | 0.0000 | |
| 69 | G | C | 0.0000 | |
| 70 | F | C | -0.2835 | |
| 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 | -0.3335 | |
| 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 | -1.1973 | |
| 88 | P | C | -1.3498 | |
| 89 | R | C | -2.4931 | |
| 90 | D | C | -2.0157 | |
| 91 | W | C | 0.0000 | |
| 92 | Q | C | -2.0178 | |
| 93 | R | C | -2.4421 | |
| 94 | L | C | 0.0000 | |
| 95 | I | C | 0.0000 | |
| 96 | N | C | -1.2917 | |
| 97 | N | C | -1.8432 | |
| 98 | N | C | 0.0000 | |
| 99 | W | C | -0.7583 | |
| 100 | G | C | 0.0000 | |
| 101 | M | C | 0.0000 | |
| 102 | R | C | -1.0324 | |
| 103 | P | C | 0.0000 | |
| 104 | K | C | -1.8398 | |
| 105 | A | C | -1.1508 | |
| 106 | M | C | 0.0000 | |
| 107 | R | C | -1.4919 | |
| 108 | V | C | 0.0000 | |
| 109 | K | C | -1.1400 | |
| 110 | I | C | 0.0000 | |
| 111 | F | C | 0.0000 | |
| 112 | N | C | -1.2518 | |
| 113 | I | C | 0.0000 | |
| 114 | Q | C | -0.9671 | |
| 115 | V | C | 0.0000 | |
| 116 | K | C | -0.6627 | |
| 117 | E | C | -0.2866 | |
| 118 | V | C | 0.2881 | |
| 119 | T | C | -0.1254 | |
| 120 | T | C | -1.0058 | |
| 121 | S | C | -1.6476 | |
| 122 | N | C | -2.2027 | |
| 123 | G | C | -2.0793 | |
| 124 | E | C | -2.5958 | |
| 125 | T | C | -1.0671 | |
| 126 | T | C | -0.1557 | |
| 127 | V | C | 0.6337 | |
| 128 | A | C | -0.2089 | |
| 129 | N | C | -1.2105 | |
| 130 | N | C | -0.7066 | |
| 131 | L | C | 0.2470 | |
| 132 | T | C | -0.0168 | |
| 133 | S | C | 0.0000 | |
| 134 | T | C | -0.6675 | |
| 135 | V | C | 0.0000 | |
| 136 | Q | C | -0.6786 | |
| 137 | I | C | 0.0000 | |
| 138 | F | C | 0.0000 | |
| 139 | A | C | -0.2680 | |
| 140 | D | C | 0.0000 | |
| 141 | S | C | -0.4121 | |
| 142 | S | C | -0.4852 | |
| 143 | Y | C | -0.5686 | |
| 144 | E | C | -0.7368 | |
| 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 | -0.1203 | |
| 152 | G | C | 0.0000 | |
| 153 | Q | C | 0.0000 | |
| 154 | E | C | -0.9469 | |
| 155 | G | C | -0.3923 | |
| 156 | S | C | -0.2654 | |
| 157 | L | C | 0.0000 | |
| 158 | P | C | -0.3047 | |
| 159 | P | C | -0.4293 | |
| 160 | F | C | -0.3772 | |
| 161 | P | C | -0.7373 | |
| 162 | N | C | -1.6093 | |
| 163 | D | C | -1.5956 | |
| 164 | V | C | 0.7543 | |
| 165 | F | C | 0.0000 | |
| 166 | M | C | 1.2972 | |
| 167 | V | C | 0.0000 | |
| 168 | P | C | 0.0000 | |
| 169 | Q | C | 0.0678 | |
| 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 | -0.6745 | |
| 178 | G | C | -0.8794 | |
| 179 | N | C | -1.0428 | |
| 180 | T | C | -1.0152 | |
| 181 | S | C | -1.1947 | |
| 182 | Q | C | -1.4887 | |
| 183 | Q | C | -1.8007 | |
| 184 | Q | C | -1.6371 | |
| 185 | T | C | -1.4722 | |
| 186 | D | C | -1.9692 | |
| 187 | R | C | 0.0000 | |
| 188 | N | C | 0.0000 | |
| 189 | A | C | -0.1611 | |
| 190 | F | C | 0.5241 | |
| 191 | Y | C | 0.0000 | |
| 192 | C | C | 0.3463 | |
| 193 | L | C | 0.0000 | |
| 194 | E | C | -0.8510 | |
| 195 | Y | C | 0.7085 | |
| 196 | F | C | 0.0000 | |
| 197 | P | C | -0.4751 | |
| 198 | S | C | -0.7481 | |
| 199 | Q | C | -1.2348 | |
| 200 | M | C | -0.7269 | |
| 201 | L | C | 0.0000 | |
| 202 | R | C | -1.6783 | |
| 203 | T | C | -1.2575 | |
| 204 | G | C | -1.2381 | |
| 205 | N | C | -1.9103 | |
| 206 | N | C | -1.8357 | |
| 207 | F | C | -1.0445 | |
| 208 | E | C | -1.2178 | |
| 209 | I | C | -0.5058 | |
| 210 | T | C | -0.6198 | |
| 211 | Y | C | -0.4062 | |
| 212 | S | C | -1.0572 | |
| 213 | F | C | 0.0000 | |
| 214 | E | C | -1.9392 | |
| 215 | K | C | -2.1610 | |
| 216 | V | C | 0.0000 | |
| 217 | P | C | -0.5438 | |
| 218 | F | C | -0.1654 | |
| 219 | H | C | 0.0000 | |
| 220 | S | C | 0.0000 | |
| 221 | M | C | 0.0000 | |
| 222 | Y | C | 0.0651 | |
| 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 | 0.2354 | |
| 232 | M | C | 0.0000 | |
| 233 | N | C | 0.0000 | |
| 234 | P | C | 0.0000 | |
| 235 | L | C | 0.3415 | |
| 236 | I | C | -0.2286 | |
| 237 | D | C | -0.9091 | |
| 238 | Q | C | 0.0000 | |
| 239 | Y | C | 0.0000 | |
| 240 | L | C | 0.0000 | |
| 241 | W | C | 0.0000 | |
| 242 | G | C | -0.2871 | |
| 243 | L | C | 0.0000 | |
| 244 | Q | C | -0.4468 | |
| 245 | S | C | 0.0000 | |
| 246 | T | C | 0.0000 | |
| 247 | T | C | 0.0000 | |
| 248 | T | C | -0.6489 | |
| 249 | G | C | -0.7360 | |
| 250 | T | C | -0.7607 | |
| 251 | T | C | -0.7284 | |
| 252 | L | C | -0.6612 | |
| 253 | N | C | -1.3439 | |
| 254 | A | C | -0.8891 | |
| 255 | G | C | -0.9166 | |
| 256 | T | C | -0.7434 | |
| 257 | A | C | -1.0984 | |
| 258 | T | C | -0.3718 | |
| 259 | T | C | 0.0000 | |
| 260 | N | C | -0.0873 | |
| 261 | F | C | 0.0000 | |
| 262 | T | C | -0.9220 | |
| 263 | K | C | -1.1579 | |
| 264 | L | C | 0.0000 | |
| 265 | R | C | -1.5961 | |
| 266 | P | C | -0.6788 | |
| 267 | T | C | -0.5576 | |
| 268 | N | C | -0.7165 | |
| 269 | F | C | 0.0000 | |
| 270 | S | C | 0.0000 | |
| 271 | N | C | -0.4804 | |
| 272 | F | C | 0.0000 | |
| 273 | K | C | 0.0000 | |
| 274 | K | C | -0.2013 | |
| 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 | -0.8478 | |
| 287 | F | C | 0.0000 | |
| 288 | S | C | -1.3914 | |
| 289 | K | C | -0.9296 | |
| 290 | T | C | -0.7605 | |
| 291 | A | C | -1.0038 | |
| 292 | N | C | -2.1084 | |
| 293 | Q | C | -2.2348 | |
| 294 | N | C | 0.0000 | |
| 295 | Y | C | 0.0000 | |
| 296 | K | C | -1.4929 | |
| 297 | I | C | 0.0000 | |
| 298 | P | C | 0.0000 | |
| 299 | A | C | -0.4277 | |
| 300 | T | C | -0.5626 | |
| 301 | G | C | -0.8576 | |
| 302 | S | C | -0.7249 | |
| 303 | D | C | -0.9182 | |
| 304 | S | C | -0.6067 | |
| 305 | L | C | 0.0000 | |
| 306 | I | C | -0.0962 | |
| 307 | K | C | -0.3625 | |
| 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 | -0.7761 | |
| 316 | G | C | -0.7216 | |
| 317 | R | C | 0.0000 | |
| 318 | W | C | -0.1204 | |
| 319 | S | C | -0.0144 | |
| 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 | -1.0480 | |
| 331 | G | C | -1.1530 | |
| 332 | P | C | -0.9460 | |
| 333 | A | C | -1.0380 | |
| 334 | D | C | -1.9880 | |
| 335 | S | C | -1.6359 | |
| 336 | K | C | -1.7148 | |
| 337 | F | C | 0.0000 | |
| 338 | S | C | 0.0000 | |
| 339 | N | C | -0.1685 | |
| 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 | -0.7999 | |
| 346 | G | C | -1.0658 | |
| 347 | P | C | -1.4932 | |
| 348 | K | C | -2.2862 | |
| 349 | Q | C | -1.7360 | |
| 350 | N | C | -2.1818 | |
| 351 | G | C | -1.4730 | |
| 352 | N | C | -1.3952 | |
| 353 | T | C | -0.7035 | |
| 354 | A | C | 0.0000 | |
| 355 | T | C | 0.5713 | |
| 356 | V | C | 1.4149 | |
| 357 | P | C | 0.4545 | |
| 358 | G | C | -0.1879 | |
| 359 | T | C | -0.5853 | |
| 360 | L | C | 0.0000 | |
| 361 | I | C | -0.1344 | |
| 362 | F | C | 0.0000 | |
| 363 | T | C | 0.0000 | |
| 364 | S | C | -0.5864 | |
| 365 | E | C | 0.0000 | |
| 366 | E | C | -1.1037 | |
| 367 | E | C | -0.7040 | |
| 368 | L | C | 0.0000 | |
| 369 | A | C | -0.5134 | |
| 370 | A | C | 0.0000 | |
| 371 | T | C | 0.0000 | |
| 372 | N | C | 0.0000 | |
| 373 | A | C | 0.0000 | |
| 374 | T | C | -0.4472 | |
| 375 | D | C | 0.0000 | |
| 376 | T | C | 0.0000 | |
| 377 | D | C | -1.1017 | |
| 378 | M | C | -0.5525 | |
| 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 | -0.7916 | |
| 385 | G | C | -1.1406 | |
| 386 | D | C | -2.1054 | |
| 387 | Q | C | 0.0000 | |
| 388 | S | C | -1.9731 | |
| 389 | N | C | -2.4826 | |
| 390 | S | C | -1.6810 | |
| 391 | N | C | -1.8124 | |
| 392 | L | C | -0.6101 | |
| 393 | P | C | 0.0000 | |
| 394 | T | C | -0.1936 | |
| 395 | V | C | -0.0769 | |
| 396 | D | C | -0.9146 | |
| 397 | R | C | -1.6581 | |
| 398 | L | C | 0.0000 | |
| 399 | T | C | -0.7201 | |
| 400 | A | C | -0.2310 | |
| 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 | -0.3635 | |
| 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 | -1.0001 | |
| 424 | I | C | 0.0000 | |
| 425 | P | C | 0.0000 | |
| 426 | H | C | -0.9512 | |
| 427 | T | C | -0.5964 | |
| 428 | D | C | -0.7357 | |
| 429 | G | C | 0.0000 | |
| 430 | H | C | -0.7178 | |
| 431 | F | C | 0.0000 | |
| 432 | H | C | -0.4722 | |
| 433 | P | C | -0.5413 | |
| 434 | S | C | -0.3490 | |
| 435 | P | C | 0.0000 | |
| 436 | L | C | 0.0000 | |
| 437 | I | C | 0.0000 | |
| 438 | G | C | 0.0000 | |
| 439 | G | C | -0.1921 | |
| 440 | F | C | 0.0000 | |
| 441 | G | C | -0.7617 | |
| 442 | L | C | 0.0000 | |
| 443 | K | C | -2.3878 | |
| 444 | H | C | -2.0031 | |
| 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 | 0.0770 | |
| 455 | P | C | 0.0307 | |
| 456 | V | C | 0.3898 | |
| 457 | P | C | 0.0279 | |
| 458 | A | C | -0.3504 | |
| 459 | N | C | -1.2658 | |
| 460 | P | C | -0.5768 | |
| 461 | A | C | 0.0955 | |
| 462 | T | C | 0.1471 | |
| 463 | T | C | 0.7711 | |
| 464 | F | C | 1.7082 | |
| 465 | S | C | 0.7103 | |
| 466 | S | C | 0.2181 | |
| 467 | T | C | 0.0503 | |
| 468 | P | C | -0.0563 | |
| 469 | V | C | 0.5056 | |
| 470 | N | C | -0.7550 | |
| 471 | S | C | -0.5546 | |
| 472 | F | C | 0.1049 | |
| 473 | I | C | 0.5797 | |
| 474 | T | C | 0.2331 | |
| 475 | Q | C | 0.0000 | |
| 476 | Y | C | 0.2824 | |
| 477 | S | C | 0.0000 | |
| 478 | T | C | 0.1437 | |
| 479 | G | C | 0.0000 | |
| 480 | Q | C | -0.3925 | |
| 481 | V | C | 0.0000 | |
| 482 | S | C | 0.0000 | |
| 483 | V | C | 0.0000 | |
| 484 | Q | C | -1.2058 | |
| 485 | I | C | 0.0000 | |
| 486 | D | C | -1.3385 | |
| 487 | W | C | 0.0000 | |
| 488 | E | C | -1.3584 | |
| 489 | I | C | 0.0000 | |
| 490 | Q | C | -1.6674 | |
| 491 | K | C | -2.1631 | |
| 492 | E | C | -2.0945 | |
| 493 | R | C | -2.6049 | |
| 494 | S | C | -1.3781 | |
| 495 | K | C | -0.5935 | |
| 496 | R | C | -0.1478 | |
| 497 | W | C | 0.9224 | |
| 498 | N | C | -0.1316 | |
| 499 | P | C | -0.5845 | |
| 500 | E | C | -0.7908 | |
| 501 | V | C | -0.6634 | |
| 502 | Q | C | -0.9393 | |
| 503 | F | C | 0.0000 | |
| 504 | T | C | -0.8923 | |
| 505 | S | C | -0.8940 | |
| 506 | N | C | -1.4945 | |
| 507 | Y | C | -0.7008 | |
| 508 | G | C | -1.3171 | |
| 509 | Q | C | -1.9151 | |
| 510 | Q | C | -1.5117 | |
| 511 | N | C | -1.6158 | |
| 512 | S | C | -0.4656 | |
| 513 | L | C | 0.8653 | |
| 514 | L | C | 0.6910 | |
| 515 | W | C | 0.3133 | |
| 516 | A | C | 0.1603 | |
| 517 | P | C | -0.7078 | |
| 518 | D | C | -1.1156 | |
| 519 | A | C | -0.7164 | |
| 520 | A | C | -0.8628 | |
| 521 | G | C | -1.4650 | |
| 522 | K | C | -2.2372 | |
| 523 | Y | C | -1.1808 | |
| 524 | T | C | -0.8247 | |
| 525 | E | C | -0.4336 | |
| 526 | P | C | -0.5473 | |
| 527 | R | C | -0.5993 | |
| 528 | A | C | -0.3249 | |
| 529 | I | C | 0.0000 | |
| 530 | G | C | -0.0695 | |
| 531 | T | C | 0.0000 | |
| 532 | R | C | 0.0000 | |
| 533 | Y | C | -0.1259 | |
| 534 | L | C | 0.0000 | |
| 535 | T | C | 0.0000 | |
| 536 | H | C | -0.5089 | |
| 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 | -0.2397 | 4.0242 | View | CSV | PDB |
| 4.5 | -0.2642 | 4.0181 | View | CSV | PDB |
| 5.0 | -0.2939 | 4.0093 | View | CSV | PDB |
| 5.5 | -0.3234 | 4.0006 | View | CSV | PDB |
| 6.0 | -0.3461 | 3.9963 | View | CSV | PDB |
| 6.5 | -0.3583 | 3.9997 | View | CSV | PDB |
| 7.0 | -0.3614 | 4.0108 | View | CSV | PDB |
| 7.5 | -0.3596 | 4.0274 | View | CSV | PDB |
| 8.0 | -0.3552 | 4.0467 | View | CSV | PDB |
| 8.5 | -0.3481 | 4.0669 | View | CSV | PDB |
| 9.0 | -0.3375 | 4.0866 | View | CSV | PDB |