| Chain sequence(s) |
A: MSTPTDPGAMPHPGPSPGPGPSPGPILGPSPGPGPSPGSVHSMMGPSPGPPSVSHPMPTMGSTDFPQEGMHQMHKPIDGIHDKGIVEDIHCGSMKGTGMRPPHPGMGPPQSPMDQHSQGYMSPHPSPLGAPEHVSSPMSGGGPTPPQMPPSQPGALIPGDPQAMSQPNRGPSPFSPVQLHQLRAQILAYKMLARGQPLPETLQLAVQGKRTLPGLQQQQQQQQQQQQQQQQQQQQQQQQPQQQPPQPQTQQQQQPALVNYNRPSGPGPELSGPSTPQKLPVPAPGGRPSPAPPAAAQPPAAAVPGPSVPQPAPGQPSPVLQLQQKQSRISPIQKPQGLDPVEILQEREYRLQARIAHRIQELENLPGSLPPDLRTKATVELKALRLLNFQRQLRQEVVACMRRDTTLETALNSKAYKRSKRQTLREARMTEKLEKQQKIEQERKRRQKHQEYLNSILQHAKDFKEYHRSVAGKIQKLSKAVATWHANTEREQKKETERIEKERMRRLMAEDEEGYRKLIDQKKDRRLAYLLQQTDEYVANLTNLVWEHKQAQAAKEKKKRRRRKKKAEENAEGGESALGPDGEPIDESSQMSDLPVKVTHTETGKVLFGPEAPKASQLDAWLEMNPGYEVAPRSDSEESDSDYEEEDEEEESSRQETEEKILLDPNSEEVSEKDAKQIIETAKQDVDDEYSMQYSARGSQSYYTVAHAISERVEKQSALLINGTLKHYQLQGLEWMVSLYNNNLNGILADEMGLGKTIQTIALITYLMEHKRLNGPYLIIVPLSTLSNWTYEFDKWAPSVVKISYKGTPAMRRSLVPQLRSGKFNVLLTTYEYIIKDKHILAKIRWKYMIVDEGHRMKNHHCKLTQVLNTHYVAPRRILLTGTPLQNKLPELWALLNFLLPTIFKSCSTFEQWFNAPFAMTGERVDLNEEETILIIRRLHKVLRPFLLRRLKKEVESQLPEKVEYVIKCDMSALQKILYRHMQAKGILLTDGSEKDKKGKGGAKTLMNTIMQLRKICNHPYMFQHIEESFAEHLGYSNGVINGAELYRASGKFELLDRILPKLRATNHRVLLFCQMTSLMTIMEDYFAFRNFLYLRLDGTTKSEDRAALLKKFNEPGSQYFIFLLSTRAGGLGLNLQAADTVVIFDSDWNPHQDLQAQDRAHRIGQQNEVRVLRLCTVNSVEEKILAAAKYKLNVDQKVIQAGMFDQKSSSHERRAFLQAILEHEEENEEEDEVPDDETLNQMIARREEEFDLFMRMDMDRRREDARNPKRKPRLMEEDELPSWIIKDDAEVERLTCEEEEEKIFGRGSRQRRDVDYSDALTEKQWLRAIEDGNLEEMEEEVRLKKRKRRRNVDKDPAKEDVEKAKKRRGRPPAEKLSPNPPKLTKQMNAIIDTVINYKDRCNVEKVPSNSQLEIEGNSSGRQLSEVFIQLPSRKELPEYYELIRKPVDFKKIKERIRNHKYRSLGDLEKDVMLLCHNAQTFNLEGSQIYEDSIVLQSVFKSARQKIAKEEESEDESNEEEEEEDEEESESEAKSVKVKIKLNKKDDKGRDKGKGKKRPNRGKAKPVVSDFDSDEEQDEREQSEGSGTDDE
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 (00:48:05)
[INFO] agg3D: Running pKa-ANI on
/STORAGE/DATA/lcbio/aggreskan/dba28670029daff/tmp/folded.pdb (00:48:05)
[INFO] Main: Simulation completed successfully. (01:18:45)
|
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 | 0.9247 | |
| 2 | S | A | 0.2578 | |
| 3 | T | A | -0.1147 | |
| 4 | P | A | -0.7239 | |
| 5 | T | A | -1.1473 | |
| 6 | D | A | -2.1201 | |
| 7 | P | A | -1.4920 | |
| 8 | G | A | -0.7657 | |
| 9 | A | A | 0.2302 | |
| 10 | M | A | 0.6406 | |
| 11 | P | A | -0.1954 | |
| 12 | H | A | -1.1199 | |
| 13 | P | A | -1.1247 | |
| 14 | G | A | -0.9832 | |
| 15 | P | A | -0.7226 | |
| 16 | S | A | -0.6650 | |
| 17 | P | A | -0.6913 | |
| 18 | G | A | -0.8537 | |
| 19 | P | A | -0.8215 | |
| 20 | G | A | -0.8710 | |
| 21 | P | A | -0.7349 | |
| 22 | S | A | -0.6732 | |
| 23 | P | A | -0.6998 | |
| 24 | G | A | -0.3696 | |
| 25 | P | A | 0.6931 | |
| 26 | I | A | 2.4723 | |
| 27 | L | A | 2.1927 | |
| 28 | G | A | 0.5767 | |
| 29 | P | A | -0.3089 | |
| 30 | S | A | -0.6767 | |
| 31 | P | A | -0.7021 | |
| 32 | G | A | -0.8783 | |
| 33 | P | A | -0.8434 | |
| 34 | G | A | -0.8750 | |
| 35 | P | A | -0.7185 | |
| 36 | S | A | -0.6754 | |
| 37 | P | A | -0.6948 | |
| 38 | G | A | -0.3773 | |
| 39 | S | A | 0.1924 | |
| 40 | V | A | 1.0481 | |
| 41 | H | A | -0.0445 | |
| 42 | S | A | 0.4480 | |
| 43 | M | A | 1.1388 | |
| 44 | M | A | 1.2348 | |
| 45 | G | A | 0.0212 | |
| 46 | P | A | -0.4385 | |
| 47 | S | A | -0.6900 | |
| 48 | P | A | -0.7480 | |
| 49 | G | A | -0.8144 | |
| 50 | P | A | -0.7056 | |
| 51 | P | A | -0.2176 | |
| 52 | S | A | 0.4232 | |
| 53 | V | A | 1.2982 | |
| 54 | S | A | 0.0831 | |
| 55 | H | A | -0.6127 | |
| 56 | P | A | -0.3768 | |
| 57 | M | A | 0.5543 | |
| 58 | P | A | 0.4194 | |
| 59 | T | A | 0.4666 | |
| 60 | M | A | 0.6610 | |
| 61 | G | A | -0.0315 | |
| 62 | S | A | -0.6305 | |
| 63 | T | A | -0.8542 | |
| 64 | D | A | -1.0066 | |
| 65 | F | A | 0.6687 | |
| 66 | P | A | -0.5070 | |
| 67 | Q | A | -1.8719 | |
| 68 | E | A | -2.4757 | |
| 69 | G | A | -1.2909 | |
| 70 | M | A | -0.2696 | |
| 71 | H | A | -0.9606 | |
| 72 | Q | A | -1.1659 | |
| 73 | M | A | -0.5754 | |
| 74 | H | A | -1.6062 | |
| 75 | K | A | -1.7306 | |
| 76 | P | A | -0.7531 | |
| 77 | I | A | 0.4812 | |
| 78 | D | A | -0.5867 | |
| 79 | G | A | -0.2119 | |
| 80 | I | A | 0.5225 | |
| 81 | H | A | -1.4832 | |
| 82 | D | A | -2.8255 | |
| 83 | K | A | -2.4098 | |
| 84 | G | A | -0.6192 | |
| 85 | I | A | 1.9250 | |
| 86 | V | A | 1.1539 | |
| 87 | E | A | -0.8161 | |
| 88 | D | A | -1.4162 | |
| 89 | I | A | 0.3644 | |
| 90 | H | A | -0.1385 | |
| 91 | C | A | 0.3138 | |
| 92 | G | A | -0.2235 | |
| 93 | S | A | -0.2629 | |
| 94 | M | A | -0.1828 | |
| 95 | K | A | -1.4743 | |
| 96 | G | A | -1.2732 | |
| 97 | T | A | -0.7159 | |
| 98 | G | A | -0.6768 | |
| 99 | M | A | -0.1198 | |
| 100 | R | A | -1.6120 | |
| 101 | P | A | -1.2666 | |
| 102 | P | A | -1.2908 | |
| 103 | H | A | -1.4125 | |
| 104 | P | A | -0.8807 | |
| 105 | G | A | -0.4327 | |
| 106 | M | A | 0.5085 | |
| 107 | G | A | -0.2474 | |
| 108 | P | A | -0.6666 | |
| 109 | P | A | -1.1111 | |
| 110 | Q | A | -1.5322 | |
| 111 | S | A | -0.7571 | |
| 112 | P | A | -0.5173 | |
| 113 | M | A | -0.3735 | |
| 114 | D | A | -2.0417 | |
| 115 | Q | A | -2.5616 | |
| 116 | H | A | -2.4455 | |
| 117 | S | A | -1.6455 | |
| 118 | Q | A | -1.6249 | |
| 119 | G | A | -0.4187 | |
| 120 | Y | A | 1.2752 | |
| 121 | M | A | 1.4490 | |
| 122 | S | A | 0.1770 | |
| 123 | P | A | -0.6533 | |
| 124 | H | A | -1.3784 | |
| 125 | P | A | -1.0481 | |
| 126 | S | A | -0.3586 | |
| 127 | P | A | 0.1325 | |
| 128 | L | A | 1.1600 | |
| 129 | G | A | 0.2071 | |
| 130 | A | A | -0.3914 | |
| 131 | P | A | -1.4327 | |
| 132 | E | A | -2.0761 | |
| 133 | H | A | -1.1275 | |
| 134 | V | A | 0.7623 | |
| 135 | S | A | 0.3912 | |
| 136 | S | A | 0.1542 | |
| 137 | P | A | 0.0432 | |
| 138 | M | A | 0.6683 | |
| 139 | S | A | -0.0084 | |
| 140 | G | A | -0.7074 | |
| 141 | G | A | -1.0499 | |
| 142 | G | A | -0.9479 | |
| 143 | P | A | -0.7092 | |
| 144 | T | A | -0.4871 | |
| 145 | P | A | -0.7061 | |
| 146 | P | A | -0.7565 | |
| 147 | Q | A | -0.9237 | |
| 148 | M | A | 0.2361 | |
| 149 | P | A | -0.1135 | |
| 150 | P | A | -0.4733 | |
| 151 | S | A | -1.0077 | |
| 152 | Q | A | -1.5887 | |
| 153 | P | A | -1.1730 | |
| 154 | G | A | -0.4815 | |
| 155 | A | A | 0.8719 | |
| 156 | L | A | 2.4177 | |
| 157 | I | A | 2.3572 | |
| 158 | P | A | 0.5889 | |
| 159 | G | A | -1.0605 | |
| 160 | D | A | -2.2768 | |
| 161 | P | A | -1.9389 | |
| 162 | Q | A | -1.5037 | |
| 163 | A | A | -0.4106 | |
| 164 | M | A | 0.4842 | |
| 165 | S | A | -0.4491 | |
| 166 | Q | A | -1.6953 | |
| 167 | P | A | -1.9034 | |
| 168 | N | A | -2.7195 | |
| 169 | R | A | -2.9726 | |
| 170 | G | A | -1.8712 | |
| 171 | P | A | -1.0258 | |
| 172 | S | A | -0.4543 | |
| 173 | P | A | 0.0179 | |
| 174 | F | A | 1.0989 | |
| 175 | S | A | 0.5880 | |
| 176 | P | A | 0.6185 | |
| 177 | V | A | 1.1616 | |
| 178 | Q | A | -0.0244 | |
| 179 | L | A | 0.1382 | |
| 180 | H | A | -0.2199 | |
| 181 | Q | A | -1.1199 | |
| 182 | L | A | -0.1773 | |
| 183 | R | A | -1.1109 | |
| 184 | A | A | 0.0000 | |
| 185 | Q | A | -0.6101 | |
| 186 | I | A | 0.6941 | |
| 187 | L | A | 0.7869 | |
| 188 | A | A | 0.0000 | |
| 189 | Y | A | 1.1836 | |
| 190 | K | A | -0.1055 | |
| 191 | M | A | 0.0560 | |
| 192 | L | A | 0.9394 | |
| 193 | A | A | -0.2482 | |
| 194 | R | A | -1.8431 | |
| 195 | G | A | -1.1964 | |
| 196 | Q | A | -1.2285 | |
| 197 | P | A | -0.7471 | |
| 198 | L | A | -0.2524 | |
| 199 | P | A | -1.1690 | |
| 200 | E | A | -2.0401 | |
| 201 | T | A | -1.5250 | |
| 202 | L | A | 0.0000 | |
| 203 | Q | A | -2.2163 | |
| 204 | L | A | -2.0612 | |
| 205 | A | A | 0.0000 | |
| 206 | V | A | -1.7074 | |
| 207 | Q | A | -2.3719 | |
| 208 | G | A | -2.2905 | |
| 209 | K | A | -3.1503 | |
| 210 | R | A | -2.9540 | |
| 211 | T | A | -0.9784 | |
| 212 | L | A | -0.3578 | |
| 213 | P | A | -0.6113 | |
| 214 | G | A | -0.8010 | |
| 215 | L | A | -0.4575 | |
| 216 | Q | A | -2.4447 | |
| 217 | Q | A | -3.2230 | |
| 218 | Q | A | -3.6262 | |
| 219 | Q | A | -4.1248 | |
| 220 | Q | A | -4.5591 | |
| 221 | Q | A | -4.9199 | |
| 222 | Q | A | -4.9948 | |
| 223 | Q | A | -4.8470 | |
| 224 | Q | A | -4.9693 | |
| 225 | Q | A | -4.9360 | |
| 226 | Q | A | -4.8358 | |
| 227 | Q | A | -4.7961 | |
| 228 | Q | A | -4.6461 | |
| 229 | Q | A | -4.5151 | |
| 230 | Q | A | -4.4610 | |
| 231 | Q | A | -4.4367 | |
| 232 | Q | A | -4.2502 | |
| 233 | Q | A | -4.3173 | |
| 234 | Q | A | -4.1826 | |
| 235 | Q | A | -4.1168 | |
| 236 | Q | A | -3.9245 | |
| 237 | Q | A | -3.6919 | |
| 238 | Q | A | -3.3800 | |
| 239 | Q | A | -2.9521 | |
| 240 | P | A | -2.1202 | |
| 241 | Q | A | -2.4330 | |
| 242 | Q | A | -2.6259 | |
| 243 | Q | A | -2.2316 | |
| 244 | P | A | -1.5101 | |
| 245 | P | A | -1.5288 | |
| 246 | Q | A | -1.7488 | |
| 247 | P | A | -1.5515 | |
| 248 | Q | A | -1.8720 | |
| 249 | T | A | -1.5474 | |
| 250 | Q | A | -2.3316 | |
| 251 | Q | A | -2.7134 | |
| 252 | Q | A | -2.9710 | |
| 253 | Q | A | -2.7136 | |
| 254 | Q | A | -2.1602 | |
| 255 | P | A | -0.8374 | |
| 256 | A | A | 0.8643 | |
| 257 | L | A | 2.1023 | |
| 258 | V | A | 2.1200 | |
| 259 | N | A | 0.3769 | |
| 260 | Y | A | 0.0904 | |
| 261 | N | A | -1.8210 | |
| 262 | R | A | -2.4008 | |
| 263 | P | A | -1.7582 | |
| 264 | S | A | -1.0281 | |
| 265 | G | A | -0.8645 | |
| 266 | P | A | -0.8360 | |
| 267 | G | A | -1.2287 | |
| 268 | P | A | -1.1405 | |
| 269 | E | A | -1.2966 | |
| 270 | L | A | 0.3751 | |
| 271 | S | A | -0.1057 | |
| 272 | G | A | -0.4602 | |
| 273 | P | A | -0.6831 | |
| 274 | S | A | -0.5259 | |
| 275 | T | A | -0.6158 | |
| 276 | P | A | -1.2557 | |
| 277 | Q | A | -1.9382 | |
| 278 | K | A | -1.7039 | |
| 279 | L | A | 0.7364 | |
| 280 | P | A | 1.0379 | |
| 281 | V | A | 1.8671 | |
| 282 | P | A | 0.6145 | |
| 283 | A | A | 0.0253 | |
| 284 | P | A | -0.6220 | |
| 285 | G | A | -1.2206 | |
| 286 | G | A | -1.6988 | |
| 287 | R | A | -2.3485 | |
| 288 | P | A | -1.5344 | |
| 289 | S | A | -0.8573 | |
| 290 | P | A | -0.4460 | |
| 291 | A | A | -0.2944 | |
| 292 | P | A | -0.3955 | |
| 293 | P | A | -0.3361 | |
| 294 | A | A | -0.0740 | |
| 295 | A | A | -0.1615 | |
| 296 | A | A | -0.5272 | |
| 297 | Q | A | -1.3516 | |
| 298 | P | A | -1.0057 | |
| 299 | P | A | -0.6174 | |
| 300 | A | A | -0.0770 | |
| 301 | A | A | 0.4147 | |
| 302 | A | A | 0.8969 | |
| 303 | V | A | 1.5724 | |
| 304 | P | A | 0.4456 | |
| 305 | G | A | -0.3917 | |
| 306 | P | A | -0.3371 | |
| 307 | S | A | 0.3729 | |
| 308 | V | A | 1.2182 | |
| 309 | P | A | 0.0365 | |
| 310 | Q | A | -1.0582 | |
| 311 | P | A | -1.0049 | |
| 312 | A | A | -0.7010 | |
| 313 | P | A | -0.7585 | |
| 314 | G | A | -1.2122 | |
| 315 | Q | A | -1.6980 | |
| 316 | P | A | -1.0121 | |
| 317 | S | A | -0.3190 | |
| 318 | P | A | 0.6300 | |
| 319 | V | A | 2.1856 | |
| 320 | L | A | 1.8963 | |
| 321 | Q | A | 0.5369 | |
| 322 | L | A | 0.4456 | |
| 323 | Q | A | -1.6402 | |
| 324 | Q | A | -2.5834 | |
| 325 | K | A | -3.2259 | |
| 326 | Q | A | -2.8026 | |
| 327 | S | A | -1.6862 | |
| 328 | R | A | -1.5556 | |
| 329 | I | A | 1.0576 | |
| 330 | S | A | 0.4305 | |
| 331 | P | A | 0.4077 | |
| 332 | I | A | 1.0648 | |
| 333 | Q | A | -1.3615 | |
| 334 | K | A | -2.3023 | |
| 335 | P | A | -1.6041 | |
| 336 | Q | A | -1.9708 | |
| 337 | G | A | -1.0740 | |
| 338 | L | A | 0.1644 | |
| 339 | D | A | -0.9147 | |
| 340 | P | A | -0.0287 | |
| 341 | V | A | 0.5992 | |
| 342 | E | A | -1.6356 | |
| 343 | I | A | -0.5866 | |
| 344 | L | A | -0.3439 | |
| 345 | Q | A | -1.6958 | |
| 346 | E | A | -2.4851 | |
| 347 | R | A | -3.0108 | |
| 348 | E | A | -3.1561 | |
| 349 | Y | A | -1.6596 | |
| 350 | R | A | -2.9893 | |
| 351 | L | A | -2.0601 | |
| 352 | Q | A | -2.3680 | |
| 353 | A | A | -2.1149 | |
| 354 | R | A | -2.8737 | |
| 355 | I | A | -1.8651 | |
| 356 | A | A | -2.1951 | |
| 357 | H | A | -2.9146 | |
| 358 | R | A | -2.8761 | |
| 359 | I | A | -2.7104 | |
| 360 | Q | A | -3.2521 | |
| 361 | E | A | -3.3618 | |
| 362 | L | A | 0.0000 | |
| 363 | E | A | -2.4929 | |
| 364 | N | A | -2.4197 | |
| 365 | L | A | -1.2478 | |
| 366 | P | A | -0.7130 | |
| 367 | G | A | -0.8008 | |
| 368 | S | A | -0.4616 | |
| 369 | L | A | -0.2482 | |
| 370 | P | A | -0.6270 | |
| 371 | P | A | -1.3035 | |
| 372 | D | A | -1.7884 | |
| 373 | L | A | -0.6408 | |
| 374 | R | A | -1.4611 | |
| 375 | T | A | -1.1955 | |
| 376 | K | A | -1.7889 | |
| 377 | A | A | -1.1725 | |
| 378 | T | A | -0.6733 | |
| 379 | V | A | 0.1069 | |
| 380 | E | A | -1.0083 | |
| 381 | L | A | -1.4677 | |
| 382 | K | A | -1.7164 | |
| 383 | A | A | -0.6650 | |
| 384 | L | A | -0.8214 | |
| 385 | R | A | -1.7750 | |
| 386 | L | A | -0.8261 | |
| 387 | L | A | -0.7983 | |
| 388 | N | A | -1.4965 | |
| 389 | F | A | -0.0048 | |
| 390 | Q | A | -1.7317 | |
| 391 | R | A | -3.1443 | |
| 392 | Q | A | -2.3932 | |
| 393 | L | A | -1.2613 | |
| 394 | R | A | -2.7830 | |
| 395 | Q | A | -2.5598 | |
| 396 | E | A | -2.2298 | |
| 397 | V | A | -0.3830 | |
| 398 | V | A | -0.5805 | |
| 399 | A | A | -1.2008 | |
| 400 | C | A | -1.0143 | |
| 401 | M | A | -0.9395 | |
| 402 | R | A | -2.2871 | |
| 403 | R | A | -2.9202 | |
| 404 | D | A | -2.6914 | |
| 405 | T | A | -1.6033 | |
| 406 | T | A | -1.0037 | |
| 407 | L | A | 0.0343 | |
| 408 | E | A | -1.0911 | |
| 409 | T | A | -0.4129 | |
| 410 | A | A | 0.2827 | |
| 411 | L | A | 0.5162 | |
| 412 | N | A | -1.0898 | |
| 413 | S | A | -1.1773 | |
| 414 | K | A | -2.3240 | |
| 415 | A | A | -1.3154 | |
| 416 | Y | A | -0.9848 | |
| 417 | K | A | -2.9656 | |
| 418 | R | A | -3.3417 | |
| 419 | S | A | -3.0720 | |
| 420 | K | A | -3.7308 | |
| 421 | R | A | -3.4841 | |
| 422 | Q | A | -2.7651 | |
| 423 | T | A | -1.7941 | |
| 424 | L | A | -0.5944 | |
| 425 | R | A | -2.5002 | |
| 426 | E | A | -2.8451 | |
| 427 | A | A | -2.1276 | |
| 428 | R | A | -3.1826 | |
| 429 | M | A | -2.1145 | |
| 430 | T | A | -2.5535 | |
| 431 | E | A | -4.2071 | |
| 432 | K | A | -3.7404 | |
| 433 | L | A | -1.9518 | |
| 434 | E | A | -4.1002 | |
| 435 | K | A | -4.0491 | |
| 436 | Q | A | -3.3399 | |
| 437 | Q | A | -4.0179 | |
| 438 | K | A | -4.1107 | |
| 439 | I | A | -2.4111 | |
| 440 | E | A | -4.3634 | |
| 441 | Q | A | -4.7024 | |
| 442 | E | A | -4.9878 | |
| 443 | R | A | -5.7055 | |
| 444 | K | A | -6.0272 | |
| 445 | R | A | -6.2086 | |
| 446 | R | A | -6.1829 | |
| 447 | Q | A | -5.5027 | |
| 448 | K | A | -5.1147 | |
| 449 | H | A | -4.0913 | |
| 450 | Q | A | -3.4162 | |
| 451 | E | A | -2.4562 | |
| 452 | Y | A | -0.3909 | |
| 453 | L | A | -0.0481 | |
| 454 | N | A | -1.0771 | |
| 455 | S | A | -0.3892 | |
| 456 | I | A | 0.5708 | |
| 457 | L | A | 0.5201 | |
| 458 | Q | A | -1.4085 | |
| 459 | H | A | -1.6852 | |
| 460 | A | A | -1.0900 | |
| 461 | K | A | -2.4217 | |
| 462 | D | A | -2.6306 | |
| 463 | F | A | -0.8446 | |
| 464 | K | A | -2.6311 | |
| 465 | E | A | -3.0208 | |
| 466 | Y | A | -0.7225 | |
| 467 | H | A | -1.7567 | |
| 468 | R | A | -2.6032 | |
| 469 | S | A | -1.3877 | |
| 470 | V | A | -0.8222 | |
| 471 | A | A | -1.0471 | |
| 472 | G | A | -1.5155 | |
| 473 | K | A | -2.0866 | |
| 474 | I | A | -0.4370 | |
| 475 | Q | A | -1.9450 | |
| 476 | K | A | -2.4669 | |
| 477 | L | A | -0.7070 | |
| 478 | S | A | -0.9903 | |
| 479 | K | A | -2.0846 | |
| 480 | A | A | -0.5080 | |
| 481 | V | A | 0.0118 | |
| 482 | A | A | -0.4461 | |
| 483 | T | A | -0.2864 | |
| 484 | W | A | 0.0070 | |
| 485 | H | A | -1.4974 | |
| 486 | A | A | -1.6318 | |
| 487 | N | A | -2.4883 | |
| 488 | T | A | -2.8218 | |
| 489 | E | A | -4.0866 | |
| 490 | R | A | -5.0009 | |
| 491 | E | A | -5.3072 | |
| 492 | Q | A | -5.0510 | |
| 493 | K | A | -5.5757 | |
| 494 | K | A | -5.4288 | |
| 495 | E | A | -5.4619 | |
| 496 | T | A | -4.6288 | |
| 497 | E | A | -4.9918 | |
| 498 | R | A | -4.8066 | |
| 499 | I | A | -3.2982 | |
| 500 | E | A | -4.4484 | |
| 501 | K | A | -4.1556 | |
| 502 | E | A | -3.7330 | |
| 503 | R | A | -2.9423 | |
| 504 | M | A | -1.8469 | |
| 505 | R | A | -2.7448 | |
| 506 | R | A | -3.0405 | |
| 507 | L | A | -1.4989 | |
| 508 | M | A | -0.4194 | |
| 509 | A | A | -1.2747 | |
| 510 | E | A | -2.7204 | |
| 511 | D | A | -3.4981 | |
| 512 | E | A | -4.1665 | |
| 513 | E | A | -4.1984 | |
| 514 | G | A | 0.0000 | |
| 515 | Y | A | -3.3584 | |
| 516 | R | A | -4.0128 | |
| 517 | K | A | -3.9641 | |
| 518 | L | A | -2.9102 | |
| 519 | I | A | -2.2170 | |
| 520 | D | A | -3.6965 | |
| 521 | Q | A | -3.6174 | |
| 522 | K | A | -3.5652 | |
| 523 | K | A | -3.1220 | |
| 524 | D | A | -2.5538 | |
| 525 | R | A | -3.0070 | |
| 526 | R | A | -1.9686 | |
| 527 | L | A | 0.0000 | |
| 528 | A | A | 0.0000 | |
| 529 | Y | A | -0.2339 | |
| 530 | L | A | -0.1119 | |
| 531 | L | A | 0.0000 | |
| 532 | Q | A | -0.4648 | |
| 533 | Q | A | -0.5478 | |
| 534 | T | A | 0.0000 | |
| 535 | D | A | -1.6924 | |
| 536 | E | A | -2.0164 | |
| 537 | Y | A | -1.2784 | |
| 538 | V | A | 0.0000 | |
| 539 | A | A | -1.2994 | |
| 540 | N | A | -1.4435 | |
| 541 | L | A | 0.0000 | |
| 542 | T | A | -0.9557 | |
| 543 | N | A | -1.4532 | |
| 544 | L | A | -0.8367 | |
| 545 | V | A | 0.0000 | |
| 546 | W | A | -0.6187 | |
| 547 | E | A | -2.0432 | |
| 548 | H | A | -1.2770 | |
| 549 | K | A | -1.3296 | |
| 550 | Q | A | -1.9269 | |
| 551 | A | A | -1.6160 | |
| 552 | Q | A | -1.7504 | |
| 553 | A | A | -2.1252 | |
| 554 | A | A | -2.3501 | |
| 555 | K | A | -3.2574 | |
| 556 | E | A | -3.7971 | |
| 557 | K | A | -4.6977 | |
| 558 | K | A | -5.0430 | |
| 559 | K | A | -5.6340 | |
| 560 | R | A | -6.1069 | |
| 561 | R | A | -6.4190 | |
| 562 | R | A | -6.6065 | |
| 563 | R | A | -6.7205 | |
| 564 | K | A | -6.3431 | |
| 565 | K | A | -6.3742 | |
| 566 | K | A | -5.9490 | |
| 567 | A | A | -4.8577 | |
| 568 | E | A | -5.2885 | |
| 569 | E | A | -5.0478 | |
| 570 | N | A | -4.1948 | |
| 571 | A | A | -3.6195 | |
| 572 | E | A | -3.3248 | |
| 573 | G | A | -2.2174 | |
| 574 | G | A | -2.1633 | |
| 575 | E | A | -2.2263 | |
| 576 | S | A | -0.5332 | |
| 577 | A | A | 0.2492 | |
| 578 | L | A | 0.6716 | |
| 579 | G | A | -0.3004 | |
| 580 | P | A | -1.2352 | |
| 581 | D | A | -2.3660 | |
| 582 | G | A | -1.4383 | |
| 583 | E | A | -2.0751 | |
| 584 | P | A | -0.8785 | |
| 585 | I | A | 0.1911 | |
| 586 | D | A | -2.4572 | |
| 587 | E | A | -2.5444 | |
| 588 | S | A | -1.9478 | |
| 589 | S | A | -2.0560 | |
| 590 | Q | A | -1.8733 | |
| 591 | M | A | -0.4656 | |
| 592 | S | A | -0.9743 | |
| 593 | D | A | -1.6131 | |
| 594 | L | A | 0.1582 | |
| 595 | P | A | -0.4919 | |
| 596 | V | A | 0.0000 | |
| 597 | K | A | -0.5163 | |
| 598 | V | A | 0.0000 | |
| 599 | T | A | -0.7082 | |
| 600 | H | A | -1.4839 | |
| 601 | T | A | -1.6000 | |
| 602 | E | A | -2.3216 | |
| 603 | T | A | -1.6052 | |
| 604 | G | A | -1.5497 | |
| 605 | K | A | -1.4068 | |
| 606 | V | A | 0.2550 | |
| 607 | L | A | 0.0000 | |
| 608 | F | A | 1.0635 | |
| 609 | G | A | 0.0445 | |
| 610 | P | A | -0.6963 | |
| 611 | E | A | -1.5521 | |
| 612 | A | A | 0.0000 | |
| 613 | P | A | 0.0000 | |
| 614 | K | A | -1.8701 | |
| 615 | A | A | -1.0222 | |
| 616 | S | A | -1.1678 | |
| 617 | Q | A | -1.5801 | |
| 618 | L | A | -1.2537 | |
| 619 | D | A | -2.1852 | |
| 620 | A | A | -1.2166 | |
| 621 | W | A | -0.8209 | |
| 622 | L | A | -1.1337 | |
| 623 | E | A | -1.7165 | |
| 624 | M | A | -0.1287 | |
| 625 | N | A | -0.8045 | |
| 626 | P | A | -0.8778 | |
| 627 | G | A | -1.0880 | |
| 628 | Y | A | -1.1761 | |
| 629 | E | A | -1.1553 | |
| 630 | V | A | -0.2027 | |
| 631 | A | A | -0.4907 | |
| 632 | P | A | -1.5368 | |
| 633 | R | A | -2.8100 | |
| 634 | S | A | -2.4785 | |
| 635 | D | A | -3.3017 | |
| 636 | S | A | -2.7940 | |
| 637 | E | A | -3.9195 | |
| 638 | E | A | -3.6421 | |
| 639 | S | A | -2.7841 | |
| 640 | D | A | -3.1299 | |
| 641 | S | A | -2.1528 | |
| 642 | D | A | -2.5137 | |
| 643 | Y | A | -1.4680 | |
| 644 | E | A | -3.2861 | |
| 645 | E | A | -4.1603 | |
| 646 | E | A | -4.5940 | |
| 647 | D | A | -4.9804 | |
| 648 | E | A | -4.9906 | |
| 649 | E | A | -4.8055 | |
| 650 | E | A | -4.3933 | |
| 651 | E | A | -3.8165 | |
| 652 | S | A | -2.5858 | |
| 653 | S | A | -2.4573 | |
| 654 | R | A | -3.3803 | |
| 655 | Q | A | -3.3356 | |
| 656 | E | A | -3.7525 | |
| 657 | T | A | -3.1795 | |
| 658 | E | A | -3.6195 | |
| 659 | E | A | -3.0756 | |
| 660 | K | A | -1.9298 | |
| 661 | I | A | 0.8850 | |
| 662 | L | A | 1.0425 | |
| 663 | L | A | -0.3486 | |
| 664 | D | A | -2.0844 | |
| 665 | P | A | -2.1766 | |
| 666 | N | A | -3.1901 | |
| 667 | S | A | -2.7488 | |
| 668 | E | A | -3.4557 | |
| 669 | E | A | -3.4097 | |
| 670 | V | A | 0.0000 | |
| 671 | S | A | -3.0325 | |
| 672 | E | A | -4.0314 | |
| 673 | K | A | -3.6624 | |
| 674 | D | A | -3.6910 | |
| 675 | A | A | 0.0000 | |
| 676 | K | A | -3.4063 | |
| 677 | Q | A | -3.5463 | |
| 678 | I | A | -2.1165 | |
| 679 | I | A | 0.0000 | |
| 680 | E | A | -3.5949 | |
| 681 | T | A | -2.4988 | |
| 682 | A | A | 0.0000 | |
| 683 | K | A | -3.0209 | |
| 684 | Q | A | -3.3653 | |
| 685 | D | A | -3.4558 | |
| 686 | V | A | -2.5935 | |
| 687 | D | A | -2.8318 | |
| 688 | D | A | -2.3879 | |
| 689 | E | A | -1.4426 | |
| 690 | Y | A | -0.6698 | |
| 691 | S | A | -0.2795 | |
| 692 | M | A | 0.4778 | |
| 693 | Q | A | -0.2547 | |
| 694 | Y | A | -0.0537 | |
| 695 | S | A | -0.7587 | |
| 696 | A | A | -0.9054 | |
| 697 | R | A | -2.1203 | |
| 698 | G | A | -1.6783 | |
| 699 | S | A | -1.4529 | |
| 700 | Q | A | -1.5150 | |
| 701 | S | A | -0.7042 | |
| 702 | Y | A | 0.0000 | |
| 703 | Y | A | 0.0000 | |
| 704 | T | A | 0.1094 | |
| 705 | V | A | 0.0000 | |
| 706 | A | A | 0.0000 | |
| 707 | H | A | 0.0000 | |
| 708 | A | A | 1.0043 | |
| 709 | I | A | 1.7819 | |
| 710 | S | A | -0.0080 | |
| 711 | E | A | -1.3343 | |
| 712 | R | A | -2.9886 | |
| 713 | V | A | 0.0000 | |
| 714 | E | A | -3.4312 | |
| 715 | K | A | -3.0583 | |
| 716 | Q | A | -1.2553 | |
| 717 | S | A | 0.0000 | |
| 718 | A | A | 0.2442 | |
| 719 | L | A | 0.7321 | |
| 720 | L | A | 0.0000 | |
| 721 | I | A | 0.7583 | |
| 722 | N | A | -0.7321 | |
| 723 | G | A | -0.5702 | |
| 724 | T | A | -0.6476 | |
| 725 | L | A | 0.0000 | |
| 726 | K | A | -1.1354 | |
| 727 | H | A | -1.6211 | |
| 728 | Y | A | 0.0000 | |
| 729 | Q | A | 0.0000 | |
| 730 | L | A | -1.4582 | |
| 731 | Q | A | -1.1894 | |
| 732 | G | A | 0.0000 | |
| 733 | L | A | 0.0000 | |
| 734 | E | A | -1.8080 | |
| 735 | W | A | 0.0000 | |
| 736 | M | A | 0.0000 | |
| 737 | V | A | 0.0000 | |
| 738 | S | A | 0.0000 | |
| 739 | L | A | 0.0000 | |
| 740 | Y | A | 0.0415 | |
| 741 | N | A | 0.1599 | |
| 742 | N | A | 0.0000 | |
| 743 | N | A | -0.3463 | |
| 744 | L | A | 0.0000 | |
| 745 | N | A | 0.0000 | |
| 746 | G | A | 0.0000 | |
| 747 | I | A | 0.0000 | |
| 748 | L | A | 0.0000 | |
| 749 | A | A | 0.0000 | |
| 750 | D | A | 0.0000 | |
| 751 | E | A | -0.5053 | |
| 752 | M | A | -0.1358 | |
| 753 | G | A | -0.3666 | |
| 754 | L | A | 0.0000 | |
| 755 | G | A | -0.1976 | |
| 756 | K | A | -0.2008 | |
| 757 | T | A | -0.1278 | |
| 758 | I | A | 0.0933 | |
| 759 | Q | A | 0.0000 | |
| 760 | T | A | 0.0000 | |
| 761 | I | A | 0.0000 | |
| 762 | A | A | 0.0000 | |
| 763 | L | A | 0.0000 | |
| 764 | I | A | 0.0000 | |
| 765 | T | A | 0.0000 | |
| 766 | Y | A | 0.0000 | |
| 767 | L | A | 0.0000 | |
| 768 | M | A | 0.0000 | |
| 769 | E | A | -1.3841 | |
| 770 | H | A | -1.4304 | |
| 771 | K | A | -1.9278 | |
| 772 | R | A | -2.6299 | |
| 773 | L | A | -1.9551 | |
| 774 | N | A | -2.0008 | |
| 775 | G | A | -1.5159 | |
| 776 | P | A | -1.1582 | |
| 777 | Y | A | 0.0000 | |
| 778 | L | A | 0.0000 | |
| 779 | I | A | 0.0000 | |
| 780 | I | A | 0.0000 | |
| 781 | V | A | 0.0000 | |
| 782 | P | A | 0.0000 | |
| 783 | L | A | 0.2985 | |
| 784 | S | A | -0.0602 | |
| 785 | T | A | 0.0000 | |
| 786 | L | A | 0.0000 | |
| 787 | S | A | -0.2669 | |
| 788 | N | A | -0.3133 | |
| 789 | W | A | 0.0000 | |
| 790 | T | A | -0.2891 | |
| 791 | Y | A | 0.1544 | |
| 792 | E | A | -0.5294 | |
| 793 | F | A | 0.0000 | |
| 794 | D | A | -1.5788 | |
| 795 | K | A | -1.2688 | |
| 796 | W | A | -0.3820 | |
| 797 | A | A | 0.0000 | |
| 798 | P | A | -0.6337 | |
| 799 | S | A | 0.0146 | |
| 800 | V | A | 0.0000 | |
| 801 | V | A | 0.4843 | |
| 802 | K | A | -0.2064 | |
| 803 | I | A | 0.0000 | |
| 804 | S | A | -0.3383 | |
| 805 | Y | A | 0.0000 | |
| 806 | K | A | -0.5076 | |
| 807 | G | A | -0.3572 | |
| 808 | T | A | -0.4357 | |
| 809 | P | A | -0.7508 | |
| 810 | A | A | -0.5025 | |
| 811 | M | A | -0.1916 | |
| 812 | R | A | -0.9662 | |
| 813 | R | A | -1.8576 | |
| 814 | S | A | -0.9897 | |
| 815 | L | A | -0.9463 | |
| 816 | V | A | 0.0000 | |
| 817 | P | A | -1.7208 | |
| 818 | Q | A | -1.9766 | |
| 819 | L | A | 0.0000 | |
| 820 | R | A | -2.4879 | |
| 821 | S | A | -2.0090 | |
| 822 | G | A | -1.9982 | |
| 823 | K | A | -2.4440 | |
| 824 | F | A | 0.0000 | |
| 825 | N | A | 0.0000 | |
| 826 | V | A | 0.0000 | |
| 827 | L | A | 0.0000 | |
| 828 | L | A | 0.0000 | |
| 829 | T | A | 0.0000 | |
| 830 | T | A | 0.0000 | |
| 831 | Y | A | -0.6478 | |
| 832 | E | A | -1.6773 | |
| 833 | Y | A | -1.2982 | |
| 834 | I | A | 0.0000 | |
| 835 | I | A | -1.6089 | |
| 836 | K | A | -2.2154 | |
| 837 | D | A | -1.6384 | |
| 838 | K | A | -2.0002 | |
| 839 | H | A | -1.8554 | |
| 840 | I | A | -1.4962 | |
| 841 | L | A | 0.0000 | |
| 842 | A | A | -1.4633 | |
| 843 | K | A | -2.4327 | |
| 844 | I | A | -1.7554 | |
| 845 | R | A | -2.0907 | |
| 846 | W | A | 0.0000 | |
| 847 | K | A | -1.2453 | |
| 848 | Y | A | 0.0000 | |
| 849 | M | A | 0.0000 | |
| 850 | I | A | 0.0000 | |
| 851 | V | A | 0.0000 | |
| 852 | D | A | 0.0000 | |
| 853 | E | A | -0.4665 | |
| 854 | G | A | 0.0000 | |
| 855 | H | A | -0.7748 | |
| 856 | R | A | -1.1573 | |
| 857 | M | A | 0.0000 | |
| 858 | K | A | -1.2006 | |
| 859 | N | A | -1.9531 | |
| 860 | H | A | -1.8178 | |
| 861 | H | A | -2.0609 | |
| 862 | C | A | -2.1420 | |
| 863 | K | A | -2.4213 | |
| 864 | L | A | 0.0000 | |
| 865 | T | A | 0.0000 | |
| 866 | Q | A | -2.3118 | |
| 867 | V | A | 0.0000 | |
| 868 | L | A | 0.0000 | |
| 869 | N | A | -1.5884 | |
| 870 | T | A | -0.9513 | |
| 871 | H | A | -1.2815 | |
| 872 | Y | A | 0.0000 | |
| 873 | V | A | -0.4710 | |
| 874 | A | A | -0.6131 | |
| 875 | P | A | -0.6267 | |
| 876 | R | A | -0.5190 | |
| 877 | R | A | -0.4395 | |
| 878 | I | A | 0.0000 | |
| 879 | L | A | 0.0000 | |
| 880 | L | A | 0.0000 | |
| 881 | T | A | 0.0000 | |
| 882 | G | A | 0.0000 | |
| 883 | T | A | 0.0000 | |
| 884 | P | A | 0.0000 | |
| 885 | L | A | 0.0000 | |
| 886 | Q | A | -0.5141 | |
| 887 | N | A | -1.1375 | |
| 888 | K | A | -1.3795 | |
| 889 | L | A | 0.0000 | |
| 890 | P | A | -0.6946 | |
| 891 | E | A | 0.0000 | |
| 892 | L | A | 0.0000 | |
| 893 | W | A | 0.0000 | |
| 894 | A | A | 0.0000 | |
| 895 | L | A | 0.0000 | |
| 896 | L | A | 0.0000 | |
| 897 | N | A | -0.7113 | |
| 898 | F | A | 0.0000 | |
| 899 | L | A | 0.0000 | |
| 900 | L | A | 0.0000 | |
| 901 | P | A | -0.8592 | |
| 902 | T | A | -0.7559 | |
| 903 | I | A | 0.0000 | |
| 904 | F | A | 0.0000 | |
| 905 | K | A | -1.8264 | |
| 906 | S | A | -1.0589 | |
| 907 | C | A | -0.8594 | |
| 908 | S | A | -0.9936 | |
| 909 | T | A | -0.9652 | |
| 910 | F | A | 0.0000 | |
| 911 | E | A | -1.5133 | |
| 912 | Q | A | -1.5865 | |
| 913 | W | A | -0.6975 | |
| 914 | F | A | 0.0000 | |
| 915 | N | A | -0.7531 | |
| 916 | A | A | -0.5994 | |
| 917 | P | A | -0.3591 | |
| 918 | F | A | -0.0465 | |
| 919 | A | A | -0.1246 | |
| 920 | M | A | 0.4598 | |
| 921 | T | A | -0.5936 | |
| 922 | G | A | -1.4447 | |
| 923 | E | A | -2.5905 | |
| 924 | R | A | -2.4090 | |
| 925 | V | A | -0.8556 | |
| 926 | D | A | -2.2701 | |
| 927 | L | A | -1.8058 | |
| 928 | N | A | -2.5779 | |
| 929 | E | A | -3.1934 | |
| 930 | E | A | -2.2666 | |
| 931 | E | A | 0.0000 | |
| 932 | T | A | -1.4353 | |
| 933 | I | A | 0.0000 | |
| 934 | L | A | 0.0000 | |
| 935 | I | A | 0.0000 | |
| 936 | I | A | 0.0000 | |
| 937 | R | A | -0.9401 | |
| 938 | R | A | -0.6819 | |
| 939 | L | A | 0.0000 | |
| 940 | H | A | 0.0000 | |
| 941 | K | A | -0.6410 | |
| 942 | V | A | 0.0000 | |
| 943 | L | A | 0.0000 | |
| 944 | R | A | -0.3345 | |
| 945 | P | A | 0.0000 | |
| 946 | F | A | 0.0000 | |
| 947 | L | A | 0.0000 | |
| 948 | L | A | 0.0000 | |
| 949 | R | A | -0.2494 | |
| 950 | R | A | 0.0000 | |
| 951 | L | A | -0.8208 | |
| 952 | K | A | 0.0000 | |
| 953 | K | A | -2.6021 | |
| 954 | E | A | -2.0394 | |
| 955 | V | A | -1.2138 | |
| 956 | E | A | 0.0000 | |
| 957 | S | A | -1.5958 | |
| 958 | Q | A | -1.8171 | |
| 959 | L | A | -1.7230 | |
| 960 | P | A | -2.0514 | |
| 961 | E | A | -2.7580 | |
| 962 | K | A | -1.5849 | |
| 963 | V | A | -0.6528 | |
| 964 | E | A | -0.5912 | |
| 965 | Y | A | 0.3304 | |
| 966 | V | A | 0.5447 | |
| 967 | I | A | 0.0000 | |
| 968 | K | A | 0.0000 | |
| 969 | C | A | 0.0000 | |
| 970 | D | A | -1.0087 | |
| 971 | M | A | 0.0000 | |
| 972 | S | A | 0.0000 | |
| 973 | A | A | 0.0000 | |
| 974 | L | A | 0.0000 | |
| 975 | Q | A | 0.0000 | |
| 976 | K | A | -1.8577 | |
| 977 | I | A | -1.0475 | |
| 978 | L | A | 0.0000 | |
| 979 | Y | A | -1.3846 | |
| 980 | R | A | -2.6393 | |
| 981 | H | A | 0.0000 | |
| 982 | M | A | 0.0000 | |
| 983 | Q | A | -2.1764 | |
| 984 | A | A | -1.9414 | |
| 985 | K | A | -2.4708 | |
| 986 | G | A | -1.2147 | |
| 987 | I | A | 0.0000 | |
| 988 | L | A | 0.0000 | |
| 989 | L | A | 0.0000 | |
| 990 | T | A | -1.2907 | |
| 991 | D | A | -1.7442 | |
| 992 | G | A | -2.4031 | |
| 993 | S | A | -2.4746 | |
| 994 | E | A | -4.0376 | |
| 995 | K | A | -5.2231 | |
| 996 | D | A | -5.1511 | |
| 997 | K | A | -4.4586 | |
| 998 | K | A | -4.1286 | |
| 999 | G | A | -4.0095 | |
| 1000 | K | A | -4.1591 | |
| 1001 | G | A | -3.6198 | |
| 1002 | G | A | -1.7146 | |
| 1003 | A | A | -0.9926 | |
| 1004 | K | A | -0.6961 | |
| 1005 | T | A | -0.4008 | |
| 1006 | L | A | 0.0010 | |
| 1007 | M | A | 0.6360 | |
| 1008 | N | A | 0.0000 | |
| 1009 | T | A | -0.0953 | |
| 1010 | I | A | 0.2345 | |
| 1011 | M | A | 0.1426 | |
| 1012 | Q | A | 0.0000 | |
| 1013 | L | A | 0.0000 | |
| 1014 | R | A | 0.0000 | |
| 1015 | K | A | 0.0000 | |
| 1016 | I | A | 0.0000 | |
| 1017 | C | A | 0.0000 | |
| 1018 | N | A | 0.0000 | |
| 1019 | H | A | 0.0000 | |
| 1020 | P | A | 0.0000 | |
| 1021 | Y | A | 0.0000 | |
| 1022 | M | A | -0.2761 | |
| 1023 | F | A | 0.0000 | |
| 1024 | Q | A | -1.4950 | |
| 1025 | H | A | -1.6454 | |
| 1026 | I | A | 0.0000 | |
| 1027 | E | A | -1.2337 | |
| 1028 | E | A | -1.9401 | |
| 1029 | S | A | 0.0000 | |
| 1030 | F | A | 0.0000 | |
| 1031 | A | A | 0.0000 | |
| 1032 | E | A | -2.3851 | |
| 1033 | H | A | -1.5077 | |
| 1034 | L | A | -0.6055 | |
| 1035 | G | A | -1.0838 | |
| 1036 | Y | A | -0.8904 | |
| 1037 | S | A | -0.9910 | |
| 1038 | N | A | -1.5478 | |
| 1039 | G | A | -1.3852 | |
| 1040 | V | A | -0.3891 | |
| 1041 | I | A | 0.0000 | |
| 1042 | N | A | -1.0723 | |
| 1043 | G | A | -0.6315 | |
| 1044 | A | A | -0.4741 | |
| 1045 | E | A | 0.0000 | |
| 1046 | L | A | 0.0000 | |
| 1047 | Y | A | -0.1150 | |
| 1048 | R | A | 0.0000 | |
| 1049 | A | A | 0.0000 | |
| 1050 | S | A | 0.0000 | |
| 1051 | G | A | 0.0000 | |
| 1052 | K | A | 0.0000 | |
| 1053 | F | A | 0.0000 | |
| 1054 | E | A | -0.3167 | |
| 1055 | L | A | 0.0000 | |
| 1056 | L | A | 0.0000 | |
| 1057 | D | A | 0.0000 | |
| 1058 | R | A | -0.3282 | |
| 1059 | I | A | 0.0000 | |
| 1060 | L | A | 0.0000 | |
| 1061 | P | A | -0.7284 | |
| 1062 | K | A | 0.0000 | |
| 1063 | L | A | 0.0000 | |
| 1064 | R | A | -1.8208 | |
| 1065 | A | A | -0.9319 | |
| 1066 | T | A | -1.1838 | |
| 1067 | N | A | -1.7916 | |
| 1068 | H | A | 0.0000 | |
| 1069 | R | A | -0.8705 | |
| 1070 | V | A | 0.0000 | |
| 1071 | L | A | 0.0000 | |
| 1072 | L | A | 0.0000 | |
| 1073 | F | A | 0.0000 | |
| 1074 | C | A | 0.0000 | |
| 1075 | Q | A | -0.4505 | |
| 1076 | M | A | 0.0000 | |
| 1077 | T | A | -0.0769 | |
| 1078 | S | A | 0.0354 | |
| 1079 | L | A | 0.0000 | |
| 1080 | M | A | 0.0000 | |
| 1081 | T | A | -0.2820 | |
| 1082 | I | A | -0.1617 | |
| 1083 | M | A | 0.0000 | |
| 1084 | E | A | -0.4066 | |
| 1085 | D | A | -0.8403 | |
| 1086 | Y | A | 0.0000 | |
| 1087 | F | A | 0.0000 | |
| 1088 | A | A | -0.4725 | |
| 1089 | F | A | -0.4266 | |
| 1090 | R | A | -0.8649 | |
| 1091 | N | A | -1.0885 | |
| 1092 | F | A | 0.0000 | |
| 1093 | L | A | 0.7491 | |
| 1094 | Y | A | 0.5488 | |
| 1095 | L | A | 0.0000 | |
| 1096 | R | A | -0.3481 | |
| 1097 | L | A | 0.0000 | |
| 1098 | D | A | 0.0000 | |
| 1099 | G | A | -0.9665 | |
| 1100 | T | A | -0.7454 | |
| 1101 | T | A | -1.8042 | |
| 1102 | K | A | -3.0571 | |
| 1103 | S | A | -2.4298 | |
| 1104 | E | A | -3.3169 | |
| 1105 | D | A | -3.2023 | |
| 1106 | R | A | -2.3818 | |
| 1107 | A | A | -1.9505 | |
| 1108 | A | A | -1.7637 | |
| 1109 | L | A | -1.4908 | |
| 1110 | L | A | -1.6366 | |
| 1111 | K | A | -2.8254 | |
| 1112 | K | A | -2.6833 | |
| 1113 | F | A | 0.0000 | |
| 1114 | N | A | -2.3524 | |
| 1115 | E | A | -3.1795 | |
| 1116 | P | A | -1.9441 | |
| 1117 | G | A | -1.5168 | |
| 1118 | S | A | -1.8027 | |
| 1119 | Q | A | -1.2520 | |
| 1120 | Y | A | -0.1763 | |
| 1121 | F | A | -0.1206 | |
| 1122 | I | A | 0.0000 | |
| 1123 | F | A | 0.0000 | |
| 1124 | L | A | 0.0000 | |
| 1125 | L | A | 0.0000 | |
| 1126 | S | A | 0.0000 | |
| 1127 | T | A | 0.0000 | |
| 1128 | R | A | -1.1634 | |
| 1129 | A | A | -0.6418 | |
| 1130 | G | A | 0.0000 | |
| 1131 | G | A | 0.0000 | |
| 1132 | L | A | -0.1297 | |
| 1133 | G | A | -0.2188 | |
| 1134 | L | A | 0.0000 | |
| 1135 | N | A | -0.9680 | |
| 1136 | L | A | 0.0000 | |
| 1137 | Q | A | -0.9625 | |
| 1138 | A | A | -1.0581 | |
| 1139 | A | A | 0.0000 | |
| 1140 | D | A | 0.0000 | |
| 1141 | T | A | 0.0000 | |
| 1142 | V | A | 0.0000 | |
| 1143 | V | A | 0.0000 | |
| 1144 | I | A | 0.0000 | |
| 1145 | F | A | 0.0000 | |
| 1146 | D | A | 0.0000 | |
| 1147 | S | A | 0.0000 | |
| 1148 | D | A | 0.0000 | |
| 1149 | W | A | 0.0000 | |
| 1150 | N | A | -0.5930 | |
| 1151 | P | A | 0.0000 | |
| 1152 | H | A | 0.0000 | |
| 1153 | Q | A | -0.3879 | |
| 1154 | D | A | 0.0000 | |
| 1155 | L | A | 0.1569 | |
| 1156 | Q | A | -0.1590 | |
| 1157 | A | A | 0.0000 | |
| 1158 | Q | A | 0.0000 | |
| 1159 | D | A | 0.0000 | |
| 1160 | R | A | 0.0000 | |
| 1161 | A | A | 0.0000 | |
| 1162 | H | A | 0.0000 | |
| 1163 | R | A | -0.7628 | |
| 1164 | I | A | -0.4492 | |
| 1165 | G | A | -0.9534 | |
| 1166 | Q | A | 0.0000 | |
| 1167 | Q | A | -2.0103 | |
| 1168 | N | A | -1.7321 | |
| 1169 | E | A | -1.5562 | |
| 1170 | V | A | 0.0000 | |
| 1171 | R | A | -0.7581 | |
| 1172 | V | A | 0.0000 | |
| 1173 | L | A | 0.0000 | |
| 1174 | R | A | 0.0000 | |
| 1175 | L | A | 0.0000 | |
| 1176 | C | A | 0.0000 | |
| 1177 | T | A | 0.0000 | |
| 1178 | V | A | -1.2418 | |
| 1179 | N | A | -1.9108 | |
| 1180 | S | A | -1.2353 | |
| 1181 | V | A | -0.7848 | |
| 1182 | E | A | 0.0000 | |
| 1183 | E | A | -1.3851 | |
| 1184 | K | A | -2.0608 | |
| 1185 | I | A | 0.0000 | |
| 1186 | L | A | -0.7065 | |
| 1187 | A | A | -0.8421 | |
| 1188 | A | A | -0.6812 | |
| 1189 | A | A | 0.0000 | |
| 1190 | K | A | -1.0515 | |
| 1191 | Y | A | -0.2212 | |
| 1192 | K | A | -0.5125 | |
| 1193 | L | A | -0.4260 | |
| 1194 | N | A | -0.6513 | |
| 1195 | V | A | 0.0000 | |
| 1196 | D | A | 0.0000 | |
| 1197 | Q | A | -0.4627 | |
| 1198 | K | A | -0.4091 | |
| 1199 | V | A | 0.0000 | |
| 1200 | I | A | 0.0000 | |
| 1201 | Q | A | -0.2584 | |
| 1202 | A | A | 0.0000 | |
| 1203 | G | A | 0.0000 | |
| 1204 | M | A | -0.4300 | |
| 1205 | F | A | 0.0000 | |
| 1206 | D | A | 0.0000 | |
| 1207 | Q | A | -1.2654 | |
| 1208 | K | A | -2.0678 | |
| 1209 | S | A | -1.8015 | |
| 1210 | S | A | -2.1757 | |
| 1211 | S | A | -2.5479 | |
| 1212 | H | A | -2.6863 | |
| 1213 | E | A | -2.7600 | |
| 1214 | R | A | 0.0000 | |
| 1215 | R | A | -2.6737 | |
| 1216 | A | A | -1.5434 | |
| 1217 | F | A | -0.8986 | |
| 1218 | L | A | 0.0000 | |
| 1219 | Q | A | -1.8228 | |
| 1220 | A | A | -1.1567 | |
| 1221 | I | A | 0.0000 | |
| 1222 | L | A | -2.0462 | |
| 1223 | E | A | -3.5447 | |
| 1224 | H | A | -3.6688 | |
| 1225 | E | A | -3.6299 | |
| 1226 | E | A | -4.5172 | |
| 1227 | E | A | -4.9463 | |
| 1228 | N | A | -4.7093 | |
| 1229 | E | A | -4.7951 | |
| 1230 | E | A | -4.9325 | |
| 1231 | E | A | -4.6654 | |
| 1232 | D | A | -4.3102 | |
| 1233 | E | A | -3.5159 | |
| 1234 | V | A | -1.5944 | |
| 1235 | P | A | -1.9459 | |
| 1236 | D | A | -2.7181 | |
| 1237 | D | A | -2.0594 | |
| 1238 | E | A | -2.6208 | |
| 1239 | T | A | -1.8661 | |
| 1240 | L | A | 0.0000 | |
| 1241 | N | A | 0.0000 | |
| 1242 | Q | A | -2.2816 | |
| 1243 | M | A | -0.6428 | |
| 1244 | I | A | 0.0000 | |
| 1245 | A | A | -1.5711 | |
| 1246 | R | A | -1.8446 | |
| 1247 | R | A | -3.1680 | |
| 1248 | E | A | -3.6911 | |
| 1249 | E | A | -3.3513 | |
| 1250 | E | A | 0.0000 | |
| 1251 | F | A | -2.4402 | |
| 1252 | D | A | -2.6095 | |
| 1253 | L | A | -1.1686 | |
| 1254 | F | A | 0.0000 | |
| 1255 | M | A | -1.5062 | |
| 1256 | R | A | -2.3075 | |
| 1257 | M | A | -1.6454 | |
| 1258 | D | A | 0.0000 | |
| 1259 | M | A | -2.3591 | |
| 1260 | D | A | -3.8781 | |
| 1261 | R | A | -3.7720 | |
| 1262 | R | A | -4.4786 | |
| 1263 | R | A | -4.7822 | |
| 1264 | E | A | -5.3052 | |
| 1265 | D | A | -5.4337 | |
| 1266 | A | A | -4.2339 | |
| 1267 | R | A | -4.6444 | |
| 1268 | N | A | -4.5886 | |
| 1269 | P | A | -3.0506 | |
| 1270 | K | A | -3.9367 | |
| 1271 | R | A | -4.8190 | |
| 1272 | K | A | -3.7652 | |
| 1273 | P | A | -2.1452 | |
| 1274 | R | A | -1.4322 | |
| 1275 | L | A | -0.9649 | |
| 1276 | M | A | 0.0000 | |
| 1277 | E | A | -3.4926 | |
| 1278 | E | A | -3.5124 | |
| 1279 | D | A | -3.3106 | |
| 1280 | E | A | -2.6290 | |
| 1281 | L | A | 0.0000 | |
| 1282 | P | A | -0.6714 | |
| 1283 | S | A | -0.3575 | |
| 1284 | W | A | -0.1398 | |
| 1285 | I | A | 0.0000 | |
| 1286 | I | A | 0.1012 | |
| 1287 | K | A | -1.3766 | |
| 1288 | D | A | -2.8152 | |
| 1289 | D | A | -2.8337 | |
| 1290 | A | A | -2.6660 | |
| 1291 | E | A | -3.1208 | |
| 1292 | V | A | 0.0000 | |
| 1293 | E | A | -3.6450 | |
| 1294 | R | A | -3.2475 | |
| 1295 | L | A | -2.2465 | |
| 1296 | T | A | -2.8756 | |
| 1297 | C | A | -2.8278 | |
| 1298 | E | A | -4.2154 | |
| 1299 | E | A | -3.8884 | |
| 1300 | E | A | -3.7206 | |
| 1301 | E | A | -3.5670 | |
| 1302 | E | A | -3.5696 | |
| 1303 | K | A | -2.9216 | |
| 1304 | I | A | 0.1247 | |
| 1305 | F | A | 0.4886 | |
| 1306 | G | A | -1.4930 | |
| 1307 | R | A | -2.2252 | |
| 1308 | G | A | -2.4112 | |
| 1309 | S | A | -2.0568 | |
| 1310 | R | A | -3.5104 | |
| 1311 | Q | A | -3.7516 | |
| 1312 | R | A | -3.9267 | |
| 1313 | R | A | -3.9160 | |
| 1314 | D | A | -2.6775 | |
| 1315 | V | A | -0.6936 | |
| 1316 | D | A | -1.4554 | |
| 1317 | Y | A | 0.0185 | |
| 1318 | S | A | -0.3849 | |
| 1319 | D | A | -1.3154 | |
| 1320 | A | A | -0.4765 | |
| 1321 | L | A | -0.6603 | |
| 1322 | T | A | -1.1562 | |
| 1323 | E | A | -1.5509 | |
| 1324 | K | A | -2.7616 | |
| 1325 | Q | A | -2.6724 | |
| 1326 | W | A | 0.0000 | |
| 1327 | L | A | -2.1968 | |
| 1328 | R | A | -3.7706 | |
| 1329 | A | A | 0.0000 | |
| 1330 | I | A | 0.0000 | |
| 1331 | E | A | -3.5461 | |
| 1332 | D | A | -3.4297 | |
| 1333 | G | A | -2.3980 | |
| 1334 | N | A | -1.9840 | |
| 1335 | L | A | -1.6521 | |
| 1336 | E | A | -1.8813 | |
| 1337 | E | A | -2.4287 | |
| 1338 | M | A | -1.6160 | |
| 1339 | E | A | -1.9876 | |
| 1340 | E | A | -3.3880 | |
| 1341 | E | A | -3.2198 | |
| 1342 | V | A | -2.1053 | |
| 1343 | R | A | -2.8675 | |
| 1344 | L | A | -2.9582 | |
| 1345 | K | A | -3.6352 | |
| 1346 | K | A | -4.1914 | |
| 1347 | R | A | -4.7619 | |
| 1348 | K | A | -4.9594 | |
| 1349 | R | A | -5.2831 | |
| 1350 | R | A | -5.2824 | |
| 1351 | R | A | -5.1876 | |
| 1352 | N | A | -4.1588 | |
| 1353 | V | A | -2.3626 | |
| 1354 | D | A | -3.8483 | |
| 1355 | K | A | -3.8107 | |
| 1356 | D | A | -3.2248 | |
| 1357 | P | A | -2.1081 | |
| 1358 | A | A | -1.9118 | |
| 1359 | K | A | -3.1117 | |
| 1360 | E | A | -3.2061 | |
| 1361 | D | A | -2.5955 | |
| 1362 | V | A | -0.8793 | |
| 1363 | E | A | -2.1331 | |
| 1364 | K | A | -2.5883 | |
| 1365 | A | A | -2.5986 | |
| 1366 | K | A | -3.2770 | |
| 1367 | K | A | -3.9505 | |
| 1368 | R | A | -4.0536 | |
| 1369 | R | A | -3.8613 | |
| 1370 | G | A | -2.9893 | |
| 1371 | R | A | -2.6584 | |
| 1372 | P | A | -1.8279 | |
| 1373 | P | A | -1.5922 | |
| 1374 | A | A | -1.5958 | |
| 1375 | E | A | -2.5472 | |
| 1376 | K | A | -2.7453 | |
| 1377 | L | A | -1.5378 | |
| 1378 | S | A | -1.0632 | |
| 1379 | P | A | -1.3129 | |
| 1380 | N | A | 0.0000 | |
| 1381 | P | A | -1.2303 | |
| 1382 | P | A | -1.6023 | |
| 1383 | K | A | -2.3997 | |
| 1384 | L | A | -1.5684 | |
| 1385 | T | A | -2.0270 | |
| 1386 | K | A | -2.4989 | |
| 1387 | Q | A | -1.6648 | |
| 1388 | M | A | 0.0000 | |
| 1389 | N | A | -1.7667 | |
| 1390 | A | A | -1.2369 | |
| 1391 | I | A | 0.0000 | |
| 1392 | I | A | 0.0000 | |
| 1393 | D | A | -1.9097 | |
| 1394 | T | A | -1.2075 | |
| 1395 | V | A | 0.0000 | |
| 1396 | I | A | -1.1464 | |
| 1397 | N | A | -2.0873 | |
| 1398 | Y | A | -1.9739 | |
| 1399 | K | A | -3.4331 | |
| 1400 | D | A | -3.7724 | |
| 1401 | R | A | -3.0376 | |
| 1402 | C | A | -1.3315 | |
| 1403 | N | A | -1.4681 | |
| 1404 | V | A | 0.0063 | |
| 1405 | E | A | -1.6397 | |
| 1406 | K | A | -1.5435 | |
| 1407 | V | A | 0.4222 | |
| 1408 | P | A | -0.4122 | |
| 1409 | S | A | -0.9970 | |
| 1410 | N | A | -1.4388 | |
| 1411 | S | A | -1.2693 | |
| 1412 | Q | A | -1.0622 | |
| 1413 | L | A | 0.2278 | |
| 1414 | E | A | -0.9606 | |
| 1415 | I | A | 0.1979 | |
| 1416 | E | A | -1.7236 | |
| 1417 | G | A | -1.6951 | |
| 1418 | N | A | -1.8921 | |
| 1419 | S | A | -1.9590 | |
| 1420 | S | A | -1.8649 | |
| 1421 | G | A | -2.6113 | |
| 1422 | R | A | -3.2626 | |
| 1423 | Q | A | -2.6364 | |
| 1424 | L | A | 0.0000 | |
| 1425 | S | A | 0.0000 | |
| 1426 | E | A | -1.3397 | |
| 1427 | V | A | 0.8165 | |
| 1428 | F | A | 0.0000 | |
| 1429 | I | A | -0.7113 | |
| 1430 | Q | A | -1.3420 | |
| 1431 | L | A | -0.5337 | |
| 1432 | P | A | -1.0850 | |
| 1433 | S | A | -2.2173 | |
| 1434 | R | A | -3.6604 | |
| 1435 | K | A | -3.6914 | |
| 1436 | E | A | -3.3933 | |
| 1437 | L | A | -2.5159 | |
| 1438 | P | A | -2.8836 | |
| 1439 | E | A | -2.8862 | |
| 1440 | Y | A | 0.0000 | |
| 1441 | Y | A | -2.0997 | |
| 1442 | E | A | -2.6531 | |
| 1443 | L | A | -1.2504 | |
| 1444 | I | A | 0.0000 | |
| 1445 | R | A | -2.7548 | |
| 1446 | K | A | -2.2623 | |
| 1447 | P | A | -1.1283 | |
| 1448 | V | A | 0.0000 | |
| 1449 | D | A | 0.0000 | |
| 1450 | F | A | 0.0000 | |
| 1451 | K | A | -2.6962 | |
| 1452 | K | A | -2.7521 | |
| 1453 | I | A | 0.0000 | |
| 1454 | K | A | -3.1235 | |
| 1455 | E | A | -4.0267 | |
| 1456 | R | A | -3.5432 | |
| 1457 | I | A | 0.0000 | |
| 1458 | R | A | -3.8421 | |
| 1459 | N | A | -3.6434 | |
| 1460 | H | A | -3.0164 | |
| 1461 | K | A | -3.2868 | |
| 1462 | Y | A | 0.0000 | |
| 1463 | R | A | -1.7276 | |
| 1464 | S | A | -1.0514 | |
| 1465 | L | A | -0.8204 | |
| 1466 | G | A | -1.2864 | |
| 1467 | D | A | -1.8236 | |
| 1468 | L | A | 0.0000 | |
| 1469 | E | A | -1.8329 | |
| 1470 | K | A | -2.0196 | |
| 1471 | D | A | 0.0000 | |
| 1472 | V | A | 0.0000 | |
| 1473 | M | A | -0.8273 | |
| 1474 | L | A | -0.8081 | |
| 1475 | L | A | 0.0000 | |
| 1476 | C | A | 0.0000 | |
| 1477 | H | A | -0.8572 | |
| 1478 | N | A | 0.0000 | |
| 1479 | A | A | 0.0000 | |
| 1480 | Q | A | -0.8079 | |
| 1481 | T | A | -0.2177 | |
| 1482 | F | A | 0.0955 | |
| 1483 | N | A | -0.3092 | |
| 1484 | L | A | 0.1420 | |
| 1485 | E | A | -1.7789 | |
| 1486 | G | A | -1.6838 | |
| 1487 | S | A | -1.3069 | |
| 1488 | Q | A | -1.7750 | |
| 1489 | I | A | -0.3818 | |
| 1490 | Y | A | -1.1791 | |
| 1491 | E | A | -1.9558 | |
| 1492 | D | A | 0.0000 | |
| 1493 | S | A | 0.0000 | |
| 1494 | I | A | 0.1699 | |
| 1495 | V | A | 0.0354 | |
| 1496 | L | A | 0.0000 | |
| 1497 | Q | A | -0.6212 | |
| 1498 | S | A | -0.5378 | |
| 1499 | V | A | 0.0000 | |
| 1500 | F | A | 0.0000 | |
| 1501 | K | A | -2.5948 | |
| 1502 | S | A | -1.9942 | |
| 1503 | A | A | 0.0000 | |
| 1504 | R | A | -2.7881 | |
| 1505 | Q | A | -3.4998 | |
| 1506 | K | A | -3.9629 | |
| 1507 | I | A | -2.8837 | |
| 1508 | A | A | -3.3517 | |
| 1509 | K | A | -4.8791 | |
| 1510 | E | A | -5.1235 | |
| 1511 | E | A | -4.7774 | |
| 1512 | E | A | -5.2266 | |
| 1513 | S | A | -4.6122 | |
| 1514 | E | A | -5.4690 | |
| 1515 | D | A | -5.9744 | |
| 1516 | E | A | -5.6811 | |
| 1517 | S | A | -4.8965 | |
| 1518 | N | A | -5.6731 | |
| 1519 | E | A | -6.2464 | |
| 1520 | E | A | -5.9239 | |
| 1521 | E | A | -6.1057 | |
| 1522 | E | A | -6.2624 | |
| 1523 | E | A | -6.2129 | |
| 1524 | E | A | -6.0644 | |
| 1525 | D | A | -5.6718 | |
| 1526 | E | A | -5.2167 | |
| 1527 | E | A | -4.9216 | |
| 1528 | E | A | -4.2238 | |
| 1529 | S | A | -2.9124 | |
| 1530 | E | A | -3.0226 | |
| 1531 | S | A | -2.2769 | |
| 1532 | E | A | -2.6950 | |
| 1533 | A | A | -1.8357 | |
| 1534 | K | A | -1.8306 | |
| 1535 | S | A | -0.4794 | |
| 1536 | V | A | 0.8522 | |
| 1537 | K | A | -0.3190 | |
| 1538 | V | A | 0.8283 | |
| 1539 | K | A | -0.5326 | |
| 1540 | I | A | 0.9866 | |
| 1541 | K | A | -0.5467 | |
| 1542 | L | A | 0.1140 | |
| 1543 | N | A | -2.1278 | |
| 1544 | K | A | -3.2235 | |
| 1545 | K | A | -4.1056 | |
| 1546 | D | A | -4.2692 | |
| 1547 | D | A | -4.0122 | |
| 1548 | K | A | -3.6061 | |
| 1549 | G | A | -3.0748 | |
| 1550 | R | A | -3.7190 | |
| 1551 | D | A | -3.7756 | |
| 1552 | K | A | -3.5554 | |
| 1553 | G | A | -2.7529 | |
| 1554 | K | A | -2.9280 | |
| 1555 | G | A | -2.7194 | |
| 1556 | K | A | -3.6582 | |
| 1557 | K | A | -3.6305 | |
| 1558 | R | A | -3.4919 | |
| 1559 | P | A | -2.8765 | |
| 1560 | N | A | -2.8360 | |
| 1561 | R | A | -3.1423 | |
| 1562 | G | A | -2.5947 | |
| 1563 | K | A | -2.6397 | |
| 1564 | A | A | -1.8552 | |
| 1565 | K | A | -1.7261 | |
| 1566 | P | A | 0.1048 | |
| 1567 | V | A | 1.8980 | |
| 1568 | V | A | 2.1259 | |
| 1569 | S | A | 0.5188 | |
| 1570 | D | A | -0.7724 | |
| 1571 | F | A | -0.0224 | |
| 1572 | D | A | -1.5872 | |
| 1573 | S | A | -2.0428 | |
| 1574 | D | A | -3.6387 | |
| 1575 | E | A | -4.0109 | |
| 1576 | E | A | -4.1731 | |
| 1577 | Q | A | -3.8686 | |
| 1578 | D | A | -4.1383 | |
| 1579 | E | A | -4.3224 | |
| 1580 | R | A | -4.3297 | |
| 1581 | E | A | -3.8146 | |
| 1582 | Q | A | -2.9452 | |
| 1583 | S | A | -2.2456 | |
| 1584 | E | A | -2.4904 | |
| 1585 | G | A | -1.7697 | |
| 1586 | S | A | -1.0892 | |
| 1587 | G | A | -1.1186 | |
| 1588 | T | A | -1.7344 | |
| 1589 | D | A | -3.1868 | |
| 1590 | D | A | -3.6824 | |
| 1591 | E | A | -3.1986 |
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 | -1.2143 | 5.1245 | View | CSV | PDB |
| 4.5 | -1.3171 | 4.9925 | View | CSV | PDB |
| 5.0 | -1.4483 | 4.8751 | View | CSV | PDB |
| 5.5 | -1.5814 | 4.8308 | View | CSV | PDB |
| 6.0 | -1.6883 | 4.7854 | View | CSV | PDB |
| 6.5 | -1.7486 | 4.7395 | View | CSV | PDB |
| 7.0 | -1.7591 | 4.6937 | View | CSV | PDB |
| 7.5 | -1.7332 | 4.6537 | View | CSV | PDB |
| 8.0 | -1.6872 | 4.6537 | View | CSV | PDB |
| 8.5 | -1.6291 | 4.6537 | View | CSV | PDB |
| 9.0 | -1.5603 | 4.6537 | 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