| Chain sequence(s) |
A: ADLASQCMLGVPSYDRPLVQGDTNDLPVTINADHAKGDYPDDAVFTGSVDIMQGNSRLQADEVQLHQKEAPGQPVRTVDALGNVHHYDDNQVILKGPKGWANLNTKDTNVWEGDYQMVGRQGRGKADLMKQRGENRYTILDNNGSFTSCLPGSDTWSVVGSEIIHDREEQVAEIWNARFKVGPVPIFYSPYLQLPVGDKRRSGFLIPNAKYYTTTNYFFEFYYLPYYWNIAPNMDATITPHYMHRRGNIMWENEFRYLSQAGAGLMELDYLPSDKVYEDEHPNDDSSRRWLFYWNHSGVMDQVWRFNVDYTKVSDPSYFNDFDNKYGSSTDGYATQKFSVGYAVQNNFNATVSTKQFQVFSEQNTSSYSAEPQLDVNYYQNDVGPFDTRIYGQAVHFVNTRDDMPEATRVHLEPTINLPLSNNWGSINTEAKFLATHYQQTNLDWYNSRNTTKLDESVNRVMPQFKVDGKMVFERDMEMLAPGYTQTLEPRAQYLYVPYRDQSDIYNYDSSLLQSDYSGLFRDRTYGGLDRIASANQVTTGVTSRIYDDAAVERFNISVGQIYYFTESRTGDDNITWENDDKTGSLVWAGDTYWRISERWGLRGGIQQYDTRLDNVATSNSSIEYRRDEDRLVQLNYHYASPEYIQATLPKYYSTAEQYKNGISQVGAVASRPIADRWSIVGAYYYDTNANKQADSMLGVQYSSCCYAIRVGYERKLNGWDNDKQHAVYDNAIGFFNIELRGLSSNYGLGTQEMLRSNILPYQNTL
B: GWHLRDTTQVPSTMKVMILDSGDPNGPLSRAVRNQLRLNGVELLDKETTRKDVPSLRLGKVSIAKDTASVFRNGQTAEYQMIMTVNATVLIPGRDIYPISAKVFRSFFDNPQMALAKDNEQDMIVKEMYDRAAEQLIRKLPSIRAADIRS input PDB |
| Selected Chain(s) | A,B |
| Distance of aggregation | 10 Å |
| FoldX usage | No |
| Dynamic mode | No |
| Automated mutations | No |
| Downloads | Download all the data |
| Simulation log |
[INFO] Logger: Verbosity set to: 2 - [INFO] (00:00:00)
[WARNING] runJob: Working directory already exists (possibly overwriting previous results -ow
to prevent this behavior) (00:00:00)
[INFO] runJob: Starting aggrescan3d job on: input.pdb with all chain(s) selected (00:00:00)
[INFO] runJob: Creating pdb object from: input.pdb (00:00:00)
[INFO] runJob: FoldX not utilized. Treating input pdb file as it was already optimized. (00:00:01)
[INFO] Analysis: Starting Aggrescan3D on folded.pdb (00:00:02)
[INFO] Main: Simulation completed successfully. (00:00:16)
|
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 | |
| 25 | A | A | -1.0980 | |
| 26 | D | A | -2.2039 | |
| 27 | L | A | 0.0000 | |
| 28 | A | A | -0.4971 | |
| 29 | S | A | -0.1426 | |
| 30 | Q | A | -0.2360 | |
| 31 | C | A | 0.0000 | |
| 32 | M | A | 0.9449 | |
| 33 | L | A | 1.6546 | |
| 34 | G | A | 0.6102 | |
| 35 | V | A | 0.3372 | |
| 36 | P | A | -0.0570 | |
| 37 | S | A | -0.6713 | |
| 38 | Y | A | -1.1277 | |
| 39 | D | A | -1.9275 | |
| 40 | R | A | -1.2030 | |
| 41 | P | A | -0.2453 | |
| 42 | L | A | 0.7780 | |
| 43 | V | A | -0.0335 | |
| 44 | Q | A | -1.3182 | |
| 45 | G | A | -1.8042 | |
| 46 | D | A | -2.8917 | |
| 47 | T | A | -2.0695 | |
| 48 | N | A | -2.7359 | |
| 49 | D | A | -2.4055 | |
| 50 | L | A | -0.9678 | |
| 51 | P | A | 0.0093 | |
| 52 | V | A | 1.1562 | |
| 53 | T | A | 0.5377 | |
| 54 | I | A | 0.1502 | |
| 55 | N | A | -1.6576 | |
| 56 | A | A | -2.0586 | |
| 57 | D | A | -2.7597 | |
| 58 | H | A | -2.4153 | |
| 59 | A | A | -1.7876 | |
| 60 | K | A | -2.3339 | |
| 61 | G | A | -2.2944 | |
| 62 | D | A | -2.6396 | |
| 63 | Y | A | -0.8753 | |
| 64 | P | A | -1.3251 | |
| 65 | D | A | -2.8785 | |
| 66 | D | A | -3.0467 | |
| 67 | A | A | 0.0000 | |
| 68 | V | A | -0.8346 | |
| 69 | F | A | 0.0000 | |
| 70 | T | A | -1.6468 | |
| 71 | G | A | -1.8365 | |
| 72 | S | A | -1.7502 | |
| 73 | V | A | 0.0000 | |
| 74 | D | A | -0.8846 | |
| 75 | I | A | 0.2105 | |
| 76 | M | A | 0.3321 | |
| 77 | Q | A | 0.0169 | |
| 78 | G | A | -0.7430 | |
| 79 | N | A | -0.7984 | |
| 80 | S | A | -0.5357 | |
| 81 | R | A | -0.3544 | |
| 82 | L | A | -0.2133 | |
| 83 | Q | A | -1.3102 | |
| 84 | A | A | 0.0000 | |
| 85 | D | A | -1.8820 | |
| 86 | E | A | -1.1384 | |
| 87 | V | A | 0.0000 | |
| 88 | Q | A | -0.3161 | |
| 89 | L | A | -0.6787 | |
| 90 | H | A | -1.8333 | |
| 91 | Q | A | -2.2669 | |
| 92 | K | A | -2.0636 | |
| 93 | E | A | -1.8258 | |
| 94 | A | A | -1.0814 | |
| 95 | P | A | -1.2929 | |
| 96 | G | A | -1.3731 | |
| 97 | Q | A | -1.6823 | |
| 98 | P | A | -1.5853 | |
| 101 | V | A | -1.2332 | |
| 102 | R | A | -1.5747 | |
| 103 | T | A | -0.8930 | |
| 104 | V | A | 0.0661 | |
| 105 | D | A | -0.0139 | |
| 106 | A | A | 0.0000 | |
| 107 | L | A | 0.3762 | |
| 108 | G | A | -1.0497 | |
| 109 | N | A | -1.9628 | |
| 110 | V | A | 0.0000 | |
| 111 | H | A | -1.3656 | |
| 112 | Y | A | -0.3958 | |
| 113 | D | A | -0.6911 | |
| 114 | D | A | -0.9230 | |
| 115 | N | A | -1.2835 | |
| 116 | Q | A | -1.5527 | |
| 117 | V | A | -0.5597 | |
| 118 | I | A | -0.4360 | |
| 119 | L | A | -0.7469 | |
| 120 | K | A | -2.2130 | |
| 121 | G | A | -2.0939 | |
| 122 | P | A | -1.4247 | |
| 123 | K | A | -1.2741 | |
| 124 | G | A | 0.0000 | |
| 125 | W | A | 0.2344 | |
| 126 | A | A | -0.4994 | |
| 127 | N | A | -0.8893 | |
| 128 | L | A | -0.5547 | |
| 129 | N | A | -1.8866 | |
| 130 | T | A | -2.0773 | |
| 131 | K | A | -2.7887 | |
| 132 | D | A | -2.1445 | |
| 133 | T | A | -1.0289 | |
| 134 | N | A | -0.5376 | |
| 135 | V | A | 0.0000 | |
| 136 | W | A | -1.7845 | |
| 137 | E | A | -3.3966 | |
| 138 | G | A | 0.0000 | |
| 139 | D | A | -2.6696 | |
| 140 | Y | A | 0.0000 | |
| 141 | Q | A | -1.0034 | |
| 142 | M | A | -0.6066 | |
| 143 | V | A | 0.0000 | |
| 144 | G | A | -0.9756 | |
| 145 | R | A | -1.1895 | |
| 146 | Q | A | 0.0000 | |
| 147 | G | A | 0.0000 | |
| 148 | R | A | -0.9109 | |
| 149 | G | A | -1.2568 | |
| 150 | K | A | -3.1564 | |
| 151 | A | A | 0.0000 | |
| 152 | D | A | -3.2425 | |
| 153 | L | A | -1.8758 | |
| 154 | M | A | 0.0000 | |
| 155 | K | A | -0.4040 | |
| 156 | Q | A | -1.5856 | |
| 157 | R | A | -2.0396 | |
| 158 | G | A | -2.1733 | |
| 159 | E | A | -3.3181 | |
| 160 | N | A | -2.6644 | |
| 161 | R | A | -2.2448 | |
| 162 | Y | A | -1.2105 | |
| 163 | T | A | -0.5644 | |
| 164 | I | A | -0.2207 | |
| 165 | L | A | 0.0000 | |
| 166 | D | A | -1.7908 | |
| 167 | N | A | -2.4797 | |
| 168 | G | A | 0.0000 | |
| 169 | S | A | -1.1738 | |
| 170 | F | A | -0.2935 | |
| 171 | T | A | 0.0000 | |
| 172 | S | A | 0.0000 | |
| 173 | C | A | 0.0000 | |
| 174 | L | A | -0.1470 | |
| 175 | P | A | -0.7785 | |
| 176 | G | A | -1.0163 | |
| 177 | S | A | -1.1817 | |
| 178 | D | A | -1.8196 | |
| 179 | T | A | -0.6116 | |
| 180 | W | A | 0.0000 | |
| 181 | S | A | -0.0267 | |
| 182 | V | A | 0.0000 | |
| 183 | V | A | -0.4903 | |
| 184 | G | A | 0.0000 | |
| 185 | S | A | -1.1896 | |
| 186 | E | A | -0.6872 | |
| 187 | I | A | 0.0000 | |
| 188 | I | A | 0.1355 | |
| 189 | H | A | -0.5401 | |
| 190 | D | A | -1.3627 | |
| 191 | R | A | -2.3190 | |
| 192 | E | A | -2.9282 | |
| 193 | E | A | -2.0991 | |
| 194 | Q | A | -1.8440 | |
| 195 | V | A | 0.0000 | |
| 196 | A | A | 0.0000 | |
| 197 | E | A | -0.1472 | |
| 198 | I | A | 0.0000 | |
| 199 | W | A | 0.2550 | |
| 200 | N | A | -0.3060 | |
| 201 | A | A | 0.0000 | |
| 202 | R | A | 0.5799 | |
| 203 | F | A | 1.1963 | |
| 204 | K | A | 1.2376 | |
| 205 | V | A | 1.7134 | |
| 206 | G | A | 0.4119 | |
| 207 | P | A | 0.6441 | |
| 208 | V | A | 2.2939 | |
| 209 | P | A | 1.9140 | |
| 210 | I | A | 2.7372 | |
| 211 | F | A | 2.5212 | |
| 212 | Y | A | 1.8027 | |
| 213 | S | A | 0.7470 | |
| 214 | P | A | 0.1763 | |
| 215 | Y | A | 0.5164 | |
| 216 | L | A | 0.6803 | |
| 217 | Q | A | 0.4297 | |
| 218 | L | A | 0.0000 | |
| 219 | P | A | -0.0637 | |
| 220 | V | A | -0.9392 | |
| 221 | G | A | 0.0000 | |
| 222 | D | A | -2.8741 | |
| 223 | K | A | -3.2796 | |
| 224 | R | A | -2.5077 | |
| 225 | R | A | -2.8423 | |
| 226 | S | A | -1.3901 | |
| 227 | G | A | -0.3658 | |
| 228 | F | A | 0.0000 | |
| 229 | L | A | 1.7382 | |
| 230 | I | A | 1.1837 | |
| 231 | P | A | 0.8826 | |
| 232 | N | A | 0.0000 | |
| 233 | A | A | 0.0000 | |
| 234 | K | A | 1.7449 | |
| 235 | Y | A | 2.4932 | |
| 236 | T | A | 0.0000 | |
| 237 | T | A | 0.5345 | |
| 238 | T | A | 0.1084 | |
| 239 | N | A | 0.0000 | |
| 240 | Y | A | 1.2571 | |
| 241 | F | A | 1.8776 | |
| 242 | E | A | 0.0000 | |
| 243 | F | A | 1.3942 | |
| 244 | Y | A | 1.0964 | |
| 245 | L | A | 1.3051 | |
| 246 | P | A | 1.2893 | |
| 247 | Y | A | 1.6022 | |
| 248 | Y | A | 1.3792 | |
| 249 | W | A | 1.3703 | |
| 250 | N | A | 0.2451 | |
| 251 | I | A | 0.6885 | |
| 252 | A | A | 0.0466 | |
| 253 | P | A | -0.6971 | |
| 254 | N | A | -0.7848 | |
| 255 | M | A | 0.1807 | |
| 256 | D | A | 0.0000 | |
| 257 | A | A | 0.0000 | |
| 258 | T | A | 0.7565 | |
| 259 | I | A | 1.0869 | |
| 260 | T | A | 0.7474 | |
| 261 | P | A | 0.8663 | |
| 262 | H | A | 0.0000 | |
| 263 | Y | A | 0.7656 | |
| 264 | M | A | 0.0000 | |
| 265 | H | A | -0.6242 | |
| 266 | R | A | -1.0858 | |
| 267 | R | A | 0.0000 | |
| 268 | G | A | -1.3594 | |
| 269 | N | A | -0.8046 | |
| 270 | I | A | 0.6112 | |
| 271 | M | A | 0.0000 | |
| 272 | W | A | 0.9885 | |
| 273 | E | A | 0.3542 | |
| 274 | N | A | 0.2896 | |
| 275 | E | A | 0.0918 | |
| 276 | F | A | 0.4003 | |
| 277 | R | A | -0.3632 | |
| 278 | Y | A | 0.3358 | |
| 279 | L | A | 0.7629 | |
| 280 | S | A | -0.1059 | |
| 281 | Q | A | -1.0033 | |
| 282 | A | A | -0.3408 | |
| 283 | G | A | 0.0712 | |
| 284 | A | A | 0.0784 | |
| 285 | G | A | 0.0499 | |
| 286 | L | A | 0.2316 | |
| 287 | M | A | 0.5049 | |
| 288 | E | A | 0.0000 | |
| 289 | L | A | 1.2136 | |
| 290 | D | A | 0.7403 | |
| 291 | Y | A | 0.7729 | |
| 292 | L | A | 0.0000 | |
| 293 | P | A | -0.3241 | |
| 294 | S | A | -1.1600 | |
| 295 | D | A | 0.0000 | |
| 296 | K | A | -3.1960 | |
| 297 | V | A | -2.3220 | |
| 298 | Y | A | -2.7947 | |
| 299 | E | A | -4.4650 | |
| 300 | D | A | -4.2337 | |
| 301 | E | A | -3.9202 | |
| 302 | H | A | -3.8014 | |
| 303 | P | A | -3.3594 | |
| 304 | N | A | -3.4818 | |
| 305 | D | A | -4.1836 | |
| 306 | D | A | -3.3897 | |
| 307 | S | A | -2.3900 | |
| 308 | S | A | -2.6493 | |
| 309 | R | A | -1.6950 | |
| 310 | R | A | 0.0000 | |
| 311 | W | A | 0.3320 | |
| 312 | L | A | 0.0000 | |
| 313 | F | A | 0.7937 | |
| 314 | Y | A | 0.4159 | |
| 315 | W | A | 0.0465 | |
| 316 | N | A | -0.7105 | |
| 317 | H | A | 0.0000 | |
| 318 | S | A | -0.4880 | |
| 319 | G | A | -0.0704 | |
| 320 | V | A | 0.1095 | |
| 321 | M | A | -0.5557 | |
| 322 | D | A | -1.9216 | |
| 323 | Q | A | -1.3866 | |
| 324 | V | A | -0.2259 | |
| 325 | W | A | 0.7946 | |
| 326 | R | A | 0.3875 | |
| 327 | F | A | 0.7221 | |
| 328 | N | A | -0.5202 | |
| 329 | V | A | -0.3944 | |
| 330 | D | A | -1.0141 | |
| 331 | Y | A | -0.3942 | |
| 332 | T | A | 0.0000 | |
| 333 | K | A | -0.5810 | |
| 334 | V | A | 0.0000 | |
| 335 | S | A | -0.2840 | |
| 336 | D | A | 0.0000 | |
| 337 | P | A | -0.6284 | |
| 338 | S | A | -0.4018 | |
| 339 | Y | A | 0.0000 | |
| 340 | F | A | 0.0000 | |
| 341 | N | A | -1.0390 | |
| 342 | D | A | -0.8628 | |
| 343 | F | A | 0.0000 | |
| 344 | D | A | -1.9474 | |
| 345 | N | A | -2.0527 | |
| 346 | K | A | -2.1920 | |
| 347 | Y | A | -0.7891 | |
| 348 | G | A | -0.9706 | |
| 349 | S | A | -1.0361 | |
| 350 | S | A | 0.0000 | |
| 351 | T | A | 0.0000 | |
| 352 | D | A | -0.4403 | |
| 353 | G | A | 0.0000 | |
| 354 | Y | A | -0.2230 | |
| 355 | A | A | 0.0000 | |
| 356 | T | A | -0.5386 | |
| 357 | Q | A | 0.0000 | |
| 358 | K | A | -0.4806 | |
| 359 | F | A | 0.4710 | |
| 360 | S | A | 0.7279 | |
| 361 | V | A | 1.6313 | |
| 362 | G | A | 0.0000 | |
| 363 | Y | A | 1.2571 | |
| 364 | A | A | 0.0000 | |
| 365 | V | A | -0.1922 | |
| 366 | Q | A | -1.4299 | |
| 367 | N | A | -1.3459 | |
| 368 | F | A | 0.1335 | |
| 369 | N | A | 0.2694 | |
| 370 | A | A | 0.9833 | |
| 371 | T | A | 1.1251 | |
| 372 | V | A | 1.6445 | |
| 373 | S | A | 0.7102 | |
| 374 | T | A | 0.0970 | |
| 375 | K | A | 0.0000 | |
| 376 | Q | A | -0.4677 | |
| 377 | F | A | 0.0000 | |
| 378 | Q | A | -0.5080 | |
| 379 | V | A | 0.0000 | |
| 380 | F | A | 0.0000 | |
| 381 | S | A | -1.5318 | |
| 382 | E | A | -2.7864 | |
| 383 | Q | A | -2.5695 | |
| 384 | N | A | -2.3044 | |
| 385 | T | A | -1.5928 | |
| 386 | S | A | -1.3038 | |
| 387 | S | A | 0.0000 | |
| 388 | Y | A | 0.0000 | |
| 389 | S | A | 0.0000 | |
| 390 | A | A | 0.0000 | |
| 391 | E | A | -0.7276 | |
| 392 | P | A | -0.2279 | |
| 393 | Q | A | 0.0000 | |
| 394 | L | A | 1.1900 | |
| 395 | D | A | 0.5267 | |
| 396 | V | A | 1.1578 | |
| 397 | N | A | 0.5109 | |
| 398 | Y | A | 0.4856 | |
| 399 | Y | A | -0.8180 | |
| 400 | Q | A | -1.4528 | |
| 401 | N | A | -1.8035 | |
| 402 | D | A | -1.8105 | |
| 403 | V | A | -0.0015 | |
| 404 | G | A | -0.3190 | |
| 405 | P | A | -0.0415 | |
| 406 | F | A | 0.5858 | |
| 407 | D | A | -0.4516 | |
| 408 | T | A | -0.0932 | |
| 409 | R | A | -0.2407 | |
| 410 | I | A | 1.4140 | |
| 411 | Y | A | 1.0397 | |
| 412 | G | A | 1.2866 | |
| 413 | Q | A | 0.0000 | |
| 414 | A | A | 0.8581 | |
| 415 | V | A | 0.0000 | |
| 416 | H | A | -0.4959 | |
| 417 | F | A | 0.0000 | |
| 418 | V | A | -0.5995 | |
| 419 | N | A | -0.9991 | |
| 420 | T | A | -1.0790 | |
| 421 | R | A | -2.0763 | |
| 422 | D | A | -2.5451 | |
| 423 | D | A | -1.7720 | |
| 424 | M | A | -1.2680 | |
| 425 | P | A | 0.0000 | |
| 426 | E | A | -1.1164 | |
| 427 | A | A | 0.0000 | |
| 428 | T | A | -0.3601 | |
| 429 | R | A | 0.0000 | |
| 430 | V | A | 1.0848 | |
| 431 | H | A | 0.0000 | |
| 432 | L | A | 2.3018 | |
| 433 | E | A | 0.0000 | |
| 434 | P | A | 1.2700 | |
| 435 | T | A | 0.0000 | |
| 436 | I | A | 1.1988 | |
| 437 | N | A | 0.6931 | |
| 438 | L | A | 1.0925 | |
| 439 | P | A | 1.2534 | |
| 440 | L | A | 1.5868 | |
| 441 | S | A | -0.0422 | |
| 442 | N | A | -1.4400 | |
| 443 | N | A | -1.5731 | |
| 444 | W | A | -0.6943 | |
| 445 | G | A | -0.1751 | |
| 446 | S | A | 0.1642 | |
| 447 | I | A | 1.0969 | |
| 448 | N | A | 0.5863 | |
| 449 | T | A | 0.8672 | |
| 450 | E | A | 0.0000 | |
| 451 | A | A | 1.1106 | |
| 452 | K | A | 0.0000 | |
| 453 | F | A | 2.6268 | |
| 454 | L | A | 0.0000 | |
| 455 | A | A | 1.3370 | |
| 456 | T | A | 0.0000 | |
| 457 | H | A | -0.2858 | |
| 458 | Y | A | 0.0000 | |
| 459 | Q | A | -1.6435 | |
| 460 | Q | A | 0.0000 | |
| 461 | T | A | -1.7238 | |
| 462 | N | A | -1.9412 | |
| 463 | L | A | -1.8219 | |
| 464 | D | A | -2.2047 | |
| 465 | W | A | -1.2731 | |
| 466 | Y | A | -1.2805 | |
| 467 | N | A | -2.0225 | |
| 468 | S | A | -1.7593 | |
| 469 | R | A | -2.4609 | |
| 470 | N | A | -1.7223 | |
| 471 | T | A | -1.1028 | |
| 472 | T | A | -1.4500 | |
| 473 | K | A | -2.4881 | |
| 474 | L | A | 0.0000 | |
| 475 | D | A | -2.6032 | |
| 476 | E | A | -2.9439 | |
| 477 | S | A | -2.0370 | |
| 478 | V | A | 0.0000 | |
| 479 | N | A | -1.0626 | |
| 480 | R | A | 0.0000 | |
| 481 | V | A | 1.4306 | |
| 482 | M | A | 0.0000 | |
| 483 | P | A | 1.2247 | |
| 484 | Q | A | 0.0000 | |
| 485 | F | A | 1.3443 | |
| 486 | K | A | 0.5909 | |
| 487 | V | A | 0.7960 | |
| 488 | D | A | 0.0077 | |
| 489 | G | A | -0.0177 | |
| 490 | K | A | -0.7230 | |
| 491 | M | A | 0.0941 | |
| 492 | V | A | 0.0789 | |
| 493 | F | A | 0.3970 | |
| 494 | E | A | -0.7903 | |
| 495 | R | A | -1.5942 | |
| 496 | D | A | -2.3910 | |
| 497 | M | A | 0.0000 | |
| 498 | E | A | -1.5365 | |
| 499 | M | A | 0.5010 | |
| 500 | L | A | 0.9744 | |
| 501 | A | A | -0.2967 | |
| 502 | P | A | -1.2127 | |
| 503 | G | A | -1.7070 | |
| 504 | Y | A | -1.1681 | |
| 505 | T | A | -1.3012 | |
| 506 | Q | A | -0.4112 | |
| 507 | T | A | 0.0000 | |
| 508 | L | A | 0.6235 | |
| 509 | E | A | 0.0126 | |
| 510 | P | A | -0.0413 | |
| 511 | R | A | -0.5440 | |
| 512 | A | A | -0.0534 | |
| 513 | Q | A | 0.0000 | |
| 514 | Y | A | 0.8557 | |
| 515 | L | A | 0.0000 | |
| 516 | Y | A | 1.0279 | |
| 517 | V | A | 0.0000 | |
| 518 | P | A | 0.3436 | |
| 519 | Y | A | -0.4026 | |
| 520 | R | A | -1.2108 | |
| 521 | D | A | -2.3896 | |
| 522 | Q | A | 0.0000 | |
| 523 | S | A | -1.8177 | |
| 524 | D | A | -1.8162 | |
| 525 | I | A | 0.0000 | |
| 526 | Y | A | -0.3977 | |
| 527 | N | A | -0.2708 | |
| 528 | Y | A | 0.0000 | |
| 529 | D | A | 0.0000 | |
| 530 | S | A | 0.0000 | |
| 531 | S | A | 0.0000 | |
| 532 | L | A | 0.4942 | |
| 533 | L | A | 0.1906 | |
| 534 | Q | A | -0.1556 | |
| 535 | S | A | -0.0655 | |
| 536 | D | A | -0.2934 | |
| 537 | Y | A | 0.0000 | |
| 538 | S | A | -0.3678 | |
| 539 | G | A | 0.0000 | |
| 540 | L | A | 0.0000 | |
| 541 | F | A | 0.0000 | |
| 542 | R | A | -0.5843 | |
| 543 | D | A | -0.3590 | |
| 544 | R | A | -0.3679 | |
| 545 | T | A | -0.0820 | |
| 546 | Y | A | 0.1822 | |
| 547 | G | A | 0.0000 | |
| 548 | G | A | -0.1917 | |
| 549 | L | A | 0.0000 | |
| 550 | D | A | 0.0000 | |
| 551 | R | A | 0.0000 | |
| 552 | I | A | 0.0000 | |
| 553 | A | A | 0.0000 | |
| 554 | S | A | 0.0000 | |
| 555 | A | A | 0.0000 | |
| 556 | N | A | 0.7655 | |
| 557 | Q | A | 0.0000 | |
| 558 | V | A | 1.0188 | |
| 559 | T | A | 0.0000 | |
| 560 | T | A | 0.2329 | |
| 561 | G | A | 0.2695 | |
| 562 | V | A | 0.8020 | |
| 563 | T | A | 0.0000 | |
| 564 | S | A | 0.7158 | |
| 565 | R | A | 0.2404 | |
| 566 | I | A | 0.4023 | |
| 567 | Y | A | -0.2835 | |
| 568 | D | A | -0.5969 | |
| 569 | D | A | -1.8017 | |
| 570 | A | A | -0.8920 | |
| 571 | A | A | -0.3839 | |
| 572 | V | A | 0.3938 | |
| 573 | E | A | -0.0943 | |
| 574 | R | A | 0.2983 | |
| 575 | F | A | 0.8580 | |
| 576 | N | A | 0.5609 | |
| 577 | I | A | 1.4147 | |
| 578 | S | A | 0.0000 | |
| 579 | V | A | 1.4572 | |
| 580 | G | A | 0.0000 | |
| 581 | Q | A | 0.4776 | |
| 582 | I | A | 0.0000 | |
| 583 | Y | A | 1.1303 | |
| 584 | Y | A | 0.0000 | |
| 585 | F | A | 1.3281 | |
| 586 | T | A | 0.0284 | |
| 587 | E | A | -1.1357 | |
| 588 | S | A | -0.8736 | |
| 589 | R | A | -1.7498 | |
| 590 | T | A | 0.0000 | |
| 591 | G | A | -2.2739 | |
| 592 | D | A | -2.5882 | |
| 593 | D | A | -2.8743 | |
| 594 | N | A | -2.1579 | |
| 595 | I | A | -0.9691 | |
| 596 | T | A | -1.1962 | |
| 597 | W | A | -1.5406 | |
| 598 | E | A | -2.5764 | |
| 599 | N | A | -2.7732 | |
| 600 | D | A | -3.2590 | |
| 601 | D | A | -3.5165 | |
| 602 | K | A | -2.9208 | |
| 603 | T | A | -1.0117 | |
| 604 | G | A | -0.1076 | |
| 605 | S | A | 0.1323 | |
| 606 | L | A | 0.0000 | |
| 607 | V | A | 0.0000 | |
| 608 | W | A | 0.9385 | |
| 609 | A | A | 0.0000 | |
| 610 | G | A | 0.6582 | |
| 611 | D | A | -0.3128 | |
| 612 | T | A | 0.5246 | |
| 613 | Y | A | 0.6771 | |
| 614 | W | A | 1.3147 | |
| 615 | R | A | 0.2363 | |
| 616 | I | A | 0.6197 | |
| 617 | S | A | -0.6160 | |
| 618 | E | A | -2.2431 | |
| 619 | R | A | -2.0520 | |
| 620 | W | A | 0.0686 | |
| 621 | G | A | 0.0000 | |
| 622 | L | A | 1.2879 | |
| 623 | R | A | 0.0850 | |
| 624 | G | A | -0.1076 | |
| 625 | G | A | -0.1275 | |
| 626 | I | A | 0.9521 | |
| 627 | Q | A | 0.4411 | |
| 628 | Y | A | 0.5221 | |
| 629 | D | A | -0.4064 | |
| 630 | T | A | -1.5205 | |
| 631 | R | A | -2.3035 | |
| 632 | L | A | 0.0000 | |
| 633 | D | A | -2.4689 | |
| 634 | N | A | -1.2604 | |
| 635 | V | A | 0.1983 | |
| 636 | A | A | 0.0000 | |
| 637 | T | A | 0.0000 | |
| 638 | S | A | 0.1538 | |
| 639 | N | A | -0.5099 | |
| 640 | S | A | 0.0458 | |
| 641 | S | A | 0.6838 | |
| 642 | I | A | 1.5710 | |
| 643 | E | A | 0.0000 | |
| 644 | Y | A | -0.1260 | |
| 645 | R | A | -2.0491 | |
| 646 | R | A | -3.2013 | |
| 647 | D | A | -3.0783 | |
| 648 | E | A | -2.9707 | |
| 649 | D | A | -2.1516 | |
| 650 | R | A | -2.1274 | |
| 651 | L | A | 0.0000 | |
| 652 | V | A | 0.4804 | |
| 653 | Q | A | 0.0000 | |
| 654 | L | A | 1.9631 | |
| 655 | N | A | 0.9076 | |
| 656 | Y | A | 0.7451 | |
| 657 | H | A | 0.1357 | |
| 658 | Y | A | 0.3496 | |
| 659 | A | A | 0.0000 | |
| 660 | S | A | 0.0000 | |
| 661 | P | A | -0.7395 | |
| 662 | E | A | -1.2999 | |
| 663 | Y | A | 0.0000 | |
| 664 | I | A | 0.0000 | |
| 665 | Q | A | -1.1497 | |
| 666 | A | A | -0.7150 | |
| 667 | T | A | -0.3325 | |
| 668 | L | A | 0.0000 | |
| 669 | P | A | -0.8658 | |
| 670 | K | A | -1.7668 | |
| 671 | Y | A | -1.0137 | |
| 672 | Y | A | 0.0000 | |
| 673 | S | A | -1.2378 | |
| 674 | T | A | -0.9058 | |
| 675 | A | A | -0.9766 | |
| 676 | E | A | -1.6507 | |
| 677 | Q | A | -1.1848 | |
| 678 | Y | A | 0.0000 | |
| 679 | K | A | -1.4802 | |
| 680 | N | A | -1.4346 | |
| 681 | G | A | 0.0000 | |
| 682 | I | A | 0.0000 | |
| 683 | S | A | 0.0000 | |
| 684 | Q | A | 0.0000 | |
| 685 | V | A | 1.2907 | |
| 686 | G | A | 0.0000 | |
| 687 | A | A | 1.2216 | |
| 688 | V | A | 0.0000 | |
| 689 | A | A | 0.3194 | |
| 690 | S | A | 0.0000 | |
| 691 | R | A | -1.4268 | |
| 692 | P | A | -0.3112 | |
| 693 | I | A | 1.0987 | |
| 694 | A | A | 0.1561 | |
| 695 | D | A | -1.0456 | |
| 696 | R | A | -0.3684 | |
| 697 | W | A | 0.8370 | |
| 698 | S | A | 0.0000 | |
| 699 | I | A | 1.0546 | |
| 700 | V | A | 0.0000 | |
| 701 | G | A | 0.8631 | |
| 702 | A | A | 0.0000 | |
| 703 | Y | A | 1.2362 | |
| 704 | Y | A | 0.0000 | |
| 705 | Y | A | -0.0622 | |
| 706 | D | A | 0.0000 | |
| 707 | T | A | -1.1971 | |
| 708 | N | A | -1.9561 | |
| 709 | A | A | -1.7423 | |
| 710 | N | A | -2.2728 | |
| 711 | K | A | -2.1424 | |
| 712 | Q | A | -0.8091 | |
| 713 | A | A | 0.0000 | |
| 714 | D | A | 0.0000 | |
| 715 | S | A | 0.3544 | |
| 716 | M | A | 0.0000 | |
| 717 | L | A | 2.1960 | |
| 718 | G | A | 0.0000 | |
| 719 | V | A | 1.5600 | |
| 720 | Q | A | 0.0000 | |
| 721 | Y | A | 0.9629 | |
| 722 | S | A | 0.0000 | |
| 723 | S | A | 0.0000 | |
| 724 | C | A | 0.0000 | |
| 725 | C | A | 0.0000 | |
| 726 | Y | A | 0.4087 | |
| 727 | A | A | 0.0000 | |
| 728 | I | A | 1.0559 | |
| 729 | R | A | 0.9263 | |
| 730 | V | A | 2.1250 | |
| 731 | G | A | 1.7251 | |
| 732 | Y | A | 1.6945 | |
| 733 | E | A | 0.2742 | |
| 734 | R | A | -0.3279 | |
| 735 | K | A | -0.4262 | |
| 736 | L | A | 0.0000 | |
| 737 | N | A | -0.2333 | |
| 738 | G | A | -0.2837 | |
| 739 | W | A | -1.1897 | |
| 740 | D | A | -2.4548 | |
| 741 | N | A | -3.3329 | |
| 742 | D | A | -3.8309 | |
| 743 | K | A | -3.7684 | |
| 744 | Q | A | -3.4923 | |
| 745 | H | A | -2.2254 | |
| 746 | A | A | -0.8863 | |
| 747 | V | A | 0.4296 | |
| 748 | Y | A | 0.1506 | |
| 749 | D | A | 0.0000 | |
| 750 | N | A | -0.0727 | |
| 751 | A | A | 0.7924 | |
| 752 | I | A | 2.3060 | |
| 753 | G | A | 1.7696 | |
| 754 | F | A | 1.7770 | |
| 755 | N | A | 0.3191 | |
| 756 | I | A | 0.9349 | |
| 757 | E | A | 0.1929 | |
| 758 | L | A | 0.0000 | |
| 759 | R | A | 0.0000 | |
| 760 | G | A | -0.2395 | |
| 761 | L | A | 0.0000 | |
| 762 | S | A | -1.7215 | |
| 763 | S | A | -1.5220 | |
| 764 | N | A | -1.0167 | |
| 765 | Y | A | -0.4942 | |
| 766 | G | A | -1.0683 | |
| 767 | L | A | 0.0000 | |
| 768 | G | A | -0.7749 | |
| 769 | T | A | 0.0000 | |
| 770 | Q | A | -2.0537 | |
| 771 | E | A | -2.3946 | |
| 772 | M | A | 0.0000 | |
| 773 | L | A | 0.0000 | |
| 774 | R | A | -1.7745 | |
| 775 | S | A | -1.4355 | |
| 776 | N | A | 0.0000 | |
| 777 | I | A | 0.0000 | |
| 778 | L | A | 0.0000 | |
| 779 | P | A | -0.7552 | |
| 780 | Y | A | 0.0000 | |
| 781 | Q | A | -0.5803 | |
| 782 | N | A | -0.6092 | |
| 783 | T | A | 0.1230 | |
| 784 | L | A | 0.1698 | |
| 1000 | G | B | -0.8477 | |
| 1001 | W | B | -0.2746 | |
| 1002 | H | B | -0.5910 | |
| 1003 | L | B | 0.1877 | |
| 1004 | R | B | -0.8929 | |
| 1005 | D | B | -2.0289 | |
| 1006 | T | B | -1.2560 | |
| 1007 | T | B | -1.1427 | |
| 1008 | Q | B | -0.9820 | |
| 1009 | V | B | 0.0000 | |
| 1010 | P | B | -0.4028 | |
| 1011 | S | B | -0.4355 | |
| 1012 | T | B | -0.4841 | |
| 1013 | M | B | 0.0000 | |
| 1014 | K | B | -0.7689 | |
| 1015 | V | B | -0.5514 | |
| 1016 | M | B | 0.0000 | |
| 1017 | I | B | -1.0428 | |
| 1018 | L | B | -1.0290 | |
| 1019 | D | B | -1.5649 | |
| 1020 | S | B | -1.3428 | |
| 1021 | G | B | -1.4292 | |
| 1022 | D | B | -1.5623 | |
| 1023 | P | B | -1.1851 | |
| 1024 | N | B | -0.9557 | |
| 1025 | G | B | 0.0000 | |
| 1026 | P | B | -0.9116 | |
| 1027 | L | B | 0.0000 | |
| 1028 | S | B | 0.0000 | |
| 1029 | R | B | -1.5806 | |
| 1030 | A | B | 0.0000 | |
| 1031 | V | B | 0.0000 | |
| 1032 | R | B | -1.3870 | |
| 1033 | N | B | -1.4151 | |
| 1034 | Q | B | -1.0642 | |
| 1035 | L | B | 0.0000 | |
| 1036 | R | B | -1.2032 | |
| 1037 | L | B | 0.0523 | |
| 1038 | N | B | -1.0389 | |
| 1039 | G | B | -1.1125 | |
| 1040 | V | B | 0.0000 | |
| 1041 | E | B | -1.2110 | |
| 1042 | L | B | -0.9207 | |
| 1043 | L | B | -1.5981 | |
| 1044 | D | B | -3.0717 | |
| 1045 | K | B | -3.5733 | |
| 1046 | E | B | -3.4499 | |
| 1047 | T | B | -2.7688 | |
| 1048 | T | B | -2.4599 | |
| 1049 | R | B | -3.3342 | |
| 1050 | K | B | -3.5091 | |
| 1051 | D | B | -3.0693 | |
| 1052 | V | B | 0.0000 | |
| 1053 | P | B | 0.0000 | |
| 1054 | S | B | -0.3910 | |
| 1055 | L | B | 0.0000 | |
| 1056 | R | B | -1.6086 | |
| 1057 | L | B | 0.0000 | |
| 1058 | G | B | -1.9443 | |
| 1059 | K | B | -2.1701 | |
| 1060 | V | B | -0.7484 | |
| 1061 | S | B | -0.2138 | |
| 1062 | I | B | 0.5781 | |
| 1063 | A | B | -0.0274 | |
| 1064 | K | B | -0.8228 | |
| 1065 | D | B | -0.6898 | |
| 1066 | T | B | -0.4123 | |
| 1067 | A | B | -0.2301 | |
| 1068 | S | B | 0.0000 | |
| 1069 | V | B | 0.0000 | |
| 1070 | F | B | 0.0000 | |
| 1071 | R | B | 0.0000 | |
| 1072 | N | B | -0.3409 | |
| 1073 | G | B | 0.0000 | |
| 1074 | Q | B | -0.3539 | |
| 1075 | T | B | 0.0000 | |
| 1076 | A | B | 0.0000 | |
| 1077 | E | B | 0.0000 | |
| 1078 | Y | B | 0.0000 | |
| 1079 | Q | B | -0.6225 | |
| 1080 | M | B | 0.0000 | |
| 1081 | I | B | 0.0000 | |
| 1082 | M | B | 0.0000 | |
| 1083 | T | B | -0.4161 | |
| 1084 | V | B | 0.0000 | |
| 1085 | N | B | -1.9182 | |
| 1086 | A | B | 0.0000 | |
| 1087 | T | B | -0.2212 | |
| 1088 | V | B | 0.0000 | |
| 1089 | L | B | 0.4214 | |
| 1090 | I | B | -0.6720 | |
| 1091 | P | B | -1.4683 | |
| 1092 | G | B | -2.0353 | |
| 1093 | R | B | -2.2415 | |
| 1094 | D | B | -1.7160 | |
| 1095 | I | B | 0.6014 | |
| 1096 | Y | B | 0.3762 | |
| 1097 | P | B | -0.2097 | |
| 1098 | I | B | -0.4232 | |
| 1099 | S | B | -0.8122 | |
| 1100 | A | B | 0.0000 | |
| 1101 | K | B | -0.3777 | |
| 1102 | V | B | 0.0000 | |
| 1103 | F | B | -0.1094 | |
| 1104 | R | B | -0.5817 | |
| 1105 | S | B | -0.5206 | |
| 1106 | F | B | 0.0000 | |
| 1107 | F | B | 0.0000 | |
| 1108 | D | B | 0.0000 | |
| 1109 | N | B | 0.0000 | |
| 1110 | P | B | 0.0000 | |
| 1111 | Q | B | -0.4602 | |
| 1112 | M | B | 0.0671 | |
| 1113 | A | B | 0.0000 | |
| 1114 | L | B | 0.0000 | |
| 1115 | A | B | 0.0000 | |
| 1116 | K | B | 0.0000 | |
| 1117 | D | B | 0.0000 | |
| 1118 | N | B | -0.5683 | |
| 1119 | E | B | 0.0000 | |
| 1120 | Q | B | -1.1609 | |
| 1121 | D | B | -1.7566 | |
| 1122 | M | B | -1.1167 | |
| 1123 | I | B | 0.0000 | |
| 1124 | V | B | -1.1968 | |
| 1125 | K | B | -2.2478 | |
| 1126 | E | B | -1.6258 | |
| 1127 | M | B | 0.0000 | |
| 1128 | Y | B | 0.0000 | |
| 1129 | D | B | -1.5723 | |
| 1130 | R | B | -1.1547 | |
| 1131 | A | B | 0.0000 | |
| 1132 | A | B | 0.0000 | |
| 1133 | E | B | -1.0569 | |
| 1134 | Q | B | -0.9102 | |
| 1135 | L | B | 0.0000 | |
| 1136 | I | B | 0.0000 | |
| 1137 | R | B | -0.7913 | |
| 1138 | K | B | -0.8379 | |
| 1139 | L | B | 0.0000 | |
| 1140 | P | B | -0.4054 | |
| 1141 | S | B | -0.3457 | |
| 1142 | I | B | 0.0000 | |
| 1143 | R | B | -0.3429 | |
| 1144 | A | B | -0.1711 | |
| 1145 | A | B | -0.1663 | |
| 1146 | D | B | 0.0000 | |
| 1147 | I | B | 0.7563 | |
| 1148 | R | B | -1.0180 | |
| 1149 | S | B | -0.8641 |
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