| Chain sequence(s) | GADGVGNSSGNWHCDSTWMGDRVITTSTRTWALPTYNNHLYKQISSQSGASNDNHYFGYSTPWGYFDFNRFHCHFSPRDWQRLINNNWGFRPKRLNFKLFNIQVKEVTQNDGTTTIANNLTSTVQVFTDSEYQLPYVLGSAHQGCLPPFPADVFMVPQYGYLTLNNGSQAVGRSSFYCLEYFPSQMLRTGNNFTFSYTFEDVPFHSSYAHSQSLDRLMNPLIDQYLYYLSRTNTPSGTTTQSRLQFSQAGASDIRDQSRNWLPGPCYRQQRVSKTSADNNNSEYSWTGATKYHLNGRDSLVNPGPAMASHKDDEEKFFPQSGVLIFGKQGSEKTNVDIEKVMITDEEEIRTTNPVATEQYGSVSTNLQRGNRQAATADVNTQGVLPGMVWQDRDVYLQGPIWAKIPHTDGHFHPSPLMGGFGLKHPPPQILIKNTPVPANPSTTFSAAKFASFITQYSTGQVSVEIEWELQKENSKRWNPEIQYTSNYNKSVNVDFTVDTNGVYSEPRPIGTRYLTRNLGADGVGNSSGNWHCDSTWMGDRVITTSTRTWALPTYNNHLYKQISSQSGASNDNHYFGYSTPWGYFDFNRFHCHFSPRDWQRLINNNWGFRPKRLNFKLFNIQVKEVTQNDGTTTIANNLTSTVQVFTDSEYQLPYVLGSAHQGCLPPFPADVFMVPQYGYLTLNNGSQAVGRSSFYCLEYFPSQMLRTGNNFTFSYTFEDVPFHSSYAHSQSLDRLMNPLIDQYLYYLSRTNTPSGTTTQSRLQFSQAGASDIRDQSRNWLPGPCYRQQRVSKTSADNNNSEYSWTGATKYHLNGRDSLVNPGPAMASHKDDEEKFFPQSGVLIFGKQGSEKTNVDIEKVMITDEEEIRTTNPVATEQYGSVSTNLQRGNRQAATADVNTQGVLPGMVWQDRDVYLQGPIWAKIPHTDGHFHPSPLMGGFGLKHPPPQILIKNTPVPANPSTTFSAAKFASFITQYSTGQVSVEIEWELQKENSKRWNPEIQYTSNYNKSVNVDFTVDTNGVYSEPRPIGTRYLTRNLGADGVGNSSGNWHCDSTWMGDRVITTSTRTWALPTYNNHLYKQISSQSGASNDNHYFGYSTPWGYFDFNRFHCHFSPRDWQRLINNNWGFRPKRLNFKLFNIQVKEVTQNDGTTTIANNLTSTVQVFTDSEYQLPYVLGSAHQGCLPPFPADVFMVPQYGYLTLNNGSQAVGRSSFYCLEYFPSQMLRTGNNFTFSYTFEDVPFHSSYAHSQSLDRLMNPLIDQYLYYLSRTNTPSGTTTQSRLQFSQAGASDIRDQSRNWLPGPCYRQQRVSKTSADNNNSEYSWTGATKYHLNGRDSLVNPGPAMASHKDDEEKFFPQSGVLIFGKQGSEKTNVDIEKVMITDEEEIRTTNPVATEQYGSVSTNLQRGNRQAATADVNTQGVLPGMVWQDRDVYLQGPIWAKIPHTDGHFHPSPLMGGFGLKHPPPQILIKNTPVPANPSTTFSAAKFASFITQYSTGQVSVEIEWELQKENSKRWNPEIQYTSNYNKSVNVDFTVDTNGVYSEPRPIGTRYLTRNL input PDB |
| Selected Chain(s) | A,B,C |
| Distance of aggregation | 10 Å |
| FoldX usage | Yes |
| pH calculations | Yes |
| Dynamic mode | No |
| Automated mutations | No |
| Downloads | Download all the data |
| Simulation log |
[INFO] Logger: Verbosity set to: 2 - [INFO] (00:00:00)
[WARNING] runJob: Working directory already exists (possibly overwriting previous results -ow
to prevent this behavior) (00:00:00)
[INFO] runJob: Starting aggrescan3d job on: input.pdb with all chain(s) selected (00:00:00)
[INFO] runJob: Creating pdb object from: input.pdb (00:00:00)
[INFO] PDB-Info: The input structure is globular. Max score is recommended for pH analysis. (00:00:05)
[INFO] FoldX: Starting FoldX energy minimization (00:00:05)
[INFO] Analysis: Starting Aggrescan4D on folded.pdb (00:06:10)
[INFO] agg3D: Running pKa-ANI on
/STORAGE/DATA/lcbio/aggreskan/3c114f7640de01/tmp/folded.pdb (00:06:10)
[INFO] Main: Simulation completed successfully. (00:19:43)
|
The table below lists A3D score for protein residues. Residues with A3D score > 0.0000 are marked by yellow rows.
| residue index | residue name | chain | Aggrescan3D score | mutation |
|---|---|---|---|---|
| residue index | residue name | chain | Aggrescan3D score | |
| 15 | G | A | -0.8375 | |
| 16 | A | A | -0.8838 | |
| 17 | D | A | -1.3481 | |
| 18 | G | A | -0.6189 | |
| 19 | V | A | 0.9019 | |
| 20 | G | A | -0.5376 | |
| 21 | N | A | -1.4924 | |
| 22 | S | A | -1.2833 | |
| 23 | S | A | -1.2332 | |
| 24 | G | A | -1.3039 | |
| 25 | N | A | -1.3352 | |
| 26 | W | A | -0.5665 | |
| 27 | H | A | -1.3517 | |
| 28 | C | A | -0.9646 | |
| 29 | D | A | -1.8689 | |
| 30 | S | A | -0.9108 | |
| 31 | T | A | -0.2640 | |
| 32 | W | A | -0.3835 | |
| 33 | M | A | -0.1308 | |
| 34 | G | A | -1.3579 | |
| 35 | D | A | -2.5992 | |
| 36 | R | A | -1.5889 | |
| 37 | V | A | 0.0000 | |
| 38 | I | A | -0.4599 | |
| 39 | T | A | 0.0000 | |
| 40 | T | A | -0.9811 | |
| 41 | S | A | 0.0000 | |
| 42 | T | A | 0.0000 | |
| 43 | R | A | 0.0000 | |
| 44 | T | A | 0.5747 | |
| 45 | W | A | 0.0000 | |
| 46 | A | A | 0.7398 | |
| 47 | L | A | 0.0000 | |
| 48 | P | A | 0.1043 | |
| 49 | T | A | -0.2762 | |
| 50 | Y | A | -0.2802 | |
| 51 | N | A | -0.9136 | |
| 52 | N | A | -1.1917 | |
| 53 | H | A | -0.4938 | |
| 54 | L | A | -0.1945 | |
| 55 | Y | A | -0.5253 | |
| 56 | K | A | -1.6042 | |
| 57 | Q | A | -1.5031 | |
| 58 | I | A | -0.7415 | |
| 59 | S | A | -0.8571 | |
| 60 | S | A | 0.0000 | |
| 61 | Q | A | -1.5225 | |
| 62 | S | A | -1.3444 | |
| 63 | G | A | -1.1668 | |
| 64 | A | A | -1.2192 | |
| 65 | S | A | -1.2656 | |
| 66 | N | A | -1.7511 | |
| 67 | D | A | -1.2437 | |
| 68 | N | A | -1.1974 | |
| 69 | H | A | -1.3115 | |
| 70 | Y | A | -0.6039 | |
| 71 | F | A | 0.0000 | |
| 72 | G | A | 0.0000 | |
| 73 | Y | A | -0.4845 | |
| 74 | S | A | 0.0000 | |
| 75 | T | A | 0.0000 | |
| 76 | P | A | 0.0000 | |
| 77 | W | A | 0.0000 | |
| 78 | G | A | 0.0000 | |
| 79 | Y | A | 0.0000 | |
| 80 | F | A | 0.0000 | |
| 81 | D | A | 0.0000 | |
| 82 | F | A | 0.0000 | |
| 83 | N | A | 0.0000 | |
| 84 | R | A | -0.2695 | |
| 85 | F | A | 0.0000 | |
| 86 | H | A | 0.0000 | |
| 87 | C | A | 0.0000 | |
| 88 | H | A | 0.0000 | |
| 89 | F | A | 0.0000 | |
| 90 | S | A | -1.0474 | |
| 91 | P | A | -1.5438 | |
| 92 | R | A | -2.5280 | |
| 93 | D | A | -2.0272 | |
| 94 | W | A | 0.0000 | |
| 95 | Q | A | -2.1332 | |
| 96 | R | A | -2.3685 | |
| 97 | L | A | 0.0000 | |
| 98 | I | A | 0.0000 | |
| 99 | N | A | 0.0000 | |
| 100 | N | A | -1.9880 | |
| 101 | N | A | 0.0000 | |
| 102 | W | A | -1.0583 | |
| 103 | G | A | 0.0000 | |
| 104 | F | A | 0.0000 | |
| 105 | R | A | -0.9329 | |
| 106 | P | A | 0.0000 | |
| 107 | K | A | -1.8644 | |
| 108 | R | A | -2.2684 | |
| 109 | L | A | 0.0000 | |
| 110 | N | A | -1.4573 | |
| 111 | F | A | 0.0000 | |
| 112 | K | A | -0.9784 | |
| 113 | L | A | 0.0000 | |
| 114 | F | A | 0.0000 | |
| 115 | N | A | -1.2515 | |
| 116 | I | A | 0.0000 | |
| 117 | Q | A | -0.9760 | |
| 118 | V | A | 0.0000 | |
| 119 | K | A | -0.3455 | |
| 120 | E | A | -0.0286 | |
| 121 | V | A | 0.1849 | |
| 122 | T | A | -0.5530 | |
| 123 | Q | A | -2.1598 | |
| 124 | N | A | -2.8993 | |
| 125 | D | A | -2.9258 | |
| 126 | G | A | -2.0959 | |
| 127 | T | A | -1.7008 | |
| 128 | T | A | -0.8377 | |
| 129 | T | A | 0.1033 | |
| 130 | I | A | 1.0882 | |
| 131 | A | A | 0.1637 | |
| 132 | N | A | -0.8626 | |
| 133 | N | A | -0.3800 | |
| 134 | L | A | 0.7925 | |
| 135 | T | A | 0.0070 | |
| 136 | S | A | 0.0000 | |
| 137 | T | A | 0.0000 | |
| 138 | V | A | 0.0000 | |
| 139 | Q | A | -0.5180 | |
| 140 | V | A | 0.0000 | |
| 141 | F | A | 0.0000 | |
| 142 | T | A | -0.4271 | |
| 143 | D | A | 0.0000 | |
| 144 | S | A | -1.0829 | |
| 145 | E | A | -1.9761 | |
| 146 | Y | A | -1.0889 | |
| 147 | Q | A | -1.1941 | |
| 148 | L | A | 0.0000 | |
| 149 | P | A | 0.0000 | |
| 150 | Y | A | 0.0000 | |
| 151 | V | A | 0.0000 | |
| 152 | L | A | 0.0000 | |
| 153 | G | A | -0.0813 | |
| 154 | S | A | -0.0611 | |
| 155 | A | A | 0.0000 | |
| 156 | H | A | 0.0000 | |
| 157 | Q | A | -0.5192 | |
| 158 | G | A | -0.0617 | |
| 159 | C | A | -0.0085 | |
| 160 | L | A | 0.0000 | |
| 161 | P | A | 0.0000 | |
| 162 | P | A | 0.2118 | |
| 163 | F | A | 1.1286 | |
| 164 | P | A | 0.4818 | |
| 165 | A | A | 0.4104 | |
| 166 | D | A | 0.6577 | |
| 167 | V | A | 1.8790 | |
| 168 | F | A | 1.4043 | |
| 169 | M | A | 1.4675 | |
| 170 | V | A | 0.0000 | |
| 171 | P | A | 0.0000 | |
| 172 | Q | A | 0.1391 | |
| 173 | Y | A | 0.0000 | |
| 174 | G | A | 0.0000 | |
| 175 | Y | A | 0.0000 | |
| 176 | L | A | 0.0000 | |
| 177 | T | A | 0.0000 | |
| 178 | L | A | 0.0000 | |
| 179 | N | A | 0.0000 | |
| 180 | N | A | -1.1836 | |
| 181 | G | A | -1.2161 | |
| 182 | S | A | -1.2715 | |
| 183 | Q | A | -1.2440 | |
| 184 | A | A | -0.5768 | |
| 185 | V | A | -0.1809 | |
| 186 | G | A | -0.2935 | |
| 187 | R | A | -0.3376 | |
| 188 | S | A | -0.2853 | |
| 189 | S | A | 0.0000 | |
| 190 | F | A | 0.0123 | |
| 191 | Y | A | 0.0000 | |
| 192 | C | A | 0.2337 | |
| 193 | L | A | 0.0000 | |
| 194 | E | A | -0.5299 | |
| 195 | Y | A | 0.7242 | |
| 196 | F | A | 0.0000 | |
| 197 | P | A | -0.3810 | |
| 198 | S | A | -0.6097 | |
| 199 | Q | A | -1.0934 | |
| 200 | M | A | -0.1411 | |
| 201 | L | A | 0.0000 | |
| 202 | R | A | -1.4280 | |
| 203 | T | A | -0.7724 | |
| 204 | G | A | -1.0058 | |
| 205 | N | A | -1.3885 | |
| 206 | N | A | -1.2174 | |
| 207 | F | A | 0.0000 | |
| 208 | T | A | -0.4663 | |
| 209 | F | A | -0.2235 | |
| 210 | S | A | -0.7931 | |
| 211 | Y | A | -0.7404 | |
| 212 | T | A | -1.4125 | |
| 213 | F | A | 0.0000 | |
| 214 | E | A | -2.0896 | |
| 215 | D | A | -2.1945 | |
| 216 | V | A | 0.0000 | |
| 217 | P | A | -0.6322 | |
| 218 | F | A | -0.2021 | |
| 219 | H | A | -0.1980 | |
| 220 | S | A | 0.0000 | |
| 221 | S | A | 0.0000 | |
| 222 | Y | A | 0.0000 | |
| 223 | A | A | 0.0000 | |
| 224 | H | A | 0.0000 | |
| 225 | S | A | 0.0000 | |
| 226 | Q | A | 0.0000 | |
| 227 | S | A | 0.0000 | |
| 228 | L | A | 0.0000 | |
| 229 | D | A | 0.0000 | |
| 230 | R | A | 0.0000 | |
| 231 | L | A | 0.2108 | |
| 232 | M | A | 0.0000 | |
| 233 | N | A | 0.0000 | |
| 234 | P | A | 0.0000 | |
| 235 | L | A | 0.6035 | |
| 236 | I | A | 0.1976 | |
| 237 | D | A | -0.4548 | |
| 238 | Q | A | 0.0000 | |
| 239 | Y | A | 0.0000 | |
| 240 | L | A | 0.0000 | |
| 241 | Y | A | 0.0000 | |
| 242 | Y | A | -0.1019 | |
| 243 | L | A | 0.0000 | |
| 244 | S | A | -0.6845 | |
| 245 | R | A | -1.3071 | |
| 246 | T | A | 0.0000 | |
| 247 | N | A | -1.6332 | |
| 248 | T | A | -1.2291 | |
| 249 | P | A | -0.7393 | |
| 250 | S | A | -0.6710 | |
| 251 | G | A | -0.6991 | |
| 252 | T | A | -0.4014 | |
| 253 | T | A | -0.5959 | |
| 254 | T | A | -1.1189 | |
| 255 | Q | A | -1.4278 | |
| 256 | S | A | -1.7481 | |
| 257 | R | A | -1.7514 | |
| 258 | L | A | 0.0000 | |
| 259 | Q | A | -1.1615 | |
| 260 | F | A | 0.0000 | |
| 261 | S | A | 0.0000 | |
| 262 | Q | A | -1.0522 | |
| 263 | A | A | 0.0000 | |
| 264 | G | A | 0.0000 | |
| 265 | A | A | -0.1708 | |
| 266 | S | A | -0.6701 | |
| 267 | D | A | -0.6206 | |
| 268 | I | A | 0.0000 | |
| 269 | R | A | -0.8187 | |
| 270 | D | A | 0.0000 | |
| 271 | Q | A | 0.0000 | |
| 272 | S | A | 0.0000 | |
| 273 | R | A | 0.0000 | |
| 274 | N | A | 0.0000 | |
| 275 | W | A | 0.0000 | |
| 276 | L | A | 0.0000 | |
| 277 | P | A | 0.0000 | |
| 278 | G | A | 0.0000 | |
| 279 | P | A | 0.0000 | |
| 280 | C | A | 0.0000 | |
| 281 | Y | A | 0.0000 | |
| 282 | R | A | 0.0000 | |
| 283 | Q | A | 0.0000 | |
| 284 | Q | A | 0.0000 | |
| 285 | R | A | -0.3966 | |
| 286 | V | A | 0.0000 | |
| 287 | S | A | 0.0000 | |
| 288 | K | A | -1.8175 | |
| 289 | T | A | -0.9565 | |
| 290 | S | A | -1.1403 | |
| 291 | A | A | -1.0956 | |
| 292 | D | A | -1.8282 | |
| 293 | N | A | 0.0000 | |
| 294 | N | A | 0.0000 | |
| 295 | N | A | -2.6764 | |
| 296 | S | A | -1.7673 | |
| 297 | E | A | -1.8401 | |
| 298 | Y | A | 0.0000 | |
| 299 | S | A | -0.5151 | |
| 300 | W | A | -0.1575 | |
| 301 | T | A | -0.2035 | |
| 302 | G | A | 0.0000 | |
| 303 | A | A | 0.0000 | |
| 304 | T | A | 0.0000 | |
| 305 | K | A | 0.0000 | |
| 306 | Y | A | 0.0000 | |
| 307 | H | A | 0.0000 | |
| 308 | L | A | 0.0000 | |
| 309 | N | A | -0.6004 | |
| 310 | G | A | -0.6961 | |
| 311 | R | A | 0.0000 | |
| 312 | D | A | -0.7600 | |
| 313 | S | A | 0.0000 | |
| 314 | L | A | 0.0000 | |
| 315 | V | A | 0.0000 | |
| 316 | N | A | 0.0000 | |
| 317 | P | A | 0.0000 | |
| 318 | G | A | 0.0000 | |
| 319 | P | A | 0.0000 | |
| 320 | A | A | -0.0793 | |
| 321 | M | A | 0.0000 | |
| 322 | A | A | 0.0000 | |
| 323 | S | A | 0.0000 | |
| 324 | H | A | 0.0000 | |
| 325 | K | A | -1.4614 | |
| 326 | D | A | -1.8999 | |
| 327 | D | A | -2.8369 | |
| 328 | E | A | -2.4781 | |
| 329 | E | A | -3.2843 | |
| 330 | K | A | -2.5901 | |
| 331 | F | A | -1.6347 | |
| 332 | F | A | 0.0000 | |
| 333 | P | A | 0.0000 | |
| 334 | Q | A | 0.0000 | |
| 335 | S | A | 0.0000 | |
| 336 | G | A | 0.0000 | |
| 337 | V | A | 0.0000 | |
| 338 | L | A | 0.0000 | |
| 339 | I | A | 0.0000 | |
| 340 | F | A | 0.0000 | |
| 341 | G | A | -1.6638 | |
| 342 | K | A | -2.3278 | |
| 343 | Q | A | -1.7112 | |
| 344 | G | A | -1.6146 | |
| 345 | S | A | -2.2242 | |
| 346 | E | A | -2.6470 | |
| 347 | K | A | -2.1088 | |
| 348 | T | A | -1.5102 | |
| 349 | N | A | -1.5628 | |
| 350 | V | A | 0.0000 | |
| 351 | D | A | -1.4646 | |
| 352 | I | A | -1.2369 | |
| 353 | E | A | -2.2746 | |
| 354 | K | A | -2.2393 | |
| 355 | V | A | 0.0000 | |
| 356 | M | A | 0.0000 | |
| 357 | I | A | -0.2858 | |
| 358 | T | A | 0.0000 | |
| 359 | D | A | -0.9735 | |
| 360 | E | A | 0.0000 | |
| 361 | E | A | -1.0744 | |
| 362 | E | A | -0.5411 | |
| 363 | I | A | 0.0000 | |
| 364 | R | A | 0.0000 | |
| 365 | T | A | 0.0000 | |
| 366 | T | A | 0.0000 | |
| 367 | N | A | 0.0000 | |
| 368 | P | A | 0.0000 | |
| 369 | V | A | 0.0000 | |
| 370 | A | A | 0.0000 | |
| 371 | T | A | 0.0000 | |
| 372 | E | A | -0.6783 | |
| 373 | Q | A | -0.9161 | |
| 374 | Y | A | 0.0000 | |
| 375 | G | A | 0.0000 | |
| 376 | S | A | -0.8797 | |
| 377 | V | A | 0.0000 | |
| 378 | S | A | 0.0000 | |
| 379 | T | A | -0.6294 | |
| 380 | N | A | -0.5773 | |
| 381 | L | A | -0.4821 | |
| 382 | Q | A | 0.0000 | |
| 383 | R | A | -2.5380 | |
| 384 | G | A | -2.4841 | |
| 385 | N | A | -2.6825 | |
| 386 | R | A | -2.5359 | |
| 387 | Q | A | -2.2303 | |
| 388 | A | A | -0.9863 | |
| 389 | A | A | -0.3570 | |
| 390 | T | A | -0.4736 | |
| 391 | A | A | -0.9539 | |
| 392 | D | A | -1.9285 | |
| 393 | V | A | 0.0000 | |
| 394 | N | A | -0.8035 | |
| 395 | T | A | -0.3619 | |
| 396 | Q | A | 0.0000 | |
| 397 | G | A | 0.0000 | |
| 398 | V | A | 0.0000 | |
| 399 | L | A | 0.0000 | |
| 400 | P | A | 0.0000 | |
| 401 | G | A | 0.0000 | |
| 402 | M | A | 0.0000 | |
| 403 | V | A | 0.0000 | |
| 404 | W | A | 0.0000 | |
| 405 | Q | A | 0.0000 | |
| 406 | D | A | -0.4692 | |
| 407 | R | A | 0.0000 | |
| 408 | D | A | 0.0000 | |
| 409 | V | A | 0.0000 | |
| 410 | Y | A | 0.0000 | |
| 411 | L | A | 0.0000 | |
| 412 | Q | A | 0.0000 | |
| 413 | G | A | 0.0000 | |
| 414 | P | A | 0.0000 | |
| 415 | I | A | 0.0000 | |
| 416 | W | A | 0.0000 | |
| 417 | A | A | 0.0000 | |
| 418 | K | A | 0.0000 | |
| 419 | I | A | 0.0000 | |
| 420 | P | A | 0.0000 | |
| 421 | H | A | -0.6052 | |
| 422 | T | A | -0.4945 | |
| 423 | D | A | -0.7579 | |
| 424 | G | A | 0.0000 | |
| 425 | H | A | -0.6077 | |
| 426 | F | A | 0.0000 | |
| 427 | H | A | -0.4538 | |
| 428 | P | A | -0.3878 | |
| 429 | S | A | -0.3079 | |
| 430 | P | A | 0.0000 | |
| 431 | L | A | 0.0000 | |
| 432 | M | A | 0.0000 | |
| 433 | G | A | 0.0000 | |
| 434 | G | A | -0.1787 | |
| 435 | F | A | 0.0000 | |
| 436 | G | A | -0.5372 | |
| 437 | L | A | 0.0000 | |
| 438 | K | A | -1.4374 | |
| 439 | H | A | -1.6409 | |
| 440 | P | A | 0.0000 | |
| 441 | P | A | 0.0000 | |
| 442 | P | A | 0.0000 | |
| 443 | Q | A | 0.0000 | |
| 444 | I | A | 0.0000 | |
| 445 | L | A | 0.0000 | |
| 446 | I | A | 0.0000 | |
| 447 | K | A | 0.0000 | |
| 448 | N | A | 0.0000 | |
| 449 | T | A | 0.1337 | |
| 450 | P | A | -0.0206 | |
| 451 | V | A | 0.2532 | |
| 452 | P | A | 0.0283 | |
| 453 | A | A | -0.3213 | |
| 454 | N | A | -1.3436 | |
| 455 | P | A | -0.6733 | |
| 456 | S | A | -0.2964 | |
| 457 | T | A | 0.0086 | |
| 458 | T | A | 0.6768 | |
| 459 | F | A | 1.7281 | |
| 460 | S | A | 0.4984 | |
| 461 | A | A | 0.1001 | |
| 462 | A | A | -0.3748 | |
| 463 | K | A | -1.3665 | |
| 464 | F | A | -0.1945 | |
| 465 | A | A | -0.2218 | |
| 466 | S | A | -0.3223 | |
| 467 | F | A | 0.2207 | |
| 468 | I | A | 0.5753 | |
| 469 | T | A | 0.1654 | |
| 470 | Q | A | 0.0000 | |
| 471 | Y | A | 0.2516 | |
| 472 | S | A | 0.0000 | |
| 473 | T | A | 0.1040 | |
| 474 | G | A | 0.0000 | |
| 475 | Q | A | -0.3102 | |
| 476 | V | A | 0.0000 | |
| 477 | S | A | -0.7296 | |
| 478 | V | A | 0.0000 | |
| 479 | E | A | -1.4595 | |
| 480 | I | A | 0.0000 | |
| 481 | E | A | -1.1777 | |
| 482 | W | A | 0.0000 | |
| 483 | E | A | -1.5639 | |
| 484 | L | A | 0.0000 | |
| 485 | Q | A | -2.3055 | |
| 486 | K | A | -3.1790 | |
| 487 | E | A | -2.2580 | |
| 488 | N | A | -2.2807 | |
| 489 | S | A | -1.3376 | |
| 490 | K | A | -0.7013 | |
| 491 | R | A | 0.0000 | |
| 492 | W | A | 0.5538 | |
| 493 | N | A | -0.4875 | |
| 494 | P | A | -0.5575 | |
| 495 | E | A | -0.4878 | |
| 496 | I | A | 0.0515 | |
| 497 | Q | A | -0.5153 | |
| 498 | Y | A | -0.5103 | |
| 499 | T | A | -0.4119 | |
| 500 | S | A | -1.0482 | |
| 501 | N | A | -1.4719 | |
| 502 | Y | A | -0.3841 | |
| 503 | N | A | -1.9334 | |
| 504 | K | A | -1.8517 | |
| 505 | S | A | -0.6394 | |
| 506 | V | A | 0.9226 | |
| 507 | N | A | -0.0575 | |
| 508 | V | A | 0.4119 | |
| 509 | D | A | -1.1967 | |
| 510 | F | A | -0.4494 | |
| 511 | T | A | 0.4120 | |
| 512 | V | A | 0.6565 | |
| 513 | D | A | -0.3707 | |
| 514 | T | A | -0.8704 | |
| 515 | N | A | -1.2374 | |
| 516 | G | A | -0.5258 | |
| 517 | V | A | 0.3978 | |
| 518 | Y | A | 0.4520 | |
| 519 | S | A | -0.2870 | |
| 520 | E | A | -0.9233 | |
| 521 | P | A | -1.1044 | |
| 522 | R | A | -1.1794 | |
| 523 | P | A | -0.5870 | |
| 524 | I | A | 0.0000 | |
| 525 | G | A | -0.2274 | |
| 526 | T | A | 0.0000 | |
| 527 | R | A | 0.0000 | |
| 528 | Y | A | 0.0250 | |
| 529 | L | A | 0.0000 | |
| 530 | T | A | 0.0000 | |
| 531 | R | A | -0.8867 | |
| 532 | N | A | -0.4225 | |
| 533 | L | A | 0.0000 | |
| 15 | G | B | -0.8046 | |
| 16 | A | B | -0.8162 | |
| 17 | D | B | -1.1828 | |
| 18 | G | B | -0.5362 | |
| 19 | V | B | 0.8990 | |
| 20 | G | B | -0.5134 | |
| 21 | N | B | -1.4471 | |
| 22 | S | B | -1.2424 | |
| 23 | S | B | -1.1799 | |
| 24 | G | B | -1.2912 | |
| 25 | N | B | -1.3433 | |
| 26 | W | B | -0.5467 | |
| 27 | H | B | -1.2710 | |
| 28 | C | B | -0.7724 | |
| 29 | D | B | -1.7728 | |
| 30 | S | B | -0.8591 | |
| 31 | T | B | -0.2384 | |
| 32 | W | B | -0.3629 | |
| 33 | M | B | -0.1277 | |
| 34 | G | B | -1.3784 | |
| 35 | D | B | -2.6735 | |
| 36 | R | B | -1.7008 | |
| 37 | V | B | 0.0000 | |
| 38 | I | B | -0.3788 | |
| 39 | T | B | 0.0000 | |
| 40 | T | B | -0.9139 | |
| 41 | S | B | 0.0000 | |
| 42 | T | B | 0.0000 | |
| 43 | R | B | 0.0000 | |
| 44 | T | B | 0.4275 | |
| 45 | W | B | 0.0000 | |
| 46 | A | B | 0.7418 | |
| 47 | L | B | 0.0000 | |
| 48 | P | B | 0.1026 | |
| 49 | T | B | -0.2963 | |
| 50 | Y | B | -0.3057 | |
| 51 | N | B | -0.9284 | |
| 52 | N | B | -1.2359 | |
| 53 | H | B | -0.5616 | |
| 54 | L | B | -0.3574 | |
| 55 | Y | B | -0.5356 | |
| 56 | K | B | -1.4861 | |
| 57 | Q | B | -1.4335 | |
| 58 | I | B | -0.6845 | |
| 59 | S | B | -0.8256 | |
| 60 | S | B | 0.0000 | |
| 61 | Q | B | -1.5216 | |
| 62 | S | B | -1.3443 | |
| 63 | G | B | -1.1667 | |
| 64 | A | B | -1.2235 | |
| 65 | S | B | -1.2748 | |
| 66 | N | B | -1.7763 | |
| 67 | D | B | -1.2535 | |
| 68 | N | B | -1.2076 | |
| 69 | H | B | -1.3399 | |
| 70 | Y | B | -0.6245 | |
| 71 | F | B | 0.0000 | |
| 72 | G | B | 0.0000 | |
| 73 | Y | B | -0.4075 | |
| 74 | S | B | 0.0000 | |
| 75 | T | B | 0.0000 | |
| 76 | P | B | 0.0000 | |
| 77 | W | B | 0.0000 | |
| 78 | G | B | 0.0000 | |
| 79 | Y | B | 0.0000 | |
| 80 | F | B | 0.0000 | |
| 81 | D | B | 0.0000 | |
| 82 | F | B | 0.0000 | |
| 83 | N | B | 0.0000 | |
| 84 | R | B | -0.2749 | |
| 85 | F | B | 0.0000 | |
| 86 | H | B | 0.0000 | |
| 87 | C | B | 0.0000 | |
| 88 | H | B | 0.0000 | |
| 89 | F | B | 0.0000 | |
| 90 | S | B | -1.1080 | |
| 91 | P | B | -1.5622 | |
| 92 | R | B | -2.5275 | |
| 93 | D | B | -2.0124 | |
| 94 | W | B | 0.0000 | |
| 95 | Q | B | -2.0728 | |
| 96 | R | B | -2.3134 | |
| 97 | L | B | 0.0000 | |
| 98 | I | B | 0.0000 | |
| 99 | N | B | 0.0000 | |
| 100 | N | B | -2.2240 | |
| 101 | N | B | 0.0000 | |
| 102 | W | B | 0.0000 | |
| 103 | G | B | 0.0000 | |
| 104 | F | B | 0.0000 | |
| 105 | R | B | -0.9407 | |
| 106 | P | B | 0.0000 | |
| 107 | K | B | -1.6804 | |
| 108 | R | B | -1.8377 | |
| 109 | L | B | 0.0000 | |
| 110 | N | B | -1.4894 | |
| 111 | F | B | 0.0000 | |
| 112 | K | B | -1.0581 | |
| 113 | L | B | 0.0000 | |
| 114 | F | B | 0.0000 | |
| 115 | N | B | -1.2124 | |
| 116 | I | B | 0.0000 | |
| 117 | Q | B | -1.0485 | |
| 118 | V | B | 0.0000 | |
| 119 | K | B | -0.3785 | |
| 120 | E | B | 0.0107 | |
| 121 | V | B | 0.2363 | |
| 122 | T | B | -0.5261 | |
| 123 | Q | B | -2.1459 | |
| 124 | N | B | -2.8970 | |
| 125 | D | B | -2.9259 | |
| 126 | G | B | -2.0944 | |
| 127 | T | B | -1.7004 | |
| 128 | T | B | -0.8193 | |
| 129 | T | B | 0.1325 | |
| 130 | I | B | 1.1435 | |
| 131 | A | B | 0.1519 | |
| 132 | N | B | -0.9433 | |
| 133 | N | B | -0.5522 | |
| 134 | L | B | 0.4308 | |
| 135 | T | B | -0.1705 | |
| 136 | S | B | 0.0000 | |
| 137 | T | B | 0.0000 | |
| 138 | V | B | 0.0000 | |
| 139 | Q | B | -0.4920 | |
| 140 | V | B | 0.0000 | |
| 141 | F | B | 0.0000 | |
| 142 | T | B | -0.4419 | |
| 143 | D | B | 0.0000 | |
| 144 | S | B | -1.1289 | |
| 145 | E | B | -2.0003 | |
| 146 | Y | B | -1.0834 | |
| 147 | Q | B | -1.1478 | |
| 148 | L | B | 0.0000 | |
| 149 | P | B | 0.0000 | |
| 150 | Y | B | 0.0000 | |
| 151 | V | B | 0.0000 | |
| 152 | L | B | 0.0000 | |
| 153 | G | B | -0.0795 | |
| 154 | S | B | -0.0610 | |
| 155 | A | B | 0.0000 | |
| 156 | H | B | 0.0000 | |
| 157 | Q | B | -0.5107 | |
| 158 | G | B | -0.0594 | |
| 159 | C | B | -0.0127 | |
| 160 | L | B | 0.0000 | |
| 161 | P | B | 0.0268 | |
| 162 | P | B | -0.2227 | |
| 163 | F | B | 0.3000 | |
| 164 | P | B | -0.0401 | |
| 165 | A | B | -0.3052 | |
| 166 | D | B | -0.6802 | |
| 167 | V | B | 1.2509 | |
| 168 | F | B | 1.1032 | |
| 169 | M | B | 1.4664 | |
| 170 | V | B | 0.0000 | |
| 171 | P | B | 0.0000 | |
| 172 | Q | B | 0.1421 | |
| 173 | Y | B | 0.0000 | |
| 174 | G | B | 0.0000 | |
| 175 | Y | B | 0.0000 | |
| 176 | L | B | 0.0000 | |
| 177 | T | B | 0.0000 | |
| 178 | L | B | 0.0000 | |
| 179 | N | B | 0.0000 | |
| 180 | N | B | -1.3304 | |
| 181 | G | B | -1.3066 | |
| 182 | S | B | -1.3061 | |
| 183 | Q | B | -1.2982 | |
| 184 | A | B | -0.6318 | |
| 185 | V | B | -0.2560 | |
| 186 | G | B | -0.3170 | |
| 187 | R | B | -0.2892 | |
| 188 | S | B | -0.3261 | |
| 189 | S | B | 0.0000 | |
| 190 | F | B | 0.0848 | |
| 191 | Y | B | 0.0000 | |
| 192 | C | B | 0.2932 | |
| 193 | L | B | 0.0000 | |
| 194 | E | B | -0.5111 | |
| 195 | Y | B | 0.7802 | |
| 196 | F | B | 0.0000 | |
| 197 | P | B | -0.3670 | |
| 198 | S | B | -0.5840 | |
| 199 | Q | B | -1.0439 | |
| 200 | M | B | -0.0173 | |
| 201 | L | B | 0.0000 | |
| 202 | R | B | -1.4953 | |
| 203 | T | B | -0.8637 | |
| 204 | G | B | -1.0056 | |
| 205 | N | B | -1.3489 | |
| 206 | N | B | -1.2475 | |
| 207 | F | B | 0.0000 | |
| 208 | T | B | -0.5307 | |
| 209 | F | B | -0.2900 | |
| 210 | S | B | -0.7696 | |
| 211 | Y | B | -0.6424 | |
| 212 | T | B | -1.2481 | |
| 213 | F | B | 0.0000 | |
| 214 | E | B | -2.0987 | |
| 215 | D | B | -2.2052 | |
| 216 | V | B | 0.0000 | |
| 217 | P | B | -0.6550 | |
| 218 | F | B | -0.2920 | |
| 219 | H | B | -0.2435 | |
| 220 | S | B | 0.0000 | |
| 221 | S | B | 0.0000 | |
| 222 | Y | B | 0.0000 | |
| 223 | A | B | 0.0000 | |
| 224 | H | B | 0.0000 | |
| 225 | S | B | 0.0000 | |
| 226 | Q | B | 0.0000 | |
| 227 | S | B | 0.0000 | |
| 228 | L | B | 0.0000 | |
| 229 | D | B | 0.0000 | |
| 230 | R | B | 0.0000 | |
| 231 | L | B | 0.2129 | |
| 232 | M | B | 0.0000 | |
| 233 | N | B | 0.0000 | |
| 234 | P | B | 0.0000 | |
| 235 | L | B | 0.5484 | |
| 236 | I | B | 0.1346 | |
| 237 | D | B | -0.6181 | |
| 238 | Q | B | 0.0000 | |
| 239 | Y | B | 0.0000 | |
| 240 | L | B | 0.0000 | |
| 241 | Y | B | 0.0000 | |
| 242 | Y | B | 0.0000 | |
| 243 | L | B | 0.0000 | |
| 244 | S | B | -0.6814 | |
| 245 | R | B | -1.3179 | |
| 246 | T | B | 0.0000 | |
| 247 | N | B | -1.6657 | |
| 248 | T | B | -1.2168 | |
| 249 | P | B | -0.7267 | |
| 250 | S | B | -0.6501 | |
| 251 | G | B | -0.6905 | |
| 252 | T | B | -0.4010 | |
| 253 | T | B | -0.5798 | |
| 254 | T | B | -1.1050 | |
| 255 | Q | B | -1.3715 | |
| 256 | S | B | -1.7423 | |
| 257 | R | B | -1.7929 | |
| 258 | L | B | 0.0000 | |
| 259 | Q | B | -1.1172 | |
| 260 | F | B | 0.0000 | |
| 261 | S | B | 0.0000 | |
| 262 | Q | B | -1.0476 | |
| 263 | A | B | 0.0000 | |
| 264 | G | B | 0.0000 | |
| 265 | A | B | -0.2092 | |
| 266 | S | B | -0.6872 | |
| 267 | D | B | -0.6167 | |
| 268 | I | B | 0.0000 | |
| 269 | R | B | -0.7998 | |
| 270 | D | B | 0.0000 | |
| 271 | Q | B | 0.0000 | |
| 272 | S | B | 0.0000 | |
| 273 | R | B | 0.0000 | |
| 274 | N | B | 0.0000 | |
| 275 | W | B | 0.0000 | |
| 276 | L | B | 0.0000 | |
| 277 | P | B | 0.0000 | |
| 278 | G | B | 0.0000 | |
| 279 | P | B | 0.0000 | |
| 280 | C | B | 0.0000 | |
| 281 | Y | B | 0.0000 | |
| 282 | R | B | 0.0000 | |
| 283 | Q | B | 0.0000 | |
| 284 | Q | B | 0.0000 | |
| 285 | R | B | -0.3251 | |
| 286 | V | B | 0.0000 | |
| 287 | S | B | 0.0000 | |
| 288 | K | B | -1.8772 | |
| 289 | T | B | -1.0118 | |
| 290 | S | B | -1.2158 | |
| 291 | A | B | -1.0444 | |
| 292 | D | B | -1.6092 | |
| 293 | N | B | 0.0000 | |
| 294 | N | B | -2.5401 | |
| 295 | N | B | -2.5217 | |
| 296 | S | B | -1.7015 | |
| 297 | E | B | -1.7833 | |
| 298 | Y | B | 0.0000 | |
| 299 | S | B | -0.4751 | |
| 300 | W | B | -0.1216 | |
| 301 | T | B | -0.1820 | |
| 302 | G | B | 0.0000 | |
| 303 | A | B | 0.0000 | |
| 304 | T | B | 0.0000 | |
| 305 | K | B | 0.0000 | |
| 306 | Y | B | 0.0000 | |
| 307 | H | B | 0.0000 | |
| 308 | L | B | 0.0000 | |
| 309 | N | B | -0.5402 | |
| 310 | G | B | -0.6529 | |
| 311 | R | B | 0.0000 | |
| 312 | D | B | -0.7735 | |
| 313 | S | B | 0.0000 | |
| 314 | L | B | 0.0000 | |
| 315 | V | B | 0.0000 | |
| 316 | N | B | 0.0000 | |
| 317 | P | B | 0.0000 | |
| 318 | G | B | 0.0000 | |
| 319 | P | B | 0.0000 | |
| 320 | A | B | -0.0796 | |
| 321 | M | B | 0.0000 | |
| 322 | A | B | 0.0000 | |
| 323 | S | B | 0.0000 | |
| 324 | H | B | 0.0000 | |
| 325 | K | B | -1.5404 | |
| 326 | D | B | -1.9275 | |
| 327 | D | B | -2.9154 | |
| 328 | E | B | -2.6987 | |
| 329 | E | B | -3.4316 | |
| 330 | K | B | -2.6199 | |
| 331 | F | B | 0.0000 | |
| 332 | F | B | 0.0000 | |
| 333 | P | B | 0.0000 | |
| 334 | Q | B | 0.0000 | |
| 335 | S | B | 0.0000 | |
| 336 | G | B | 0.0000 | |
| 337 | V | B | 0.0000 | |
| 338 | L | B | 0.0000 | |
| 339 | I | B | 0.0000 | |
| 340 | F | B | 0.0000 | |
| 341 | G | B | -1.8049 | |
| 342 | K | B | -2.5338 | |
| 343 | Q | B | -2.1160 | |
| 344 | G | B | -1.8625 | |
| 345 | S | B | -2.4889 | |
| 346 | E | B | -3.0040 | |
| 347 | K | B | -2.2681 | |
| 348 | T | B | -1.5812 | |
| 349 | N | B | -1.5735 | |
| 350 | V | B | 0.0000 | |
| 351 | D | B | -1.5000 | |
| 352 | I | B | -1.2391 | |
| 353 | E | B | -2.2530 | |
| 354 | K | B | -2.3664 | |
| 355 | V | B | 0.0000 | |
| 356 | M | B | 0.0000 | |
| 357 | I | B | -0.3420 | |
| 358 | T | B | 0.0000 | |
| 359 | D | B | -1.2731 | |
| 360 | E | B | 0.0000 | |
| 361 | E | B | -1.3650 | |
| 362 | E | B | -0.7842 | |
| 363 | I | B | 0.0000 | |
| 364 | R | B | 0.0000 | |
| 365 | T | B | 0.0000 | |
| 366 | T | B | 0.0000 | |
| 367 | N | B | 0.0000 | |
| 368 | P | B | 0.0000 | |
| 369 | V | B | 0.0000 | |
| 370 | A | B | 0.0000 | |
| 371 | T | B | 0.0000 | |
| 372 | E | B | -0.7091 | |
| 373 | Q | B | -0.9560 | |
| 374 | Y | B | 0.0000 | |
| 375 | G | B | 0.0000 | |
| 376 | S | B | -0.8629 | |
| 377 | V | B | 0.0000 | |
| 378 | S | B | 0.0000 | |
| 379 | T | B | -0.6303 | |
| 380 | N | B | -0.6029 | |
| 381 | L | B | -0.5077 | |
| 382 | Q | B | 0.0000 | |
| 383 | R | B | -2.5289 | |
| 384 | G | B | -2.4772 | |
| 385 | N | B | -2.6823 | |
| 386 | R | B | -2.5676 | |
| 387 | Q | B | -2.5049 | |
| 388 | A | B | -1.1263 | |
| 389 | A | B | -0.4208 | |
| 390 | T | B | -0.4637 | |
| 391 | A | B | -0.9362 | |
| 392 | D | B | -1.8992 | |
| 393 | V | B | 0.0000 | |
| 394 | N | B | -0.8374 | |
| 395 | T | B | -0.3739 | |
| 396 | Q | B | 0.0000 | |
| 397 | G | B | 0.0000 | |
| 398 | V | B | 0.0000 | |
| 399 | L | B | 0.0000 | |
| 400 | P | B | 0.0000 | |
| 401 | G | B | 0.0000 | |
| 402 | M | B | 0.0000 | |
| 403 | V | B | 0.0000 | |
| 404 | W | B | 0.0000 | |
| 405 | Q | B | 0.0000 | |
| 406 | D | B | -0.4711 | |
| 407 | R | B | 0.0000 | |
| 408 | D | B | 0.0000 | |
| 409 | V | B | 0.0000 | |
| 410 | Y | B | 0.0000 | |
| 411 | L | B | 0.0000 | |
| 412 | Q | B | 0.0000 | |
| 413 | G | B | 0.0000 | |
| 414 | P | B | 0.0000 | |
| 415 | I | B | 0.0000 | |
| 416 | W | B | 0.0000 | |
| 417 | A | B | 0.0000 | |
| 418 | K | B | 0.0000 | |
| 419 | I | B | 0.0000 | |
| 420 | P | B | 0.0000 | |
| 421 | H | B | -0.7860 | |
| 422 | T | B | -0.5352 | |
| 423 | D | B | -0.7479 | |
| 424 | G | B | 0.0000 | |
| 425 | H | B | -0.5208 | |
| 426 | F | B | 0.0000 | |
| 427 | H | B | -0.4283 | |
| 428 | P | B | -0.3873 | |
| 429 | S | B | -0.3058 | |
| 430 | P | B | 0.0000 | |
| 431 | L | B | 0.0000 | |
| 432 | M | B | 0.0000 | |
| 433 | G | B | 0.0000 | |
| 434 | G | B | -0.1826 | |
| 435 | F | B | 0.0000 | |
| 436 | G | B | -0.5969 | |
| 437 | L | B | 0.0000 | |
| 438 | K | B | -1.7395 | |
| 439 | H | B | -1.8350 | |
| 440 | P | B | 0.0000 | |
| 441 | P | B | 0.0000 | |
| 442 | P | B | 0.0000 | |
| 443 | Q | B | 0.0000 | |
| 444 | I | B | 0.0000 | |
| 445 | L | B | 0.0000 | |
| 446 | I | B | 0.0000 | |
| 447 | K | B | 0.0000 | |
| 448 | N | B | 0.0000 | |
| 449 | T | B | 0.1508 | |
| 450 | P | B | 0.0898 | |
| 451 | V | B | 0.3734 | |
| 452 | P | B | 0.1033 | |
| 453 | A | B | -0.2632 | |
| 454 | N | B | -1.3349 | |
| 455 | P | B | -0.6404 | |
| 456 | S | B | -0.2973 | |
| 457 | T | B | 0.0086 | |
| 458 | T | B | 0.6773 | |
| 459 | F | B | 1.7271 | |
| 460 | S | B | 0.5223 | |
| 461 | A | B | 0.1269 | |
| 462 | A | B | -0.3255 | |
| 463 | K | B | -1.2704 | |
| 464 | F | B | 0.0358 | |
| 465 | A | B | -0.1381 | |
| 466 | S | B | -0.2402 | |
| 467 | F | B | 0.3228 | |
| 468 | I | B | 0.6296 | |
| 469 | T | B | 0.2050 | |
| 470 | Q | B | 0.0000 | |
| 471 | Y | B | 0.2624 | |
| 472 | S | B | 0.0000 | |
| 473 | T | B | 0.1103 | |
| 474 | G | B | 0.0000 | |
| 475 | Q | B | -0.2904 | |
| 476 | V | B | 0.0000 | |
| 477 | S | B | -0.7296 | |
| 478 | V | B | 0.0000 | |
| 479 | E | B | -1.3948 | |
| 480 | I | B | 0.0000 | |
| 481 | E | B | -1.0580 | |
| 482 | W | B | 0.0000 | |
| 483 | E | B | -1.6195 | |
| 484 | L | B | 0.0000 | |
| 485 | Q | B | -2.4548 | |
| 486 | K | B | -3.3466 | |
| 487 | E | B | -2.4688 | |
| 488 | N | B | -2.3789 | |
| 489 | S | B | -1.4291 | |
| 490 | K | B | -0.9365 | |
| 491 | R | B | 0.0000 | |
| 492 | W | B | 0.5225 | |
| 493 | N | B | -0.5080 | |
| 494 | P | B | -0.6161 | |
| 495 | E | B | -0.6417 | |
| 496 | I | B | -0.1207 | |
| 497 | Q | B | -0.6401 | |
| 498 | Y | B | -0.5293 | |
| 499 | T | B | -0.4218 | |
| 500 | S | B | -1.0800 | |
| 501 | N | B | -1.4742 | |
| 502 | Y | B | -0.3843 | |
| 503 | N | B | -1.9317 | |
| 504 | K | B | -1.7862 | |
| 505 | S | B | -0.4924 | |
| 506 | V | B | 1.1455 | |
| 507 | N | B | 0.3302 | |
| 508 | V | B | 0.5309 | |
| 509 | D | B | -1.2671 | |
| 510 | F | B | 0.0000 | |
| 511 | T | B | 0.1877 | |
| 512 | V | B | 0.3901 | |
| 513 | D | B | -0.4145 | |
| 514 | T | B | -0.8609 | |
| 515 | N | B | -1.2819 | |
| 516 | G | B | -0.7303 | |
| 517 | V | B | 0.0659 | |
| 518 | Y | B | -0.1296 | |
| 519 | S | B | -0.6293 | |
| 520 | E | B | -1.1731 | |
| 521 | P | B | -1.2533 | |
| 522 | R | B | -1.2449 | |
| 523 | P | B | -0.6211 | |
| 524 | I | B | 0.0000 | |
| 525 | G | B | -0.2574 | |
| 526 | T | B | 0.0000 | |
| 527 | R | B | 0.0000 | |
| 528 | Y | B | -0.1202 | |
| 529 | L | B | 0.0000 | |
| 530 | T | B | 0.0000 | |
| 531 | R | B | -0.9267 | |
| 532 | N | B | -0.4129 | |
| 533 | L | B | 0.0000 | |
| 15 | G | C | -0.8600 | |
| 16 | A | C | -0.9185 | |
| 17 | D | C | -1.3776 | |
| 18 | G | C | -0.6254 | |
| 19 | V | C | 0.8486 | |
| 20 | G | C | -0.5402 | |
| 21 | N | C | -1.4903 | |
| 22 | S | C | -1.2751 | |
| 23 | S | C | -1.2437 | |
| 24 | G | C | -1.3083 | |
| 25 | N | C | -1.3232 | |
| 26 | W | C | -0.5082 | |
| 27 | H | C | -1.2615 | |
| 28 | C | C | -0.7803 | |
| 29 | D | C | -1.7766 | |
| 30 | S | C | -0.8687 | |
| 31 | T | C | -0.2602 | |
| 32 | W | C | -0.4041 | |
| 33 | M | C | -0.1921 | |
| 34 | G | C | -1.3198 | |
| 35 | D | C | -2.5081 | |
| 36 | R | C | -1.6659 | |
| 37 | V | C | 0.0000 | |
| 38 | I | C | -0.4982 | |
| 39 | T | C | 0.0000 | |
| 40 | T | C | 0.0000 | |
| 41 | S | C | 0.0000 | |
| 42 | T | C | 0.0000 | |
| 43 | R | C | 0.0000 | |
| 44 | T | C | 0.3865 | |
| 45 | W | C | 0.0000 | |
| 46 | A | C | 0.7468 | |
| 47 | L | C | 0.0000 | |
| 48 | P | C | 0.1054 | |
| 49 | T | C | -0.2897 | |
| 50 | Y | C | -0.2937 | |
| 51 | N | C | -0.9061 | |
| 52 | N | C | -1.2153 | |
| 53 | H | C | -0.5183 | |
| 54 | L | C | -0.2922 | |
| 55 | Y | C | -0.5053 | |
| 56 | K | C | -1.4624 | |
| 57 | Q | C | -1.4325 | |
| 58 | I | C | -0.6989 | |
| 59 | S | C | -0.8388 | |
| 60 | S | C | 0.0000 | |
| 61 | Q | C | -1.5228 | |
| 62 | S | C | -1.3443 | |
| 63 | G | C | -1.1657 | |
| 64 | A | C | -1.2215 | |
| 65 | S | C | -1.2699 | |
| 66 | N | C | -1.7652 | |
| 67 | D | C | -1.2303 | |
| 68 | N | C | -1.2002 | |
| 69 | H | C | -1.3333 | |
| 70 | Y | C | -0.6216 | |
| 71 | F | C | 0.0000 | |
| 72 | G | C | 0.0000 | |
| 73 | Y | C | -0.4395 | |
| 74 | S | C | 0.0000 | |
| 75 | T | C | 0.0000 | |
| 76 | P | C | 0.0000 | |
| 77 | W | C | 0.0000 | |
| 78 | G | C | 0.0000 | |
| 79 | Y | C | 0.0000 | |
| 80 | F | C | 0.0000 | |
| 81 | D | C | 0.0000 | |
| 82 | F | C | 0.0000 | |
| 83 | N | C | 0.0000 | |
| 84 | R | C | -0.2563 | |
| 85 | F | C | 0.0000 | |
| 86 | H | C | 0.0000 | |
| 87 | C | C | 0.0000 | |
| 88 | H | C | 0.0000 | |
| 89 | F | C | 0.0000 | |
| 90 | S | C | -1.0848 | |
| 91 | P | C | -1.5399 | |
| 92 | R | C | -2.5099 | |
| 93 | D | C | -1.9727 | |
| 94 | W | C | 0.0000 | |
| 95 | Q | C | -2.1157 | |
| 96 | R | C | -2.3380 | |
| 97 | L | C | 0.0000 | |
| 98 | I | C | 0.0000 | |
| 99 | N | C | 0.0000 | |
| 100 | N | C | -1.9097 | |
| 101 | N | C | 0.0000 | |
| 102 | W | C | 0.0000 | |
| 103 | G | C | 0.0000 | |
| 104 | F | C | 0.0000 | |
| 105 | R | C | -1.0049 | |
| 106 | P | C | 0.0000 | |
| 107 | K | C | -1.9757 | |
| 108 | R | C | -2.2135 | |
| 109 | L | C | 0.0000 | |
| 110 | N | C | -1.5602 | |
| 111 | F | C | 0.0000 | |
| 112 | K | C | -1.0418 | |
| 113 | L | C | 0.0000 | |
| 114 | F | C | 0.0000 | |
| 115 | N | C | -1.2301 | |
| 116 | I | C | 0.0000 | |
| 117 | Q | C | -1.0252 | |
| 118 | V | C | 0.0000 | |
| 119 | K | C | -0.3861 | |
| 120 | E | C | -0.0034 | |
| 121 | V | C | 0.1967 | |
| 122 | T | C | -0.5490 | |
| 123 | Q | C | -2.1530 | |
| 124 | N | C | -2.8976 | |
| 125 | D | C | -2.9243 | |
| 126 | G | C | -2.0957 | |
| 127 | T | C | -1.6997 | |
| 128 | T | C | -0.8272 | |
| 129 | T | C | 0.1222 | |
| 130 | I | C | 1.1266 | |
| 131 | A | C | 0.1409 | |
| 132 | N | C | -0.9500 | |
| 133 | N | C | -0.5614 | |
| 134 | L | C | 0.3875 | |
| 135 | T | C | -0.1875 | |
| 136 | S | C | 0.0000 | |
| 137 | T | C | 0.0000 | |
| 138 | V | C | 0.0000 | |
| 139 | Q | C | -0.4639 | |
| 140 | V | C | 0.0000 | |
| 141 | F | C | 0.0000 | |
| 142 | T | C | -0.4016 | |
| 143 | D | C | 0.0000 | |
| 144 | S | C | -1.0949 | |
| 145 | E | C | -2.0490 | |
| 146 | Y | C | -1.0581 | |
| 147 | Q | C | -1.1439 | |
| 148 | L | C | 0.0000 | |
| 149 | P | C | 0.0000 | |
| 150 | Y | C | 0.0000 | |
| 151 | V | C | 0.0000 | |
| 152 | L | C | 0.0000 | |
| 153 | G | C | -0.0785 | |
| 154 | S | C | -0.0649 | |
| 155 | A | C | 0.0000 | |
| 156 | H | C | 0.0000 | |
| 157 | Q | C | -0.4194 | |
| 158 | G | C | -0.0134 | |
| 159 | C | C | 0.0305 | |
| 160 | L | C | 0.0000 | |
| 161 | P | C | 0.0749 | |
| 162 | P | C | -0.2097 | |
| 163 | F | C | 0.3369 | |
| 164 | P | C | -0.0198 | |
| 165 | A | C | -0.2468 | |
| 166 | D | C | -0.5487 | |
| 167 | V | C | 1.3132 | |
| 168 | F | C | 1.1378 | |
| 169 | M | C | 1.4675 | |
| 170 | V | C | 0.0000 | |
| 171 | P | C | 0.0000 | |
| 172 | Q | C | 0.1423 | |
| 173 | Y | C | 0.0000 | |
| 174 | G | C | 0.0000 | |
| 175 | Y | C | 0.0000 | |
| 176 | L | C | 0.0000 | |
| 177 | T | C | 0.0000 | |
| 178 | L | C | 0.0000 | |
| 179 | N | C | 0.0000 | |
| 180 | N | C | -1.2633 | |
| 181 | G | C | -1.2803 | |
| 182 | S | C | -1.2962 | |
| 183 | Q | C | -1.2786 | |
| 184 | A | C | -0.6133 | |
| 185 | V | C | -0.2267 | |
| 186 | G | C | -0.3584 | |
| 187 | R | C | -0.4413 | |
| 188 | S | C | -0.3048 | |
| 189 | S | C | 0.0000 | |
| 190 | F | C | 0.0711 | |
| 191 | Y | C | 0.0000 | |
| 192 | C | C | 0.3129 | |
| 193 | L | C | 0.0000 | |
| 194 | E | C | -0.4487 | |
| 195 | Y | C | 0.8561 | |
| 196 | F | C | 0.1998 | |
| 197 | P | C | -0.2723 | |
| 198 | S | C | -0.5264 | |
| 199 | Q | C | -1.0395 | |
| 200 | M | C | -0.0040 | |
| 201 | L | C | 0.0000 | |
| 202 | R | C | -1.4976 | |
| 203 | T | C | -0.8954 | |
| 204 | G | C | -1.0811 | |
| 205 | N | C | -1.4087 | |
| 206 | N | C | -1.3192 | |
| 207 | F | C | 0.0000 | |
| 208 | T | C | -0.5273 | |
| 209 | F | C | -0.2752 | |
| 210 | S | C | -0.8220 | |
| 211 | Y | C | -0.7479 | |
| 212 | T | C | -1.4222 | |
| 213 | F | C | 0.0000 | |
| 214 | E | C | -2.2200 | |
| 215 | D | C | -2.2532 | |
| 216 | V | C | 0.0000 | |
| 217 | P | C | -0.6641 | |
| 218 | F | C | -0.2731 | |
| 219 | H | C | -0.2287 | |
| 220 | S | C | 0.0000 | |
| 221 | S | C | 0.0000 | |
| 222 | Y | C | 0.0000 | |
| 223 | A | C | 0.0000 | |
| 224 | H | C | 0.0000 | |
| 225 | S | C | 0.0000 | |
| 226 | Q | C | 0.0000 | |
| 227 | S | C | 0.0000 | |
| 228 | L | C | 0.0000 | |
| 229 | D | C | 0.0000 | |
| 230 | R | C | 0.0000 | |
| 231 | L | C | 0.2070 | |
| 232 | M | C | 0.0000 | |
| 233 | N | C | 0.0000 | |
| 234 | P | C | 0.0000 | |
| 235 | L | C | 0.6079 | |
| 236 | I | C | 0.2081 | |
| 237 | D | C | -0.4286 | |
| 238 | Q | C | 0.0000 | |
| 239 | Y | C | 0.0000 | |
| 240 | L | C | 0.0000 | |
| 241 | Y | C | 0.0000 | |
| 242 | Y | C | -0.1158 | |
| 243 | L | C | 0.0000 | |
| 244 | S | C | -0.7222 | |
| 245 | R | C | -1.2816 | |
| 246 | T | C | 0.0000 | |
| 247 | N | C | 0.0000 | |
| 248 | T | C | -1.1418 | |
| 249 | P | C | -0.7108 | |
| 250 | S | C | -0.7225 | |
| 251 | G | C | -0.7271 | |
| 252 | T | C | -0.4032 | |
| 253 | T | C | -0.6481 | |
| 254 | T | C | -1.1523 | |
| 255 | Q | C | -1.4617 | |
| 256 | S | C | -1.5759 | |
| 257 | R | C | -1.2963 | |
| 258 | L | C | 0.0000 | |
| 259 | Q | C | -1.0996 | |
| 260 | F | C | 0.0000 | |
| 261 | S | C | 0.0000 | |
| 262 | Q | C | -1.0000 | |
| 263 | A | C | 0.0000 | |
| 264 | G | C | 0.0000 | |
| 265 | A | C | -0.1641 | |
| 266 | S | C | -0.6624 | |
| 267 | D | C | -0.6123 | |
| 268 | I | C | 0.0000 | |
| 269 | R | C | -0.7980 | |
| 270 | D | C | 0.0000 | |
| 271 | Q | C | 0.0000 | |
| 272 | S | C | 0.0000 | |
| 273 | R | C | 0.0000 | |
| 274 | N | C | 0.0000 | |
| 275 | W | C | 0.0000 | |
| 276 | L | C | 0.0000 | |
| 277 | P | C | 0.0000 | |
| 278 | G | C | 0.0000 | |
| 279 | P | C | 0.0000 | |
| 280 | C | C | 0.0000 | |
| 281 | Y | C | 0.0000 | |
| 282 | R | C | 0.0000 | |
| 283 | Q | C | 0.0000 | |
| 284 | Q | C | 0.0000 | |
| 285 | R | C | -0.3302 | |
| 286 | V | C | 0.0000 | |
| 287 | S | C | 0.0000 | |
| 288 | K | C | -1.8300 | |
| 289 | T | C | -0.9676 | |
| 290 | S | C | -1.1845 | |
| 291 | A | C | -0.9980 | |
| 292 | D | C | -1.5117 | |
| 293 | N | C | 0.0000 | |
| 294 | N | C | -2.5945 | |
| 295 | N | C | -2.5588 | |
| 296 | S | C | -1.8320 | |
| 297 | E | C | -1.9436 | |
| 298 | Y | C | 0.0000 | |
| 299 | S | C | 0.0000 | |
| 300 | W | C | -0.1188 | |
| 301 | T | C | -0.1900 | |
| 302 | G | C | 0.0000 | |
| 303 | A | C | 0.0000 | |
| 304 | T | C | 0.0000 | |
| 305 | K | C | 0.0000 | |
| 306 | Y | C | 0.0000 | |
| 307 | H | C | 0.0000 | |
| 308 | L | C | 0.0000 | |
| 309 | N | C | 0.0000 | |
| 310 | G | C | -0.6011 | |
| 311 | R | C | 0.0000 | |
| 312 | D | C | -0.7249 | |
| 313 | S | C | 0.0000 | |
| 314 | L | C | 0.0000 | |
| 315 | V | C | 0.0000 | |
| 316 | N | C | 0.0000 | |
| 317 | P | C | 0.0000 | |
| 318 | G | C | 0.0000 | |
| 319 | P | C | 0.0000 | |
| 320 | A | C | -0.1010 | |
| 321 | M | C | 0.0000 | |
| 322 | A | C | 0.0000 | |
| 323 | S | C | 0.0000 | |
| 324 | H | C | 0.0000 | |
| 325 | K | C | -1.6079 | |
| 326 | D | C | -1.9414 | |
| 327 | D | C | -2.9224 | |
| 328 | E | C | -2.7100 | |
| 329 | E | C | -3.3679 | |
| 330 | K | C | -2.5527 | |
| 331 | F | C | 0.0000 | |
| 332 | F | C | 0.0000 | |
| 333 | P | C | 0.0000 | |
| 334 | Q | C | 0.0000 | |
| 335 | S | C | 0.0000 | |
| 336 | G | C | 0.0000 | |
| 337 | V | C | 0.0000 | |
| 338 | L | C | 0.0000 | |
| 339 | I | C | 0.0000 | |
| 340 | F | C | 0.0000 | |
| 341 | G | C | -1.7984 | |
| 342 | K | C | -2.5691 | |
| 343 | Q | C | -2.0725 | |
| 344 | G | C | -1.7729 | |
| 345 | S | C | -2.3169 | |
| 346 | E | C | -2.6256 | |
| 347 | K | C | -2.0966 | |
| 348 | T | C | -1.4073 | |
| 349 | N | C | -1.3300 | |
| 350 | V | C | 0.0000 | |
| 351 | D | C | -1.4324 | |
| 352 | I | C | -1.2141 | |
| 353 | E | C | -2.2391 | |
| 354 | K | C | -2.2588 | |
| 355 | V | C | 0.0000 | |
| 356 | M | C | 0.0000 | |
| 357 | I | C | -0.3592 | |
| 358 | T | C | 0.0000 | |
| 359 | D | C | -1.0421 | |
| 360 | E | C | 0.0000 | |
| 361 | E | C | -1.0935 | |
| 362 | E | C | -0.5998 | |
| 363 | I | C | 0.0000 | |
| 364 | R | C | -0.5248 | |
| 365 | T | C | 0.0000 | |
| 366 | T | C | 0.0000 | |
| 367 | N | C | 0.0000 | |
| 368 | P | C | 0.0000 | |
| 369 | V | C | 0.0000 | |
| 370 | A | C | 0.0000 | |
| 371 | T | C | 0.0000 | |
| 372 | E | C | -0.7270 | |
| 373 | Q | C | -0.9478 | |
| 374 | Y | C | 0.0000 | |
| 375 | G | C | 0.0000 | |
| 376 | S | C | -0.8766 | |
| 377 | V | C | 0.0000 | |
| 378 | S | C | 0.0000 | |
| 379 | T | C | -0.6320 | |
| 380 | N | C | -0.7379 | |
| 381 | L | C | -0.7743 | |
| 382 | Q | C | 0.0000 | |
| 383 | R | C | -3.3430 | |
| 384 | G | C | -2.9080 | |
| 385 | N | C | -3.0825 | |
| 386 | R | C | -3.2044 | |
| 387 | Q | C | -2.8369 | |
| 388 | A | C | -1.3231 | |
| 389 | A | C | -0.4852 | |
| 390 | T | C | -0.4700 | |
| 391 | A | C | -0.9518 | |
| 392 | D | C | -1.9401 | |
| 393 | V | C | 0.0000 | |
| 394 | N | C | -0.8456 | |
| 395 | T | C | -0.3773 | |
| 396 | Q | C | 0.0000 | |
| 397 | G | C | 0.0000 | |
| 398 | V | C | 0.0000 | |
| 399 | L | C | 0.0000 | |
| 400 | P | C | 0.0000 | |
| 401 | G | C | 0.0000 | |
| 402 | M | C | 0.0000 | |
| 403 | V | C | 0.0000 | |
| 404 | W | C | 0.0000 | |
| 405 | Q | C | 0.0000 | |
| 406 | D | C | -0.4743 | |
| 407 | R | C | 0.0000 | |
| 408 | D | C | 0.0000 | |
| 409 | V | C | 0.0000 | |
| 410 | Y | C | 0.0000 | |
| 411 | L | C | 0.0000 | |
| 412 | Q | C | 0.0000 | |
| 413 | G | C | 0.0000 | |
| 414 | P | C | 0.0000 | |
| 415 | I | C | 0.0000 | |
| 416 | W | C | 0.0000 | |
| 417 | A | C | 0.0000 | |
| 418 | K | C | 0.0000 | |
| 419 | I | C | 0.0000 | |
| 420 | P | C | 0.0000 | |
| 421 | H | C | -0.7006 | |
| 422 | T | C | -0.4938 | |
| 423 | D | C | -0.7368 | |
| 424 | G | C | 0.0000 | |
| 425 | H | C | -0.5093 | |
| 426 | F | C | 0.0000 | |
| 427 | H | C | -0.4417 | |
| 428 | P | C | -0.3813 | |
| 429 | S | C | -0.3057 | |
| 430 | P | C | 0.0000 | |
| 431 | L | C | 0.0000 | |
| 432 | M | C | 0.0000 | |
| 433 | G | C | 0.0000 | |
| 434 | G | C | -0.1856 | |
| 435 | F | C | 0.0000 | |
| 436 | G | C | -0.6012 | |
| 437 | L | C | 0.0000 | |
| 438 | K | C | -1.7406 | |
| 439 | H | C | -1.8858 | |
| 440 | P | C | 0.0000 | |
| 441 | P | C | 0.0000 | |
| 442 | P | C | 0.0000 | |
| 443 | Q | C | 0.0000 | |
| 444 | I | C | 0.0000 | |
| 445 | L | C | 0.0000 | |
| 446 | I | C | 0.0000 | |
| 447 | K | C | 0.0000 | |
| 448 | N | C | 0.0000 | |
| 449 | T | C | 0.1851 | |
| 450 | P | C | 0.0490 | |
| 451 | V | C | 0.4871 | |
| 452 | P | C | 0.1721 | |
| 453 | A | C | -0.2368 | |
| 454 | N | C | -1.3207 | |
| 455 | P | C | -0.6244 | |
| 456 | S | C | -0.2967 | |
| 457 | T | C | 0.0091 | |
| 458 | T | C | 0.6754 | |
| 459 | F | C | 1.7281 | |
| 460 | S | C | 0.5290 | |
| 461 | A | C | 0.1316 | |
| 462 | A | C | -0.3162 | |
| 463 | K | C | -1.2531 | |
| 464 | F | C | 0.0937 | |
| 465 | A | C | -0.1085 | |
| 466 | S | C | -0.2133 | |
| 467 | F | C | 0.3565 | |
| 468 | I | C | 0.6144 | |
| 469 | T | C | 0.1927 | |
| 470 | Q | C | 0.0000 | |
| 471 | Y | C | 0.2532 | |
| 472 | S | C | 0.0000 | |
| 473 | T | C | 0.1201 | |
| 474 | G | C | 0.0000 | |
| 475 | Q | C | -0.2782 | |
| 476 | V | C | 0.0000 | |
| 477 | S | C | -0.7217 | |
| 478 | V | C | 0.0000 | |
| 479 | E | C | -1.4826 | |
| 480 | I | C | 0.0000 | |
| 481 | E | C | -1.2278 | |
| 482 | W | C | 0.0000 | |
| 483 | E | C | -1.6284 | |
| 484 | L | C | 0.0000 | |
| 485 | Q | C | -1.9538 | |
| 486 | K | C | -2.5876 | |
| 487 | E | C | -2.2206 | |
| 488 | N | C | -2.2960 | |
| 489 | S | C | -1.4735 | |
| 490 | K | C | -0.9844 | |
| 491 | R | C | -0.4573 | |
| 492 | W | C | 0.4536 | |
| 493 | N | C | -0.5565 | |
| 494 | P | C | -0.5806 | |
| 495 | E | C | -0.5153 | |
| 496 | I | C | 0.0657 | |
| 497 | Q | C | -0.5285 | |
| 498 | Y | C | -0.5093 | |
| 499 | T | C | -0.4094 | |
| 500 | S | C | -1.0633 | |
| 501 | N | C | -1.4711 | |
| 502 | Y | C | -0.3872 | |
| 503 | N | C | -1.9335 | |
| 504 | K | C | -1.7913 | |
| 505 | S | C | -0.4995 | |
| 506 | V | C | 1.1316 | |
| 507 | N | C | 0.3255 | |
| 508 | V | C | 0.5609 | |
| 509 | D | C | -1.2503 | |
| 510 | F | C | -0.6846 | |
| 511 | T | C | 0.2676 | |
| 512 | V | C | 0.4170 | |
| 513 | D | C | -0.4097 | |
| 514 | T | C | -0.8697 | |
| 515 | N | C | -1.2830 | |
| 516 | G | C | -0.7153 | |
| 517 | V | C | 0.0924 | |
| 518 | Y | C | -0.0548 | |
| 519 | S | C | -0.6332 | |
| 520 | E | C | -1.2677 | |
| 521 | P | C | -1.4280 | |
| 522 | R | C | -1.6547 | |
| 523 | P | C | -0.8146 | |
| 524 | I | C | 0.0000 | |
| 525 | G | C | -0.2853 | |
| 526 | T | C | 0.0000 | |
| 527 | R | C | 0.0000 | |
| 528 | Y | C | -0.0119 | |
| 529 | L | C | 0.0000 | |
| 530 | T | C | 0.0000 | |
| 531 | R | C | -0.8509 | |
| 532 | N | C | -0.3629 | |
| 533 | L | C | 0.0000 |
Calculations for various pH values
This page contains details and comparisons for all models calculated at different pH points.
pH |
Average A3D Score |
Max A3D Score |
|||
| 4.0 | -0.2715 | 4.0385 | View | CSV | PDB |
| 4.5 | -0.3056 | 4.0385 | View | CSV | PDB |
| 5.0 | -0.3457 | 4.0385 | View | CSV | PDB |
| 5.5 | -0.3856 | 4.0385 | View | CSV | PDB |
| 6.0 | -0.4194 | 4.0385 | View | CSV | PDB |
| 6.5 | -0.4427 | 4.0385 | View | CSV | PDB |
| 7.0 | -0.4556 | 4.0385 | View | CSV | PDB |
| 7.5 | -0.4619 | 4.0385 | View | CSV | PDB |
| 8.0 | -0.4641 | 4.0385 | View | CSV | PDB |
| 8.5 | -0.4623 | 4.0385 | View | CSV | PDB |
| 9.0 | -0.455 | 4.0385 | 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