| Chain sequence(s) |
A: EVQLVESGGGSVQPGGSLRLSCVASESTYTYRSYCMGWFRQAPGKNREGVAAIDRFGITSYVDSVKGRFTISRDSSKASLYLQMDSLRAEDTAMYYCAADLAGAPYCRGGRASDFMFGGQGTLVTVSSASGGGGSGGGGSGGGGSDKTHTCPPCPAPEAAGGPSVFLFPPKPKDTLMISRTPEVTCVVVDVSHEDPEVKFNWYVDGVEVHNAKTKPREEQYNSTYRVVSVLTVLHQDWLNGKEYKCKVSNKALPAPIEKTISKAKGQPREPQVCTLPPSRDELTKNQVSLSCAVKGFYPSDIAVEWESNGQPENNYKTTPPVLDSDGSFFLVSKLTVDKSRWQQGNVFSCSVMHEALHNHYTQKSLSLSPGK
B: APASSSTKKTQLQLEHLLADLQMILNGINNYKNPKLTRMLTFKFYMPKKATELKHLQCLEEELKTLEEVLNLAQSKNFHLRPRDLISRINVIVLELKGSETTFMCEYADETATIVEFLNRWITFSQSIISTLTGGGGSGGGGSGGGGSDKTHTCPPCPAPEAAGGPSVFLFPPKPKDTLMISRTPEVTCVVVDVSHEDPEVKFNWYVDGVEVHNAKTKPREEQYNSTYRVVSVLTVLHQDWLNGKEYKCKVSNKALPAPIEKTISKAKGQPREPQVYTLPPCRDELTKNQVSLWCLVKGFYPSDIAVEWESNGQPENNYKTTPPVLDSDGSFFLYSKLTVDKSRWQQGNVFSCSVMHEALHNHYTQKSLSLSPGK 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] (00:00:08)
[WARNING] runJob: Working directory already exists (possibly overwriting previous results -ow
to prevent this behavior) (00:00:08)
[INFO] runJob: Starting aggrescan3d job on: input.pdb with all chain(s) selected (00:00:08)
[INFO] runJob: Creating pdb object from: input.pdb (00:00:08)
[INFO] FoldX: Starting FoldX energy minimalization (00:00:08)
[INFO] Analysis: Starting Aggrescan3D on folded.pdb (00:16:58)
[INFO] Main: Simulation completed successfully. (00:17:09)
|
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 | E | A | -2.0853 | |
| 2 | V | A | -1.2341 | |
| 3 | Q | A | -1.0586 | |
| 4 | L | A | 0.0000 | |
| 5 | V | A | 0.7245 | |
| 6 | E | A | 0.0000 | |
| 7 | S | A | -0.2009 | |
| 8 | G | A | -0.8310 | |
| 9 | G | A | -0.3063 | |
| 10 | G | A | -0.2464 | |
| 11 | S | A | -0.3401 | |
| 12 | V | A | -0.8036 | |
| 13 | Q | A | -1.6096 | |
| 14 | P | A | -1.6021 | |
| 15 | G | A | -1.3252 | |
| 16 | G | A | -1.0600 | |
| 17 | S | A | -1.3075 | |
| 18 | L | A | -1.1795 | |
| 19 | R | A | -2.1590 | |
| 20 | L | A | 0.0000 | |
| 21 | S | A | -0.2433 | |
| 22 | C | A | 0.0000 | |
| 23 | V | A | 0.5519 | |
| 24 | A | A | -0.1799 | |
| 25 | S | A | -0.7237 | |
| 26 | E | A | -1.4283 | |
| 27 | S | A | -0.9038 | |
| 28 | T | A | -0.4505 | |
| 29 | Y | A | -0.7254 | |
| 30 | T | A | -1.1220 | |
| 31 | Y | A | 0.0000 | |
| 32 | R | A | -2.1191 | |
| 33 | S | A | -0.6929 | |
| 34 | Y | A | 0.0032 | |
| 35 | C | A | 0.0000 | |
| 36 | M | A | 0.0000 | |
| 37 | G | A | 0.0000 | |
| 38 | W | A | 0.0000 | |
| 39 | F | A | 0.0000 | |
| 40 | R | A | 0.0000 | |
| 41 | Q | A | -1.4132 | |
| 42 | A | A | -1.4472 | |
| 43 | P | A | -1.2518 | |
| 44 | G | A | -1.7181 | |
| 45 | K | A | -2.7377 | |
| 46 | N | A | -2.6554 | |
| 47 | R | A | -1.9966 | |
| 48 | E | A | -1.5793 | |
| 49 | G | A | -1.1359 | |
| 50 | V | A | 0.0000 | |
| 51 | A | A | 0.0000 | |
| 52 | A | A | 0.0000 | |
| 53 | I | A | 0.0000 | |
| 54 | D | A | 0.0000 | |
| 55 | R | A | 0.0078 | |
| 56 | F | A | 1.8545 | |
| 57 | G | A | 1.3055 | |
| 58 | I | A | 2.4297 | |
| 59 | T | A | 1.0096 | |
| 60 | S | A | -0.1112 | |
| 61 | Y | A | -0.6406 | |
| 62 | V | A | -1.0102 | |
| 63 | D | A | -2.2974 | |
| 64 | S | A | -1.7288 | |
| 65 | V | A | 0.0000 | |
| 66 | K | A | -2.4871 | |
| 67 | G | A | -1.7583 | |
| 68 | R | A | -1.7454 | |
| 69 | F | A | 0.0000 | |
| 70 | T | A | -0.9262 | |
| 71 | I | A | 0.0000 | |
| 72 | S | A | -0.1375 | |
| 73 | R | A | -0.8043 | |
| 74 | D | A | -1.2918 | |
| 75 | S | A | -1.5201 | |
| 76 | S | A | -1.5445 | |
| 77 | K | A | -2.0541 | |
| 78 | A | A | -1.3715 | |
| 79 | S | A | 0.0000 | |
| 80 | L | A | 0.0000 | |
| 81 | Y | A | -0.4540 | |
| 82 | L | A | 0.0000 | |
| 83 | Q | A | -1.4109 | |
| 84 | M | A | 0.0000 | |
| 85 | D | A | -1.5808 | |
| 86 | S | A | -1.2415 | |
| 87 | L | A | 0.0000 | |
| 88 | R | A | -2.0023 | |
| 89 | A | A | -1.5690 | |
| 90 | E | A | -2.1243 | |
| 91 | D | A | 0.0000 | |
| 92 | T | A | -0.6717 | |
| 93 | A | A | 0.0000 | |
| 94 | M | A | 0.2911 | |
| 95 | Y | A | 0.0000 | |
| 96 | Y | A | 0.1048 | |
| 97 | C | A | 0.0000 | |
| 98 | A | A | 0.0000 | |
| 99 | A | A | 0.0000 | |
| 100 | D | A | 0.0000 | |
| 101 | L | A | 0.7554 | |
| 102 | A | A | 0.1195 | |
| 103 | G | A | 0.0443 | |
| 104 | A | A | -0.0235 | |
| 105 | P | A | 0.2705 | |
| 106 | Y | A | 1.2313 | |
| 107 | C | A | -0.1929 | |
| 108 | R | A | -2.2753 | |
| 109 | G | A | -1.7648 | |
| 110 | G | A | -1.6703 | |
| 111 | R | A | -2.7310 | |
| 112 | A | A | -1.5027 | |
| 113 | S | A | -1.1794 | |
| 114 | D | A | -1.1859 | |
| 115 | F | A | 0.0000 | |
| 116 | M | A | 0.6385 | |
| 117 | F | A | 0.5431 | |
| 118 | G | A | -0.1758 | |
| 119 | G | A | -0.1522 | |
| 120 | Q | A | -0.8762 | |
| 121 | G | A | -0.0996 | |
| 122 | T | A | 0.2986 | |
| 123 | L | A | 0.8384 | |
| 124 | V | A | 0.0000 | |
| 125 | T | A | -0.3955 | |
| 126 | V | A | 0.0000 | |
| 127 | S | A | -1.0651 | |
| 128 | S | A | -0.9335 | |
| 129 | A | A | -0.6721 | |
| 130 | S | A | -0.7067 | |
| 131 | G | A | -1.0193 | |
| 132 | G | A | -1.1429 | |
| 133 | G | A | -1.2097 | |
| 134 | G | A | -1.2144 | |
| 135 | S | A | -1.0199 | |
| 136 | G | A | -1.1975 | |
| 137 | G | A | -1.2137 | |
| 138 | G | A | -1.1561 | |
| 139 | G | A | -1.1935 | |
| 140 | S | A | -1.0414 | |
| 141 | G | A | -1.1274 | |
| 142 | G | A | -1.2058 | |
| 143 | G | A | -1.3105 | |
| 144 | G | A | -1.5842 | |
| 145 | S | A | -1.9300 | |
| 146 | D | A | -3.0635 | |
| 147 | K | A | -3.0242 | |
| 148 | T | A | -1.9534 | |
| 149 | H | A | -1.9232 | |
| 150 | T | A | -0.9510 | |
| 151 | C | A | -0.3737 | |
| 152 | P | A | -0.3557 | |
| 153 | P | A | -0.1360 | |
| 154 | C | A | 0.0903 | |
| 155 | P | A | -0.4653 | |
| 156 | A | A | -0.6327 | |
| 157 | P | A | -1.2963 | |
| 158 | E | A | -2.0227 | |
| 159 | A | A | -1.0397 | |
| 160 | A | A | -0.7859 | |
| 161 | G | A | -0.8697 | |
| 162 | G | A | -0.9132 | |
| 163 | P | A | 0.0000 | |
| 164 | S | A | 0.0415 | |
| 165 | V | A | 0.0000 | |
| 166 | F | A | 1.3819 | |
| 167 | L | A | 1.0318 | |
| 168 | F | A | 1.3417 | |
| 169 | P | A | -0.0457 | |
| 170 | P | A | 0.0000 | |
| 171 | K | A | -2.2663 | |
| 172 | P | A | -1.4656 | |
| 173 | K | A | -1.3142 | |
| 174 | D | A | -1.3905 | |
| 175 | T | A | 0.0000 | |
| 176 | L | A | 0.0000 | |
| 177 | M | A | 0.2068 | |
| 178 | I | A | 1.3651 | |
| 179 | S | A | -0.0207 | |
| 180 | R | A | -1.4080 | |
| 181 | T | A | -0.8593 | |
| 182 | P | A | 0.0000 | |
| 183 | E | A | -1.2238 | |
| 184 | V | A | 0.0000 | |
| 185 | T | A | 0.3057 | |
| 186 | C | A | 0.0000 | |
| 187 | V | A | 0.0000 | |
| 188 | V | A | 0.0000 | |
| 189 | V | A | -0.7185 | |
| 190 | D | A | -1.2444 | |
| 191 | V | A | 0.0000 | |
| 192 | S | A | -2.1859 | |
| 193 | H | A | -2.5692 | |
| 194 | E | A | -2.9301 | |
| 195 | D | A | -2.5110 | |
| 196 | P | A | -2.6217 | |
| 197 | E | A | -3.0699 | |
| 198 | V | A | -1.9825 | |
| 199 | K | A | -2.2417 | |
| 200 | F | A | -1.1856 | |
| 201 | N | A | -1.1522 | |
| 202 | W | A | 0.0000 | |
| 203 | Y | A | -0.5924 | |
| 204 | V | A | -0.8277 | |
| 205 | D | A | -2.0768 | |
| 206 | G | A | -0.8602 | |
| 207 | V | A | 0.6018 | |
| 208 | E | A | -0.6877 | |
| 209 | V | A | -0.5760 | |
| 210 | H | A | -1.8813 | |
| 211 | N | A | -2.1719 | |
| 212 | A | A | -1.8999 | |
| 213 | K | A | -2.4139 | |
| 214 | T | A | -1.8768 | |
| 215 | K | A | -2.2495 | |
| 216 | P | A | -2.3032 | |
| 217 | R | A | -3.3808 | |
| 218 | E | A | -3.7922 | |
| 219 | E | A | -3.3445 | |
| 220 | Q | A | -1.5520 | |
| 221 | Y | A | 0.4023 | |
| 222 | N | A | -0.6148 | |
| 223 | S | A | -0.9158 | |
| 224 | T | A | -1.8926 | |
| 225 | Y | A | 0.0000 | |
| 226 | R | A | -2.3751 | |
| 227 | V | A | 0.0000 | |
| 228 | V | A | -0.8800 | |
| 229 | S | A | 0.0000 | |
| 230 | V | A | 0.0000 | |
| 231 | L | A | 0.0000 | |
| 232 | T | A | -0.7525 | |
| 233 | V | A | 0.0000 | |
| 234 | L | A | 0.3506 | |
| 235 | H | A | -0.3463 | |
| 236 | Q | A | -1.2844 | |
| 237 | D | A | -1.5887 | |
| 238 | W | A | 0.0000 | |
| 239 | L | A | -1.0606 | |
| 240 | N | A | -2.1432 | |
| 241 | G | A | -2.0968 | |
| 242 | K | A | -2.2634 | |
| 243 | E | A | -2.0566 | |
| 244 | Y | A | 0.0000 | |
| 245 | K | A | -1.5382 | |
| 246 | C | A | 0.0000 | |
| 247 | K | A | -1.4857 | |
| 248 | V | A | 0.0000 | |
| 249 | S | A | -1.4737 | |
| 250 | N | A | 0.0000 | |
| 251 | K | A | -2.5259 | |
| 252 | A | A | -1.4006 | |
| 253 | L | A | -0.7417 | |
| 254 | P | A | -0.6874 | |
| 255 | A | A | -0.4332 | |
| 256 | P | A | -0.9515 | |
| 257 | I | A | -0.5757 | |
| 258 | E | A | -1.8679 | |
| 259 | K | A | -1.1204 | |
| 260 | T | A | -0.9737 | |
| 261 | I | A | -0.1967 | |
| 262 | S | A | -1.1615 | |
| 263 | K | A | -1.3440 | |
| 264 | A | A | -1.2293 | |
| 265 | K | A | -2.3510 | |
| 266 | G | A | -1.9500 | |
| 267 | Q | A | -2.1033 | |
| 268 | P | A | -1.7035 | |
| 269 | R | A | -1.9897 | |
| 270 | E | A | -2.6298 | |
| 271 | P | A | 0.0000 | |
| 272 | Q | A | -1.6173 | |
| 273 | V | A | 0.0000 | |
| 274 | C | A | 0.0000 | |
| 275 | T | A | 0.0000 | |
| 276 | L | A | 0.0000 | |
| 277 | P | A | -0.3980 | |
| 278 | P | A | -0.9049 | |
| 279 | S | A | -1.5370 | |
| 280 | R | A | -2.6834 | |
| 281 | D | A | -2.8397 | |
| 282 | E | A | 0.0000 | |
| 283 | L | A | -1.9072 | |
| 284 | T | A | -1.6538 | |
| 285 | K | A | -2.2514 | |
| 286 | N | A | -2.5261 | |
| 287 | Q | A | -2.2614 | |
| 288 | V | A | 0.0000 | |
| 289 | S | A | 0.0000 | |
| 290 | L | A | 0.0000 | |
| 291 | S | A | 0.0000 | |
| 292 | C | A | 0.0000 | |
| 293 | A | A | 0.0000 | |
| 294 | V | A | 0.0000 | |
| 295 | K | A | -0.6666 | |
| 296 | G | A | -1.1099 | |
| 297 | F | A | 0.0000 | |
| 298 | Y | A | -1.0157 | |
| 299 | P | A | 0.0000 | |
| 300 | S | A | -0.2388 | |
| 301 | D | A | -1.2621 | |
| 302 | I | A | -0.6641 | |
| 303 | A | A | 0.0000 | |
| 304 | V | A | 0.0000 | |
| 305 | E | A | -1.1846 | |
| 306 | W | A | 0.0000 | |
| 307 | E | A | -1.6791 | |
| 308 | S | A | 0.0000 | |
| 309 | N | A | -1.8079 | |
| 310 | G | A | -1.7226 | |
| 311 | Q | A | -2.2519 | |
| 312 | P | A | -1.8654 | |
| 313 | E | A | 0.0000 | |
| 314 | N | A | -1.9567 | |
| 315 | N | A | -1.2918 | |
| 316 | Y | A | -0.9540 | |
| 317 | K | A | -0.7512 | |
| 318 | T | A | -0.2605 | |
| 319 | T | A | 0.0000 | |
| 320 | P | A | -0.0391 | |
| 321 | P | A | 0.1285 | |
| 322 | V | A | 0.5242 | |
| 323 | L | A | 0.7428 | |
| 324 | D | A | -0.5129 | |
| 325 | S | A | -1.1332 | |
| 326 | D | A | -1.9027 | |
| 327 | G | A | -0.8849 | |
| 328 | S | A | 0.0000 | |
| 329 | F | A | 0.1304 | |
| 330 | F | A | 0.0000 | |
| 331 | L | A | 0.0000 | |
| 332 | V | A | 0.0000 | |
| 333 | S | A | 0.0000 | |
| 334 | K | A | 0.0000 | |
| 335 | L | A | 0.0000 | |
| 336 | T | A | -0.8697 | |
| 337 | V | A | 0.0000 | |
| 338 | D | A | -2.5442 | |
| 339 | K | A | -2.7247 | |
| 340 | S | A | -2.2758 | |
| 341 | R | A | -1.9736 | |
| 342 | W | A | 0.0000 | |
| 343 | Q | A | -2.4136 | |
| 344 | Q | A | -2.1264 | |
| 345 | G | A | -1.1472 | |
| 346 | N | A | -0.7633 | |
| 347 | V | A | 0.3792 | |
| 348 | F | A | 0.0000 | |
| 349 | S | A | 0.0000 | |
| 350 | C | A | 0.0000 | |
| 351 | S | A | 0.0000 | |
| 352 | V | A | 0.0000 | |
| 353 | M | A | 0.0000 | |
| 354 | H | A | 0.0000 | |
| 355 | E | A | -1.0647 | |
| 356 | A | A | -1.4354 | |
| 357 | L | A | -1.4097 | |
| 358 | H | A | -1.7383 | |
| 359 | N | A | -1.6493 | |
| 360 | H | A | -1.1342 | |
| 361 | Y | A | -0.3195 | |
| 362 | T | A | -0.6147 | |
| 363 | Q | A | -0.8908 | |
| 364 | K | A | -0.9467 | |
| 365 | S | A | -0.3963 | |
| 366 | L | A | 0.0000 | |
| 367 | S | A | -0.0972 | |
| 368 | L | A | -0.3807 | |
| 369 | S | A | -0.6193 | |
| 370 | P | A | -1.2783 | |
| 371 | G | A | -1.4289 | |
| 372 | K | A | -2.0345 | |
| 373 | A | B | -0.1190 | |
| 374 | P | B | -0.3536 | |
| 375 | A | B | -0.4916 | |
| 376 | S | B | -1.0743 | |
| 377 | S | B | -1.4680 | |
| 378 | S | B | -1.4330 | |
| 379 | T | B | -1.4034 | |
| 380 | K | B | -2.3796 | |
| 381 | K | B | -2.6627 | |
| 382 | T | B | -1.6264 | |
| 383 | Q | B | -1.1930 | |
| 384 | L | B | -0.4932 | |
| 385 | Q | B | -1.0298 | |
| 386 | L | B | 0.0000 | |
| 387 | E | B | -1.2102 | |
| 388 | H | B | -1.1250 | |
| 389 | L | B | 0.0000 | |
| 390 | L | B | -0.6635 | |
| 391 | A | B | -0.5704 | |
| 392 | D | B | 0.0000 | |
| 393 | L | B | 0.0000 | |
| 394 | Q | B | -1.0713 | |
| 395 | M | B | -0.6384 | |
| 396 | I | B | 0.0000 | |
| 397 | L | B | -1.3706 | |
| 398 | N | B | -2.1018 | |
| 399 | G | B | -1.9021 | |
| 400 | I | B | 0.0000 | |
| 401 | N | B | -2.5775 | |
| 402 | N | B | -2.8620 | |
| 403 | Y | B | -2.4156 | |
| 404 | K | B | -2.6826 | |
| 405 | N | B | -2.1519 | |
| 406 | P | B | -1.5687 | |
| 407 | K | B | -1.8767 | |
| 408 | L | B | -1.4960 | |
| 409 | T | B | -1.1840 | |
| 410 | R | B | -1.8173 | |
| 411 | M | B | 0.0000 | |
| 412 | L | B | -0.2337 | |
| 413 | T | B | -0.4275 | |
| 414 | F | B | -0.5027 | |
| 415 | K | B | -1.1407 | |
| 416 | F | B | 0.0000 | |
| 417 | Y | B | -0.3149 | |
| 418 | M | B | 0.0000 | |
| 419 | P | B | 0.0000 | |
| 420 | K | B | -3.0660 | |
| 421 | K | B | -2.9709 | |
| 422 | A | B | -2.0595 | |
| 423 | T | B | -1.5756 | |
| 424 | E | B | -2.0947 | |
| 425 | L | B | -1.2761 | |
| 426 | K | B | -1.3629 | |
| 427 | H | B | -1.5244 | |
| 428 | L | B | 0.0000 | |
| 429 | Q | B | 0.0000 | |
| 430 | C | B | 0.0000 | |
| 431 | L | B | 0.0000 | |
| 432 | E | B | -0.8090 | |
| 433 | E | B | -1.3111 | |
| 434 | E | B | 0.0000 | |
| 435 | L | B | 0.0000 | |
| 436 | K | B | -2.8880 | |
| 437 | T | B | -1.7965 | |
| 438 | L | B | 0.0000 | |
| 439 | E | B | -2.7084 | |
| 440 | E | B | -2.5712 | |
| 441 | V | B | 0.0000 | |
| 442 | L | B | 0.0000 | |
| 443 | N | B | -1.6717 | |
| 444 | L | B | -0.8230 | |
| 445 | A | B | 0.0000 | |
| 446 | Q | B | -2.1557 | |
| 447 | S | B | -2.0373 | |
| 448 | K | B | -2.8083 | |
| 449 | N | B | -2.7199 | |
| 450 | F | B | 0.0000 | |
| 451 | H | B | -2.2608 | |
| 452 | L | B | -2.0697 | |
| 453 | R | B | -3.1616 | |
| 454 | P | B | 0.0000 | |
| 455 | R | B | -3.7141 | |
| 456 | D | B | -3.0404 | |
| 457 | L | B | 0.0000 | |
| 458 | I | B | 0.0000 | |
| 459 | S | B | -1.7843 | |
| 460 | R | B | -1.3453 | |
| 461 | I | B | 0.0000 | |
| 462 | N | B | -0.5614 | |
| 463 | V | B | 0.8672 | |
| 464 | I | B | 0.0000 | |
| 465 | V | B | 0.0000 | |
| 466 | L | B | -0.0678 | |
| 467 | E | B | -1.4656 | |
| 468 | L | B | 0.0000 | |
| 469 | K | B | 0.0000 | |
| 470 | G | B | -1.3405 | |
| 471 | S | B | -1.4594 | |
| 472 | E | B | -2.0953 | |
| 473 | T | B | -0.9195 | |
| 474 | T | B | -0.2992 | |
| 475 | F | B | -0.0442 | |
| 476 | M | B | 0.5640 | |
| 477 | C | B | -0.7798 | |
| 478 | E | B | -2.1991 | |
| 479 | Y | B | -1.6446 | |
| 480 | A | B | -2.3385 | |
| 481 | D | B | -2.8679 | |
| 482 | E | B | -2.7657 | |
| 483 | T | B | -1.4298 | |
| 484 | A | B | 0.0000 | |
| 485 | T | B | -0.4335 | |
| 486 | I | B | 0.0000 | |
| 487 | V | B | -0.7704 | |
| 488 | E | B | -1.7954 | |
| 489 | F | B | 0.0000 | |
| 490 | L | B | 0.0000 | |
| 491 | N | B | -1.5042 | |
| 492 | R | B | -1.5061 | |
| 493 | W | B | 0.0000 | |
| 494 | I | B | -1.0006 | |
| 495 | T | B | -0.8153 | |
| 496 | F | B | 0.0000 | |
| 497 | S | B | 0.0000 | |
| 498 | Q | B | -1.3951 | |
| 499 | S | B | -0.8441 | |
| 500 | I | B | 0.0000 | |
| 501 | I | B | -0.5138 | |
| 502 | S | B | -0.5642 | |
| 503 | T | B | -0.3420 | |
| 504 | L | B | -0.2615 | |
| 505 | T | B | -0.5987 | |
| 506 | G | B | -0.8694 | |
| 507 | G | B | -1.0526 | |
| 508 | G | B | -1.1367 | |
| 509 | G | B | -1.1989 | |
| 510 | S | B | -1.0303 | |
| 511 | G | B | -1.1592 | |
| 512 | G | B | -1.2062 | |
| 513 | G | B | -1.1829 | |
| 514 | G | B | -1.1778 | |
| 515 | S | B | -1.0393 | |
| 516 | G | B | -1.2056 | |
| 517 | G | B | -1.1889 | |
| 518 | G | B | -1.1633 | |
| 519 | G | B | -1.5506 | |
| 520 | S | B | -1.9608 | |
| 521 | D | B | -3.0071 | |
| 522 | K | B | -3.0555 | |
| 523 | T | B | -2.0340 | |
| 524 | H | B | -1.9442 | |
| 525 | T | B | -0.9049 | |
| 526 | C | B | -0.2834 | |
| 527 | P | B | -0.2867 | |
| 528 | P | B | -0.1661 | |
| 529 | C | B | 0.0489 | |
| 530 | P | B | -0.5497 | |
| 531 | A | B | -0.9356 | |
| 532 | P | B | -1.1585 | |
| 533 | E | B | -1.9261 | |
| 534 | A | B | -0.9636 | |
| 535 | A | B | -0.6745 | |
| 536 | G | B | 0.0000 | |
| 537 | G | B | 0.0000 | |
| 538 | P | B | 0.0000 | |
| 539 | S | B | -0.0322 | |
| 540 | V | B | 0.0000 | |
| 541 | F | B | 1.1476 | |
| 542 | L | B | 0.7049 | |
| 543 | F | B | 0.9237 | |
| 544 | P | B | -0.1445 | |
| 545 | P | B | 0.0000 | |
| 546 | K | B | -2.0969 | |
| 547 | P | B | -1.3920 | |
| 548 | K | B | -1.1000 | |
| 549 | D | B | -1.1145 | |
| 550 | T | B | 0.0000 | |
| 551 | L | B | 0.0000 | |
| 552 | M | B | 0.3365 | |
| 553 | I | B | 1.3425 | |
| 554 | S | B | 0.1847 | |
| 555 | R | B | -1.0079 | |
| 556 | T | B | -0.5148 | |
| 557 | P | B | 0.0000 | |
| 558 | E | B | -0.7256 | |
| 559 | V | B | 0.0000 | |
| 560 | T | B | 0.2193 | |
| 561 | C | B | 0.0000 | |
| 562 | V | B | 0.0000 | |
| 563 | V | B | 0.0000 | |
| 564 | V | B | -0.7421 | |
| 565 | D | B | -1.3166 | |
| 566 | V | B | 0.0000 | |
| 567 | S | B | -2.4042 | |
| 568 | H | B | -2.5745 | |
| 569 | E | B | -2.9542 | |
| 570 | D | B | -2.5613 | |
| 571 | P | B | -2.8214 | |
| 572 | E | B | -3.1048 | |
| 573 | V | B | -2.0473 | |
| 574 | K | B | -2.2478 | |
| 575 | F | B | -1.2109 | |
| 576 | N | B | -1.1897 | |
| 577 | W | B | 0.0000 | |
| 578 | Y | B | -0.6859 | |
| 579 | V | B | -0.8813 | |
| 580 | D | B | -2.1373 | |
| 581 | G | B | -0.9211 | |
| 582 | V | B | 0.5159 | |
| 583 | E | B | -0.8020 | |
| 584 | V | B | -0.5905 | |
| 585 | H | B | -1.8945 | |
| 586 | N | B | -2.1678 | |
| 587 | A | B | -1.8010 | |
| 588 | K | B | -2.3444 | |
| 589 | T | B | -1.8841 | |
| 590 | K | B | -2.2261 | |
| 591 | P | B | -2.2213 | |
| 592 | R | B | -3.2035 | |
| 593 | E | B | -3.3939 | |
| 594 | E | B | -3.1302 | |
| 595 | Q | B | -1.4772 | |
| 596 | Y | B | 0.3802 | |
| 597 | N | B | -0.5355 | |
| 598 | S | B | -0.9523 | |
| 599 | T | B | 0.0000 | |
| 600 | Y | B | 0.0000 | |
| 601 | R | B | -2.2273 | |
| 602 | V | B | 0.0000 | |
| 603 | V | B | 0.0000 | |
| 604 | S | B | 0.0000 | |
| 605 | V | B | 0.0000 | |
| 606 | L | B | 0.0000 | |
| 607 | T | B | -0.4954 | |
| 608 | V | B | 0.0000 | |
| 609 | L | B | 0.6908 | |
| 610 | H | B | -0.1118 | |
| 611 | Q | B | -1.1630 | |
| 612 | D | B | -1.3604 | |
| 613 | W | B | 0.0000 | |
| 614 | L | B | -0.9895 | |
| 615 | N | B | -2.0530 | |
| 616 | G | B | -2.0553 | |
| 617 | K | B | -2.0949 | |
| 618 | E | B | -2.0129 | |
| 619 | Y | B | 0.0000 | |
| 620 | K | B | -1.6642 | |
| 621 | C | B | 0.0000 | |
| 622 | K | B | -1.5956 | |
| 623 | V | B | 0.0000 | |
| 624 | S | B | -1.5175 | |
| 625 | N | B | 0.0000 | |
| 626 | K | B | -2.5427 | |
| 627 | A | B | -1.5204 | |
| 628 | L | B | -0.5287 | |
| 629 | P | B | -0.4720 | |
| 630 | A | B | -0.4673 | |
| 631 | P | B | -1.0206 | |
| 632 | I | B | -0.7072 | |
| 633 | E | B | -2.0685 | |
| 634 | K | B | -1.2847 | |
| 635 | T | B | -1.0947 | |
| 636 | I | B | -0.1504 | |
| 637 | S | B | -1.1514 | |
| 638 | K | B | -1.2810 | |
| 639 | A | B | -1.2186 | |
| 640 | K | B | -2.3506 | |
| 641 | G | B | -1.9781 | |
| 642 | Q | B | -2.1390 | |
| 643 | P | B | -1.7646 | |
| 644 | R | B | -2.0865 | |
| 645 | E | B | -2.6478 | |
| 646 | P | B | 0.0000 | |
| 647 | Q | B | -1.3006 | |
| 648 | V | B | 0.0000 | |
| 649 | Y | B | 0.0000 | |
| 650 | T | B | -0.7601 | |
| 651 | L | B | 0.0000 | |
| 652 | P | B | -0.3606 | |
| 653 | P | B | -0.8136 | |
| 654 | C | B | -1.3770 | |
| 655 | R | B | -2.6177 | |
| 656 | D | B | -2.9012 | |
| 657 | E | B | 0.0000 | |
| 658 | L | B | -1.9684 | |
| 659 | T | B | -1.8146 | |
| 660 | K | B | -2.6340 | |
| 661 | N | B | -2.7143 | |
| 662 | Q | B | -2.4372 | |
| 663 | V | B | 0.0000 | |
| 664 | S | B | 0.0000 | |
| 665 | L | B | 0.0000 | |
| 666 | W | B | 0.0000 | |
| 667 | C | B | 0.0000 | |
| 668 | L | B | 0.0000 | |
| 669 | V | B | 0.0000 | |
| 670 | K | B | -0.4604 | |
| 671 | G | B | -0.9524 | |
| 672 | F | B | 0.0000 | |
| 673 | Y | B | -1.0393 | |
| 674 | P | B | 0.0000 | |
| 675 | S | B | -0.2628 | |
| 676 | D | B | -1.2880 | |
| 677 | I | B | -0.6248 | |
| 678 | A | B | -0.4938 | |
| 679 | V | B | 0.0000 | |
| 680 | E | B | -1.1021 | |
| 681 | W | B | 0.0000 | |
| 682 | E | B | -1.7513 | |
| 683 | S | B | 0.0000 | |
| 684 | N | B | -1.8426 | |
| 685 | G | B | -1.7580 | |
| 686 | Q | B | -2.3058 | |
| 687 | P | B | -1.9762 | |
| 688 | E | B | -1.8523 | |
| 689 | N | B | -2.0668 | |
| 690 | N | B | -1.4236 | |
| 691 | Y | B | -0.8887 | |
| 692 | K | B | -0.7781 | |
| 693 | T | B | -0.2594 | |
| 694 | T | B | 0.0000 | |
| 695 | P | B | 0.0006 | |
| 696 | P | B | 0.2091 | |
| 697 | V | B | 0.7241 | |
| 698 | L | B | 1.1299 | |
| 699 | D | B | -0.2718 | |
| 700 | S | B | -1.0079 | |
| 701 | D | B | -1.7760 | |
| 702 | G | B | -0.6608 | |
| 703 | S | B | 0.0000 | |
| 704 | F | B | 0.2992 | |
| 705 | F | B | 0.0000 | |
| 706 | L | B | 0.0000 | |
| 707 | Y | B | 0.0000 | |
| 708 | S | B | 0.0000 | |
| 709 | K | B | 0.0000 | |
| 710 | L | B | 0.0000 | |
| 711 | T | B | -0.8889 | |
| 712 | V | B | 0.0000 | |
| 713 | D | B | -2.5746 | |
| 714 | K | B | -2.7262 | |
| 715 | S | B | -2.2464 | |
| 716 | R | B | -1.9729 | |
| 717 | W | B | 0.0000 | |
| 718 | Q | B | -2.3793 | |
| 719 | Q | B | -2.1202 | |
| 720 | G | B | -1.1570 | |
| 721 | N | B | -0.7920 | |
| 722 | V | B | 0.3099 | |
| 723 | F | B | 0.0000 | |
| 724 | S | B | -0.8627 | |
| 725 | C | B | 0.0000 | |
| 726 | S | B | 0.0000 | |
| 727 | V | B | 0.0000 | |
| 728 | M | B | 0.0000 | |
| 729 | H | B | 0.0000 | |
| 730 | E | B | -1.0978 | |
| 731 | A | B | -1.5556 | |
| 732 | L | B | 0.0000 | |
| 733 | H | B | -1.7911 | |
| 734 | N | B | -1.4232 | |
| 735 | H | B | -0.8934 | |
| 736 | Y | B | -0.2894 | |
| 737 | T | B | -0.5876 | |
| 738 | Q | B | -0.8744 | |
| 739 | K | B | -0.9509 | |
| 740 | S | B | -0.4235 | |
| 741 | L | B | 0.0000 | |
| 742 | S | B | -0.1025 | |
| 743 | L | B | -0.3582 | |
| 744 | S | B | -0.6112 | |
| 745 | P | B | -1.2595 | |
| 746 | G | B | -1.4281 | |
| 747 | K | B | -2.0352 |