| Chain sequence(s) |
A: QVQLVQSGAEVKKPGASVKVSCKASGLTIEDYYMHWVRQAPGQGLEWMGWIDPENGDTEYGPKFQGRVTMTRDTSINTAYMELSRLRSDDTAVYYCAVHNAHYGTWFAYWGQGTLVTVSSASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKKVEPKSCEAAAKEAAAKDKDCEMKRTTLDSPLGKLELSGCEQGLHEIIFLGKGTSAADAVEVPAPAAVLGGPEPLMQATAWLNAYFHQPEAIEEFPVPALHHPVFQQESFTRQVLWKLLKVVKFGEVISYSHLAALAGNPAATAAVKTALSGNPVPILIPCHRVVQGDLDVGGYEGGLAVKEWLLAHEGHRLGKPGLG
B: DVVMTQSPLSLPVTLGQPASISCRSSQSLLHSSGNTYLEWYQQRPGQSPRPLIYKISTRFSGVPDRFSGSGSGTDFTLKISRVEAEDVGVYYCFQGSHVPYTFGGGTKVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGEC input PDB |
| Selected Chain(s) | A,B |
| Distance of aggregation | 10 Å |
| FoldX usage | Yes |
| Dynamic mode | No |
| Automated mutations | No |
| Downloads | Download all the data |
| Simulation log |
[INFO] Logger: Verbosity set to: 2 - [INFO] (00:00:01)
[WARNING] runJob: Working directory already exists (possibly overwriting previous results -ow
to prevent this behavior) (00:00:01)
[INFO] runJob: Starting aggrescan3d job on: input.pdb with all chain(s) selected (00:00:01)
[INFO] runJob: Creating pdb object from: input.pdb (00:00:01)
[INFO] FoldX: Starting FoldX energy minimalization (00:00:01)
[INFO] Analysis: Starting Aggrescan3D on folded.pdb (00:12:00)
[INFO] Main: Simulation completed successfully. (00:12:07)
|
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 | |
| 1 | Q | A | -1.5471 | |
| 2 | V | A | -1.0505 | |
| 3 | Q | A | -1.3241 | |
| 4 | L | A | 0.0000 | |
| 5 | V | A | 0.5648 | |
| 6 | Q | A | 0.0000 | |
| 7 | S | A | -0.4384 | |
| 8 | G | A | -0.4910 | |
| 9 | A | A | -0.1759 | |
| 10 | E | A | -0.5236 | |
| 11 | V | A | -0.0153 | |
| 12 | K | A | -1.3001 | |
| 13 | K | A | -2.4496 | |
| 14 | P | A | -2.3827 | |
| 15 | G | A | -2.0203 | |
| 16 | A | A | -1.5275 | |
| 17 | S | A | -1.6675 | |
| 18 | V | A | 0.0000 | |
| 19 | K | A | -1.8259 | |
| 20 | V | A | 0.0000 | |
| 21 | S | A | -0.5207 | |
| 22 | C | A | 0.0000 | |
| 23 | K | A | -0.5954 | |
| 24 | A | A | 0.0000 | |
| 25 | S | A | -0.7739 | |
| 26 | G | A | -1.0610 | |
| 27 | L | A | -0.8244 | |
| 28 | T | A | -0.8572 | |
| 29 | I | A | 0.0000 | |
| 30 | E | A | -2.6329 | |
| 31 | D | A | -2.3034 | |
| 32 | Y | A | -1.1039 | |
| 33 | Y | A | -0.5250 | |
| 34 | M | A | 0.0000 | |
| 35 | H | A | 0.0000 | |
| 36 | W | A | 0.0000 | |
| 37 | V | A | 0.0000 | |
| 38 | R | A | 0.0000 | |
| 39 | Q | A | -0.5588 | |
| 40 | A | A | -0.9610 | |
| 41 | P | A | -0.9713 | |
| 42 | G | A | -1.2120 | |
| 43 | Q | A | -1.7341 | |
| 44 | G | A | -1.0860 | |
| 45 | L | A | 0.0000 | |
| 46 | E | A | -0.6489 | |
| 47 | W | A | 0.0000 | |
| 48 | M | A | 0.0000 | |
| 49 | G | A | 0.0000 | |
| 50 | W | A | 0.0000 | |
| 51 | I | A | 0.0000 | |
| 52 | D | A | -2.1777 | |
| 53 | P | A | 0.0000 | |
| 54 | E | A | -3.5175 | |
| 55 | N | A | -3.0506 | |
| 56 | G | A | -2.5469 | |
| 57 | D | A | -2.7214 | |
| 58 | T | A | -1.3391 | |
| 59 | E | A | -0.9192 | |
| 60 | Y | A | -0.7009 | |
| 61 | G | A | 0.0000 | |
| 62 | P | A | -1.6817 | |
| 63 | K | A | -2.2468 | |
| 64 | F | A | 0.0000 | |
| 65 | Q | A | -2.1240 | |
| 66 | G | A | -1.6501 | |
| 67 | R | A | -1.7021 | |
| 68 | V | A | 0.0000 | |
| 69 | T | A | -0.7389 | |
| 70 | M | A | 0.0000 | |
| 71 | T | A | -0.9959 | |
| 72 | R | A | -1.5584 | |
| 73 | D | A | -1.0257 | |
| 74 | T | A | -0.8959 | |
| 75 | S | A | 0.0418 | |
| 76 | I | A | 0.6432 | |
| 77 | N | A | -0.3854 | |
| 78 | T | A | 0.0000 | |
| 79 | A | A | 0.0000 | |
| 80 | Y | A | -0.7315 | |
| 81 | M | A | 0.0000 | |
| 82 | E | A | -1.1951 | |
| 83 | L | A | 0.0000 | |
| 84 | S | A | -1.7756 | |
| 85 | R | A | -2.7321 | |
| 86 | L | A | 0.0000 | |
| 87 | R | A | -3.3838 | |
| 88 | S | A | -2.3282 | |
| 89 | D | A | -2.5196 | |
| 90 | D | A | 0.0000 | |
| 91 | T | A | -0.8449 | |
| 92 | A | A | 0.0000 | |
| 93 | V | A | 0.3343 | |
| 94 | Y | A | 0.0000 | |
| 95 | Y | A | 0.0000 | |
| 96 | C | A | 0.0000 | |
| 97 | A | A | 0.0000 | |
| 98 | V | A | 0.0000 | |
| 99 | H | A | 0.0000 | |
| 100 | N | A | 0.0000 | |
| 101 | A | A | -0.1303 | |
| 102 | H | A | -0.5189 | |
| 103 | Y | A | 0.8508 | |
| 104 | G | A | 0.2013 | |
| 105 | T | A | 0.0000 | |
| 106 | W | A | 0.0000 | |
| 107 | F | A | 0.0000 | |
| 108 | A | A | 0.1125 | |
| 109 | Y | A | 0.0215 | |
| 110 | W | A | -0.1139 | |
| 111 | G | A | 0.0000 | |
| 112 | Q | A | -1.1349 | |
| 113 | G | A | -0.4320 | |
| 114 | T | A | 0.0000 | |
| 115 | L | A | 0.2401 | |
| 116 | V | A | 0.0000 | |
| 117 | T | A | 0.0000 | |
| 118 | V | A | 0.0000 | |
| 119 | S | A | -1.2772 | |
| 120 | S | A | -0.9199 | |
| 121 | A | A | -0.5909 | |
| 122 | S | A | -0.6596 | |
| 123 | T | A | -0.5483 | |
| 124 | K | A | -1.1619 | |
| 125 | G | A | -1.3597 | |
| 126 | P | A | 0.0000 | |
| 127 | S | A | -0.3893 | |
| 128 | V | A | 0.0000 | |
| 129 | F | A | 0.0000 | |
| 130 | P | A | -1.1095 | |
| 131 | L | A | 0.0000 | |
| 132 | A | A | -1.2232 | |
| 133 | P | A | 0.0000 | |
| 134 | S | A | -0.9192 | |
| 135 | S | A | -0.7103 | |
| 136 | K | A | -0.8880 | |
| 137 | S | A | 0.0000 | |
| 138 | T | A | -0.6573 | |
| 139 | S | A | -0.7038 | |
| 140 | G | A | -0.8088 | |
| 141 | G | A | -0.8733 | |
| 142 | T | A | -0.6120 | |
| 143 | A | A | 0.0000 | |
| 144 | A | A | 0.0000 | |
| 145 | L | A | 0.0000 | |
| 146 | G | A | 0.0000 | |
| 147 | C | A | 0.0000 | |
| 148 | L | A | 0.0000 | |
| 149 | V | A | 0.0000 | |
| 150 | K | A | 0.0000 | |
| 151 | D | A | -0.3641 | |
| 152 | Y | A | 0.0000 | |
| 153 | F | A | 0.0000 | |
| 154 | P | A | 0.0000 | |
| 155 | E | A | -0.4310 | |
| 156 | P | A | -0.7426 | |
| 157 | V | A | -0.7713 | |
| 158 | T | A | -0.6748 | |
| 159 | V | A | -0.2280 | |
| 160 | S | A | -0.4185 | |
| 161 | W | A | 0.0000 | |
| 162 | N | A | -0.7541 | |
| 163 | S | A | -0.6567 | |
| 164 | G | A | -0.4858 | |
| 165 | A | A | -0.2225 | |
| 166 | L | A | 0.0207 | |
| 167 | T | A | -0.1556 | |
| 168 | S | A | -0.1643 | |
| 169 | G | A | -0.1921 | |
| 170 | V | A | 0.1898 | |
| 171 | H | A | -0.3141 | |
| 172 | T | A | 0.0322 | |
| 173 | F | A | 0.0000 | |
| 174 | P | A | -0.3063 | |
| 175 | A | A | 0.2323 | |
| 176 | V | A | 0.5534 | |
| 177 | L | A | 1.2650 | |
| 178 | Q | A | 0.3449 | |
| 179 | S | A | -0.0222 | |
| 180 | S | A | -0.1610 | |
| 181 | G | A | 0.0705 | |
| 182 | L | A | 0.1399 | |
| 183 | Y | A | 0.4321 | |
| 184 | S | A | 0.0000 | |
| 185 | L | A | 0.0000 | |
| 186 | S | A | 0.0000 | |
| 187 | S | A | 0.0000 | |
| 188 | V | A | 0.0000 | |
| 189 | V | A | 0.0000 | |
| 190 | T | A | -0.1141 | |
| 191 | V | A | 0.0000 | |
| 192 | P | A | -0.6081 | |
| 193 | S | A | -0.5723 | |
| 194 | S | A | -0.5744 | |
| 195 | S | A | -0.5456 | |
| 196 | L | A | -0.7526 | |
| 197 | G | A | -0.9265 | |
| 198 | T | A | -0.6556 | |
| 199 | Q | A | -1.1056 | |
| 200 | T | A | -1.0837 | |
| 201 | Y | A | 0.0000 | |
| 202 | I | A | -1.3135 | |
| 203 | C | A | 0.0000 | |
| 204 | N | A | -1.5252 | |
| 205 | V | A | 0.0000 | |
| 206 | N | A | -2.2189 | |
| 207 | H | A | 0.0000 | |
| 208 | K | A | -2.8009 | |
| 209 | P | A | -1.5999 | |
| 210 | S | A | -1.8554 | |
| 211 | N | A | -2.6098 | |
| 212 | T | A | -2.1331 | |
| 213 | K | A | -2.8148 | |
| 214 | V | A | -1.6647 | |
| 215 | D | A | -2.5528 | |
| 216 | K | A | -2.1274 | |
| 217 | K | A | -2.5338 | |
| 218 | V | A | 0.0000 | |
| 219 | E | A | -2.8405 | |
| 220 | P | A | -1.7967 | |
| 221 | K | A | -2.2326 | |
| 222 | S | A | -1.5594 | |
| 223 | C | A | -0.9773 | |
| 224 | E | A | -2.4007 | |
| 225 | A | A | -2.3231 | |
| 226 | A | A | -1.9269 | |
| 227 | A | A | -2.1732 | |
| 228 | K | A | -3.2400 | |
| 229 | E | A | -3.3071 | |
| 230 | A | A | 0.0000 | |
| 231 | A | A | -2.6735 | |
| 232 | A | A | -2.8485 | |
| 233 | K | A | -3.6611 | |
| 234 | D | A | -3.3664 | |
| 235 | K | A | -3.5464 | |
| 236 | D | A | -3.7143 | |
| 237 | C | A | 0.0000 | |
| 238 | E | A | -3.1502 | |
| 239 | M | A | -2.2733 | |
| 240 | K | A | -2.5377 | |
| 241 | R | A | -2.4769 | |
| 242 | T | A | -1.1988 | |
| 243 | T | A | -0.8059 | |
| 244 | L | A | 0.0000 | |
| 245 | D | A | -1.7969 | |
| 246 | S | A | 0.0000 | |
| 247 | P | A | -0.6882 | |
| 248 | L | A | 0.0000 | |
| 249 | G | A | -1.1116 | |
| 250 | K | A | -1.5405 | |
| 251 | L | A | 0.0000 | |
| 252 | E | A | -0.6207 | |
| 253 | L | A | 0.0000 | |
| 254 | S | A | -1.2100 | |
| 255 | G | A | 0.0000 | |
| 256 | C | A | 0.0000 | |
| 257 | E | A | -3.3386 | |
| 258 | Q | A | -2.7366 | |
| 259 | G | A | 0.0000 | |
| 260 | L | A | 0.0000 | |
| 261 | H | A | -0.8396 | |
| 262 | E | A | -0.7279 | |
| 263 | I | A | 0.0000 | |
| 264 | I | A | 0.7622 | |
| 265 | F | A | 0.3381 | |
| 266 | L | A | 0.3558 | |
| 267 | G | A | -0.8976 | |
| 268 | K | A | -1.9553 | |
| 269 | G | A | -1.4100 | |
| 270 | T | A | -1.3271 | |
| 271 | S | A | -0.9846 | |
| 272 | A | A | -0.4892 | |
| 273 | A | A | -0.5272 | |
| 274 | D | A | -1.5444 | |
| 275 | A | A | -0.4042 | |
| 276 | V | A | 0.2704 | |
| 277 | E | A | -1.2829 | |
| 278 | V | A | -0.6178 | |
| 279 | P | A | -0.6317 | |
| 280 | A | A | -0.6709 | |
| 281 | P | A | -0.2469 | |
| 282 | A | A | 0.3861 | |
| 283 | A | A | 0.7181 | |
| 284 | V | A | 1.1274 | |
| 285 | L | A | 1.3652 | |
| 286 | G | A | -0.0345 | |
| 287 | G | A | -1.4001 | |
| 288 | P | A | 0.0000 | |
| 289 | E | A | -2.4730 | |
| 290 | P | A | 0.0000 | |
| 291 | L | A | 0.0000 | |
| 292 | M | A | -0.2420 | |
| 293 | Q | A | -0.2743 | |
| 294 | A | A | 0.0000 | |
| 295 | T | A | 0.0000 | |
| 296 | A | A | 0.2386 | |
| 297 | W | A | 0.0000 | |
| 298 | L | A | 0.0000 | |
| 299 | N | A | -0.5648 | |
| 300 | A | A | 0.0000 | |
| 301 | Y | A | 0.0000 | |
| 302 | F | A | 0.0000 | |
| 303 | H | A | -1.2534 | |
| 304 | Q | A | -1.8122 | |
| 305 | P | A | -1.9312 | |
| 306 | E | A | -2.6859 | |
| 307 | A | A | -2.2602 | |
| 308 | I | A | 0.0000 | |
| 309 | E | A | -2.8149 | |
| 310 | E | A | -2.6178 | |
| 311 | F | A | -0.8767 | |
| 312 | P | A | -0.3461 | |
| 313 | V | A | 0.6322 | |
| 314 | P | A | 0.0000 | |
| 315 | A | A | -0.4391 | |
| 316 | L | A | -0.0848 | |
| 317 | H | A | 0.0000 | |
| 318 | H | A | -0.6065 | |
| 319 | P | A | -1.1128 | |
| 320 | V | A | -0.3100 | |
| 321 | F | A | 0.0000 | |
| 322 | Q | A | -1.1350 | |
| 323 | Q | A | -1.1033 | |
| 324 | E | A | -1.0660 | |
| 325 | S | A | 0.0000 | |
| 326 | F | A | 0.0000 | |
| 327 | T | A | -0.5876 | |
| 328 | R | A | -0.7476 | |
| 329 | Q | A | -0.5267 | |
| 330 | V | A | 0.0000 | |
| 331 | L | A | 0.0000 | |
| 332 | W | A | -0.2108 | |
| 333 | K | A | -0.6014 | |
| 334 | L | A | 0.0000 | |
| 335 | L | A | -0.4418 | |
| 336 | K | A | -1.4971 | |
| 337 | V | A | -0.5135 | |
| 338 | V | A | 0.0000 | |
| 339 | K | A | -1.4843 | |
| 340 | F | A | -0.8641 | |
| 341 | G | A | -1.1079 | |
| 342 | E | A | -1.3188 | |
| 343 | V | A | -0.5745 | |
| 344 | I | A | 0.0000 | |
| 345 | S | A | -0.9837 | |
| 346 | Y | A | -0.8386 | |
| 347 | S | A | -0.9977 | |
| 348 | H | A | -1.1311 | |
| 349 | L | A | 0.0000 | |
| 350 | A | A | 0.0000 | |
| 351 | A | A | -0.5266 | |
| 352 | L | A | -0.1454 | |
| 353 | A | A | 0.0000 | |
| 354 | G | A | -0.5938 | |
| 355 | N | A | -0.7818 | |
| 356 | P | A | -0.6916 | |
| 357 | A | A | -0.3643 | |
| 358 | A | A | -0.4413 | |
| 359 | T | A | -0.7610 | |
| 360 | A | A | -0.4604 | |
| 361 | A | A | -0.5264 | |
| 362 | V | A | 0.0000 | |
| 363 | K | A | -1.6363 | |
| 364 | T | A | -0.9492 | |
| 365 | A | A | 0.0000 | |
| 366 | L | A | 0.0000 | |
| 367 | S | A | -1.4697 | |
| 368 | G | A | -1.0560 | |
| 369 | N | A | -0.7708 | |
| 370 | P | A | -0.3013 | |
| 371 | V | A | 0.0000 | |
| 372 | P | A | -0.3060 | |
| 373 | I | A | 0.0000 | |
| 374 | L | A | 0.0000 | |
| 375 | I | A | 0.0000 | |
| 376 | P | A | 0.0000 | |
| 377 | C | A | 0.0000 | |
| 378 | H | A | 0.0000 | |
| 379 | R | A | 0.0000 | |
| 380 | V | A | 0.0000 | |
| 381 | V | A | 0.0000 | |
| 382 | Q | A | -1.7108 | |
| 383 | G | A | -1.2882 | |
| 384 | D | A | -1.6865 | |
| 385 | L | A | -0.1309 | |
| 386 | D | A | -0.9922 | |
| 387 | V | A | -0.6447 | |
| 388 | G | A | -0.6964 | |
| 389 | G | A | -1.1909 | |
| 390 | Y | A | -1.1910 | |
| 391 | E | A | -2.0678 | |
| 392 | G | A | -1.2898 | |
| 393 | G | A | -1.0181 | |
| 394 | L | A | -0.0434 | |
| 395 | A | A | -0.0921 | |
| 396 | V | A | 0.0000 | |
| 397 | K | A | 0.0000 | |
| 398 | E | A | -1.1396 | |
| 399 | W | A | -0.4930 | |
| 400 | L | A | 0.0000 | |
| 401 | L | A | 0.0000 | |
| 402 | A | A | -1.2902 | |
| 403 | H | A | -0.6185 | |
| 404 | E | A | 0.0000 | |
| 405 | G | A | -1.3178 | |
| 406 | H | A | -1.7034 | |
| 407 | R | A | -2.5865 | |
| 408 | L | A | -1.5480 | |
| 409 | G | A | -1.7119 | |
| 410 | K | A | -1.9408 | |
| 411 | P | A | -1.0820 | |
| 412 | G | A | -0.3702 | |
| 413 | L | A | 0.8123 | |
| 414 | G | A | 0.1212 | |
| 1 | D | B | -1.3526 | |
| 2 | V | B | 0.0000 | |
| 3 | V | B | 0.6940 | |
| 4 | M | B | 0.0000 | |
| 5 | T | B | -0.4163 | |
| 6 | Q | B | 0.0000 | |
| 7 | S | B | -0.1896 | |
| 8 | P | B | 0.3803 | |
| 9 | L | B | 1.1957 | |
| 10 | S | B | 0.3588 | |
| 11 | L | B | -0.0042 | |
| 12 | P | B | -0.8136 | |
| 13 | V | B | 0.0000 | |
| 14 | T | B | -1.0414 | |
| 15 | L | B | -0.5699 | |
| 16 | G | B | -1.1691 | |
| 17 | Q | B | -1.4722 | |
| 18 | P | B | -1.7353 | |
| 19 | A | B | 0.0000 | |
| 20 | S | B | -0.8340 | |
| 21 | I | B | 0.0000 | |
| 22 | S | B | -0.9905 | |
| 23 | C | B | 0.0000 | |
| 24 | R | B | -2.3504 | |
| 25 | S | B | 0.0000 | |
| 26 | S | B | -0.9723 | |
| 27 | Q | B | -1.4812 | |
| 28 | S | B | -0.7677 | |
| 29 | L | B | 0.0000 | |
| 30 | L | B | 0.7812 | |
| 31 | H | B | -0.1244 | |
| 32 | S | B | -0.3713 | |
| 33 | S | B | -0.5380 | |
| 34 | G | B | -0.5644 | |
| 35 | N | B | -0.5334 | |
| 36 | T | B | 0.0000 | |
| 37 | Y | B | 0.0341 | |
| 38 | L | B | 0.0000 | |
| 39 | E | B | 0.0000 | |
| 40 | W | B | 0.0000 | |
| 41 | Y | B | 0.0000 | |
| 42 | Q | B | 0.0000 | |
| 43 | Q | B | 0.0000 | |
| 44 | R | B | -1.3340 | |
| 45 | P | B | -1.2346 | |
| 46 | G | B | -1.4782 | |
| 47 | Q | B | -1.7899 | |
| 48 | S | B | -1.2031 | |
| 49 | P | B | 0.0000 | |
| 50 | R | B | -1.0428 | |
| 51 | P | B | 0.0000 | |
| 52 | L | B | 0.0000 | |
| 53 | I | B | 0.0000 | |
| 54 | Y | B | -0.1386 | |
| 55 | K | B | -0.6127 | |
| 56 | I | B | -0.5195 | |
| 57 | S | B | -0.6232 | |
| 58 | T | B | -0.7480 | |
| 59 | R | B | -1.6169 | |
| 60 | F | B | 0.0000 | |
| 61 | S | B | -0.7265 | |
| 62 | G | B | -0.9933 | |
| 63 | V | B | 0.0000 | |
| 64 | P | B | -1.3667 | |
| 65 | D | B | -2.4197 | |
| 66 | R | B | -2.1369 | |
| 67 | F | B | 0.0000 | |
| 68 | S | B | -1.4264 | |
| 69 | G | B | 0.0000 | |
| 70 | S | B | -0.8777 | |
| 71 | G | B | -1.0506 | |
| 72 | S | B | -0.7509 | |
| 73 | G | B | -0.6357 | |
| 74 | T | B | -1.4690 | |
| 75 | D | B | -2.1975 | |
| 76 | F | B | 0.0000 | |
| 77 | T | B | -1.1518 | |
| 78 | L | B | 0.0000 | |
| 79 | K | B | -1.9737 | |
| 80 | I | B | 0.0000 | |
| 81 | S | B | -2.2560 | |
| 82 | R | B | -2.9049 | |
| 83 | V | B | 0.0000 | |
| 84 | E | B | -2.2756 | |
| 85 | A | B | -1.4239 | |
| 86 | E | B | -1.9383 | |
| 87 | D | B | 0.0000 | |
| 88 | V | B | -0.8767 | |
| 89 | G | B | 0.0000 | |
| 90 | V | B | 0.1742 | |
| 91 | Y | B | 0.0000 | |
| 92 | Y | B | 0.0000 | |
| 93 | C | B | 0.0000 | |
| 94 | F | B | 0.0000 | |
| 95 | Q | B | 0.0000 | |
| 96 | G | B | 0.0000 | |
| 97 | S | B | 0.0000 | |
| 98 | H | B | -0.1556 | |
| 99 | V | B | 0.4611 | |
| 100 | P | B | -0.2299 | |
| 101 | Y | B | 0.2598 | |
| 102 | T | B | 0.0710 | |
| 103 | F | B | 0.0000 | |
| 104 | G | B | 0.0000 | |
| 105 | G | B | -0.3428 | |
| 106 | G | B | -0.1858 | |
| 107 | T | B | 0.0000 | |
| 108 | K | B | -0.1311 | |
| 109 | V | B | 0.0000 | |
| 110 | E | B | -0.7968 | |
| 111 | I | B | 0.0000 | |
| 112 | K | B | -1.6627 | |
| 113 | R | B | -1.1056 | |
| 114 | T | B | -0.1704 | |
| 115 | V | B | 0.3672 | |
| 116 | A | B | 0.0152 | |
| 117 | A | B | -0.1105 | |
| 118 | P | B | 0.0000 | |
| 119 | S | B | -0.2203 | |
| 120 | V | B | 0.0000 | |
| 121 | F | B | 0.0000 | |
| 122 | I | B | 0.0000 | |
| 123 | F | B | 0.0000 | |
| 124 | P | B | -0.5252 | |
| 125 | P | B | 0.0000 | |
| 126 | S | B | -1.7805 | |
| 127 | D | B | -2.9225 | |
| 128 | E | B | -2.9321 | |
| 129 | Q | B | 0.0000 | |
| 130 | L | B | -2.2521 | |
| 131 | K | B | -2.8459 | |
| 132 | S | B | -1.7586 | |
| 133 | G | B | -1.2323 | |
| 134 | T | B | -1.0074 | |
| 135 | A | B | 0.0000 | |
| 136 | S | B | 0.0000 | |
| 137 | V | B | 0.0000 | |
| 138 | V | B | 0.0000 | |
| 139 | C | B | 0.0000 | |
| 140 | L | B | 0.0000 | |
| 141 | L | B | 0.0000 | |
| 142 | N | B | 0.0000 | |
| 143 | N | B | -0.8780 | |
| 144 | F | B | 0.0000 | |
| 145 | Y | B | 0.0000 | |
| 146 | P | B | -1.5703 | |
| 147 | R | B | -2.4860 | |
| 148 | E | B | -2.9557 | |
| 149 | A | B | -2.1842 | |
| 150 | K | B | -2.3120 | |
| 151 | V | B | -0.9328 | |
| 152 | Q | B | -0.4319 | |
| 153 | W | B | 0.0000 | |
| 154 | K | B | -0.5282 | |
| 155 | V | B | 0.0000 | |
| 156 | D | B | -1.6985 | |
| 157 | N | B | -1.4568 | |
| 158 | A | B | -0.3072 | |
| 159 | L | B | 0.7307 | |
| 160 | Q | B | -0.2560 | |
| 161 | S | B | -0.6166 | |
| 162 | G | B | -1.2415 | |
| 163 | N | B | -1.5266 | |
| 164 | S | B | -1.3621 | |
| 165 | Q | B | -1.3288 | |
| 166 | E | B | -1.5488 | |
| 167 | S | B | -0.8531 | |
| 168 | V | B | -0.7323 | |
| 169 | T | B | -1.1712 | |
| 170 | E | B | -2.2613 | |
| 171 | Q | B | -1.8954 | |
| 172 | D | B | -2.0195 | |
| 173 | S | B | -1.9134 | |
| 174 | K | B | -2.2097 | |
| 175 | D | B | -1.6612 | |
| 176 | S | B | -1.7967 | |
| 177 | T | B | 0.0000 | |
| 178 | Y | B | 0.0000 | |
| 179 | S | B | 0.0000 | |
| 180 | L | B | 0.0000 | |
| 181 | S | B | 0.0000 | |
| 182 | S | B | 0.0000 | |
| 183 | T | B | -0.6697 | |
| 184 | L | B | 0.0000 | |
| 185 | T | B | -0.6303 | |
| 186 | L | B | -0.8122 | |
| 187 | S | B | -1.0380 | |
| 188 | K | B | -1.9975 | |
| 189 | A | B | -1.8805 | |
| 190 | D | B | -2.6201 | |
| 191 | Y | B | 0.0000 | |
| 192 | E | B | -3.0474 | |
| 193 | K | B | -3.2978 | |
| 194 | H | B | -2.3064 | |
| 195 | K | B | -1.5824 | |
| 196 | V | B | -0.8668 | |
| 197 | Y | B | 0.0000 | |
| 198 | A | B | 0.0000 | |
| 199 | C | B | 0.0000 | |
| 200 | E | B | -0.3773 | |
| 201 | V | B | 0.0000 | |
| 202 | T | B | -1.1190 | |
| 203 | H | B | 0.0000 | |
| 204 | Q | B | -1.6883 | |
| 205 | G | B | -0.4135 | |
| 206 | L | B | -0.1999 | |
| 207 | S | B | -0.4330 | |
| 208 | S | B | -0.3750 | |
| 209 | P | B | -0.4648 | |
| 210 | V | B | 0.3228 | |
| 211 | T | B | -0.1255 | |
| 212 | K | B | -0.4437 | |
| 213 | S | B | -0.4891 | |
| 214 | F | B | 0.0000 | |
| 215 | N | B | 0.0000 | |
| 216 | R | B | -1.0569 | |
| 217 | G | B | -0.9285 | |
| 218 | E | B | -0.5761 | |
| 219 | C | B | -0.2468 |
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