| Chain sequence(s) |
A: MSTPTDPGAMPHPGPSPGPGPSPGPILGPSPGPGPSPGSVHSMMGPSPGPPSVSHPMPTMGSTDFPQEGMHQMHKPIDGIHDKGIVEDIHCGSMKGTGMRPPHPGMGPPQSPMDQHSQGYMSPHPSPLGAPEHVSSPMSGGGPTPPQMPPSQPGALIPGDPQAMSQPNRGPSPFSPVQLHQLRAQILAYKMLARGQPLPETLQLAVQGKRTLPGLQQQQQQQQQQQQQQQQQQQQQQQPQQQPPQPQTQQQQQPALVNYNRPSGPGPELSGPSTPQKLPVPAPGGRPSPAPPAAAQPPAAAVPGPSVPQPAPGQPSPVLQLQQKQSRISPIQKPQGLDPVEILQEREYRLQARIAHRIQELENLPGSLPPDLRTKATVELKALRLLNFQRQLRQEVVACMRRDTTLETALNSKAYKRSKRQTLREARMTEKLEKQQKIEQERKRRQKHQEYLNSILQHAKDFKEYHRSVAGKIQKLSKAVATWHANTEREQKKETERIEKERMRRLMAEDEEGYRKLIDQKKDRRLAYLLQQTDEYVANLTNLVWEHKQAQAAKEKKKRRRRKKKAEENAEGGESALGPDGEPIDESSQMSDLPVKVTHTETGKVLFGPEAPKASQLDAWLEMNPGYEVAPRSDSEESDSDYEEEDEEEESSRQETEEKILLDPNSEEVSEKDAKQIIETAKQDVDDEYSMQYSARGSQSYYTVAHAISERVEKQSALLINGTLKHYQLQGLEWMVSLYNNNLNGILADEMGLGKTIQTIALITYLMEHKRLNGPYLIIVPLSTLSNWTYEFDKWAPSVVKISYKGTPAMRRSLVPQLRSGKFNVLLTTYEYIIKDKHILAKIRWKYMIVDEGHRMKNHHCKLTQVLNTHYVAPRRILLTGTPLQNKLPELWALLNFLLPTIFKSCSTFEQWFNAPFAMTGERVDLNEEETILIIRRLHKVLRPFLLRRLKKEVESQLPEKVEYVIKCDMSALQKILYRHMQAKGILLTDGSEKDKKGKGGAKTLMNTIMQLRKICNHPYMFQHIEESFAEHLGYSNGVINGAELYRASGKFELLDRILPKLRATNHRVLLFCQMTSLMTIMEDYFAFRNFLYLRLDGTTKSEDRAALLKKFNEPGSQYFIFLLSTRAGGLGLNLQAADTVVIFDSDWNPHQDLQAQDRAHRIGQQNEVRVLRLCTVNSVEEKILAAAKYKLNVDQKVIQAGMFDQKSSSHERRAFLQAILEHEEENEEEDEVPDDETLNQMIARREEEFDLFMRMDMDRRREDARNPKRKPRLMEEDELPSWIIKDDAEVERLTCEEEEEKIFGRGSRQRRDVDYSDALTEKQWLRAIEDGNLEEMEEEVRLKKRKRRRNVDKDPAKEDVEKAKKRRGRPPAEKLSPNPPKLTKQMNAIIDTVINYKDRCNVEKVPSNSQLEIEGNSSGRQLSEVFIQLPSRKELPEYYELIRKPVDFKKIKERIRNHKYRSLGDLEKDVMLLCHNAQTFNLEGSQIYEDSIVLQSVFKSARQKIAKEEESEDESNEEEEEEDEEESESEAKSVKVKIKLNKKDDKGRDKGKGKKRPNRGKAKPVVSDFDSDEEQDEREQSEGSGTDDE
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] (00:00:01)
[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 A chain(s) selected (00:00:01)
[INFO] runJob: Creating pdb object from: input.pdb (00:00:01)
[INFO] PDB-Info: The input structure is partially or entirely disordered. Average score is
recommended for pH analysis. (00:00:12)
[INFO] FoldX: Starting FoldX energy minimization (00:00:12)
[INFO] Analysis: Starting Aggrescan4D on folded.pdb (00:50:21)
[INFO] agg3D: Running pKa-ANI on
/STORAGE/DATA/lcbio/aggreskan/e6795c3cbd92783/tmp/folded.pdb (00:50:21)
[INFO] Main: Simulation completed successfully. (01:21:12)
|
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 | 0.9185 | |
| 2 | S | A | 0.2880 | |
| 3 | T | A | -0.1021 | |
| 4 | P | A | -0.7547 | |
| 5 | T | A | -1.1479 | |
| 6 | D | A | -2.1195 | |
| 7 | P | A | -1.4827 | |
| 8 | G | A | -0.7531 | |
| 9 | A | A | 0.2288 | |
| 10 | M | A | 0.6361 | |
| 11 | P | A | -0.1836 | |
| 12 | H | A | -1.1171 | |
| 13 | P | A | -1.1186 | |
| 14 | G | A | -0.9836 | |
| 15 | P | A | -0.7199 | |
| 16 | S | A | -0.6699 | |
| 17 | P | A | -0.6927 | |
| 18 | G | A | -0.8759 | |
| 19 | P | A | -0.8463 | |
| 20 | G | A | -0.8825 | |
| 21 | P | A | -0.7346 | |
| 22 | S | A | -0.6807 | |
| 23 | P | A | -0.6960 | |
| 24 | G | A | -0.3818 | |
| 25 | P | A | 0.7183 | |
| 26 | I | A | 2.4571 | |
| 27 | L | A | 2.1949 | |
| 28 | G | A | 0.4929 | |
| 29 | P | A | -0.3247 | |
| 30 | S | A | -0.6741 | |
| 31 | P | A | -0.6953 | |
| 32 | G | A | -0.8809 | |
| 33 | P | A | -0.8423 | |
| 34 | G | A | -0.8828 | |
| 35 | P | A | -0.7215 | |
| 36 | S | A | -0.7063 | |
| 37 | P | A | -0.6969 | |
| 38 | G | A | -0.3443 | |
| 39 | S | A | 0.0965 | |
| 40 | V | A | 1.0436 | |
| 41 | H | A | -0.0630 | |
| 42 | S | A | 0.3707 | |
| 43 | M | A | 1.1638 | |
| 44 | M | A | 1.2725 | |
| 45 | G | A | 0.0715 | |
| 46 | P | A | -0.4337 | |
| 47 | S | A | -0.6739 | |
| 48 | P | A | -0.6962 | |
| 49 | G | A | -0.8121 | |
| 50 | P | A | -0.7137 | |
| 51 | P | A | -0.2446 | |
| 52 | S | A | 0.4181 | |
| 53 | V | A | 1.3132 | |
| 54 | S | A | 0.1144 | |
| 55 | H | A | -0.6319 | |
| 56 | P | A | -0.3849 | |
| 57 | M | A | 0.5541 | |
| 58 | P | A | 0.4473 | |
| 59 | T | A | 0.4605 | |
| 60 | M | A | 0.6653 | |
| 61 | G | A | -0.0356 | |
| 62 | S | A | -0.4909 | |
| 63 | T | A | -0.8432 | |
| 64 | D | A | -1.0061 | |
| 65 | F | A | 0.4247 | |
| 66 | P | A | -0.5728 | |
| 67 | Q | A | -1.8356 | |
| 68 | E | A | -2.2889 | |
| 69 | G | A | -1.4672 | |
| 70 | M | A | -0.3117 | |
| 71 | H | A | -0.9336 | |
| 72 | Q | A | -1.1490 | |
| 73 | M | A | -0.5710 | |
| 74 | H | A | -1.6097 | |
| 75 | K | A | -1.7188 | |
| 76 | P | A | -0.7722 | |
| 77 | I | A | 0.5835 | |
| 78 | D | A | -0.6935 | |
| 79 | G | A | -0.2852 | |
| 80 | I | A | 0.4492 | |
| 81 | H | A | -1.3973 | |
| 82 | D | A | -2.7937 | |
| 83 | K | A | -2.3933 | |
| 84 | G | A | -0.5654 | |
| 85 | I | A | 1.9681 | |
| 86 | V | A | 1.3344 | |
| 87 | E | A | -1.0920 | |
| 88 | D | A | -1.6518 | |
| 89 | I | A | 0.3469 | |
| 90 | H | A | -0.0219 | |
| 91 | C | A | 0.3481 | |
| 92 | G | A | -0.1620 | |
| 93 | S | A | -0.0766 | |
| 94 | M | A | -0.0813 | |
| 95 | K | A | -1.5068 | |
| 96 | G | A | -1.3386 | |
| 97 | T | A | -0.7009 | |
| 98 | G | A | -0.4522 | |
| 99 | M | A | -0.1254 | |
| 100 | R | A | -1.6219 | |
| 101 | P | A | -1.3651 | |
| 102 | P | A | -1.3265 | |
| 103 | H | A | -1.4086 | |
| 104 | P | A | -0.8797 | |
| 105 | G | A | -0.4320 | |
| 106 | M | A | 0.5087 | |
| 107 | G | A | -0.2384 | |
| 108 | P | A | -0.6580 | |
| 109 | P | A | -1.1053 | |
| 110 | Q | A | -1.5289 | |
| 111 | S | A | -0.7516 | |
| 112 | P | A | -0.4925 | |
| 113 | M | A | -0.3462 | |
| 114 | D | A | -2.0303 | |
| 115 | Q | A | -2.3682 | |
| 116 | H | A | -2.2595 | |
| 117 | S | A | -1.6793 | |
| 118 | Q | A | -1.4823 | |
| 119 | G | A | -0.3582 | |
| 120 | Y | A | 1.3107 | |
| 121 | M | A | 1.4525 | |
| 122 | S | A | 0.1912 | |
| 123 | P | A | -0.6586 | |
| 124 | H | A | -1.3478 | |
| 125 | P | A | -1.0164 | |
| 126 | S | A | -0.3602 | |
| 127 | P | A | 0.2269 | |
| 128 | L | A | 1.1642 | |
| 129 | G | A | 0.2118 | |
| 130 | A | A | -0.3702 | |
| 131 | P | A | -1.3863 | |
| 132 | E | A | -2.0758 | |
| 133 | H | A | -1.1176 | |
| 134 | V | A | 0.7690 | |
| 135 | S | A | 0.3082 | |
| 136 | S | A | 0.1232 | |
| 137 | P | A | 0.0605 | |
| 138 | M | A | 0.6711 | |
| 139 | S | A | -0.1078 | |
| 140 | G | A | -0.6672 | |
| 141 | G | A | -1.0156 | |
| 142 | G | A | -0.9430 | |
| 143 | P | A | -0.7123 | |
| 144 | T | A | -0.6240 | |
| 145 | P | A | -0.6672 | |
| 146 | P | A | -0.7970 | |
| 147 | Q | A | -0.8888 | |
| 148 | M | A | 0.1473 | |
| 149 | P | A | -0.1522 | |
| 150 | P | A | -0.5144 | |
| 151 | S | A | -1.0174 | |
| 152 | Q | A | -1.5925 | |
| 153 | P | A | -1.1820 | |
| 154 | G | A | -0.5043 | |
| 155 | A | A | 0.9718 | |
| 156 | L | A | 2.3876 | |
| 157 | I | A | 2.5255 | |
| 158 | P | A | 0.5744 | |
| 159 | G | A | -1.0788 | |
| 160 | D | A | -2.4562 | |
| 161 | P | A | -1.9100 | |
| 162 | Q | A | -1.4297 | |
| 163 | A | A | -0.2431 | |
| 164 | M | A | 0.4651 | |
| 165 | S | A | -0.4900 | |
| 166 | Q | A | -1.7238 | |
| 167 | P | A | -1.9889 | |
| 168 | N | A | -2.7475 | |
| 169 | R | A | -2.9559 | |
| 170 | G | A | -1.8829 | |
| 171 | P | A | -1.0340 | |
| 172 | S | A | -0.4069 | |
| 173 | P | A | 0.0232 | |
| 174 | F | A | 1.0753 | |
| 175 | S | A | 0.5697 | |
| 176 | P | A | 0.6683 | |
| 177 | V | A | 1.0580 | |
| 178 | Q | A | 0.2102 | |
| 179 | L | A | 0.2410 | |
| 180 | H | A | -0.2991 | |
| 181 | Q | A | -0.9895 | |
| 182 | L | A | 0.0755 | |
| 183 | R | A | -0.9539 | |
| 184 | A | A | 0.0000 | |
| 185 | Q | A | -0.4129 | |
| 186 | I | A | 0.8975 | |
| 187 | L | A | 0.7967 | |
| 188 | A | A | 0.0000 | |
| 189 | Y | A | 1.0277 | |
| 190 | K | A | -0.5656 | |
| 191 | M | A | -0.2628 | |
| 192 | L | A | 0.7268 | |
| 193 | A | A | -0.4858 | |
| 194 | R | A | -2.0705 | |
| 195 | G | A | -1.3993 | |
| 196 | Q | A | -1.5709 | |
| 197 | P | A | -0.8459 | |
| 198 | L | A | -0.1573 | |
| 199 | P | A | -1.0945 | |
| 200 | E | A | -1.9054 | |
| 201 | T | A | -1.4261 | |
| 202 | L | A | 0.0000 | |
| 203 | Q | A | -1.7272 | |
| 204 | L | A | -1.8019 | |
| 205 | A | A | 0.0000 | |
| 206 | V | A | -1.5195 | |
| 207 | Q | A | -2.0057 | |
| 208 | G | A | -2.0534 | |
| 209 | K | A | -3.0341 | |
| 210 | R | A | -2.7168 | |
| 211 | T | A | -1.0010 | |
| 212 | L | A | -0.2184 | |
| 213 | P | A | -0.6567 | |
| 214 | G | A | -0.7910 | |
| 215 | L | A | -0.5839 | |
| 216 | Q | A | -2.4519 | |
| 217 | Q | A | -3.2860 | |
| 218 | Q | A | -3.5756 | |
| 219 | Q | A | -4.0411 | |
| 220 | Q | A | -4.4207 | |
| 221 | Q | A | -4.8011 | |
| 222 | Q | A | -4.8019 | |
| 223 | Q | A | -4.7776 | |
| 224 | Q | A | -4.7757 | |
| 225 | Q | A | -4.7065 | |
| 226 | Q | A | -4.5756 | |
| 227 | Q | A | -4.4693 | |
| 228 | Q | A | -4.4175 | |
| 229 | Q | A | -4.2612 | |
| 230 | Q | A | -4.0774 | |
| 231 | Q | A | -4.0016 | |
| 232 | Q | A | -4.0373 | |
| 233 | Q | A | -4.1070 | |
| 234 | Q | A | -4.0337 | |
| 235 | Q | A | -3.8254 | |
| 236 | Q | A | -3.6072 | |
| 237 | Q | A | -3.2210 | |
| 238 | Q | A | -2.7541 | |
| 239 | P | A | -2.0537 | |
| 240 | Q | A | -2.4149 | |
| 241 | Q | A | -2.4587 | |
| 242 | Q | A | -2.2216 | |
| 243 | P | A | -1.5052 | |
| 244 | P | A | -1.2733 | |
| 245 | Q | A | -1.7567 | |
| 246 | P | A | -1.5462 | |
| 247 | Q | A | -1.8494 | |
| 248 | T | A | -1.6108 | |
| 249 | Q | A | -2.3901 | |
| 250 | Q | A | -2.7084 | |
| 251 | Q | A | -2.9542 | |
| 252 | Q | A | -2.7484 | |
| 253 | Q | A | -1.9783 | |
| 254 | P | A | -0.8133 | |
| 255 | A | A | 0.7226 | |
| 256 | L | A | 1.9794 | |
| 257 | V | A | 2.1158 | |
| 258 | N | A | 0.4059 | |
| 259 | Y | A | -0.0629 | |
| 260 | N | A | -1.7381 | |
| 261 | R | A | -2.3878 | |
| 262 | P | A | -1.7395 | |
| 263 | S | A | -1.0638 | |
| 264 | G | A | -1.0879 | |
| 265 | P | A | -0.8435 | |
| 266 | G | A | -1.2255 | |
| 267 | P | A | -1.1716 | |
| 268 | E | A | -1.2384 | |
| 269 | L | A | 0.3079 | |
| 270 | S | A | -0.1227 | |
| 271 | G | A | -0.4631 | |
| 272 | P | A | -0.6822 | |
| 273 | S | A | -0.5221 | |
| 274 | T | A | -0.5964 | |
| 275 | P | A | -1.2374 | |
| 276 | Q | A | -1.8715 | |
| 277 | K | A | -1.6393 | |
| 278 | L | A | 0.7475 | |
| 279 | P | A | 1.0190 | |
| 280 | V | A | 1.8768 | |
| 281 | P | A | 0.5780 | |
| 282 | A | A | 0.1079 | |
| 283 | P | A | -0.5901 | |
| 284 | G | A | -1.1697 | |
| 285 | G | A | -1.6935 | |
| 286 | R | A | -2.3469 | |
| 287 | P | A | -1.5324 | |
| 288 | S | A | -0.8605 | |
| 289 | P | A | -0.4454 | |
| 290 | A | A | -0.2811 | |
| 291 | P | A | -0.4008 | |
| 292 | P | A | -0.3409 | |
| 293 | A | A | -0.0775 | |
| 294 | A | A | -0.1799 | |
| 295 | A | A | -0.5214 | |
| 296 | Q | A | -1.3386 | |
| 297 | P | A | -0.9620 | |
| 298 | P | A | -0.6068 | |
| 299 | A | A | -0.0796 | |
| 300 | A | A | 0.4290 | |
| 301 | A | A | 0.8879 | |
| 302 | V | A | 1.5759 | |
| 303 | P | A | 0.4562 | |
| 304 | G | A | -0.4061 | |
| 305 | P | A | -0.3467 | |
| 306 | S | A | 0.3666 | |
| 307 | V | A | 1.2269 | |
| 308 | P | A | 0.0696 | |
| 309 | Q | A | -1.0667 | |
| 310 | P | A | -0.9900 | |
| 311 | A | A | -0.5657 | |
| 312 | P | A | -0.7338 | |
| 313 | G | A | -1.1998 | |
| 314 | Q | A | -1.6891 | |
| 315 | P | A | -1.1846 | |
| 316 | S | A | -0.2041 | |
| 317 | P | A | 0.6497 | |
| 318 | V | A | 2.0792 | |
| 319 | L | A | 2.0720 | |
| 320 | Q | A | 0.4507 | |
| 321 | L | A | 0.2868 | |
| 322 | Q | A | -1.7572 | |
| 323 | Q | A | -2.5506 | |
| 324 | K | A | -3.2219 | |
| 325 | Q | A | -2.7817 | |
| 326 | S | A | -1.6264 | |
| 327 | R | A | -1.5575 | |
| 328 | I | A | 1.0375 | |
| 329 | S | A | 0.5704 | |
| 330 | P | A | 0.3853 | |
| 331 | I | A | 1.0457 | |
| 332 | Q | A | -1.3431 | |
| 333 | K | A | -2.2767 | |
| 334 | P | A | -1.6098 | |
| 335 | Q | A | -1.9191 | |
| 336 | G | A | -1.0336 | |
| 337 | L | A | 0.1835 | |
| 338 | D | A | -0.9331 | |
| 339 | P | A | -0.1468 | |
| 340 | V | A | 0.4404 | |
| 341 | E | A | -1.8947 | |
| 342 | I | A | -0.9173 | |
| 343 | L | A | -0.6635 | |
| 344 | Q | A | -2.2005 | |
| 345 | E | A | -3.4106 | |
| 346 | R | A | -3.4744 | |
| 347 | E | A | -3.4861 | |
| 348 | Y | A | -2.0579 | |
| 349 | R | A | -3.2866 | |
| 350 | L | A | -2.2873 | |
| 351 | Q | A | -2.5171 | |
| 352 | A | A | -2.1547 | |
| 353 | R | A | -2.9177 | |
| 354 | I | A | -1.9237 | |
| 355 | A | A | -2.1776 | |
| 356 | H | A | -2.9086 | |
| 357 | R | A | -2.9269 | |
| 358 | I | A | -2.6261 | |
| 359 | Q | A | -3.2549 | |
| 360 | E | A | -3.3596 | |
| 361 | L | A | 0.0000 | |
| 362 | E | A | -2.5618 | |
| 363 | N | A | -2.5056 | |
| 364 | L | A | -1.1781 | |
| 365 | P | A | -0.6765 | |
| 366 | G | A | -0.7409 | |
| 367 | S | A | -0.4303 | |
| 368 | L | A | -0.2137 | |
| 369 | P | A | -0.6815 | |
| 370 | P | A | -1.3969 | |
| 371 | D | A | -2.1394 | |
| 372 | L | A | -0.6754 | |
| 373 | R | A | -1.4688 | |
| 374 | T | A | -1.2440 | |
| 375 | K | A | -1.7760 | |
| 376 | A | A | -1.0867 | |
| 377 | T | A | -0.6790 | |
| 378 | V | A | 0.2775 | |
| 379 | E | A | -0.6471 | |
| 380 | L | A | -1.2968 | |
| 381 | K | A | -1.5147 | |
| 382 | A | A | -0.4561 | |
| 383 | L | A | -0.6254 | |
| 384 | R | A | -1.5397 | |
| 385 | L | A | -0.7097 | |
| 386 | L | A | -0.8171 | |
| 387 | N | A | -1.5793 | |
| 388 | F | A | -0.2272 | |
| 389 | Q | A | -1.8928 | |
| 390 | R | A | -3.1626 | |
| 391 | Q | A | -2.5327 | |
| 392 | L | A | -1.3608 | |
| 393 | R | A | -2.8760 | |
| 394 | Q | A | -2.6830 | |
| 395 | E | A | -2.2545 | |
| 396 | V | A | -0.3168 | |
| 397 | V | A | -0.9787 | |
| 398 | A | A | -1.3498 | |
| 399 | C | A | -0.9236 | |
| 400 | M | A | -0.9142 | |
| 401 | R | A | -2.4652 | |
| 402 | R | A | -2.9712 | |
| 403 | D | A | -2.7554 | |
| 404 | T | A | -1.6351 | |
| 405 | T | A | -1.0558 | |
| 406 | L | A | -0.0048 | |
| 407 | E | A | -1.1556 | |
| 408 | T | A | -0.4581 | |
| 409 | A | A | 0.2095 | |
| 410 | L | A | 0.4526 | |
| 411 | N | A | -1.2166 | |
| 412 | S | A | -1.3052 | |
| 413 | K | A | -2.3866 | |
| 414 | A | A | -1.3698 | |
| 415 | Y | A | -1.0248 | |
| 416 | K | A | -2.9820 | |
| 417 | R | A | -3.3325 | |
| 418 | S | A | -3.0908 | |
| 419 | K | A | -3.7607 | |
| 420 | R | A | -3.4950 | |
| 421 | Q | A | -3.0065 | |
| 422 | T | A | -1.8141 | |
| 423 | L | A | -0.6302 | |
| 424 | R | A | -2.5547 | |
| 425 | E | A | -2.9694 | |
| 426 | A | A | -2.2589 | |
| 427 | R | A | -3.4043 | |
| 428 | M | A | -2.2334 | |
| 429 | T | A | -2.7174 | |
| 430 | E | A | -4.4264 | |
| 431 | K | A | -4.0994 | |
| 432 | L | A | -2.2423 | |
| 433 | E | A | -4.3140 | |
| 434 | K | A | -4.3871 | |
| 435 | Q | A | -3.7199 | |
| 436 | Q | A | -4.2105 | |
| 437 | K | A | -4.3092 | |
| 438 | I | A | -2.5402 | |
| 439 | E | A | -4.3034 | |
| 440 | Q | A | -4.8178 | |
| 441 | E | A | -5.3242 | |
| 442 | R | A | -5.7468 | |
| 443 | K | A | -5.9946 | |
| 444 | R | A | -6.3770 | |
| 445 | R | A | -6.3596 | |
| 446 | Q | A | -5.7251 | |
| 447 | K | A | -5.4732 | |
| 448 | H | A | -4.4565 | |
| 449 | Q | A | -4.0225 | |
| 450 | E | A | -3.4303 | |
| 451 | Y | A | -0.9489 | |
| 452 | L | A | -0.5664 | |
| 453 | N | A | -1.4899 | |
| 454 | S | A | -0.6878 | |
| 455 | I | A | 0.2720 | |
| 456 | L | A | 0.3123 | |
| 457 | Q | A | -1.4694 | |
| 458 | H | A | -1.7758 | |
| 459 | A | A | -1.2581 | |
| 460 | K | A | -2.7576 | |
| 461 | D | A | -2.8067 | |
| 462 | F | A | -0.9352 | |
| 463 | K | A | -2.9865 | |
| 464 | E | A | -3.2632 | |
| 465 | Y | A | -0.9651 | |
| 466 | H | A | -2.0016 | |
| 467 | R | A | -2.7561 | |
| 468 | S | A | -1.4215 | |
| 469 | V | A | -0.8927 | |
| 470 | A | A | -0.9601 | |
| 471 | G | A | -1.2755 | |
| 472 | K | A | -1.5654 | |
| 473 | I | A | 0.0910 | |
| 474 | Q | A | -1.5418 | |
| 475 | K | A | -1.9641 | |
| 476 | L | A | 0.1056 | |
| 477 | S | A | -0.4882 | |
| 478 | K | A | -1.7233 | |
| 479 | A | A | -0.1432 | |
| 480 | V | A | 0.5025 | |
| 481 | A | A | -0.1558 | |
| 482 | T | A | -0.1235 | |
| 483 | W | A | 0.1091 | |
| 484 | H | A | -1.5315 | |
| 485 | A | A | -1.7546 | |
| 486 | N | A | -2.5129 | |
| 487 | T | A | -3.2341 | |
| 488 | E | A | -4.8494 | |
| 489 | R | A | -5.4299 | |
| 490 | E | A | -5.7689 | |
| 491 | Q | A | -5.5794 | |
| 492 | K | A | -5.7929 | |
| 493 | K | A | -6.0103 | |
| 494 | E | A | -5.4363 | |
| 495 | T | A | -4.4477 | |
| 496 | E | A | -5.2052 | |
| 497 | R | A | -5.0225 | |
| 498 | I | A | -3.5643 | |
| 499 | E | A | -4.4808 | |
| 500 | K | A | -4.4228 | |
| 501 | E | A | -4.1620 | |
| 502 | R | A | -3.0911 | |
| 503 | M | A | -2.1474 | |
| 504 | R | A | -3.0824 | |
| 505 | R | A | -3.1356 | |
| 506 | L | A | -1.4754 | |
| 507 | M | A | -0.5310 | |
| 508 | A | A | -1.3452 | |
| 509 | E | A | -2.6918 | |
| 510 | D | A | -3.5416 | |
| 511 | E | A | -3.9224 | |
| 512 | E | A | -4.1209 | |
| 513 | G | A | 0.0000 | |
| 514 | Y | A | -3.3645 | |
| 515 | R | A | -3.9854 | |
| 516 | K | A | -4.0123 | |
| 517 | L | A | -2.6315 | |
| 518 | I | A | -2.0543 | |
| 519 | D | A | -3.4220 | |
| 520 | Q | A | -3.3901 | |
| 521 | K | A | -2.9964 | |
| 522 | K | A | -2.4071 | |
| 523 | D | A | -2.4824 | |
| 524 | R | A | -2.3715 | |
| 525 | R | A | -1.5181 | |
| 526 | L | A | 0.0000 | |
| 527 | A | A | 0.0000 | |
| 528 | Y | A | 0.0231 | |
| 529 | L | A | -0.1300 | |
| 530 | L | A | 0.0000 | |
| 531 | Q | A | -0.6422 | |
| 532 | Q | A | -0.5828 | |
| 533 | T | A | 0.0000 | |
| 534 | D | A | -1.8845 | |
| 535 | E | A | -1.9152 | |
| 536 | Y | A | -1.2690 | |
| 537 | V | A | 0.0000 | |
| 538 | A | A | -1.2804 | |
| 539 | N | A | -1.3936 | |
| 540 | L | A | 0.0000 | |
| 541 | T | A | -0.8436 | |
| 542 | N | A | -1.3323 | |
| 543 | L | A | -0.6328 | |
| 544 | V | A | 0.0000 | |
| 545 | W | A | -0.3506 | |
| 546 | E | A | -1.8375 | |
| 547 | H | A | -1.1079 | |
| 548 | K | A | -1.1814 | |
| 549 | Q | A | -1.6118 | |
| 550 | A | A | -1.5886 | |
| 551 | Q | A | -1.8202 | |
| 552 | A | A | -2.1310 | |
| 553 | A | A | -2.5558 | |
| 554 | K | A | -3.7792 | |
| 555 | E | A | -3.8782 | |
| 556 | K | A | -4.8782 | |
| 557 | K | A | -5.3469 | |
| 558 | K | A | -5.8286 | |
| 559 | R | A | -6.3641 | |
| 560 | R | A | -6.4160 | |
| 561 | R | A | -6.1943 | |
| 562 | R | A | -6.0590 | |
| 563 | K | A | -6.1790 | |
| 564 | K | A | -6.1370 | |
| 565 | K | A | -5.6401 | |
| 566 | A | A | -4.7948 | |
| 567 | E | A | -5.1552 | |
| 568 | E | A | -5.0287 | |
| 569 | N | A | -4.2208 | |
| 570 | A | A | -3.5412 | |
| 571 | E | A | -3.3367 | |
| 572 | G | A | -2.4227 | |
| 573 | G | A | -2.1608 | |
| 574 | E | A | -2.2202 | |
| 575 | S | A | -0.6169 | |
| 576 | A | A | 0.1707 | |
| 577 | L | A | 0.5993 | |
| 578 | G | A | -0.3887 | |
| 579 | P | A | -1.2267 | |
| 580 | D | A | -2.3544 | |
| 581 | G | A | -1.3867 | |
| 582 | E | A | -2.4437 | |
| 583 | P | A | -0.9055 | |
| 584 | I | A | 0.0571 | |
| 585 | D | A | -2.6129 | |
| 586 | E | A | -2.6564 | |
| 587 | S | A | -1.6927 | |
| 588 | S | A | -2.1765 | |
| 589 | Q | A | -2.1228 | |
| 590 | M | A | -0.6305 | |
| 591 | S | A | -0.8220 | |
| 592 | D | A | -1.6257 | |
| 593 | L | A | 0.3827 | |
| 594 | P | A | -0.0756 | |
| 595 | V | A | -0.0114 | |
| 596 | K | A | -0.3639 | |
| 597 | V | A | 0.0000 | |
| 598 | T | A | -0.7773 | |
| 599 | H | A | -1.5226 | |
| 600 | T | A | -1.6721 | |
| 601 | E | A | -2.3156 | |
| 602 | T | A | -1.5745 | |
| 603 | G | A | -1.4782 | |
| 604 | K | A | -1.2661 | |
| 605 | V | A | 0.3996 | |
| 606 | L | A | 0.5320 | |
| 607 | F | A | 1.2328 | |
| 608 | G | A | 0.1647 | |
| 609 | P | A | -0.5997 | |
| 610 | E | A | -1.4210 | |
| 611 | A | A | 0.0000 | |
| 612 | P | A | 0.0000 | |
| 613 | K | A | -1.4137 | |
| 614 | A | A | -0.8165 | |
| 615 | S | A | -1.1216 | |
| 616 | Q | A | -1.6406 | |
| 617 | L | A | -1.1119 | |
| 618 | D | A | -2.1503 | |
| 619 | A | A | -1.2579 | |
| 620 | W | A | -0.8066 | |
| 621 | L | A | -1.2155 | |
| 622 | E | A | -1.7003 | |
| 623 | M | A | -0.1179 | |
| 624 | N | A | -0.6285 | |
| 625 | P | A | -0.8649 | |
| 626 | G | A | -1.1920 | |
| 627 | Y | A | -1.3130 | |
| 628 | E | A | -1.5314 | |
| 629 | V | A | -0.4741 | |
| 630 | A | A | -0.5961 | |
| 631 | P | A | -1.6203 | |
| 632 | R | A | -2.8111 | |
| 633 | S | A | -2.4480 | |
| 634 | D | A | -3.2521 | |
| 635 | S | A | -2.8099 | |
| 636 | E | A | -3.8874 | |
| 637 | E | A | -3.6350 | |
| 638 | S | A | -2.8056 | |
| 639 | D | A | -3.1708 | |
| 640 | S | A | -2.1303 | |
| 641 | D | A | -2.5295 | |
| 642 | Y | A | -1.4409 | |
| 643 | E | A | -3.3123 | |
| 644 | E | A | -4.1204 | |
| 645 | E | A | -4.5654 | |
| 646 | D | A | -4.9167 | |
| 647 | E | A | -4.9952 | |
| 648 | E | A | -4.7961 | |
| 649 | E | A | -4.4300 | |
| 650 | E | A | -3.8213 | |
| 651 | S | A | -2.7012 | |
| 652 | S | A | -2.5070 | |
| 653 | R | A | -3.3746 | |
| 654 | Q | A | -3.3259 | |
| 655 | E | A | -3.7589 | |
| 656 | T | A | -3.2132 | |
| 657 | E | A | -3.6376 | |
| 658 | E | A | -2.9968 | |
| 659 | K | A | -1.6663 | |
| 660 | I | A | 1.0760 | |
| 661 | L | A | 1.5786 | |
| 662 | L | A | 0.0527 | |
| 663 | D | A | -1.8215 | |
| 664 | P | A | -1.8319 | |
| 665 | N | A | -2.6379 | |
| 666 | S | A | -2.5741 | |
| 667 | E | A | -3.1373 | |
| 668 | E | A | -3.2615 | |
| 669 | V | A | -2.4433 | |
| 670 | S | A | -3.1402 | |
| 671 | E | A | -4.2009 | |
| 672 | K | A | -4.1174 | |
| 673 | D | A | -4.0854 | |
| 674 | A | A | 0.0000 | |
| 675 | K | A | -4.3419 | |
| 676 | Q | A | -3.9427 | |
| 677 | I | A | -2.3575 | |
| 678 | I | A | 0.0000 | |
| 679 | E | A | -3.9074 | |
| 680 | T | A | -2.6938 | |
| 681 | A | A | 0.0000 | |
| 682 | K | A | -3.2736 | |
| 683 | Q | A | -3.2728 | |
| 684 | D | A | -3.2637 | |
| 685 | V | A | -2.2509 | |
| 686 | D | A | -2.7064 | |
| 687 | D | A | -1.9167 | |
| 688 | E | A | -1.2644 | |
| 689 | Y | A | -0.6118 | |
| 690 | S | A | -0.3183 | |
| 691 | M | A | 0.3070 | |
| 692 | Q | A | -0.9166 | |
| 693 | Y | A | -1.2008 | |
| 694 | S | A | -1.2289 | |
| 695 | A | A | -1.2865 | |
| 696 | R | A | -2.4185 | |
| 697 | G | A | -1.7573 | |
| 698 | S | A | -1.5368 | |
| 699 | Q | A | -1.6063 | |
| 700 | S | A | -0.9149 | |
| 701 | Y | A | 0.0000 | |
| 702 | Y | A | 0.0000 | |
| 703 | T | A | 0.1579 | |
| 704 | V | A | 0.1436 | |
| 705 | A | A | 0.0000 | |
| 706 | H | A | 0.3918 | |
| 707 | A | A | 0.8825 | |
| 708 | I | A | 1.4936 | |
| 709 | S | A | -0.1039 | |
| 710 | E | A | -1.3304 | |
| 711 | R | A | -2.8844 | |
| 712 | V | A | 0.0000 | |
| 713 | E | A | -3.3817 | |
| 714 | K | A | -2.9272 | |
| 715 | Q | A | -1.3295 | |
| 716 | S | A | 0.0000 | |
| 717 | A | A | 0.0310 | |
| 718 | L | A | 0.4262 | |
| 719 | L | A | 0.0000 | |
| 720 | I | A | -0.0431 | |
| 721 | N | A | -1.1116 | |
| 722 | G | A | -0.8363 | |
| 723 | T | A | -0.8482 | |
| 724 | L | A | 0.0000 | |
| 725 | K | A | -1.4126 | |
| 726 | H | A | -1.6038 | |
| 727 | Y | A | 0.0000 | |
| 728 | Q | A | 0.0000 | |
| 729 | L | A | -1.4412 | |
| 730 | Q | A | -1.2132 | |
| 731 | G | A | 0.0000 | |
| 732 | L | A | 0.0000 | |
| 733 | E | A | -1.3385 | |
| 734 | W | A | 0.0000 | |
| 735 | M | A | 0.0000 | |
| 736 | V | A | 0.0000 | |
| 737 | S | A | 0.0000 | |
| 738 | L | A | 0.0000 | |
| 739 | Y | A | 0.0317 | |
| 740 | N | A | 0.0430 | |
| 741 | N | A | 0.0000 | |
| 742 | N | A | -0.3815 | |
| 743 | L | A | 0.0000 | |
| 744 | N | A | 0.0000 | |
| 745 | G | A | 0.0000 | |
| 746 | I | A | 0.0000 | |
| 747 | L | A | 0.0000 | |
| 748 | A | A | 0.0000 | |
| 749 | D | A | 0.0000 | |
| 750 | E | A | -0.5184 | |
| 751 | M | A | 0.0000 | |
| 752 | G | A | -0.4813 | |
| 753 | L | A | 0.0000 | |
| 754 | G | A | -0.2654 | |
| 755 | K | A | -0.2279 | |
| 756 | T | A | -0.1279 | |
| 757 | I | A | 0.0924 | |
| 758 | Q | A | 0.0000 | |
| 759 | T | A | 0.0000 | |
| 760 | I | A | 0.0000 | |
| 761 | A | A | 0.0000 | |
| 762 | L | A | 0.0000 | |
| 763 | I | A | 0.0000 | |
| 764 | T | A | 0.0000 | |
| 765 | Y | A | 0.0000 | |
| 766 | L | A | 0.0000 | |
| 767 | M | A | 0.0000 | |
| 768 | E | A | -1.6233 | |
| 769 | H | A | -1.9038 | |
| 770 | K | A | -2.0679 | |
| 771 | R | A | -2.7328 | |
| 772 | L | A | -2.0763 | |
| 773 | N | A | -2.2072 | |
| 774 | G | A | -1.5475 | |
| 775 | P | A | -1.2070 | |
| 776 | Y | A | 0.0000 | |
| 777 | L | A | 0.0000 | |
| 778 | I | A | 0.0000 | |
| 779 | I | A | 0.0000 | |
| 780 | V | A | 0.0000 | |
| 781 | P | A | 0.0000 | |
| 782 | L | A | 0.5257 | |
| 783 | S | A | 0.2060 | |
| 784 | T | A | 0.0000 | |
| 785 | L | A | 0.0000 | |
| 786 | S | A | -0.1883 | |
| 787 | N | A | -0.2651 | |
| 788 | W | A | 0.0000 | |
| 789 | T | A | -0.2823 | |
| 790 | Y | A | 0.1827 | |
| 791 | E | A | -0.4960 | |
| 792 | F | A | 0.0000 | |
| 793 | D | A | -1.6523 | |
| 794 | K | A | -1.4240 | |
| 795 | W | A | -0.6747 | |
| 796 | A | A | 0.0000 | |
| 797 | P | A | -0.7460 | |
| 798 | S | A | -0.0789 | |
| 799 | V | A | 0.0000 | |
| 800 | V | A | 0.4944 | |
| 801 | K | A | -0.2155 | |
| 802 | I | A | 0.0000 | |
| 803 | S | A | -0.4345 | |
| 804 | Y | A | 0.0000 | |
| 805 | K | A | -0.6578 | |
| 806 | G | A | -0.4181 | |
| 807 | T | A | -0.4653 | |
| 808 | P | A | -0.7832 | |
| 809 | A | A | -0.5130 | |
| 810 | M | A | -0.2582 | |
| 811 | R | A | -1.0424 | |
| 812 | R | A | -1.8759 | |
| 813 | S | A | -1.0038 | |
| 814 | L | A | -0.9823 | |
| 815 | V | A | 0.0000 | |
| 816 | P | A | -1.6838 | |
| 817 | Q | A | -1.9244 | |
| 818 | L | A | 0.0000 | |
| 819 | R | A | -2.4148 | |
| 820 | S | A | -1.8752 | |
| 821 | G | A | -1.8723 | |
| 822 | K | A | -2.3330 | |
| 823 | F | A | 0.0000 | |
| 824 | N | A | 0.0000 | |
| 825 | V | A | 0.0000 | |
| 826 | L | A | 0.0000 | |
| 827 | L | A | 0.0000 | |
| 828 | T | A | 0.0000 | |
| 829 | T | A | 0.0000 | |
| 830 | Y | A | 0.0000 | |
| 831 | E | A | -1.4242 | |
| 832 | Y | A | -1.1886 | |
| 833 | I | A | 0.0000 | |
| 834 | I | A | -1.3716 | |
| 835 | K | A | -2.0802 | |
| 836 | D | A | -1.5543 | |
| 837 | K | A | -1.9138 | |
| 838 | H | A | -1.8295 | |
| 839 | I | A | -1.4852 | |
| 840 | L | A | 0.0000 | |
| 841 | A | A | -1.3879 | |
| 842 | K | A | -2.3869 | |
| 843 | I | A | -1.7095 | |
| 844 | R | A | -2.0647 | |
| 845 | W | A | 0.0000 | |
| 846 | K | A | -1.3694 | |
| 847 | Y | A | 0.0000 | |
| 848 | M | A | 0.0000 | |
| 849 | I | A | 0.0000 | |
| 850 | V | A | 0.0000 | |
| 851 | D | A | 0.0000 | |
| 852 | E | A | -0.5422 | |
| 853 | G | A | 0.0000 | |
| 854 | H | A | -1.0137 | |
| 855 | R | A | -1.5851 | |
| 856 | M | A | 0.0000 | |
| 857 | K | A | -1.4137 | |
| 858 | N | A | -1.9959 | |
| 859 | H | A | -1.7516 | |
| 860 | H | A | -2.0525 | |
| 861 | C | A | -2.0119 | |
| 862 | K | A | -2.3851 | |
| 863 | L | A | 0.0000 | |
| 864 | T | A | 0.0000 | |
| 865 | Q | A | -2.2539 | |
| 866 | V | A | 0.0000 | |
| 867 | L | A | 0.0000 | |
| 868 | N | A | -1.5960 | |
| 869 | T | A | -0.9624 | |
| 870 | H | A | -1.2277 | |
| 871 | Y | A | 0.0000 | |
| 872 | V | A | -0.2449 | |
| 873 | A | A | -0.5584 | |
| 874 | P | A | -0.6528 | |
| 875 | R | A | -0.5524 | |
| 876 | R | A | -0.4714 | |
| 877 | I | A | 0.0000 | |
| 878 | L | A | 0.0000 | |
| 879 | L | A | 0.0000 | |
| 880 | T | A | 0.0000 | |
| 881 | G | A | 0.0000 | |
| 882 | T | A | 0.0000 | |
| 883 | P | A | 0.0000 | |
| 884 | L | A | 0.0000 | |
| 885 | Q | A | 0.0000 | |
| 886 | N | A | -0.9589 | |
| 887 | K | A | -1.2142 | |
| 888 | L | A | 0.0000 | |
| 889 | P | A | -0.6120 | |
| 890 | E | A | 0.0000 | |
| 891 | L | A | 0.0000 | |
| 892 | W | A | 0.0000 | |
| 893 | A | A | 0.0000 | |
| 894 | L | A | 0.0000 | |
| 895 | L | A | 0.0000 | |
| 896 | N | A | -0.7157 | |
| 897 | F | A | 0.0000 | |
| 898 | L | A | 0.0000 | |
| 899 | L | A | 0.0000 | |
| 900 | P | A | -0.8538 | |
| 901 | T | A | -0.7273 | |
| 902 | I | A | 0.0000 | |
| 903 | F | A | 0.0000 | |
| 904 | K | A | -1.8415 | |
| 905 | S | A | -1.0485 | |
| 906 | C | A | -0.7725 | |
| 907 | S | A | -0.9429 | |
| 908 | T | A | -0.9159 | |
| 909 | F | A | 0.0000 | |
| 910 | E | A | -1.3353 | |
| 911 | Q | A | -1.5279 | |
| 912 | W | A | -0.6611 | |
| 913 | F | A | 0.0000 | |
| 914 | N | A | -0.8046 | |
| 915 | A | A | -0.4077 | |
| 916 | P | A | -0.2327 | |
| 917 | F | A | 0.2577 | |
| 918 | A | A | 0.0004 | |
| 919 | M | A | 0.5122 | |
| 920 | T | A | -0.4865 | |
| 921 | G | A | -1.3929 | |
| 922 | E | A | -2.5714 | |
| 923 | R | A | -2.3592 | |
| 924 | V | A | -0.5914 | |
| 925 | D | A | -2.0255 | |
| 926 | L | A | -1.3459 | |
| 927 | N | A | -1.8833 | |
| 928 | E | A | -2.9931 | |
| 929 | E | A | -2.2606 | |
| 930 | E | A | 0.0000 | |
| 931 | T | A | -1.2070 | |
| 932 | I | A | -1.1842 | |
| 933 | L | A | 0.0000 | |
| 934 | I | A | 0.0000 | |
| 935 | I | A | 0.0000 | |
| 936 | R | A | -0.6735 | |
| 937 | R | A | -0.7135 | |
| 938 | L | A | 0.0000 | |
| 939 | H | A | 0.0000 | |
| 940 | K | A | -0.7529 | |
| 941 | V | A | 0.0000 | |
| 942 | L | A | 0.0000 | |
| 943 | R | A | 0.0000 | |
| 944 | P | A | 0.0000 | |
| 945 | F | A | 0.0000 | |
| 946 | L | A | 0.0000 | |
| 947 | L | A | 0.0000 | |
| 948 | R | A | -0.3046 | |
| 949 | R | A | 0.0000 | |
| 950 | L | A | -1.0739 | |
| 951 | K | A | 0.0000 | |
| 952 | K | A | -2.9989 | |
| 953 | E | A | -2.5251 | |
| 954 | V | A | -1.6120 | |
| 955 | E | A | -1.4423 | |
| 956 | S | A | -1.7929 | |
| 957 | Q | A | -1.8176 | |
| 958 | L | A | -1.7401 | |
| 959 | P | A | -2.1057 | |
| 960 | E | A | -2.7772 | |
| 961 | K | A | -1.7337 | |
| 962 | V | A | -0.6183 | |
| 963 | E | A | -0.6714 | |
| 964 | Y | A | 0.2727 | |
| 965 | V | A | 0.1644 | |
| 966 | I | A | 0.0000 | |
| 967 | K | A | -1.1124 | |
| 968 | C | A | 0.0000 | |
| 969 | D | A | -1.1239 | |
| 970 | M | A | 0.0000 | |
| 971 | S | A | 0.0000 | |
| 972 | A | A | -1.8179 | |
| 973 | L | A | 0.0000 | |
| 974 | Q | A | 0.0000 | |
| 975 | K | A | -1.9084 | |
| 976 | I | A | -1.0884 | |
| 977 | L | A | 0.0000 | |
| 978 | Y | A | -1.3680 | |
| 979 | R | A | -2.5353 | |
| 980 | H | A | 0.0000 | |
| 981 | M | A | 0.0000 | |
| 982 | Q | A | -2.1064 | |
| 983 | A | A | -1.8571 | |
| 984 | K | A | -2.4612 | |
| 985 | G | A | -1.1924 | |
| 986 | I | A | 0.0000 | |
| 987 | L | A | 0.0000 | |
| 988 | L | A | 0.0000 | |
| 989 | T | A | 0.0000 | |
| 990 | D | A | -2.4220 | |
| 991 | G | A | 0.0000 | |
| 992 | S | A | -3.7269 | |
| 993 | E | A | -4.2475 | |
| 994 | K | A | -4.3588 | |
| 995 | D | A | -4.6818 | |
| 996 | K | A | -4.8668 | |
| 997 | K | A | -4.4846 | |
| 998 | G | A | -2.8274 | |
| 999 | K | A | -3.1646 | |
| 1000 | G | A | 0.0000 | |
| 1001 | G | A | -2.1454 | |
| 1002 | A | A | -1.0045 | |
| 1003 | K | A | -0.3366 | |
| 1004 | T | A | -0.5380 | |
| 1005 | L | A | 0.0000 | |
| 1006 | M | A | 0.5765 | |
| 1007 | N | A | 0.0000 | |
| 1008 | T | A | -0.2744 | |
| 1009 | I | A | 0.1563 | |
| 1010 | M | A | 0.1351 | |
| 1011 | Q | A | 0.0000 | |
| 1012 | L | A | 0.0000 | |
| 1013 | R | A | 0.0000 | |
| 1014 | K | A | -0.0845 | |
| 1015 | I | A | 0.0000 | |
| 1016 | C | A | 0.0000 | |
| 1017 | N | A | 0.0000 | |
| 1018 | H | A | 0.0000 | |
| 1019 | P | A | 0.0000 | |
| 1020 | Y | A | 0.0000 | |
| 1021 | M | A | -0.3049 | |
| 1022 | F | A | 0.0000 | |
| 1023 | Q | A | -1.1607 | |
| 1024 | H | A | -1.4542 | |
| 1025 | I | A | 0.0000 | |
| 1026 | E | A | -1.1781 | |
| 1027 | E | A | -2.0378 | |
| 1028 | S | A | -1.5125 | |
| 1029 | F | A | 0.0000 | |
| 1030 | A | A | 0.0000 | |
| 1031 | E | A | -2.3730 | |
| 1032 | H | A | -1.5043 | |
| 1033 | L | A | -0.6446 | |
| 1034 | G | A | -1.0603 | |
| 1035 | Y | A | -0.7809 | |
| 1036 | S | A | -0.9423 | |
| 1037 | N | A | -1.3731 | |
| 1038 | G | A | -1.1198 | |
| 1039 | V | A | 0.1890 | |
| 1040 | I | A | 0.0000 | |
| 1041 | N | A | -1.1527 | |
| 1042 | G | A | -0.8910 | |
| 1043 | A | A | -0.6773 | |
| 1044 | E | A | -0.7351 | |
| 1045 | L | A | 0.0000 | |
| 1046 | Y | A | 0.0000 | |
| 1047 | R | A | 0.0000 | |
| 1048 | A | A | 0.0000 | |
| 1049 | S | A | 0.0000 | |
| 1050 | G | A | 0.0000 | |
| 1051 | K | A | 0.0000 | |
| 1052 | F | A | 0.0000 | |
| 1053 | E | A | -0.3752 | |
| 1054 | L | A | 0.0000 | |
| 1055 | L | A | 0.0000 | |
| 1056 | D | A | 0.0000 | |
| 1057 | R | A | -0.3536 | |
| 1058 | I | A | 0.0000 | |
| 1059 | L | A | 0.0000 | |
| 1060 | P | A | -0.7948 | |
| 1061 | K | A | 0.0000 | |
| 1062 | L | A | 0.0000 | |
| 1063 | R | A | -2.3377 | |
| 1064 | A | A | -1.1725 | |
| 1065 | T | A | -1.3500 | |
| 1066 | N | A | -1.9779 | |
| 1067 | H | A | 0.0000 | |
| 1068 | R | A | -1.0452 | |
| 1069 | V | A | 0.0000 | |
| 1070 | L | A | 0.0000 | |
| 1071 | L | A | 0.0000 | |
| 1072 | F | A | 0.0000 | |
| 1073 | C | A | 0.0000 | |
| 1074 | Q | A | -0.4001 | |
| 1075 | M | A | -0.1969 | |
| 1076 | T | A | -0.1991 | |
| 1077 | S | A | -0.1751 | |
| 1078 | L | A | 0.0000 | |
| 1079 | M | A | 0.0000 | |
| 1080 | T | A | -0.4811 | |
| 1081 | I | A | -0.3695 | |
| 1082 | M | A | 0.0000 | |
| 1083 | E | A | -0.8290 | |
| 1084 | D | A | -1.5475 | |
| 1085 | Y | A | 0.0000 | |
| 1086 | F | A | 0.0000 | |
| 1087 | A | A | -0.8630 | |
| 1088 | F | A | -0.7614 | |
| 1089 | R | A | -1.1437 | |
| 1090 | N | A | -1.3251 | |
| 1091 | F | A | 0.0000 | |
| 1092 | L | A | 0.3355 | |
| 1093 | Y | A | 0.3396 | |
| 1094 | L | A | 0.0000 | |
| 1095 | R | A | -0.3527 | |
| 1096 | L | A | 0.0000 | |
| 1097 | D | A | 0.0000 | |
| 1098 | G | A | -0.9582 | |
| 1099 | T | A | -0.7536 | |
| 1100 | T | A | -1.8432 | |
| 1101 | K | A | -3.1212 | |
| 1102 | S | A | -2.5095 | |
| 1103 | E | A | -3.3944 | |
| 1104 | D | A | -3.3278 | |
| 1105 | R | A | -2.4651 | |
| 1106 | A | A | -1.9660 | |
| 1107 | A | A | -1.7884 | |
| 1108 | L | A | -1.4768 | |
| 1109 | L | A | -1.6259 | |
| 1110 | K | A | -2.7568 | |
| 1111 | K | A | -2.5647 | |
| 1112 | F | A | 0.0000 | |
| 1113 | N | A | -2.2674 | |
| 1114 | E | A | -3.0886 | |
| 1115 | P | A | -1.8933 | |
| 1116 | G | A | -1.4890 | |
| 1117 | S | A | -1.8656 | |
| 1118 | Q | A | -1.3679 | |
| 1119 | Y | A | -0.3700 | |
| 1120 | F | A | 0.0000 | |
| 1121 | I | A | 0.0000 | |
| 1122 | F | A | 0.0000 | |
| 1123 | L | A | 0.0000 | |
| 1124 | L | A | 0.0000 | |
| 1125 | S | A | 0.0000 | |
| 1126 | T | A | 0.0000 | |
| 1127 | R | A | -1.1120 | |
| 1128 | A | A | -0.5678 | |
| 1129 | G | A | 0.0000 | |
| 1130 | G | A | 0.0000 | |
| 1131 | L | A | -0.0494 | |
| 1132 | G | A | -0.2055 | |
| 1133 | L | A | 0.0000 | |
| 1134 | N | A | -1.2076 | |
| 1135 | L | A | 0.0000 | |
| 1136 | Q | A | -1.3567 | |
| 1137 | A | A | -1.1429 | |
| 1138 | A | A | 0.0000 | |
| 1139 | D | A | 0.0000 | |
| 1140 | T | A | 0.0000 | |
| 1141 | V | A | 0.0000 | |
| 1142 | V | A | 0.0000 | |
| 1143 | I | A | 0.0000 | |
| 1144 | F | A | 0.0000 | |
| 1145 | D | A | 0.0000 | |
| 1146 | S | A | 0.0000 | |
| 1147 | D | A | 0.0000 | |
| 1148 | W | A | -0.2763 | |
| 1149 | N | A | -0.2809 | |
| 1150 | P | A | 0.0000 | |
| 1151 | H | A | 0.0000 | |
| 1152 | Q | A | -0.2287 | |
| 1153 | D | A | 0.0000 | |
| 1154 | L | A | 0.2200 | |
| 1155 | Q | A | 0.0000 | |
| 1156 | A | A | 0.0000 | |
| 1157 | Q | A | 0.0000 | |
| 1158 | D | A | 0.0000 | |
| 1159 | R | A | -0.6645 | |
| 1160 | A | A | 0.0000 | |
| 1161 | H | A | 0.0000 | |
| 1162 | R | A | -1.0124 | |
| 1163 | I | A | -0.4712 | |
| 1164 | G | A | -0.9874 | |
| 1165 | Q | A | 0.0000 | |
| 1166 | Q | A | -2.0780 | |
| 1167 | N | A | -1.8151 | |
| 1168 | E | A | -1.6392 | |
| 1169 | V | A | 0.0000 | |
| 1170 | R | A | 0.0000 | |
| 1171 | V | A | 0.0000 | |
| 1172 | L | A | 0.0000 | |
| 1173 | R | A | 0.0000 | |
| 1174 | L | A | 0.0000 | |
| 1175 | C | A | 0.0000 | |
| 1176 | T | A | 0.0000 | |
| 1177 | V | A | 0.0000 | |
| 1178 | N | A | -2.0658 | |
| 1179 | S | A | 0.0000 | |
| 1180 | V | A | 0.0000 | |
| 1181 | E | A | 0.0000 | |
| 1182 | E | A | -1.7090 | |
| 1183 | K | A | -2.0021 | |
| 1184 | I | A | 0.0000 | |
| 1185 | L | A | 0.0000 | |
| 1186 | A | A | -0.7313 | |
| 1187 | A | A | -0.5344 | |
| 1188 | A | A | 0.0000 | |
| 1189 | K | A | -0.6666 | |
| 1190 | Y | A | -0.0933 | |
| 1191 | K | A | -0.2950 | |
| 1192 | L | A | -0.1468 | |
| 1193 | N | A | -0.5141 | |
| 1194 | V | A | 0.0000 | |
| 1195 | D | A | 0.0000 | |
| 1196 | Q | A | -0.3772 | |
| 1197 | K | A | 0.0000 | |
| 1198 | V | A | 0.0000 | |
| 1199 | I | A | 0.0000 | |
| 1200 | Q | A | -0.2413 | |
| 1201 | A | A | 0.0000 | |
| 1202 | G | A | 0.0000 | |
| 1203 | M | A | -0.4694 | |
| 1204 | F | A | 0.0000 | |
| 1205 | D | A | -1.1440 | |
| 1206 | Q | A | -1.3995 | |
| 1207 | K | A | -1.9913 | |
| 1208 | S | A | -1.6493 | |
| 1209 | S | A | -1.9499 | |
| 1210 | S | A | -2.2024 | |
| 1211 | H | A | -2.4125 | |
| 1212 | E | A | -2.5086 | |
| 1213 | R | A | 0.0000 | |
| 1214 | R | A | -2.0884 | |
| 1215 | A | A | -1.3214 | |
| 1216 | F | A | -0.7929 | |
| 1217 | L | A | 0.0000 | |
| 1218 | Q | A | -1.6636 | |
| 1219 | A | A | -1.1487 | |
| 1220 | I | A | -1.4082 | |
| 1221 | L | A | -2.1142 | |
| 1222 | E | A | -3.6558 | |
| 1223 | H | A | -3.9222 | |
| 1224 | E | A | -4.3353 | |
| 1225 | E | A | -4.7914 | |
| 1226 | E | A | -5.1170 | |
| 1227 | N | A | -4.8371 | |
| 1228 | E | A | -4.9485 | |
| 1229 | E | A | -4.8218 | |
| 1230 | E | A | -4.6556 | |
| 1231 | D | A | -4.3803 | |
| 1232 | E | A | -3.5869 | |
| 1233 | V | A | -1.6851 | |
| 1234 | P | A | -1.7891 | |
| 1235 | D | A | -2.5783 | |
| 1236 | D | A | -2.0612 | |
| 1237 | E | A | -2.5043 | |
| 1238 | T | A | -1.8054 | |
| 1239 | L | A | 0.0000 | |
| 1240 | N | A | 0.0000 | |
| 1241 | Q | A | -2.1593 | |
| 1242 | M | A | -0.6492 | |
| 1243 | I | A | 0.0000 | |
| 1244 | A | A | 0.0000 | |
| 1245 | R | A | -2.0589 | |
| 1246 | R | A | -3.7067 | |
| 1247 | E | A | -4.0048 | |
| 1248 | E | A | -3.6120 | |
| 1249 | E | A | 0.0000 | |
| 1250 | F | A | -2.6677 | |
| 1251 | D | A | -2.9179 | |
| 1252 | L | A | -1.3900 | |
| 1253 | F | A | 0.0000 | |
| 1254 | M | A | -1.5814 | |
| 1255 | R | A | -2.4076 | |
| 1256 | M | A | -1.7570 | |
| 1257 | D | A | 0.0000 | |
| 1258 | M | A | -2.4096 | |
| 1259 | D | A | -3.9129 | |
| 1260 | R | A | -3.7421 | |
| 1261 | R | A | -4.4692 | |
| 1262 | R | A | -4.8227 | |
| 1263 | E | A | -5.1482 | |
| 1264 | D | A | -5.0462 | |
| 1265 | A | A | -4.0128 | |
| 1266 | R | A | -4.3974 | |
| 1267 | N | A | -4.1078 | |
| 1268 | P | A | -2.8083 | |
| 1269 | K | A | -3.7287 | |
| 1270 | R | A | -4.5646 | |
| 1271 | K | A | -3.5631 | |
| 1272 | P | A | -2.1265 | |
| 1273 | R | A | -1.5157 | |
| 1274 | L | A | -1.0687 | |
| 1275 | M | A | 0.0000 | |
| 1276 | E | A | -3.5438 | |
| 1277 | E | A | -3.5421 | |
| 1278 | D | A | -3.2588 | |
| 1279 | E | A | -2.4355 | |
| 1280 | L | A | 0.0000 | |
| 1281 | P | A | -0.5938 | |
| 1282 | S | A | -0.5835 | |
| 1283 | W | A | -0.4805 | |
| 1284 | I | A | 0.0000 | |
| 1285 | I | A | -0.0461 | |
| 1286 | K | A | -1.1549 | |
| 1287 | D | A | -2.7900 | |
| 1288 | D | A | -3.0684 | |
| 1289 | A | A | -2.6989 | |
| 1290 | E | A | -3.1911 | |
| 1291 | V | A | 0.0000 | |
| 1292 | E | A | -3.6418 | |
| 1293 | R | A | -3.5586 | |
| 1294 | L | A | -2.8008 | |
| 1295 | T | A | -2.7921 | |
| 1296 | C | A | -2.9721 | |
| 1297 | E | A | -4.0388 | |
| 1298 | E | A | -3.5774 | |
| 1299 | E | A | -3.7738 | |
| 1300 | E | A | -3.4563 | |
| 1301 | E | A | -3.7646 | |
| 1302 | K | A | -3.0197 | |
| 1303 | I | A | -0.1936 | |
| 1304 | F | A | 0.2293 | |
| 1305 | G | A | -1.8065 | |
| 1306 | R | A | -2.2670 | |
| 1307 | G | A | -2.2497 | |
| 1308 | S | A | -2.5339 | |
| 1309 | R | A | -3.5753 | |
| 1310 | Q | A | -4.0173 | |
| 1311 | R | A | -4.3429 | |
| 1312 | R | A | -3.9714 | |
| 1313 | D | A | -3.2849 | |
| 1314 | V | A | -0.7194 | |
| 1315 | D | A | -1.6314 | |
| 1316 | Y | A | -0.4109 | |
| 1317 | S | A | -0.2221 | |
| 1318 | D | A | -0.9191 | |
| 1319 | A | A | -1.6031 | |
| 1320 | L | A | 0.0000 | |
| 1321 | T | A | -0.9942 | |
| 1322 | E | A | -1.3913 | |
| 1323 | K | A | -2.5051 | |
| 1324 | Q | A | -2.1362 | |
| 1325 | W | A | 0.0000 | |
| 1326 | L | A | -1.9297 | |
| 1327 | R | A | -3.4741 | |
| 1328 | A | A | 0.0000 | |
| 1329 | I | A | -2.1986 | |
| 1330 | E | A | -3.3321 | |
| 1331 | D | A | -3.3344 | |
| 1332 | G | A | -2.4428 | |
| 1333 | N | A | -2.6407 | |
| 1334 | L | A | -2.7579 | |
| 1335 | E | A | -3.4893 | |
| 1336 | E | A | -4.1196 | |
| 1337 | M | A | -3.1232 | |
| 1338 | E | A | -4.2678 | |
| 1339 | E | A | -4.9035 | |
| 1340 | E | A | -4.5146 | |
| 1341 | V | A | -3.5786 | |
| 1342 | R | A | -4.5931 | |
| 1343 | L | A | -3.7829 | |
| 1344 | K | A | -4.6582 | |
| 1345 | K | A | -4.9580 | |
| 1346 | R | A | -5.2509 | |
| 1347 | K | A | -5.5350 | |
| 1348 | R | A | -5.5396 | |
| 1349 | R | A | -5.5386 | |
| 1350 | R | A | -5.8755 | |
| 1351 | N | A | -4.7441 | |
| 1352 | V | A | -2.9074 | |
| 1353 | D | A | -4.5053 | |
| 1354 | K | A | -4.2306 | |
| 1355 | D | A | -3.7088 | |
| 1356 | P | A | -2.7427 | |
| 1357 | A | A | -2.5525 | |
| 1358 | K | A | -3.4827 | |
| 1359 | E | A | -3.5624 | |
| 1360 | D | A | -3.0869 | |
| 1361 | V | A | -1.0723 | |
| 1362 | E | A | -2.6120 | |
| 1363 | K | A | -2.9209 | |
| 1364 | A | A | -2.4087 | |
| 1365 | K | A | -3.2821 | |
| 1366 | K | A | -3.8279 | |
| 1367 | R | A | -4.0662 | |
| 1368 | R | A | -3.7777 | |
| 1369 | G | A | -2.7422 | |
| 1370 | R | A | -2.6607 | |
| 1371 | P | A | -1.8357 | |
| 1372 | P | A | -1.5746 | |
| 1373 | A | A | -1.5974 | |
| 1374 | E | A | -2.5192 | |
| 1375 | K | A | -2.5238 | |
| 1376 | L | A | -1.3077 | |
| 1377 | S | A | -1.0050 | |
| 1378 | P | A | -1.3212 | |
| 1379 | N | A | 0.0000 | |
| 1380 | P | A | -1.2424 | |
| 1381 | P | A | -1.5892 | |
| 1382 | K | A | -2.3852 | |
| 1383 | L | A | -1.6066 | |
| 1384 | T | A | -2.1048 | |
| 1385 | K | A | -2.5832 | |
| 1386 | Q | A | -1.6478 | |
| 1387 | M | A | 0.0000 | |
| 1388 | N | A | -1.6952 | |
| 1389 | A | A | -0.9992 | |
| 1390 | I | A | 0.0000 | |
| 1391 | I | A | 0.0000 | |
| 1392 | D | A | -1.0107 | |
| 1393 | T | A | -0.8583 | |
| 1394 | V | A | 0.0000 | |
| 1395 | I | A | -1.0082 | |
| 1396 | N | A | -1.9208 | |
| 1397 | Y | A | -1.8264 | |
| 1398 | K | A | -3.2322 | |
| 1399 | D | A | -2.8712 | |
| 1400 | R | A | -2.6379 | |
| 1401 | C | A | -1.2296 | |
| 1402 | N | A | -1.5138 | |
| 1403 | V | A | -0.1230 | |
| 1404 | E | A | -1.6005 | |
| 1405 | K | A | -1.4921 | |
| 1406 | V | A | 0.3623 | |
| 1407 | P | A | -0.4930 | |
| 1408 | S | A | -1.0056 | |
| 1409 | N | A | -1.4186 | |
| 1410 | S | A | -1.3126 | |
| 1411 | Q | A | -1.0734 | |
| 1412 | L | A | 0.2112 | |
| 1413 | E | A | -0.9382 | |
| 1414 | I | A | 0.2119 | |
| 1415 | E | A | -1.7126 | |
| 1416 | G | A | -1.6792 | |
| 1417 | N | A | -1.8991 | |
| 1418 | S | A | -1.6426 | |
| 1419 | S | A | -1.9134 | |
| 1420 | G | A | -2.5291 | |
| 1421 | R | A | -3.3686 | |
| 1422 | Q | A | -2.8535 | |
| 1423 | L | A | 0.0000 | |
| 1424 | S | A | 0.0000 | |
| 1425 | E | A | -1.4621 | |
| 1426 | V | A | 0.7863 | |
| 1427 | F | A | 0.0000 | |
| 1428 | I | A | -0.7065 | |
| 1429 | Q | A | -1.3217 | |
| 1430 | L | A | -0.4307 | |
| 1431 | P | A | -0.9094 | |
| 1432 | S | A | -2.0414 | |
| 1433 | R | A | -3.4506 | |
| 1434 | K | A | -3.5319 | |
| 1435 | E | A | -3.1423 | |
| 1436 | L | A | -2.0263 | |
| 1437 | P | A | -2.5593 | |
| 1438 | E | A | -2.6331 | |
| 1439 | Y | A | -1.4704 | |
| 1440 | Y | A | -1.9100 | |
| 1441 | E | A | -2.5600 | |
| 1442 | L | A | -1.1438 | |
| 1443 | I | A | 0.0000 | |
| 1444 | R | A | -2.7156 | |
| 1445 | K | A | -2.2117 | |
| 1446 | P | A | -1.0626 | |
| 1447 | V | A | 0.0000 | |
| 1448 | D | A | 0.0000 | |
| 1449 | F | A | 0.0000 | |
| 1450 | K | A | -2.8364 | |
| 1451 | K | A | -2.7211 | |
| 1452 | I | A | 0.0000 | |
| 1453 | K | A | -3.0601 | |
| 1454 | E | A | -4.1765 | |
| 1455 | R | A | -3.5670 | |
| 1456 | I | A | 0.0000 | |
| 1457 | R | A | -3.8335 | |
| 1458 | N | A | -3.5266 | |
| 1459 | H | A | -3.0251 | |
| 1460 | K | A | -3.2255 | |
| 1461 | Y | A | 0.0000 | |
| 1462 | R | A | -2.0715 | |
| 1463 | S | A | -1.2045 | |
| 1464 | L | A | -0.9267 | |
| 1465 | G | A | -1.3171 | |
| 1466 | D | A | -1.9545 | |
| 1467 | L | A | 0.0000 | |
| 1468 | E | A | -2.0714 | |
| 1469 | K | A | -2.1365 | |
| 1470 | D | A | 0.0000 | |
| 1471 | V | A | 0.0000 | |
| 1472 | M | A | -0.8795 | |
| 1473 | L | A | -0.8213 | |
| 1474 | L | A | 0.0000 | |
| 1475 | C | A | 0.0000 | |
| 1476 | H | A | -0.7411 | |
| 1477 | N | A | 0.0000 | |
| 1478 | A | A | 0.0000 | |
| 1479 | Q | A | -0.5014 | |
| 1480 | T | A | -0.0134 | |
| 1481 | F | A | 0.4099 | |
| 1482 | N | A | -0.0735 | |
| 1483 | L | A | 0.2816 | |
| 1484 | E | A | -1.6527 | |
| 1485 | G | A | -1.5784 | |
| 1486 | S | A | -1.2046 | |
| 1487 | Q | A | -1.6673 | |
| 1488 | I | A | -0.2378 | |
| 1489 | Y | A | -0.8562 | |
| 1490 | E | A | -1.4580 | |
| 1491 | D | A | 0.0000 | |
| 1492 | S | A | 0.0000 | |
| 1493 | I | A | 0.6153 | |
| 1494 | V | A | 0.6065 | |
| 1495 | L | A | 0.0000 | |
| 1496 | Q | A | -0.5337 | |
| 1497 | S | A | -0.5217 | |
| 1498 | V | A | 0.0000 | |
| 1499 | F | A | 0.0000 | |
| 1500 | K | A | -2.7102 | |
| 1501 | S | A | -1.9983 | |
| 1502 | A | A | 0.0000 | |
| 1503 | R | A | -2.7956 | |
| 1504 | Q | A | -3.4913 | |
| 1505 | K | A | -3.9991 | |
| 1506 | I | A | -3.0354 | |
| 1507 | A | A | -3.5504 | |
| 1508 | K | A | -5.0646 | |
| 1509 | E | A | -5.4202 | |
| 1510 | E | A | -5.4323 | |
| 1511 | E | A | -5.5381 | |
| 1512 | S | A | -4.8202 | |
| 1513 | E | A | -5.6691 | |
| 1514 | D | A | -6.1030 | |
| 1515 | E | A | -5.8113 | |
| 1516 | S | A | -4.9751 | |
| 1517 | N | A | -5.5235 | |
| 1518 | E | A | -6.2641 | |
| 1519 | E | A | -6.0691 | |
| 1520 | E | A | -6.0708 | |
| 1521 | E | A | -6.0824 | |
| 1522 | E | A | -6.2293 | |
| 1523 | E | A | -6.2111 | |
| 1524 | D | A | -5.4726 | |
| 1525 | E | A | -5.0871 | |
| 1526 | E | A | -4.6738 | |
| 1527 | E | A | -4.1068 | |
| 1528 | S | A | -2.6065 | |
| 1529 | E | A | -2.8110 | |
| 1530 | S | A | -2.4632 | |
| 1531 | E | A | -2.6912 | |
| 1532 | A | A | -1.7404 | |
| 1533 | K | A | -2.0124 | |
| 1534 | S | A | -0.4021 | |
| 1535 | V | A | 0.7273 | |
| 1536 | K | A | -0.4322 | |
| 1537 | V | A | 0.9034 | |
| 1538 | K | A | -0.3539 | |
| 1539 | I | A | 0.9073 | |
| 1540 | K | A | -0.7211 | |
| 1541 | L | A | -0.1902 | |
| 1542 | N | A | -2.1327 | |
| 1543 | K | A | -3.5649 | |
| 1544 | K | A | -3.9481 | |
| 1545 | D | A | -4.4016 | |
| 1546 | D | A | -4.1919 | |
| 1547 | K | A | -3.5376 | |
| 1548 | G | A | -2.9968 | |
| 1549 | R | A | -3.8082 | |
| 1550 | D | A | -3.8523 | |
| 1551 | K | A | -3.5906 | |
| 1552 | G | A | -2.5849 | |
| 1553 | K | A | -2.8821 | |
| 1554 | G | A | -2.5771 | |
| 1555 | K | A | -3.4881 | |
| 1556 | K | A | -3.5932 | |
| 1557 | R | A | -3.4579 | |
| 1558 | P | A | -2.6078 | |
| 1559 | N | A | -2.8216 | |
| 1560 | R | A | -3.1524 | |
| 1561 | G | A | -2.6459 | |
| 1562 | K | A | -2.7531 | |
| 1563 | A | A | -1.7416 | |
| 1564 | K | A | -1.5396 | |
| 1565 | P | A | 0.0232 | |
| 1566 | V | A | 1.8365 | |
| 1567 | V | A | 2.0024 | |
| 1568 | S | A | 0.4949 | |
| 1569 | D | A | -0.6903 | |
| 1570 | F | A | 0.3006 | |
| 1571 | D | A | -2.0093 | |
| 1572 | S | A | -2.1330 | |
| 1573 | D | A | -3.8516 | |
| 1574 | E | A | -4.4481 | |
| 1575 | E | A | -4.3468 | |
| 1576 | Q | A | -4.3510 | |
| 1577 | D | A | -4.6020 | |
| 1578 | E | A | -4.6780 | |
| 1579 | R | A | -4.5503 | |
| 1580 | E | A | -4.1950 | |
| 1581 | Q | A | -3.3655 | |
| 1582 | S | A | -2.4647 | |
| 1583 | E | A | -2.7528 | |
| 1584 | G | A | -1.7439 | |
| 1585 | S | A | -1.1200 | |
| 1586 | G | A | -1.2943 | |
| 1587 | T | A | -1.5928 | |
| 1588 | D | A | -3.1574 | |
| 1589 | D | A | -3.5559 | |
| 1590 | E | A | -3.0350 |
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 partially or entirely disordered. Average score is recommended for pH analysis.
pH |
Average A4D Score |
Max A4D Score |
|||
| 4.0 | -1.2456 | 4.9139 | View | CSV | PDB |
| 4.5 | -1.348 | 4.8906 | View | CSV | PDB |
| 5.0 | -1.4814 | 4.8906 | View | CSV | PDB |
| 5.5 | -1.6184 | 4.8906 | View | CSV | PDB |
| 6.0 | -1.7295 | 4.8906 | View | CSV | PDB |
| 6.5 | -1.7935 | 4.8906 | View | CSV | PDB |
| 7.0 | -1.8058 | 4.8906 | View | CSV | PDB |
| 7.5 | -1.7793 | 4.8906 | View | CSV | PDB |
| 8.0 | -1.7313 | 4.8906 | View | CSV | PDB |
| 8.5 | -1.6711 | 4.8906 | View | CSV | PDB |
| 9.0 | -1.6006 | 4.8906 | 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