| Chain sequence(s) |
A: MRDEVDLSLTIPSKLLGKRDREQKNCEEEKNKNKKAKKQQKDPILLHTSAATHKFLPPPLTMPYSEIGDDLRSLDFDHADVSSDLHLTSSSSVSSFSSSSSSLFSAAGTDDPSPKMEKDPRKIARRYQVELCKKATEENVIVYLGTGCGKTHIAVMLIYELGHLVLSPKKSVCIFLAPTVALVEQQAKVIADSVNFKVAIHCGGKRIVKSHSEWEREIAANEVLVMTPQILLHNLQHCFIKMECISLLIFDECHHAQQQSNHPYAEIMKVFYKSESLQRPRIFGMTASPVVGKGSFQSENLSKSINSLENLLNAKVYSVESNVQLDGFVSSPLVKVYYYRSALSDASQSTIRYENMLEDIKQRCLASLKLLIDTHQTQTLLSMKRLLKRSHDNLIYTLLNLGLWGAIQAAKIQLNSDHNVQDEPVGKNPKSKICDTYLSMAAEALSSGVAKDENASDLLSLAALKEPLFSRKLVQLIKILSVFRLEPHMKCIIFVNRIVTARTLSCILNNLELLRSWKSDFLVGLSSGLKSMSRRSMETILKRFQSKELNLLVATKVGEEGLDIQTCCLVIRYDLPETVTSFIQSRGRARMPQSEYAFLVDSGNEKEMDLIENFKVNEDRMNLEITYRSSEETCPRLDEELYKVHETGACISGGSSISLLYKYCSRLPHDEFFQPKPEFQFKPVDEFGGTICRITLPANAPISEIESSLLPSTEAAKKDACLKAVHELHNLGVLNDFLLPDSKDEIEDELSDDEFDFDNIKGEGCSRGDLYEMRVPVLFKQKWDPSTSCVNLHSYYIMFVPHPADRIYKKFGFFMKSPLPVEAETMDIDLHLAHQRSVSVKIFPSGVTEFDNDEIRLAELFQEIALKVLFERGELIPDFVPLELQDSSRTSKSTFYLLLPLCLHDGESVISVDWVTIRNCLSSPIFKTPSVLVEDIFPPSGSHLKLANGCWNIDDVKNSLVFTTYSKQFYFVADICHGRNGFSPVKESSTKSHVESIYKLYGVELKHPAQPLLRVKPLCHVRNLLHNRMQTNLEPQELDEYFIEIPPELSHLKIKGLSKDIGSSLSLLPSIMHRMENLLVAIELKHVLSASIPEIAEVSGHRVLEALTTEKCHERLSLERLEVLGDAFLKFAVSRHLFLHHDSLDEGELTRRRSNVVNNSNLCRLAIKKNLQVYIRDQALDPTQFFAFGHPCRVTCDEVASKEVHSLNRDLGILESNTGEIRCSKGHHWLYKKTIADVVEALVGAFLVDSGFKGAVKFLKWIGVNVDFESLQVQDACIASRRYLPLTTRNNLETLENQLDYKFLHKGLLVQAFIHPSYNRHGGGCYQRLEFLGDAVLDYLMTSYFFTVFPKLKPGQLTDLRSLSVNNEALANVAVSFSLKRFLFCESIYLHEVIEDYTNFLASSPLASGQSEGPRCPKVLGDLVESCLGALFLDCGFNLNHVWTMMLSFLDPVKNLSNLQISPIKELIELCQSYKWDREISATKKDGAFTVELKVTKNGCCLTVSATGRNKREGTKKAAQLMITNLKAHENITTSHPLEDVLKNGIRNEAKLIGYNEDPIDVVDLVGLDVENLNILETFGGNSERSSSYVIRRGLPQAPSKTEDRLPQKAIIKAGGPSSKTAKSLLHETCVANCWKPPHFECCEEEGPGHLKSFVYKVILEVEDAPNMTLECYGEARATKKGAAEHAAQAAIWCLKHSGFLC
input PDB |
| Selected Chain(s) | A |
| Distance of aggregation | 10 Å |
| FoldX usage | Yes |
| pH calculations | Yes |
| alphaCutter usage | No |
| Dynamic mode | No |
| Automated mutations | No |
| Downloads | Download all the data |
| Simulation log |
[INFO] Logger: Verbosity set to: 2 - [INFO] (00:00:00)
[WARNING] runJob: Working directory already exists (possibly overwriting previous results -ow
to prevent this behavior) (00:00:00)
[INFO] runJob: Starting aggrescan3d job on: input.pdb with A chain(s) selected (00:00:00)
[INFO] runJob: Creating pdb object from: input.pdb (00:00:00)
[INFO] PDB-Info: The input structure is globular. Max score is recommended for pH analysis. (00:00:11)
[INFO] FoldX: Starting FoldX energy minimization (00:00:11)
[INFO] Analysis: Starting Aggrescan4D on folded.pdb (00:29:20)
[INFO] agg3D: Running pKa-ANI on
/STORAGE/DATA/lcbio/aggreskan/37907179a2133d6/tmp/folded.pdb (00:29:20)
[INFO] Main: Simulation completed successfully. (00:40:27)
|
The table below lists A4D score for protein residues. Residues with A4D score > 0.0000 are marked by yellow rows.
| residue index | residue name | chain | Aggrescan4D score | mutation |
|---|---|---|---|---|
| 1 | M | A | -0.6368 | |
| 2 | R | A | -2.6660 | |
| 3 | D | A | -3.0705 | |
| 4 | E | A | -2.3936 | |
| 5 | V | A | -0.1890 | |
| 6 | D | A | -0.5365 | |
| 7 | L | A | 1.1474 | |
| 8 | S | A | 1.2098 | |
| 9 | L | A | 2.1968 | |
| 10 | T | A | 1.6923 | |
| 11 | I | A | 2.1445 | |
| 12 | P | A | 0.2787 | |
| 13 | S | A | -0.4296 | |
| 14 | K | A | -0.6755 | |
| 15 | L | A | 1.1866 | |
| 16 | L | A | 1.2676 | |
| 17 | G | A | -0.5849 | |
| 18 | K | A | -2.8783 | |
| 19 | R | A | -3.9919 | |
| 20 | D | A | -4.2586 | |
| 21 | R | A | -4.2771 | |
| 22 | E | A | -4.1160 | |
| 23 | Q | A | -3.6165 | |
| 24 | K | A | -3.1611 | |
| 25 | N | A | -2.5181 | |
| 26 | C | A | -1.6456 | |
| 27 | E | A | -2.9202 | |
| 28 | E | A | -4.0365 | |
| 29 | E | A | -4.2736 | |
| 30 | K | A | -4.0048 | |
| 31 | N | A | -3.7682 | |
| 32 | K | A | -3.6716 | |
| 33 | N | A | -3.6642 | |
| 34 | K | A | -3.7955 | |
| 35 | K | A | -3.1103 | |
| 36 | A | A | -2.5025 | |
| 37 | K | A | -3.2632 | |
| 38 | K | A | -3.3784 | |
| 39 | Q | A | -3.3587 | |
| 40 | Q | A | -3.4705 | |
| 41 | K | A | -3.5509 | |
| 42 | D | A | -2.4213 | |
| 43 | P | A | -0.1383 | |
| 44 | I | A | 2.7494 | |
| 45 | L | A | 3.0484 | |
| 46 | L | A | 2.3411 | |
| 47 | H | A | -0.0342 | |
| 48 | T | A | -0.3687 | |
| 49 | S | A | -0.4054 | |
| 50 | A | A | -0.0631 | |
| 51 | A | A | -0.2012 | |
| 52 | T | A | -0.8479 | |
| 53 | H | A | -1.4822 | |
| 54 | K | A | -0.8854 | |
| 55 | F | A | 1.4557 | |
| 56 | L | A | 1.9252 | |
| 57 | P | A | 0.7881 | |
| 58 | P | A | 0.0862 | |
| 59 | P | A | 0.2692 | |
| 60 | L | A | 1.5577 | |
| 61 | T | A | 1.0854 | |
| 62 | M | A | 1.4433 | |
| 63 | P | A | 0.8237 | |
| 64 | Y | A | 0.8640 | |
| 65 | S | A | -0.1234 | |
| 66 | E | A | -0.8044 | |
| 67 | I | A | 0.5113 | |
| 68 | G | A | -0.9256 | |
| 69 | D | A | -2.2599 | |
| 70 | D | A | -2.4706 | |
| 71 | L | A | -0.5890 | |
| 72 | R | A | -1.1895 | |
| 73 | S | A | -0.4402 | |
| 74 | L | A | 0.5782 | |
| 75 | D | A | -0.5407 | |
| 76 | F | A | 0.2945 | |
| 77 | D | A | -1.7502 | |
| 78 | H | A | -1.8366 | |
| 79 | A | A | -1.3584 | |
| 80 | D | A | -1.1857 | |
| 81 | V | A | 0.5535 | |
| 82 | S | A | -0.1820 | |
| 83 | S | A | -0.6399 | |
| 84 | D | A | -1.1003 | |
| 85 | L | A | 0.4886 | |
| 86 | H | A | -0.0680 | |
| 87 | L | A | 1.1159 | |
| 88 | T | A | 0.4007 | |
| 89 | S | A | -0.2033 | |
| 90 | S | A | -0.3139 | |
| 91 | S | A | -0.0829 | |
| 92 | S | A | 0.4247 | |
| 93 | V | A | 1.4737 | |
| 94 | S | A | 0.8876 | |
| 95 | S | A | 0.9354 | |
| 96 | F | A | 1.6059 | |
| 97 | S | A | 0.6383 | |
| 98 | S | A | -0.0536 | |
| 99 | S | A | -0.2947 | |
| 100 | S | A | -0.5381 | |
| 101 | S | A | -0.1396 | |
| 102 | S | A | 0.7147 | |
| 103 | L | A | 2.2953 | |
| 104 | F | A | 2.5600 | |
| 105 | S | A | 1.0158 | |
| 106 | A | A | 0.2527 | |
| 107 | A | A | -0.4456 | |
| 108 | G | A | -1.2436 | |
| 109 | T | A | -1.6167 | |
| 110 | D | A | -2.9200 | |
| 111 | D | A | -2.9387 | |
| 112 | P | A | -2.0426 | |
| 113 | S | A | -1.5345 | |
| 114 | P | A | -1.4460 | |
| 115 | K | A | -2.1906 | |
| 116 | M | A | -1.1707 | |
| 117 | E | A | -2.5412 | |
| 118 | K | A | -2.8201 | |
| 119 | D | A | -1.8323 | |
| 120 | P | A | 0.0000 | |
| 121 | R | A | -1.8516 | |
| 122 | K | A | -1.5607 | |
| 123 | I | A | 0.4371 | |
| 124 | A | A | -0.6538 | |
| 125 | R | A | -1.3506 | |
| 126 | R | A | -2.3247 | |
| 127 | Y | A | 0.0000 | |
| 128 | Q | A | 0.0000 | |
| 129 | V | A | -1.8222 | |
| 130 | E | A | -2.6743 | |
| 131 | L | A | 0.0000 | |
| 132 | C | A | 0.0000 | |
| 133 | K | A | -3.0489 | |
| 134 | K | A | -2.5310 | |
| 135 | A | A | 0.0000 | |
| 136 | T | A | -2.1239 | |
| 137 | E | A | -2.7627 | |
| 138 | E | A | -2.1299 | |
| 139 | N | A | -1.4401 | |
| 140 | V | A | 0.0000 | |
| 141 | I | A | 0.0000 | |
| 142 | V | A | 0.0000 | |
| 143 | Y | A | 0.0000 | |
| 144 | L | A | 0.0000 | |
| 145 | G | A | -0.2913 | |
| 146 | T | A | -0.3876 | |
| 147 | G | A | -0.1140 | |
| 148 | C | A | 0.0000 | |
| 149 | G | A | -0.4141 | |
| 150 | K | A | -0.3627 | |
| 151 | T | A | -0.1436 | |
| 152 | H | A | -0.1107 | |
| 153 | I | A | 0.0000 | |
| 154 | A | A | 0.0000 | |
| 155 | V | A | 0.0000 | |
| 156 | M | A | 0.0000 | |
| 157 | L | A | 0.0000 | |
| 158 | I | A | 0.0000 | |
| 159 | Y | A | -0.8346 | |
| 160 | E | A | -1.4370 | |
| 161 | L | A | 0.0000 | |
| 162 | G | A | 0.0000 | |
| 163 | H | A | -0.3124 | |
| 164 | L | A | 0.0731 | |
| 165 | V | A | 0.0000 | |
| 166 | L | A | 0.6400 | |
| 167 | S | A | -0.5740 | |
| 168 | P | A | -1.2035 | |
| 169 | K | A | -2.3144 | |
| 170 | K | A | -2.1742 | |
| 171 | S | A | -1.1801 | |
| 172 | V | A | 0.0000 | |
| 173 | C | A | 0.0000 | |
| 174 | I | A | 0.0000 | |
| 175 | F | A | 0.0000 | |
| 176 | L | A | 0.0000 | |
| 177 | A | A | 0.0000 | |
| 178 | P | A | -0.2381 | |
| 179 | T | A | 0.0770 | |
| 180 | V | A | 0.0665 | |
| 181 | A | A | -0.7322 | |
| 182 | L | A | 0.0000 | |
| 183 | V | A | 0.0000 | |
| 184 | E | A | -0.8162 | |
| 185 | Q | A | -1.1722 | |
| 186 | Q | A | 0.0000 | |
| 187 | A | A | 0.0000 | |
| 188 | K | A | -1.7215 | |
| 189 | V | A | -0.8376 | |
| 190 | I | A | 0.0000 | |
| 191 | A | A | -1.7581 | |
| 192 | D | A | -2.2584 | |
| 193 | S | A | -1.7531 | |
| 194 | V | A | 0.0000 | |
| 195 | N | A | -2.5079 | |
| 196 | F | A | -1.3719 | |
| 197 | K | A | -1.9030 | |
| 198 | V | A | -1.0096 | |
| 199 | A | A | -0.3437 | |
| 200 | I | A | -0.3856 | |
| 201 | H | A | 0.0000 | |
| 202 | C | A | 0.0000 | |
| 203 | G | A | -1.0173 | |
| 204 | G | A | -1.4967 | |
| 205 | K | A | -2.4126 | |
| 206 | R | A | -2.0552 | |
| 207 | I | A | -0.0626 | |
| 208 | V | A | 0.0000 | |
| 209 | K | A | -1.6662 | |
| 210 | S | A | -1.5627 | |
| 211 | H | A | -1.7447 | |
| 212 | S | A | -2.1259 | |
| 213 | E | A | -2.5961 | |
| 214 | W | A | 0.0000 | |
| 215 | E | A | -2.9880 | |
| 216 | R | A | -3.1390 | |
| 217 | E | A | -1.8633 | |
| 218 | I | A | -1.5917 | |
| 219 | A | A | -1.6725 | |
| 220 | A | A | -1.2856 | |
| 221 | N | A | -1.2045 | |
| 222 | E | A | -0.8807 | |
| 223 | V | A | 0.0000 | |
| 224 | L | A | 0.0000 | |
| 225 | V | A | 0.0000 | |
| 226 | M | A | 0.0000 | |
| 227 | T | A | 0.0000 | |
| 228 | P | A | 0.0000 | |
| 229 | Q | A | -1.1945 | |
| 230 | I | A | -0.3845 | |
| 231 | L | A | 0.0000 | |
| 232 | L | A | -0.3180 | |
| 233 | H | A | -0.4368 | |
| 234 | N | A | 0.0000 | |
| 235 | L | A | 0.0000 | |
| 236 | Q | A | 0.0000 | |
| 237 | H | A | 0.0000 | |
| 238 | C | A | 0.0000 | |
| 239 | F | A | 0.0000 | |
| 240 | I | A | 0.0000 | |
| 241 | K | A | -1.6805 | |
| 242 | M | A | -1.9675 | |
| 243 | E | A | -2.8078 | |
| 244 | C | A | -2.0777 | |
| 245 | I | A | 0.0000 | |
| 246 | S | A | -1.0433 | |
| 247 | L | A | 0.0000 | |
| 248 | L | A | 0.0000 | |
| 249 | I | A | 0.0000 | |
| 250 | F | A | 0.0000 | |
| 251 | D | A | 0.0000 | |
| 252 | E | A | 0.0000 | |
| 253 | C | A | 0.0000 | |
| 254 | H | A | 0.0000 | |
| 255 | H | A | -0.3593 | |
| 256 | A | A | 0.0000 | |
| 257 | Q | A | 0.0000 | |
| 258 | Q | A | -1.3668 | |
| 259 | Q | A | -1.4463 | |
| 260 | S | A | -1.4699 | |
| 261 | N | A | -1.8201 | |
| 262 | H | A | -1.2826 | |
| 263 | P | A | -0.9771 | |
| 264 | Y | A | 0.0000 | |
| 265 | A | A | 0.0000 | |
| 266 | E | A | -0.9632 | |
| 267 | I | A | 0.0000 | |
| 268 | M | A | 0.0000 | |
| 269 | K | A | -1.4781 | |
| 270 | V | A | -0.9319 | |
| 271 | F | A | -0.6883 | |
| 272 | Y | A | 0.0000 | |
| 273 | K | A | -1.8987 | |
| 274 | S | A | -1.7704 | |
| 275 | E | A | -2.2558 | |
| 276 | S | A | -1.6467 | |
| 277 | L | A | -0.3018 | |
| 278 | Q | A | -2.2956 | |
| 279 | R | A | -3.0712 | |
| 280 | P | A | 0.0000 | |
| 281 | R | A | -1.3650 | |
| 282 | I | A | 0.0000 | |
| 283 | F | A | 0.0000 | |
| 284 | G | A | 0.0000 | |
| 285 | M | A | 0.0000 | |
| 286 | T | A | 0.0000 | |
| 287 | A | A | 0.0000 | |
| 288 | S | A | 0.0000 | |
| 289 | P | A | 0.0000 | |
| 290 | V | A | 0.0000 | |
| 291 | V | A | 0.0034 | |
| 292 | G | A | -1.2991 | |
| 293 | K | A | -2.3489 | |
| 294 | G | A | -1.6477 | |
| 295 | S | A | -1.7666 | |
| 296 | F | A | -1.5228 | |
| 297 | Q | A | -2.1167 | |
| 298 | S | A | -2.2062 | |
| 299 | E | A | -3.0751 | |
| 300 | N | A | -2.7607 | |
| 301 | L | A | 0.0000 | |
| 302 | S | A | -2.1471 | |
| 303 | K | A | -2.7204 | |
| 304 | S | A | -1.4301 | |
| 305 | I | A | 0.0000 | |
| 306 | N | A | 0.0000 | |
| 307 | S | A | 0.0000 | |
| 308 | L | A | 0.0000 | |
| 309 | E | A | 0.0000 | |
| 310 | N | A | -1.6036 | |
| 311 | L | A | -0.9127 | |
| 312 | L | A | 0.0000 | |
| 313 | N | A | -1.2814 | |
| 314 | A | A | 0.0000 | |
| 315 | K | A | -1.6496 | |
| 316 | V | A | 0.0000 | |
| 317 | Y | A | -0.4091 | |
| 318 | S | A | -0.5793 | |
| 319 | V | A | -1.0007 | |
| 320 | E | A | -2.0300 | |
| 321 | S | A | -1.2753 | |
| 322 | N | A | -1.4676 | |
| 323 | V | A | 0.3352 | |
| 324 | Q | A | -0.6488 | |
| 325 | L | A | -0.3365 | |
| 326 | D | A | -1.1843 | |
| 327 | G | A | -0.1684 | |
| 328 | F | A | 1.3246 | |
| 329 | V | A | 0.2563 | |
| 330 | S | A | -0.3865 | |
| 331 | S | A | -0.4394 | |
| 332 | P | A | -0.1952 | |
| 333 | L | A | 0.3863 | |
| 334 | V | A | 0.8083 | |
| 335 | K | A | 0.2714 | |
| 336 | V | A | 0.7722 | |
| 337 | Y | A | 0.8107 | |
| 338 | Y | A | 0.5888 | |
| 339 | Y | A | -0.5531 | |
| 340 | R | A | -1.8722 | |
| 341 | S | A | -0.9934 | |
| 342 | A | A | -0.5919 | |
| 343 | L | A | 0.5179 | |
| 344 | S | A | -0.5353 | |
| 345 | D | A | -1.7987 | |
| 346 | A | A | -0.9841 | |
| 347 | S | A | -0.8813 | |
| 348 | Q | A | -1.6662 | |
| 349 | S | A | -1.2808 | |
| 350 | T | A | -0.5996 | |
| 351 | I | A | -0.6734 | |
| 352 | R | A | -2.0579 | |
| 353 | Y | A | 0.0000 | |
| 354 | E | A | -1.5510 | |
| 355 | N | A | -2.2553 | |
| 356 | M | A | -1.6027 | |
| 357 | L | A | 0.0000 | |
| 358 | E | A | -2.4625 | |
| 359 | D | A | -2.5821 | |
| 360 | I | A | 0.0000 | |
| 361 | K | A | 0.0000 | |
| 362 | Q | A | -2.2502 | |
| 363 | R | A | -2.4623 | |
| 364 | C | A | 0.0000 | |
| 365 | L | A | -1.2142 | |
| 366 | A | A | -0.7876 | |
| 367 | S | A | -0.1140 | |
| 368 | L | A | 0.0000 | |
| 369 | K | A | -0.6246 | |
| 370 | L | A | 1.2792 | |
| 371 | L | A | 1.5882 | |
| 372 | I | A | -0.1004 | |
| 373 | D | A | -1.7515 | |
| 374 | T | A | -1.5791 | |
| 375 | H | A | -2.0320 | |
| 376 | Q | A | -1.9089 | |
| 377 | T | A | -1.2935 | |
| 378 | Q | A | -1.4337 | |
| 379 | T | A | -0.8646 | |
| 380 | L | A | -0.8092 | |
| 381 | L | A | -0.4479 | |
| 382 | S | A | -0.6736 | |
| 383 | M | A | 0.0000 | |
| 384 | K | A | -1.5235 | |
| 385 | R | A | -2.1110 | |
| 386 | L | A | -1.3234 | |
| 387 | L | A | 0.0000 | |
| 388 | K | A | -2.4702 | |
| 389 | R | A | -2.9967 | |
| 390 | S | A | -1.7907 | |
| 391 | H | A | -1.5821 | |
| 392 | D | A | -2.1492 | |
| 393 | N | A | -1.3616 | |
| 394 | L | A | 0.0000 | |
| 395 | I | A | -0.1943 | |
| 396 | Y | A | 0.1795 | |
| 397 | T | A | 0.0000 | |
| 398 | L | A | 0.0000 | |
| 399 | L | A | 1.4356 | |
| 400 | N | A | 0.5102 | |
| 401 | L | A | 0.0000 | |
| 402 | G | A | 0.0000 | |
| 403 | L | A | 0.0000 | |
| 404 | W | A | 0.2218 | |
| 405 | G | A | 0.0000 | |
| 406 | A | A | 0.0000 | |
| 407 | I | A | 0.0000 | |
| 408 | Q | A | -0.6786 | |
| 409 | A | A | 0.0000 | |
| 410 | A | A | 0.0000 | |
| 411 | K | A | -1.9127 | |
| 412 | I | A | 0.0000 | |
| 413 | Q | A | -1.3508 | |
| 414 | L | A | -1.2510 | |
| 415 | N | A | -2.1612 | |
| 416 | S | A | -1.8840 | |
| 417 | D | A | -2.7501 | |
| 418 | H | A | -3.1652 | |
| 419 | N | A | -2.6945 | |
| 420 | V | A | -0.7730 | |
| 421 | Q | A | -2.1137 | |
| 422 | D | A | -3.5556 | |
| 423 | E | A | -2.5077 | |
| 424 | P | A | -1.4862 | |
| 425 | V | A | -0.1512 | |
| 426 | G | A | -0.8216 | |
| 427 | K | A | -2.4413 | |
| 428 | N | A | -2.3537 | |
| 429 | P | A | -2.0709 | |
| 430 | K | A | -1.8799 | |
| 431 | S | A | -1.9357 | |
| 432 | K | A | -2.6696 | |
| 433 | I | A | 0.0000 | |
| 434 | C | A | -1.1239 | |
| 435 | D | A | -1.4623 | |
| 436 | T | A | -0.6999 | |
| 437 | Y | A | 0.0000 | |
| 438 | L | A | 0.0000 | |
| 439 | S | A | -0.7768 | |
| 440 | M | A | -0.5068 | |
| 441 | A | A | 0.0000 | |
| 442 | A | A | 0.0000 | |
| 443 | E | A | -1.9853 | |
| 444 | A | A | -0.8874 | |
| 445 | L | A | 0.0000 | |
| 446 | S | A | -0.9828 | |
| 447 | S | A | -1.2877 | |
| 448 | G | A | 0.0000 | |
| 449 | V | A | 0.0000 | |
| 450 | A | A | -1.9523 | |
| 451 | K | A | -3.2155 | |
| 452 | D | A | -3.7340 | |
| 453 | E | A | -3.9421 | |
| 454 | N | A | -3.1721 | |
| 455 | A | A | -1.9123 | |
| 456 | S | A | -1.4994 | |
| 457 | D | A | -1.9605 | |
| 458 | L | A | -0.5758 | |
| 459 | L | A | -0.0766 | |
| 460 | S | A | 0.3231 | |
| 461 | L | A | 1.2449 | |
| 462 | A | A | 0.4165 | |
| 463 | A | A | -0.3379 | |
| 464 | L | A | -0.1597 | |
| 465 | K | A | -1.6806 | |
| 466 | E | A | -1.3921 | |
| 467 | P | A | -0.7728 | |
| 468 | L | A | 0.0000 | |
| 469 | F | A | 0.0000 | |
| 470 | S | A | 0.0000 | |
| 471 | R | A | -1.3186 | |
| 472 | K | A | -0.4726 | |
| 473 | L | A | 0.0000 | |
| 474 | V | A | -0.6173 | |
| 475 | Q | A | -0.7317 | |
| 476 | L | A | 0.0000 | |
| 477 | I | A | 0.0000 | |
| 478 | K | A | -1.0346 | |
| 479 | I | A | 0.0000 | |
| 480 | L | A | 0.0000 | |
| 481 | S | A | 0.0441 | |
| 482 | V | A | 1.1732 | |
| 483 | F | A | 0.1889 | |
| 484 | R | A | -0.7948 | |
| 485 | L | A | 0.5721 | |
| 486 | E | A | -0.7180 | |
| 487 | P | A | -0.9475 | |
| 488 | H | A | -1.4605 | |
| 489 | M | A | -0.9834 | |
| 490 | K | A | 0.0000 | |
| 491 | C | A | 0.0000 | |
| 492 | I | A | 0.0000 | |
| 493 | I | A | 0.0000 | |
| 494 | F | A | 0.0000 | |
| 495 | V | A | 0.0000 | |
| 496 | N | A | -1.2549 | |
| 497 | R | A | -0.7240 | |
| 498 | I | A | -0.0442 | |
| 499 | V | A | 0.0000 | |
| 500 | T | A | 0.0000 | |
| 501 | A | A | 0.0000 | |
| 502 | R | A | -0.2042 | |
| 503 | T | A | 0.0000 | |
| 504 | L | A | 0.0000 | |
| 505 | S | A | 0.0000 | |
| 506 | C | A | -0.3952 | |
| 507 | I | A | 0.0000 | |
| 508 | L | A | 0.0000 | |
| 509 | N | A | -2.1289 | |
| 510 | N | A | -2.2221 | |
| 511 | L | A | 0.0000 | |
| 512 | E | A | -2.4194 | |
| 513 | L | A | -1.2952 | |
| 514 | L | A | 0.0000 | |
| 515 | R | A | -3.3500 | |
| 516 | S | A | -1.8904 | |
| 517 | W | A | 0.0000 | |
| 518 | K | A | -2.6441 | |
| 519 | S | A | 0.0000 | |
| 520 | D | A | -0.5537 | |
| 521 | F | A | 0.2877 | |
| 522 | L | A | 0.0000 | |
| 523 | V | A | 0.0000 | |
| 524 | G | A | -0.2538 | |
| 525 | L | A | 0.1169 | |
| 526 | S | A | -0.1251 | |
| 527 | S | A | -0.2213 | |
| 528 | G | A | -0.0872 | |
| 529 | L | A | 0.6518 | |
| 530 | K | A | -0.5916 | |
| 531 | S | A | 0.0426 | |
| 532 | M | A | -0.1939 | |
| 533 | S | A | -1.3326 | |
| 534 | R | A | -2.6192 | |
| 535 | R | A | -3.0834 | |
| 536 | S | A | -2.0460 | |
| 537 | M | A | -1.9421 | |
| 538 | E | A | -2.9872 | |
| 539 | T | A | -2.2246 | |
| 540 | I | A | 0.0000 | |
| 541 | L | A | 0.0000 | |
| 542 | K | A | -2.9964 | |
| 543 | R | A | -2.6027 | |
| 544 | F | A | 0.0000 | |
| 545 | Q | A | -2.6699 | |
| 546 | S | A | -2.3905 | |
| 547 | K | A | -3.1624 | |
| 548 | E | A | -2.7615 | |
| 549 | L | A | 0.0000 | |
| 550 | N | A | 0.0000 | |
| 551 | L | A | 0.0000 | |
| 552 | L | A | 0.0000 | |
| 553 | V | A | 0.0000 | |
| 554 | A | A | 0.0000 | |
| 555 | T | A | 0.0000 | |
| 556 | K | A | -1.7670 | |
| 557 | V | A | -0.4570 | |
| 558 | G | A | 0.0000 | |
| 559 | E | A | 0.0000 | |
| 560 | E | A | -1.0154 | |
| 561 | G | A | -0.6683 | |
| 562 | L | A | 0.0000 | |
| 563 | D | A | -2.1953 | |
| 564 | I | A | 0.0000 | |
| 565 | Q | A | -1.5263 | |
| 566 | T | A | -0.9612 | |
| 567 | C | A | 0.0000 | |
| 568 | C | A | -0.7125 | |
| 569 | L | A | 0.0000 | |
| 570 | V | A | 0.0000 | |
| 571 | I | A | 0.0000 | |
| 572 | R | A | 0.0000 | |
| 573 | Y | A | 0.0000 | |
| 574 | D | A | 0.0000 | |
| 575 | L | A | -0.2600 | |
| 576 | P | A | 0.0000 | |
| 577 | E | A | -2.3335 | |
| 578 | T | A | -1.4400 | |
| 579 | V | A | 0.0000 | |
| 580 | T | A | -0.5233 | |
| 581 | S | A | -0.8221 | |
| 582 | F | A | 0.0000 | |
| 583 | I | A | 0.0000 | |
| 584 | Q | A | 0.0000 | |
| 585 | S | A | 0.0000 | |
| 586 | R | A | -0.3209 | |
| 587 | G | A | -0.4272 | |
| 588 | R | A | 0.0000 | |
| 589 | A | A | 0.0000 | |
| 590 | R | A | -0.6064 | |
| 591 | M | A | -0.6955 | |
| 592 | P | A | -0.8077 | |
| 593 | Q | A | -1.2761 | |
| 594 | S | A | 0.0000 | |
| 595 | E | A | -0.2625 | |
| 596 | Y | A | 0.0000 | |
| 597 | A | A | 0.0000 | |
| 598 | F | A | 0.0000 | |
| 599 | L | A | 0.0000 | |
| 600 | V | A | 0.0000 | |
| 601 | D | A | -1.3379 | |
| 602 | S | A | -1.0545 | |
| 603 | G | A | -1.5903 | |
| 604 | N | A | -2.6227 | |
| 605 | E | A | -3.4065 | |
| 606 | K | A | -3.5559 | |
| 607 | E | A | -2.4685 | |
| 608 | M | A | -2.4389 | |
| 609 | D | A | -3.4959 | |
| 610 | L | A | -2.1329 | |
| 611 | I | A | 0.0000 | |
| 612 | E | A | -2.8476 | |
| 613 | N | A | -2.0479 | |
| 614 | F | A | 0.0000 | |
| 615 | K | A | -1.9846 | |
| 616 | V | A | -0.9339 | |
| 617 | N | A | -1.2716 | |
| 618 | E | A | -1.4088 | |
| 619 | D | A | -2.0373 | |
| 620 | R | A | -1.0880 | |
| 621 | M | A | 0.0000 | |
| 622 | N | A | -0.7014 | |
| 623 | L | A | 0.5595 | |
| 624 | E | A | -0.0780 | |
| 625 | I | A | 0.0000 | |
| 626 | T | A | 0.3515 | |
| 627 | Y | A | 1.2076 | |
| 628 | R | A | -0.0878 | |
| 629 | S | A | -0.9768 | |
| 630 | S | A | -1.9024 | |
| 631 | E | A | -2.9187 | |
| 632 | E | A | -3.0654 | |
| 633 | T | A | -1.7382 | |
| 634 | C | A | -1.2084 | |
| 635 | P | A | -1.1722 | |
| 636 | R | A | -2.0446 | |
| 637 | L | A | -1.1721 | |
| 638 | D | A | -2.8800 | |
| 639 | E | A | -3.3571 | |
| 640 | E | A | -2.9362 | |
| 641 | L | A | -1.4414 | |
| 642 | Y | A | -0.9485 | |
| 643 | K | A | -1.9641 | |
| 644 | V | A | 0.0000 | |
| 645 | H | A | -2.3482 | |
| 646 | E | A | -2.6302 | |
| 647 | T | A | -1.5691 | |
| 648 | G | A | -1.5047 | |
| 649 | A | A | 0.0000 | |
| 650 | C | A | 0.0000 | |
| 651 | I | A | 0.0000 | |
| 652 | S | A | 0.0000 | |
| 653 | G | A | 0.0000 | |
| 654 | G | A | -1.2175 | |
| 655 | S | A | -0.1859 | |
| 656 | S | A | 0.0000 | |
| 657 | I | A | 0.0240 | |
| 658 | S | A | -0.0920 | |
| 659 | L | A | 0.0000 | |
| 660 | L | A | 0.0000 | |
| 661 | Y | A | -0.2668 | |
| 662 | K | A | -1.1216 | |
| 663 | Y | A | 0.0000 | |
| 664 | C | A | 0.0000 | |
| 665 | S | A | -1.8295 | |
| 666 | R | A | -2.3940 | |
| 667 | L | A | -1.7181 | |
| 668 | P | A | -1.6048 | |
| 669 | H | A | -2.3174 | |
| 670 | D | A | -2.3271 | |
| 671 | E | A | -2.3057 | |
| 672 | F | A | -0.6451 | |
| 673 | F | A | -1.4591 | |
| 674 | Q | A | -2.3985 | |
| 675 | P | A | 0.0000 | |
| 676 | K | A | -1.9603 | |
| 677 | P | A | 0.0000 | |
| 678 | E | A | -1.6469 | |
| 679 | F | A | -1.2813 | |
| 680 | Q | A | -1.5708 | |
| 681 | F | A | -0.6234 | |
| 682 | K | A | -1.5127 | |
| 683 | P | A | -0.5640 | |
| 684 | V | A | 0.1325 | |
| 685 | D | A | -0.9452 | |
| 686 | E | A | -1.3040 | |
| 687 | F | A | 0.6434 | |
| 688 | G | A | -0.0771 | |
| 689 | G | A | 0.1221 | |
| 690 | T | A | -0.1496 | |
| 691 | I | A | -0.2850 | |
| 692 | C | A | 0.0000 | |
| 693 | R | A | -2.1512 | |
| 694 | I | A | 0.0000 | |
| 695 | T | A | -1.7276 | |
| 696 | L | A | 0.0000 | |
| 697 | P | A | 0.0000 | |
| 698 | A | A | 0.0000 | |
| 699 | N | A | -0.6371 | |
| 700 | A | A | 0.0000 | |
| 701 | P | A | -0.2912 | |
| 702 | I | A | -0.3456 | |
| 703 | S | A | -1.0001 | |
| 704 | E | A | -1.7361 | |
| 705 | I | A | 0.0000 | |
| 706 | E | A | -2.2498 | |
| 707 | S | A | 0.0000 | |
| 708 | S | A | 0.0375 | |
| 709 | L | A | 0.9349 | |
| 710 | L | A | 0.3749 | |
| 711 | P | A | 0.0413 | |
| 712 | S | A | -0.7284 | |
| 713 | T | A | -1.0138 | |
| 714 | E | A | -2.1515 | |
| 715 | A | A | -1.0532 | |
| 716 | A | A | 0.0000 | |
| 717 | K | A | -1.4460 | |
| 718 | K | A | -1.4711 | |
| 719 | D | A | -1.2407 | |
| 720 | A | A | 0.0000 | |
| 721 | C | A | 0.0000 | |
| 722 | L | A | -0.8864 | |
| 723 | K | A | -1.5615 | |
| 724 | A | A | 0.0000 | |
| 725 | V | A | 0.0000 | |
| 726 | H | A | -1.6069 | |
| 727 | E | A | -1.7342 | |
| 728 | L | A | 0.0000 | |
| 729 | H | A | -1.2373 | |
| 730 | N | A | -1.4135 | |
| 731 | L | A | 0.3330 | |
| 732 | G | A | -0.5246 | |
| 733 | V | A | -0.1963 | |
| 734 | L | A | 0.0000 | |
| 735 | N | A | -0.9417 | |
| 736 | D | A | -1.8902 | |
| 737 | F | A | -0.7020 | |
| 738 | L | A | 0.0000 | |
| 739 | L | A | -0.4319 | |
| 740 | P | A | 0.0000 | |
| 741 | D | A | -1.7888 | |
| 742 | S | A | -2.4602 | |
| 743 | K | A | -3.9001 | |
| 744 | D | A | -4.6866 | |
| 745 | E | A | -4.2368 | |
| 746 | I | A | -2.9070 | |
| 747 | E | A | -3.9984 | |
| 748 | D | A | -4.7382 | |
| 749 | E | A | -3.8053 | |
| 750 | L | A | -1.8118 | |
| 751 | S | A | -2.6890 | |
| 752 | D | A | -4.0100 | |
| 753 | D | A | -3.5926 | |
| 754 | E | A | -2.3210 | |
| 755 | F | A | -0.4017 | |
| 756 | D | A | -1.7547 | |
| 757 | F | A | 0.2000 | |
| 758 | D | A | -1.6794 | |
| 759 | N | A | -1.5623 | |
| 760 | I | A | -0.2112 | |
| 761 | K | A | -1.9300 | |
| 762 | G | A | -1.8966 | |
| 763 | E | A | -2.3053 | |
| 764 | G | A | -1.4689 | |
| 765 | C | A | -0.7589 | |
| 766 | S | A | -1.3965 | |
| 767 | R | A | -2.2441 | |
| 768 | G | A | -1.2885 | |
| 769 | D | A | -1.4296 | |
| 770 | L | A | -0.4618 | |
| 771 | Y | A | -0.2266 | |
| 772 | E | A | -0.9320 | |
| 773 | M | A | -0.6043 | |
| 774 | R | A | -0.4565 | |
| 775 | V | A | 0.2440 | |
| 776 | P | A | 0.0000 | |
| 777 | V | A | 1.3637 | |
| 778 | L | A | 0.1983 | |
| 779 | F | A | 0.0000 | |
| 780 | K | A | -1.3357 | |
| 781 | Q | A | -2.2275 | |
| 782 | K | A | -3.1573 | |
| 783 | W | A | 0.0000 | |
| 784 | D | A | -2.5918 | |
| 785 | P | A | -1.5621 | |
| 786 | S | A | -1.0064 | |
| 787 | T | A | -0.9997 | |
| 788 | S | A | -0.9953 | |
| 789 | C | A | -1.4870 | |
| 790 | V | A | 0.0000 | |
| 791 | N | A | -1.3437 | |
| 792 | L | A | 0.0000 | |
| 793 | H | A | -0.4007 | |
| 794 | S | A | 0.0000 | |
| 795 | Y | A | 0.0000 | |
| 796 | Y | A | 0.3424 | |
| 797 | I | A | 0.0000 | |
| 798 | M | A | 0.2177 | |
| 799 | F | A | 0.3466 | |
| 800 | V | A | 0.3404 | |
| 801 | P | A | -0.5885 | |
| 802 | H | A | -1.7953 | |
| 803 | P | A | -1.5412 | |
| 804 | A | A | -0.8969 | |
| 805 | D | A | -1.7316 | |
| 806 | R | A | -0.2482 | |
| 807 | I | A | 1.4365 | |
| 808 | Y | A | 0.0000 | |
| 809 | K | A | -0.0473 | |
| 810 | K | A | 0.1055 | |
| 811 | F | A | 0.0000 | |
| 812 | G | A | 0.0000 | |
| 813 | F | A | 0.0000 | |
| 814 | F | A | 0.0000 | |
| 815 | M | A | 0.0000 | |
| 816 | K | A | -1.3953 | |
| 817 | S | A | -0.3858 | |
| 818 | P | A | -0.0765 | |
| 819 | L | A | 0.0000 | |
| 820 | P | A | 0.4959 | |
| 821 | V | A | 1.3051 | |
| 822 | E | A | 0.0931 | |
| 823 | A | A | 0.0000 | |
| 824 | E | A | -0.1084 | |
| 825 | T | A | -0.3528 | |
| 826 | M | A | 0.0000 | |
| 827 | D | A | -2.0960 | |
| 828 | I | A | 0.0000 | |
| 829 | D | A | -2.5961 | |
| 830 | L | A | 0.0000 | |
| 831 | H | A | -1.5208 | |
| 832 | L | A | -1.0505 | |
| 833 | A | A | 0.0000 | |
| 834 | H | A | -1.7939 | |
| 835 | Q | A | -2.0390 | |
| 836 | R | A | -1.8248 | |
| 837 | S | A | -1.2640 | |
| 838 | V | A | 0.0000 | |
| 839 | S | A | 0.0000 | |
| 840 | V | A | 0.0000 | |
| 841 | K | A | -0.9159 | |
| 842 | I | A | 0.0000 | |
| 843 | F | A | 0.3936 | |
| 844 | P | A | 0.2479 | |
| 845 | S | A | 0.4974 | |
| 846 | G | A | 0.5273 | |
| 847 | V | A | 0.5591 | |
| 848 | T | A | -0.4547 | |
| 849 | E | A | -1.9523 | |
| 850 | F | A | 0.0000 | |
| 851 | D | A | -2.5385 | |
| 852 | N | A | -2.7464 | |
| 853 | D | A | -3.1375 | |
| 854 | E | A | -2.3710 | |
| 855 | I | A | 0.0000 | |
| 856 | R | A | -2.6826 | |
| 857 | L | A | -1.8086 | |
| 858 | A | A | 0.0000 | |
| 859 | E | A | -1.2041 | |
| 860 | L | A | -0.7727 | |
| 861 | F | A | 0.0000 | |
| 862 | Q | A | 0.0000 | |
| 863 | E | A | -1.1483 | |
| 864 | I | A | 0.0000 | |
| 865 | A | A | 0.0000 | |
| 866 | L | A | -0.3391 | |
| 867 | K | A | -1.3533 | |
| 868 | V | A | 0.0000 | |
| 869 | L | A | 0.0000 | |
| 870 | F | A | -0.8278 | |
| 871 | E | A | -1.8494 | |
| 872 | R | A | -1.6694 | |
| 873 | G | A | -1.7377 | |
| 874 | E | A | -2.2617 | |
| 875 | L | A | 0.0000 | |
| 876 | I | A | -0.6760 | |
| 877 | P | A | -0.7935 | |
| 878 | D | A | -1.7319 | |
| 879 | F | A | -0.6419 | |
| 880 | V | A | 0.0000 | |
| 881 | P | A | -0.2902 | |
| 882 | L | A | -0.1074 | |
| 883 | E | A | -0.6488 | |
| 884 | L | A | -0.1318 | |
| 885 | Q | A | -1.7512 | |
| 886 | D | A | -2.4618 | |
| 887 | S | A | -1.6219 | |
| 888 | S | A | -1.6685 | |
| 889 | R | A | -2.0495 | |
| 890 | T | A | -1.3389 | |
| 891 | S | A | -1.1197 | |
| 892 | K | A | -1.9102 | |
| 893 | S | A | -1.5000 | |
| 894 | T | A | -0.7098 | |
| 895 | F | A | 0.0000 | |
| 896 | Y | A | 0.0000 | |
| 897 | L | A | 0.0000 | |
| 898 | L | A | 0.0000 | |
| 899 | L | A | 0.0000 | |
| 900 | P | A | 0.0000 | |
| 901 | L | A | 0.0000 | |
| 902 | C | A | 0.7946 | |
| 903 | L | A | 0.4356 | |
| 904 | H | A | -1.4112 | |
| 905 | D | A | -2.4655 | |
| 906 | G | A | -2.1037 | |
| 907 | E | A | -2.0343 | |
| 908 | S | A | -0.4937 | |
| 909 | V | A | 0.9581 | |
| 910 | I | A | 1.0928 | |
| 911 | S | A | 0.7859 | |
| 912 | V | A | 0.7372 | |
| 913 | D | A | 0.0000 | |
| 914 | W | A | 0.4761 | |
| 915 | V | A | 1.1073 | |
| 916 | T | A | 0.0852 | |
| 917 | I | A | 0.0000 | |
| 918 | R | A | -1.5020 | |
| 919 | N | A | -1.2009 | |
| 920 | C | A | 0.0000 | |
| 921 | L | A | -0.7586 | |
| 922 | S | A | -0.9653 | |
| 923 | S | A | 0.0000 | |
| 924 | P | A | -0.1883 | |
| 925 | I | A | 0.0000 | |
| 926 | F | A | -0.3903 | |
| 927 | K | A | -0.5502 | |
| 928 | T | A | -0.1125 | |
| 929 | P | A | 0.4898 | |
| 930 | S | A | 1.1092 | |
| 931 | V | A | 2.3460 | |
| 932 | L | A | 2.2524 | |
| 933 | V | A | 1.8563 | |
| 934 | E | A | -0.3182 | |
| 935 | D | A | -0.5448 | |
| 936 | I | A | 1.7412 | |
| 937 | F | A | 2.1145 | |
| 938 | P | A | 0.7189 | |
| 939 | P | A | 0.0741 | |
| 940 | S | A | -0.4766 | |
| 941 | G | A | -0.8217 | |
| 942 | S | A | -0.9311 | |
| 943 | H | A | -1.0806 | |
| 944 | L | A | 0.0000 | |
| 945 | K | A | -1.2383 | |
| 946 | L | A | 0.0000 | |
| 947 | A | A | -0.4186 | |
| 948 | N | A | -0.8502 | |
| 949 | G | A | -0.4476 | |
| 950 | C | A | 0.1428 | |
| 951 | W | A | -0.6188 | |
| 952 | N | A | -1.3056 | |
| 953 | I | A | -1.5526 | |
| 954 | D | A | -2.4822 | |
| 955 | D | A | -1.9386 | |
| 956 | V | A | 0.0000 | |
| 957 | K | A | -2.3747 | |
| 958 | N | A | -2.1610 | |
| 959 | S | A | 0.0000 | |
| 960 | L | A | 0.0000 | |
| 961 | V | A | 0.0000 | |
| 962 | F | A | 0.0000 | |
| 963 | T | A | 0.0000 | |
| 964 | T | A | -0.6500 | |
| 965 | Y | A | -0.1509 | |
| 966 | S | A | -0.9044 | |
| 967 | K | A | -2.1551 | |
| 968 | Q | A | -1.9395 | |
| 969 | F | A | 0.0000 | |
| 970 | Y | A | 0.0000 | |
| 971 | F | A | 0.0000 | |
| 972 | V | A | 0.0000 | |
| 973 | A | A | -1.2865 | |
| 974 | D | A | -1.9631 | |
| 975 | I | A | 0.0000 | |
| 976 | C | A | -1.3624 | |
| 977 | H | A | -1.5602 | |
| 978 | G | A | -1.2525 | |
| 979 | R | A | -0.9837 | |
| 980 | N | A | -0.3358 | |
| 981 | G | A | 0.0000 | |
| 982 | F | A | 1.4594 | |
| 983 | S | A | 0.0669 | |
| 984 | P | A | -1.0884 | |
| 985 | V | A | -1.1641 | |
| 986 | K | A | -2.6426 | |
| 987 | E | A | -2.7955 | |
| 988 | S | A | -1.7303 | |
| 989 | S | A | -1.4729 | |
| 990 | T | A | -1.1840 | |
| 991 | K | A | -1.2913 | |
| 992 | S | A | -0.2323 | |
| 993 | H | A | 0.0000 | |
| 994 | V | A | -0.4354 | |
| 995 | E | A | -1.5014 | |
| 996 | S | A | 0.0000 | |
| 997 | I | A | 0.0000 | |
| 998 | Y | A | 0.1403 | |
| 999 | K | A | -0.8210 | |
| 1000 | L | A | 1.2042 | |
| 1001 | Y | A | 1.1726 | |
| 1002 | G | A | -0.0183 | |
| 1003 | V | A | -0.2371 | |
| 1004 | E | A | -1.9642 | |
| 1005 | L | A | -1.4470 | |
| 1006 | K | A | -2.2561 | |
| 1007 | H | A | -1.5955 | |
| 1008 | P | A | -0.4307 | |
| 1009 | A | A | -0.1428 | |
| 1010 | Q | A | -0.7714 | |
| 1011 | P | A | -0.8097 | |
| 1012 | L | A | 0.0000 | |
| 1013 | L | A | 0.0000 | |
| 1014 | R | A | -1.2720 | |
| 1015 | V | A | 0.0000 | |
| 1016 | K | A | 0.0000 | |
| 1017 | P | A | -0.2755 | |
| 1018 | L | A | -0.3288 | |
| 1019 | C | A | -0.6811 | |
| 1020 | H | A | -1.2173 | |
| 1021 | V | A | 0.0000 | |
| 1022 | R | A | -1.3846 | |
| 1023 | N | A | -1.0593 | |
| 1024 | L | A | -0.9482 | |
| 1025 | L | A | 0.0000 | |
| 1026 | H | A | -1.9953 | |
| 1027 | N | A | -2.4185 | |
| 1028 | R | A | -1.2555 | |
| 1029 | M | A | -0.4890 | |
| 1030 | Q | A | -1.4350 | |
| 1031 | T | A | -0.7386 | |
| 1032 | N | A | -0.9723 | |
| 1033 | L | A | 0.2966 | |
| 1034 | E | A | -1.0732 | |
| 1035 | P | A | -1.3088 | |
| 1036 | Q | A | -2.0825 | |
| 1037 | E | A | -2.5166 | |
| 1038 | L | A | -1.4321 | |
| 1039 | D | A | -1.3492 | |
| 1040 | E | A | -0.7916 | |
| 1041 | Y | A | 0.3898 | |
| 1042 | F | A | 0.5957 | |
| 1043 | I | A | 0.4062 | |
| 1044 | E | A | -0.7288 | |
| 1045 | I | A | 0.0000 | |
| 1046 | P | A | 0.0000 | |
| 1047 | P | A | 0.0000 | |
| 1048 | E | A | 0.0000 | |
| 1049 | L | A | 0.0000 | |
| 1050 | S | A | 0.0000 | |
| 1051 | H | A | -0.5627 | |
| 1052 | L | A | 0.0000 | |
| 1053 | K | A | 0.0000 | |
| 1054 | I | A | 0.0000 | |
| 1055 | K | A | -1.3375 | |
| 1056 | G | A | -1.2490 | |
| 1057 | L | A | 0.0000 | |
| 1058 | S | A | -0.9348 | |
| 1059 | K | A | -0.5040 | |
| 1060 | D | A | -0.1992 | |
| 1061 | I | A | 0.0000 | |
| 1062 | G | A | 0.0000 | |
| 1063 | S | A | 0.0000 | |
| 1064 | S | A | 0.0000 | |
| 1065 | L | A | 0.0000 | |
| 1066 | S | A | -0.3318 | |
| 1067 | L | A | 0.0000 | |
| 1068 | L | A | 0.0000 | |
| 1069 | P | A | 0.0000 | |
| 1070 | S | A | 0.0000 | |
| 1071 | I | A | 0.0000 | |
| 1072 | M | A | 0.0000 | |
| 1073 | H | A | -0.3021 | |
| 1074 | R | A | 0.0000 | |
| 1075 | M | A | 0.0000 | |
| 1076 | E | A | -0.3910 | |
| 1077 | N | A | 0.0000 | |
| 1078 | L | A | 0.0000 | |
| 1079 | L | A | 0.0000 | |
| 1080 | V | A | 0.0000 | |
| 1081 | A | A | 0.0000 | |
| 1082 | I | A | 0.0000 | |
| 1083 | E | A | -0.0399 | |
| 1084 | L | A | 0.0000 | |
| 1085 | K | A | 0.0000 | |
| 1086 | H | A | -0.5208 | |
| 1087 | V | A | 0.6723 | |
| 1088 | L | A | 0.0000 | |
| 1089 | S | A | -0.4605 | |
| 1090 | A | A | 0.0078 | |
| 1091 | S | A | -0.1713 | |
| 1092 | I | A | 0.0000 | |
| 1093 | P | A | -1.0458 | |
| 1094 | E | A | -1.3834 | |
| 1095 | I | A | 0.0000 | |
| 1096 | A | A | -1.2651 | |
| 1097 | E | A | -2.0688 | |
| 1098 | V | A | 0.0000 | |
| 1099 | S | A | -1.0640 | |
| 1100 | G | A | 0.0000 | |
| 1101 | H | A | -0.8198 | |
| 1102 | R | A | -0.7832 | |
| 1103 | V | A | 0.0000 | |
| 1104 | L | A | 0.0000 | |
| 1105 | E | A | -0.8894 | |
| 1106 | A | A | 0.0000 | |
| 1107 | L | A | 0.0000 | |
| 1108 | T | A | 0.0000 | |
| 1109 | T | A | 0.0000 | |
| 1110 | E | A | -3.2435 | |
| 1111 | K | A | -2.9866 | |
| 1112 | C | A | 0.0000 | |
| 1113 | H | A | -2.6455 | |
| 1114 | E | A | -2.4776 | |
| 1115 | R | A | -2.8747 | |
| 1116 | L | A | -1.5209 | |
| 1117 | S | A | -1.7738 | |
| 1118 | L | A | 0.0000 | |
| 1119 | E | A | -1.3426 | |
| 1120 | R | A | -0.9404 | |
| 1121 | L | A | 0.0000 | |
| 1122 | E | A | -0.7954 | |
| 1123 | V | A | 0.0000 | |
| 1124 | L | A | 0.0000 | |
| 1125 | G | A | 0.0000 | |
| 1126 | D | A | -0.4943 | |
| 1127 | A | A | 0.0000 | |
| 1128 | F | A | 0.0000 | |
| 1129 | L | A | 0.0000 | |
| 1130 | K | A | -0.6124 | |
| 1131 | F | A | 0.0000 | |
| 1132 | A | A | 0.0000 | |
| 1133 | V | A | 0.0000 | |
| 1134 | S | A | 0.0000 | |
| 1135 | R | A | 0.0000 | |
| 1136 | H | A | -0.8944 | |
| 1137 | L | A | 0.0000 | |
| 1138 | F | A | 0.0000 | |
| 1139 | L | A | 0.0000 | |
| 1140 | H | A | -1.3792 | |
| 1141 | H | A | -1.4573 | |
| 1142 | D | A | -2.3868 | |
| 1143 | S | A | -1.2945 | |
| 1144 | L | A | -1.0396 | |
| 1145 | D | A | -1.4342 | |
| 1146 | E | A | -1.4351 | |
| 1147 | G | A | -1.5986 | |
| 1148 | E | A | -2.0577 | |
| 1149 | L | A | 0.0000 | |
| 1150 | T | A | -1.7338 | |
| 1151 | R | A | -2.8379 | |
| 1152 | R | A | -1.8656 | |
| 1153 | R | A | -1.5509 | |
| 1154 | S | A | -1.8258 | |
| 1155 | N | A | -2.2896 | |
| 1156 | V | A | -1.2283 | |
| 1157 | V | A | -1.0038 | |
| 1158 | N | A | -1.4652 | |
| 1159 | N | A | -2.0556 | |
| 1160 | S | A | -1.7234 | |
| 1161 | N | A | -1.4688 | |
| 1162 | L | A | 0.0000 | |
| 1163 | C | A | 0.0000 | |
| 1164 | R | A | -2.5609 | |
| 1165 | L | A | -1.7123 | |
| 1166 | A | A | 0.0000 | |
| 1167 | I | A | -1.4459 | |
| 1168 | K | A | -2.5823 | |
| 1169 | K | A | -2.1760 | |
| 1170 | N | A | -2.0356 | |
| 1171 | L | A | 0.0000 | |
| 1172 | Q | A | 0.0000 | |
| 1173 | V | A | 0.0000 | |
| 1174 | Y | A | 0.0000 | |
| 1175 | I | A | 0.0000 | |
| 1176 | R | A | 0.0000 | |
| 1177 | D | A | 0.0000 | |
| 1178 | Q | A | -1.5078 | |
| 1179 | A | A | -1.5609 | |
| 1180 | L | A | 0.0000 | |
| 1181 | D | A | -1.3369 | |
| 1182 | P | A | -0.9055 | |
| 1183 | T | A | -0.8299 | |
| 1184 | Q | A | -1.0160 | |
| 1185 | F | A | -0.0251 | |
| 1186 | F | A | 0.2589 | |
| 1187 | A | A | 0.0000 | |
| 1188 | F | A | 0.0000 | |
| 1189 | G | A | -1.2012 | |
| 1190 | H | A | -1.3736 | |
| 1191 | P | A | -1.3150 | |
| 1192 | C | A | -0.9178 | |
| 1193 | R | A | -1.2490 | |
| 1194 | V | A | 0.5862 | |
| 1195 | T | A | -0.5575 | |
| 1196 | C | A | -0.9362 | |
| 1197 | D | A | -2.2635 | |
| 1198 | E | A | -2.6588 | |
| 1199 | V | A | -0.6857 | |
| 1200 | A | A | -1.4195 | |
| 1201 | S | A | -1.9911 | |
| 1202 | K | A | -2.6995 | |
| 1203 | E | A | -2.3098 | |
| 1204 | V | A | 0.0000 | |
| 1205 | H | A | -1.5926 | |
| 1206 | S | A | -1.7003 | |
| 1207 | L | A | -0.6521 | |
| 1208 | N | A | -1.8444 | |
| 1209 | R | A | -2.6428 | |
| 1210 | D | A | -2.1626 | |
| 1211 | L | A | 0.1962 | |
| 1212 | G | A | 0.5843 | |
| 1213 | I | A | 2.4877 | |
| 1214 | L | A | 1.4665 | |
| 1215 | E | A | -1.0792 | |
| 1216 | S | A | -1.5380 | |
| 1217 | N | A | -2.1297 | |
| 1218 | T | A | -1.1210 | |
| 1219 | G | A | -1.3446 | |
| 1220 | E | A | -1.6917 | |
| 1221 | I | A | 0.2856 | |
| 1222 | R | A | -1.3275 | |
| 1223 | C | A | -0.9702 | |
| 1224 | S | A | -1.0531 | |
| 1225 | K | A | -1.9487 | |
| 1226 | G | A | -1.2243 | |
| 1227 | H | A | -0.6972 | |
| 1228 | H | A | 0.0000 | |
| 1229 | W | A | 0.4534 | |
| 1230 | L | A | 0.0000 | |
| 1231 | Y | A | -0.6336 | |
| 1232 | K | A | -1.7461 | |
| 1233 | K | A | -1.5549 | |
| 1234 | T | A | -0.7640 | |
| 1235 | I | A | 0.0000 | |
| 1236 | A | A | 0.0000 | |
| 1237 | D | A | -0.9401 | |
| 1238 | V | A | 0.0000 | |
| 1239 | V | A | 0.0000 | |
| 1240 | E | A | 0.0000 | |
| 1241 | A | A | 0.0000 | |
| 1242 | L | A | 0.0000 | |
| 1243 | V | A | 0.0000 | |
| 1244 | G | A | 0.0000 | |
| 1245 | A | A | 0.0000 | |
| 1246 | F | A | 0.0000 | |
| 1247 | L | A | 0.0000 | |
| 1248 | V | A | 0.2019 | |
| 1249 | D | A | -0.8468 | |
| 1250 | S | A | 0.0000 | |
| 1251 | G | A | 0.0000 | |
| 1252 | F | A | 0.0000 | |
| 1253 | K | A | -1.9183 | |
| 1254 | G | A | 0.0000 | |
| 1255 | A | A | 0.0000 | |
| 1256 | V | A | -1.3195 | |
| 1257 | K | A | -2.0365 | |
| 1258 | F | A | 0.0000 | |
| 1259 | L | A | 0.0000 | |
| 1260 | K | A | -2.5424 | |
| 1261 | W | A | -1.2269 | |
| 1262 | I | A | 0.0000 | |
| 1263 | G | A | -1.8259 | |
| 1264 | V | A | 0.0000 | |
| 1265 | N | A | -2.1112 | |
| 1266 | V | A | 0.0000 | |
| 1267 | D | A | -1.7862 | |
| 1268 | F | A | -0.9292 | |
| 1269 | E | A | -1.4330 | |
| 1270 | S | A | -0.6622 | |
| 1271 | L | A | 0.3225 | |
| 1272 | Q | A | -0.9652 | |
| 1273 | V | A | 0.0000 | |
| 1274 | Q | A | -0.6648 | |
| 1275 | D | A | -1.4780 | |
| 1276 | A | A | -0.8854 | |
| 1277 | C | A | 0.0000 | |
| 1278 | I | A | -0.2535 | |
| 1279 | A | A | -0.9301 | |
| 1280 | S | A | 0.0000 | |
| 1281 | R | A | -1.0024 | |
| 1282 | R | A | -1.9143 | |
| 1283 | Y | A | 0.0000 | |
| 1284 | L | A | -0.2543 | |
| 1285 | P | A | -0.6573 | |
| 1286 | L | A | 0.0000 | |
| 1287 | T | A | -0.8712 | |
| 1288 | T | A | -1.2323 | |
| 1289 | R | A | -2.3300 | |
| 1290 | N | A | -2.2965 | |
| 1291 | N | A | -2.5784 | |
| 1292 | L | A | 0.0000 | |
| 1293 | E | A | -2.9936 | |
| 1294 | T | A | -2.1424 | |
| 1295 | L | A | 0.0000 | |
| 1296 | E | A | 0.0000 | |
| 1297 | N | A | -3.0944 | |
| 1298 | Q | A | -2.3677 | |
| 1299 | L | A | 0.0000 | |
| 1300 | D | A | -2.8763 | |
| 1301 | Y | A | -2.1528 | |
| 1302 | K | A | -2.4831 | |
| 1303 | F | A | 0.0000 | |
| 1304 | L | A | 0.2583 | |
| 1305 | H | A | 0.0000 | |
| 1306 | K | A | -0.4009 | |
| 1307 | G | A | 0.0000 | |
| 1308 | L | A | 0.0000 | |
| 1309 | L | A | 0.0000 | |
| 1310 | V | A | 0.0000 | |
| 1311 | Q | A | -0.4217 | |
| 1312 | A | A | 0.0000 | |
| 1313 | F | A | 0.0000 | |
| 1314 | I | A | 0.0000 | |
| 1315 | H | A | 0.0000 | |
| 1316 | P | A | 0.0000 | |
| 1317 | S | A | -0.8386 | |
| 1318 | Y | A | 0.0000 | |
| 1319 | N | A | -1.4048 | |
| 1320 | R | A | -2.2249 | |
| 1321 | H | A | -1.5939 | |
| 1322 | G | A | -1.6099 | |
| 1323 | G | A | -1.0716 | |
| 1324 | G | A | -0.7625 | |
| 1325 | C | A | 0.0000 | |
| 1326 | Y | A | 0.0000 | |
| 1327 | Q | A | -0.7862 | |
| 1328 | R | A | -1.0325 | |
| 1329 | L | A | 0.0000 | |
| 1330 | E | A | -0.6836 | |
| 1331 | F | A | 0.0000 | |
| 1332 | L | A | 0.0000 | |
| 1333 | G | A | 0.0000 | |
| 1334 | D | A | -0.6530 | |
| 1335 | A | A | 0.0000 | |
| 1336 | V | A | 0.0000 | |
| 1337 | L | A | 0.0000 | |
| 1338 | D | A | -0.4732 | |
| 1339 | Y | A | 0.0000 | |
| 1340 | L | A | 0.0000 | |
| 1341 | M | A | 0.0000 | |
| 1342 | T | A | 0.0000 | |
| 1343 | S | A | 0.0000 | |
| 1344 | Y | A | 0.0000 | |
| 1345 | F | A | 0.0000 | |
| 1346 | F | A | -0.3417 | |
| 1347 | T | A | -1.4005 | |
| 1348 | V | A | 0.0000 | |
| 1349 | F | A | 0.0000 | |
| 1350 | P | A | -1.2962 | |
| 1351 | K | A | -1.9451 | |
| 1352 | L | A | 0.0000 | |
| 1353 | K | A | -2.4753 | |
| 1354 | P | A | -1.6139 | |
| 1355 | G | A | -1.2567 | |
| 1356 | Q | A | -1.1542 | |
| 1357 | L | A | 0.0000 | |
| 1358 | T | A | -0.8777 | |
| 1359 | D | A | -1.0695 | |
| 1360 | L | A | 0.0000 | |
| 1361 | R | A | -0.5316 | |
| 1362 | S | A | -0.4414 | |
| 1363 | L | A | -0.5627 | |
| 1364 | S | A | 0.0000 | |
| 1365 | V | A | -0.4923 | |
| 1366 | N | A | -1.3530 | |
| 1367 | N | A | -1.8441 | |
| 1368 | E | A | -2.5425 | |
| 1369 | A | A | -1.0860 | |
| 1370 | L | A | 0.0000 | |
| 1371 | A | A | 0.0000 | |
| 1372 | N | A | -0.7126 | |
| 1373 | V | A | 0.0000 | |
| 1374 | A | A | 0.0000 | |
| 1375 | V | A | -0.2755 | |
| 1376 | S | A | -0.1187 | |
| 1377 | F | A | -0.3435 | |
| 1378 | S | A | -0.7111 | |
| 1379 | L | A | 0.0000 | |
| 1380 | K | A | -1.5977 | |
| 1381 | R | A | -2.1420 | |
| 1382 | F | A | 0.0000 | |
| 1383 | L | A | -0.7012 | |
| 1384 | F | A | 0.0000 | |
| 1385 | C | A | -0.0444 | |
| 1386 | E | A | -0.4040 | |
| 1387 | S | A | 0.5820 | |
| 1388 | I | A | 1.6014 | |
| 1389 | Y | A | 0.5628 | |
| 1390 | L | A | 0.0000 | |
| 1391 | H | A | -1.2450 | |
| 1392 | E | A | -2.2856 | |
| 1393 | V | A | -1.5358 | |
| 1394 | I | A | 0.0000 | |
| 1395 | E | A | -3.5434 | |
| 1396 | D | A | -3.4438 | |
| 1397 | Y | A | 0.0000 | |
| 1398 | T | A | -1.5355 | |
| 1399 | N | A | -1.7406 | |
| 1400 | F | A | -0.3320 | |
| 1401 | L | A | 0.1217 | |
| 1402 | A | A | -0.1852 | |
| 1403 | S | A | 0.0458 | |
| 1404 | S | A | 0.1864 | |
| 1405 | P | A | 0.4898 | |
| 1406 | L | A | 1.2311 | |
| 1407 | A | A | 0.4429 | |
| 1408 | S | A | -0.6389 | |
| 1409 | G | A | -1.1990 | |
| 1410 | Q | A | -2.1084 | |
| 1411 | S | A | -1.9526 | |
| 1412 | E | A | -2.7048 | |
| 1413 | G | A | -1.7553 | |
| 1414 | P | A | -1.7453 | |
| 1415 | R | A | -2.3065 | |
| 1416 | C | A | -1.7602 | |
| 1417 | P | A | 0.0000 | |
| 1418 | K | A | -2.6330 | |
| 1419 | V | A | 0.0000 | |
| 1420 | L | A | 0.0000 | |
| 1421 | G | A | 0.0000 | |
| 1422 | D | A | -0.9162 | |
| 1423 | L | A | 0.0000 | |
| 1424 | V | A | 0.0000 | |
| 1425 | E | A | 0.0000 | |
| 1426 | S | A | 0.0000 | |
| 1427 | C | A | 0.0000 | |
| 1428 | L | A | 0.0000 | |
| 1429 | G | A | 0.0000 | |
| 1430 | A | A | 0.0000 | |
| 1431 | L | A | 0.0000 | |
| 1432 | F | A | 0.0000 | |
| 1433 | L | A | 0.0000 | |
| 1434 | D | A | 0.0000 | |
| 1435 | C | A | -0.5419 | |
| 1436 | G | A | 0.0000 | |
| 1437 | F | A | 0.0000 | |
| 1438 | N | A | -1.2781 | |
| 1439 | L | A | 0.0000 | |
| 1440 | N | A | -1.8711 | |
| 1441 | H | A | -1.6924 | |
| 1442 | V | A | 0.0000 | |
| 1443 | W | A | 0.0000 | |
| 1444 | T | A | -0.6999 | |
| 1445 | M | A | 0.0000 | |
| 1446 | M | A | 0.0000 | |
| 1447 | L | A | 0.0401 | |
| 1448 | S | A | -0.5730 | |
| 1449 | F | A | 0.0000 | |
| 1450 | L | A | 0.0000 | |
| 1451 | D | A | -2.2971 | |
| 1452 | P | A | -1.5102 | |
| 1453 | V | A | -1.4567 | |
| 1454 | K | A | -2.3867 | |
| 1455 | N | A | -2.4112 | |
| 1456 | L | A | -1.6520 | |
| 1457 | S | A | -1.9141 | |
| 1458 | N | A | -1.9686 | |
| 1459 | L | A | -1.1929 | |
| 1460 | Q | A | -1.4678 | |
| 1461 | I | A | -0.8717 | |
| 1462 | S | A | -0.9420 | |
| 1463 | P | A | 0.0000 | |
| 1464 | I | A | 0.0000 | |
| 1465 | K | A | -1.8372 | |
| 1466 | E | A | -1.7625 | |
| 1467 | L | A | 0.0000 | |
| 1468 | I | A | -1.4157 | |
| 1469 | E | A | -2.5746 | |
| 1470 | L | A | 0.0000 | |
| 1471 | C | A | 0.0000 | |
| 1472 | Q | A | -2.5152 | |
| 1473 | S | A | -1.3300 | |
| 1474 | Y | A | -1.0574 | |
| 1475 | K | A | -2.7184 | |
| 1476 | W | A | -2.1520 | |
| 1477 | D | A | -3.2234 | |
| 1478 | R | A | -2.7048 | |
| 1479 | E | A | -2.6228 | |
| 1480 | I | A | -0.8460 | |
| 1481 | S | A | -0.7808 | |
| 1482 | A | A | -0.8043 | |
| 1483 | T | A | -1.4340 | |
| 1484 | K | A | -3.3111 | |
| 1485 | K | A | -3.4767 | |
| 1486 | D | A | -3.7276 | |
| 1487 | G | A | -3.5752 | |
| 1488 | A | A | -2.7070 | |
| 1489 | F | A | -2.5870 | |
| 1490 | T | A | -1.7568 | |
| 1491 | V | A | 0.0000 | |
| 1492 | E | A | -1.2076 | |
| 1493 | L | A | 0.0000 | |
| 1494 | K | A | -1.7210 | |
| 1495 | V | A | 0.0000 | |
| 1496 | T | A | -1.5646 | |
| 1497 | K | A | -1.4998 | |
| 1498 | N | A | -1.8147 | |
| 1499 | G | A | -0.9016 | |
| 1500 | C | A | 0.2452 | |
| 1501 | C | A | 0.0594 | |
| 1502 | L | A | 0.2347 | |
| 1503 | T | A | -0.4453 | |
| 1504 | V | A | 0.0000 | |
| 1505 | S | A | -0.6869 | |
| 1506 | A | A | -0.6827 | |
| 1507 | T | A | -1.5216 | |
| 1508 | G | A | 0.0000 | |
| 1509 | R | A | -3.3400 | |
| 1510 | N | A | -3.4091 | |
| 1511 | K | A | -3.1927 | |
| 1512 | R | A | -3.4566 | |
| 1513 | E | A | -2.9359 | |
| 1514 | G | A | 0.0000 | |
| 1515 | T | A | 0.0000 | |
| 1516 | K | A | -2.3387 | |
| 1517 | K | A | -1.9188 | |
| 1518 | A | A | 0.0000 | |
| 1519 | A | A | 0.0000 | |
| 1520 | Q | A | -0.9416 | |
| 1521 | L | A | -0.1318 | |
| 1522 | M | A | 0.0000 | |
| 1523 | I | A | -0.2299 | |
| 1524 | T | A | -0.4557 | |
| 1525 | N | A | -0.8582 | |
| 1526 | L | A | 0.0000 | |
| 1527 | K | A | -1.9163 | |
| 1528 | A | A | -1.6228 | |
| 1529 | H | A | -2.3161 | |
| 1530 | E | A | -2.9235 | |
| 1531 | N | A | -2.4360 | |
| 1532 | I | A | 0.0000 | |
| 1533 | T | A | -0.9812 | |
| 1534 | T | A | -1.0036 | |
| 1535 | S | A | -1.0533 | |
| 1536 | H | A | -1.4076 | |
| 1537 | P | A | -1.2259 | |
| 1538 | L | A | 0.0000 | |
| 1539 | E | A | -2.2645 | |
| 1540 | D | A | -2.2339 | |
| 1541 | V | A | -1.4298 | |
| 1542 | L | A | 0.0000 | |
| 1543 | K | A | -2.6145 | |
| 1544 | N | A | -2.1010 | |
| 1545 | G | A | -1.3490 | |
| 1546 | I | A | -0.0796 | |
| 1547 | R | A | -2.5087 | |
| 1548 | N | A | -2.7370 | |
| 1549 | E | A | -3.2003 | |
| 1550 | A | A | -2.0403 | |
| 1551 | K | A | -2.1812 | |
| 1552 | L | A | -0.7051 | |
| 1553 | I | A | 0.0000 | |
| 1554 | G | A | -0.6092 | |
| 1555 | Y | A | -1.1399 | |
| 1556 | N | A | -1.8625 | |
| 1557 | E | A | -2.0433 | |
| 1558 | D | A | -2.4403 | |
| 1559 | P | A | -1.6595 | |
| 1560 | I | A | -0.9103 | |
| 1561 | D | A | -1.4571 | |
| 1562 | V | A | 0.1636 | |
| 1563 | V | A | 1.3352 | |
| 1564 | D | A | 0.4698 | |
| 1565 | L | A | 1.4986 | |
| 1566 | V | A | 1.9970 | |
| 1567 | G | A | 0.8645 | |
| 1568 | L | A | 1.2479 | |
| 1569 | D | A | -0.7381 | |
| 1570 | V | A | 0.5264 | |
| 1571 | E | A | -1.7490 | |
| 1572 | N | A | -1.3002 | |
| 1573 | L | A | 1.0150 | |
| 1574 | N | A | 0.0078 | |
| 1575 | I | A | 1.9404 | |
| 1576 | L | A | 1.6682 | |
| 1577 | E | A | -0.2855 | |
| 1578 | T | A | 0.4642 | |
| 1579 | F | A | 1.2586 | |
| 1580 | G | A | -0.2911 | |
| 1581 | G | A | -0.9361 | |
| 1582 | N | A | -2.0987 | |
| 1583 | S | A | -2.3213 | |
| 1584 | E | A | -3.1438 | |
| 1585 | R | A | -2.9278 | |
| 1586 | S | A | -1.6746 | |
| 1587 | S | A | -0.5325 | |
| 1588 | S | A | 0.9002 | |
| 1589 | Y | A | 2.2919 | |
| 1590 | V | A | 2.7221 | |
| 1591 | I | A | 1.6852 | |
| 1592 | R | A | -1.3323 | |
| 1593 | R | A | -1.8023 | |
| 1594 | G | A | -0.8366 | |
| 1595 | L | A | 0.3672 | |
| 1596 | P | A | -0.5286 | |
| 1597 | Q | A | -1.0471 | |
| 1598 | A | A | -0.7460 | |
| 1599 | P | A | -0.9855 | |
| 1600 | S | A | -1.2757 | |
| 1601 | K | A | -2.5296 | |
| 1602 | T | A | -2.3631 | |
| 1603 | E | A | -3.4557 | |
| 1604 | D | A | -3.4909 | |
| 1605 | R | A | -2.4601 | |
| 1606 | L | A | -0.4117 | |
| 1607 | P | A | -0.7464 | |
| 1608 | Q | A | -1.7380 | |
| 1609 | K | A | -1.8478 | |
| 1610 | A | A | 0.1451 | |
| 1611 | I | A | 2.1388 | |
| 1612 | I | A | 2.0570 | |
| 1613 | K | A | -0.3054 | |
| 1614 | A | A | -0.4357 | |
| 1615 | G | A | -0.8546 | |
| 1616 | G | A | -0.9213 | |
| 1617 | P | A | -0.9712 | |
| 1618 | S | A | -0.9712 | |
| 1619 | S | A | -1.3346 | |
| 1620 | K | A | -1.9254 | |
| 1621 | T | A | -1.4155 | |
| 1622 | A | A | -1.4027 | |
| 1623 | K | A | -1.8250 | |
| 1624 | S | A | -1.4398 | |
| 1625 | L | A | -1.0211 | |
| 1626 | L | A | 0.0000 | |
| 1627 | H | A | -1.4026 | |
| 1628 | E | A | -1.5010 | |
| 1629 | T | A | 0.0000 | |
| 1630 | C | A | 0.0000 | |
| 1631 | V | A | 0.8968 | |
| 1632 | A | A | 0.2282 | |
| 1633 | N | A | -0.4918 | |
| 1634 | C | A | 0.1258 | |
| 1635 | W | A | 0.0000 | |
| 1636 | K | A | -1.4584 | |
| 1637 | P | A | -0.9921 | |
| 1638 | P | A | -0.9242 | |
| 1639 | H | A | -1.3417 | |
| 1640 | F | A | -0.6187 | |
| 1641 | E | A | -1.1177 | |
| 1642 | C | A | -0.9382 | |
| 1643 | C | A | -0.8236 | |
| 1644 | E | A | -3.0009 | |
| 1645 | E | A | -3.9190 | |
| 1646 | E | A | -3.3733 | |
| 1647 | G | A | -1.8191 | |
| 1648 | P | A | -1.2271 | |
| 1649 | G | A | -1.1336 | |
| 1650 | H | A | -0.7977 | |
| 1651 | L | A | 0.0025 | |
| 1652 | K | A | -2.0890 | |
| 1653 | S | A | -2.5029 | |
| 1654 | F | A | -2.6996 | |
| 1655 | V | A | -1.9282 | |
| 1656 | Y | A | -1.3110 | |
| 1657 | K | A | -0.4679 | |
| 1658 | V | A | 0.0000 | |
| 1659 | I | A | -0.4816 | |
| 1660 | L | A | 0.0000 | |
| 1661 | E | A | -2.4692 | |
| 1662 | V | A | 0.0000 | |
| 1663 | E | A | -3.3624 | |
| 1664 | D | A | -2.9386 | |
| 1665 | A | A | -2.0332 | |
| 1666 | P | A | -2.0612 | |
| 1667 | N | A | -1.9175 | |
| 1668 | M | A | -1.1219 | |
| 1669 | T | A | -0.9288 | |
| 1670 | L | A | -0.3352 | |
| 1671 | E | A | -0.6659 | |
| 1672 | C | A | 0.0000 | |
| 1673 | Y | A | 0.2548 | |
| 1674 | G | A | 0.0000 | |
| 1675 | E | A | -1.8074 | |
| 1676 | A | A | -2.2913 | |
| 1677 | R | A | -2.5950 | |
| 1678 | A | A | -1.7208 | |
| 1679 | T | A | -1.7945 | |
| 1680 | K | A | -2.7833 | |
| 1681 | K | A | -2.7913 | |
| 1682 | G | A | -2.2481 | |
| 1683 | A | A | 0.0000 | |
| 1684 | A | A | 0.0000 | |
| 1685 | E | A | -2.0757 | |
| 1686 | H | A | -1.9062 | |
| 1687 | A | A | 0.0000 | |
| 1688 | A | A | 0.0000 | |
| 1689 | Q | A | -0.8818 | |
| 1690 | A | A | -0.2287 | |
| 1691 | A | A | 0.0000 | |
| 1692 | I | A | 0.0000 | |
| 1693 | W | A | 0.0278 | |
| 1694 | C | A | -0.5092 | |
| 1695 | L | A | 0.0000 | |
| 1696 | K | A | -0.9034 | |
| 1697 | H | A | -1.2276 | |
| 1698 | S | A | -0.5678 | |
| 1699 | G | A | -0.6978 | |
| 1700 | F | A | -0.2542 | |
| 1701 | L | A | 0.1497 | |
| 1702 | C | A | 0.4556 |
Calculations for various pH values
This page contains details and comparisons for all models calculated at different pH points.
Please find suggestions on interpreting the results below. More details can be found in the Tutorial.
The input structure is globular. Max score is recommended for pH analysis.
pH |
Average A4D Score |
Max A4D Score |
|||
| 4.0 | -0.722 | 6.5262 | View | CSV | PDB |
| 4.5 | -0.7999 | 6.4167 | View | CSV | PDB |
| 5.0 | -0.8958 | 6.2696 | View | CSV | PDB |
| 5.5 | -0.9901 | 6.1051 | View | CSV | PDB |
| 6.0 | -1.0635 | 5.9386 | View | CSV | PDB |
| 6.5 | -1.1038 | 5.7815 | View | CSV | PDB |
| 7.0 | -1.1119 | 5.6409 | View | CSV | PDB |
| 7.5 | -1.099 | 5.5151 | View | CSV | PDB |
| 8.0 | -1.0751 | 5.3987 | View | CSV | PDB |
| 8.5 | -1.043 | 5.2914 | View | CSV | PDB |
| 9.0 | -1.0014 | 5.2007 | View | CSV | PDB |
ALA alanine
ARG arginine
ASN asparagine
ASP aspartic acid
CYS cysteine
GLN glutamine
GLU glutamic acid
GLY glycine
HIS histidine
ILE isoleucine
LEU leucine
LYS lysine
MET methionine
PHE phenylalanine
PRO proline
SER serine
THR threonine
TRP tryptophan
TYR tyrosine
VAL valine