| Chain sequence(s) |
A: SIEKIWAREILDSRGNPTVEVDLYTAKGLFRAAVPSGASTGIYEALELRDGDKQRYLGKGVLKAVDHINSTIAPALISSGLSVVEQEKLDNLMLELDGTENKSKFGANAILGVSLAVCKAGAAERELPLYRHIAQLAGNSDLILPVPAFNVINGGSHAGNKLAMQEFMILPVGAESFRDAMRLGAEVYHTLKGVIKDKYGKDATNVGDEGGFAPNILENSEALELVKEAIDKAGYTEKIVIGMDVAASEFYRDGKYDLDFKSPTDPSRYITGDQLGALYQDFVRDYPVVSIEDPFDQDDWAAWSKFTANVGIQIVGDDLTVTNPKRIERAVEEKACNCLLLKVNQIGSVTEAIQACKLAQENGWGVMVSHRSGETEDTFIADLVVGLCTGQIKTGAPCRSERLAKYNQLMRIEEELGDEARFAGHNFRNPSVLH
B: SIEKIWAREILDSRGNPTVEVDLYTAKGLFRAAVPSGASTGIYEALELRDGDKQRYLGKGVLKAVDHINSTIAPALISSGLSVVEQEKLDNLMLELDGTENKSKFGANAILGVSLAVCKAGAAERELPLYRHIAQLAGNSDLILPVPAFNVINGGSHAGNKLAMQEFMILPVGAESFRDAMRLGAEVYHTLKGVIKDKYGKDATNVGDEGGFAPNILENSEALELVKEAIDKAGYTEKIVIGMDVAASEFYRDGKYDLDFKSPTDPSRYITGDQLGALYQDFVRDYPVVSIEDPFDQDDWAAWSKFTANVGIQIVGDDLTVTNPKRIERAVEEKACNCLLLKVNQIGSVTEAIQACKLAQENGWGVMVSHRSGETEDTFIADLVVGLCTGQIKTGAPCRSERLAKYNQLMRIEEELGDEARFAGHNFRNPSVL 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] (00:00:07)
[WARNING] runJob: Working directory already exists (possibly overwriting previous results -ow
to prevent this behavior) (00:00:07)
[INFO] runJob: Starting aggrescan3d job on: input.pdb with all chain(s) selected (00:00:07)
[INFO] runJob: Creating pdb object from: input.pdb (00:00:07)
[INFO] FoldX: Starting FoldX energy minimalization (00:00:07)
[INFO] Analysis: Starting Aggrescan3D on folded.pdb (00:12:09)
[INFO] Main: Simulation completed successfully. (00:12:17)
|
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 | S | A | -0.8006 | |
| 2 | I | A | 0.0000 | |
| 3 | E | A | -2.4456 | |
| 4 | K | A | -2.0976 | |
| 5 | I | A | 0.0000 | |
| 6 | W | A | -0.0928 | |
| 7 | A | A | 0.0000 | |
| 8 | R | A | 0.0000 | |
| 9 | E | A | -0.3395 | |
| 10 | I | A | 0.0000 | |
| 11 | L | A | 0.0000 | |
| 12 | D | A | 0.0000 | |
| 13 | S | A | 0.0000 | |
| 14 | R | A | -0.3214 | |
| 15 | G | A | 0.0000 | |
| 16 | N | A | 0.0000 | |
| 17 | P | A | 0.0000 | |
| 18 | T | A | 0.0000 | |
| 19 | V | A | 0.0000 | |
| 20 | E | A | 0.0000 | |
| 21 | V | A | 0.0000 | |
| 22 | D | A | 0.0000 | |
| 23 | L | A | 0.0000 | |
| 24 | Y | A | -0.5121 | |
| 25 | T | A | 0.0000 | |
| 26 | A | A | -0.6148 | |
| 27 | K | A | -0.9250 | |
| 28 | G | A | -0.1947 | |
| 29 | L | A | 0.5380 | |
| 30 | F | A | 0.2539 | |
| 31 | R | A | -0.2546 | |
| 32 | A | A | 0.0000 | |
| 33 | A | A | 0.0000 | |
| 34 | V | A | 0.0000 | |
| 35 | P | A | -0.1052 | |
| 36 | S | A | 0.0000 | |
| 37 | G | A | -0.1669 | |
| 38 | A | A | -0.1116 | |
| 39 | S | A | 0.0000 | |
| 40 | T | A | 0.3525 | |
| 41 | G | A | 0.0000 | |
| 42 | I | A | 2.1433 | |
| 43 | Y | A | 1.2243 | |
| 44 | E | A | 0.5531 | |
| 45 | A | A | -0.1486 | |
| 46 | L | A | -0.1228 | |
| 47 | E | A | -0.5867 | |
| 48 | L | A | -0.8682 | |
| 49 | R | A | -1.4257 | |
| 50 | D | A | -2.1062 | |
| 51 | G | A | -2.4680 | |
| 52 | D | A | -3.1833 | |
| 53 | K | A | -3.1068 | |
| 54 | Q | A | -2.5976 | |
| 55 | R | A | -2.0617 | |
| 56 | Y | A | 0.0000 | |
| 57 | L | A | -1.1147 | |
| 58 | G | A | -2.2843 | |
| 59 | K | A | -1.6429 | |
| 60 | G | A | 0.0000 | |
| 61 | V | A | 0.0000 | |
| 62 | L | A | -0.9445 | |
| 63 | K | A | -2.3535 | |
| 64 | A | A | 0.0000 | |
| 65 | V | A | 0.0000 | |
| 66 | D | A | -2.3091 | |
| 67 | H | A | -1.6538 | |
| 68 | I | A | 0.0000 | |
| 69 | N | A | -1.0680 | |
| 70 | S | A | -0.8976 | |
| 71 | T | A | -0.5605 | |
| 72 | I | A | 0.0000 | |
| 73 | A | A | 0.0000 | |
| 74 | P | A | -0.5778 | |
| 75 | A | A | 0.0639 | |
| 76 | L | A | 0.0000 | |
| 77 | I | A | -0.4032 | |
| 78 | S | A | -0.2780 | |
| 79 | S | A | -0.2902 | |
| 80 | G | A | -0.4866 | |
| 81 | L | A | -0.4277 | |
| 82 | S | A | -0.5081 | |
| 83 | V | A | 0.0000 | |
| 84 | V | A | -1.1568 | |
| 85 | E | A | -1.8402 | |
| 86 | Q | A | 0.0000 | |
| 87 | E | A | -2.7711 | |
| 88 | K | A | -2.8862 | |
| 89 | L | A | 0.0000 | |
| 90 | D | A | 0.0000 | |
| 91 | N | A | -2.1537 | |
| 92 | L | A | -1.3501 | |
| 93 | M | A | 0.0000 | |
| 94 | L | A | -1.3800 | |
| 95 | E | A | -2.0002 | |
| 96 | L | A | -0.7207 | |
| 97 | D | A | 0.0000 | |
| 98 | G | A | -1.6839 | |
| 99 | T | A | -1.9097 | |
| 100 | E | A | -2.5696 | |
| 101 | N | A | -1.7867 | |
| 102 | K | A | 0.0000 | |
| 103 | S | A | -1.3691 | |
| 104 | K | A | -1.8460 | |
| 105 | F | A | 0.0000 | |
| 106 | G | A | 0.0000 | |
| 107 | A | A | 0.0000 | |
| 108 | N | A | 0.0000 | |
| 109 | A | A | 0.0000 | |
| 110 | I | A | 0.0000 | |
| 111 | L | A | 0.0000 | |
| 112 | G | A | 0.0000 | |
| 113 | V | A | 0.0000 | |
| 114 | S | A | 0.0000 | |
| 115 | L | A | 0.0000 | |
| 116 | A | A | 0.0000 | |
| 117 | V | A | 0.0000 | |
| 118 | C | A | 0.0000 | |
| 119 | K | A | -0.0938 | |
| 120 | A | A | 0.0000 | |
| 121 | G | A | 0.0000 | |
| 122 | A | A | 0.0000 | |
| 123 | A | A | -1.3891 | |
| 124 | E | A | -1.8898 | |
| 125 | R | A | -2.5872 | |
| 126 | E | A | -2.4735 | |
| 127 | L | A | -0.6388 | |
| 128 | P | A | -0.4656 | |
| 129 | L | A | -0.1511 | |
| 130 | Y | A | 0.0000 | |
| 131 | R | A | -0.8920 | |
| 132 | H | A | 0.0000 | |
| 133 | I | A | 0.0000 | |
| 134 | A | A | 0.0000 | |
| 135 | Q | A | -1.4851 | |
| 136 | L | A | -0.8964 | |
| 137 | A | A | 0.0000 | |
| 138 | G | A | -1.2053 | |
| 139 | N | A | -1.4800 | |
| 140 | S | A | -1.6981 | |
| 141 | D | A | -2.7202 | |
| 142 | L | A | 0.0000 | |
| 143 | I | A | 0.0000 | |
| 144 | L | A | 0.0000 | |
| 145 | P | A | 0.0000 | |
| 146 | V | A | 0.0000 | |
| 147 | P | A | 0.0000 | |
| 148 | A | A | 0.0000 | |
| 149 | F | A | 0.0000 | |
| 150 | N | A | 0.0000 | |
| 151 | V | A | 0.0000 | |
| 152 | I | A | 0.0000 | |
| 153 | N | A | 0.0000 | |
| 154 | G | A | 0.0000 | |
| 155 | G | A | 0.0000 | |
| 156 | S | A | -0.2606 | |
| 157 | H | A | 0.0000 | |
| 158 | A | A | -0.6165 | |
| 159 | G | A | 0.0000 | |
| 160 | N | A | 0.0000 | |
| 161 | K | A | -1.3124 | |
| 162 | L | A | 0.0000 | |
| 163 | A | A | 0.0000 | |
| 164 | M | A | 0.0000 | |
| 165 | Q | A | 0.0000 | |
| 166 | E | A | 0.0000 | |
| 167 | F | A | 0.0000 | |
| 168 | M | A | 0.0000 | |
| 169 | I | A | 0.0000 | |
| 170 | L | A | 0.0000 | |
| 171 | P | A | 0.0000 | |
| 172 | V | A | 0.0000 | |
| 173 | G | A | -1.6625 | |
| 174 | A | A | 0.0000 | |
| 175 | E | A | -2.4146 | |
| 176 | S | A | -1.7090 | |
| 177 | F | A | 0.0000 | |
| 178 | R | A | -1.5784 | |
| 179 | D | A | -1.5279 | |
| 180 | A | A | 0.0000 | |
| 181 | M | A | 0.0000 | |
| 182 | R | A | -0.8192 | |
| 183 | L | A | 0.0000 | |
| 184 | G | A | 0.0000 | |
| 185 | A | A | 0.0000 | |
| 186 | E | A | 0.0000 | |
| 187 | V | A | 0.0000 | |
| 188 | Y | A | 0.0000 | |
| 189 | H | A | -0.3966 | |
| 190 | T | A | -1.0359 | |
| 191 | L | A | 0.0000 | |
| 192 | K | A | -1.5662 | |
| 193 | G | A | -1.7720 | |
| 194 | V | A | 0.0000 | |
| 195 | I | A | 0.0000 | |
| 196 | K | A | -3.1953 | |
| 197 | D | A | -3.3321 | |
| 198 | K | A | -2.8810 | |
| 199 | Y | A | -2.0980 | |
| 200 | G | A | -2.5360 | |
| 201 | K | A | -2.6046 | |
| 202 | D | A | -2.8323 | |
| 203 | A | A | 0.0000 | |
| 204 | T | A | 0.0000 | |
| 205 | N | A | -1.0610 | |
| 206 | V | A | 0.0000 | |
| 207 | G | A | 0.0000 | |
| 208 | D | A | -0.3060 | |
| 209 | E | A | 0.0000 | |
| 210 | G | A | 0.0000 | |
| 211 | G | A | 0.0000 | |
| 212 | F | A | 0.0000 | |
| 213 | A | A | 0.0000 | |
| 214 | P | A | 0.0000 | |
| 215 | N | A | -2.0305 | |
| 216 | I | A | 0.0000 | |
| 217 | L | A | -0.7326 | |
| 218 | E | A | -1.9266 | |
| 219 | N | A | 0.0000 | |
| 220 | S | A | -1.3054 | |
| 221 | E | A | -1.3468 | |
| 222 | A | A | 0.0000 | |
| 223 | L | A | 0.0000 | |
| 224 | E | A | -2.4045 | |
| 225 | L | A | 0.0000 | |
| 226 | V | A | 0.0000 | |
| 227 | K | A | -2.0061 | |
| 228 | E | A | -2.8411 | |
| 229 | A | A | 0.0000 | |
| 230 | I | A | 0.0000 | |
| 231 | D | A | -2.8775 | |
| 232 | K | A | -2.7563 | |
| 233 | A | A | -1.7135 | |
| 234 | G | A | -1.8477 | |
| 235 | Y | A | -1.5623 | |
| 236 | T | A | -2.1596 | |
| 237 | E | A | -2.5164 | |
| 238 | K | A | -2.4369 | |
| 239 | I | A | 0.0000 | |
| 240 | V | A | -0.5773 | |
| 241 | I | A | 0.0000 | |
| 242 | G | A | 0.0000 | |
| 243 | M | A | 0.0000 | |
| 244 | D | A | 0.0000 | |
| 245 | V | A | 0.0000 | |
| 246 | A | A | 0.0000 | |
| 247 | A | A | 0.0000 | |
| 248 | S | A | -0.1737 | |
| 249 | E | A | -0.3670 | |
| 250 | F | A | 0.0000 | |
| 251 | Y | A | -0.8314 | |
| 252 | R | A | -1.6834 | |
| 253 | D | A | -2.4528 | |
| 254 | G | A | -1.8962 | |
| 255 | K | A | -1.9304 | |
| 256 | Y | A | 0.0000 | |
| 257 | D | A | 0.0000 | |
| 258 | L | A | -0.1098 | |
| 259 | D | A | -0.4968 | |
| 260 | F | A | -0.3324 | |
| 261 | K | A | -0.3739 | |
| 262 | S | A | -0.5603 | |
| 263 | P | A | -0.5983 | |
| 264 | T | A | -0.7994 | |
| 265 | D | A | -1.3314 | |
| 266 | P | A | -1.2560 | |
| 267 | S | A | -0.7578 | |
| 268 | R | A | -0.7510 | |
| 269 | Y | A | -0.8076 | |
| 270 | I | A | -0.6421 | |
| 271 | T | A | -1.3772 | |
| 272 | G | A | -1.4282 | |
| 273 | D | A | -2.5014 | |
| 274 | Q | A | -1.8245 | |
| 275 | L | A | 0.0000 | |
| 276 | G | A | -1.4631 | |
| 277 | A | A | -0.9851 | |
| 278 | L | A | -0.6652 | |
| 279 | Y | A | 0.0000 | |
| 280 | Q | A | -1.6152 | |
| 281 | D | A | -1.9404 | |
| 282 | F | A | 0.0000 | |
| 283 | V | A | -1.2702 | |
| 284 | R | A | -2.8707 | |
| 285 | D | A | -2.9716 | |
| 286 | Y | A | -1.5957 | |
| 287 | P | A | -0.7935 | |
| 288 | V | A | 0.0000 | |
| 289 | V | A | 0.4237 | |
| 290 | S | A | 0.0000 | |
| 291 | I | A | 0.0000 | |
| 292 | E | A | 0.0000 | |
| 293 | D | A | 0.0000 | |
| 294 | P | A | 0.0000 | |
| 295 | F | A | 0.0000 | |
| 296 | D | A | 0.0000 | |
| 297 | Q | A | 0.0000 | |
| 298 | D | A | -1.1316 | |
| 299 | D | A | -0.9652 | |
| 300 | W | A | 0.0000 | |
| 301 | A | A | -1.0801 | |
| 302 | A | A | -1.1637 | |
| 303 | W | A | 0.0000 | |
| 304 | S | A | -2.1371 | |
| 305 | K | A | -2.5727 | |
| 306 | F | A | 0.0000 | |
| 307 | T | A | -1.3064 | |
| 308 | A | A | -1.4345 | |
| 309 | N | A | -1.6856 | |
| 310 | V | A | -0.7093 | |
| 311 | G | A | -0.3970 | |
| 312 | I | A | -0.0437 | |
| 313 | Q | A | 0.0000 | |
| 314 | I | A | 0.0000 | |
| 315 | V | A | 0.0000 | |
| 316 | G | A | 0.0000 | |
| 317 | D | A | 0.0000 | |
| 318 | D | A | 0.0000 | |
| 319 | L | A | 0.0000 | |
| 320 | T | A | 0.0000 | |
| 321 | V | A | 0.0000 | |
| 322 | T | A | 0.0000 | |
| 323 | N | A | -1.2209 | |
| 324 | P | A | -2.0495 | |
| 325 | K | A | -2.8046 | |
| 326 | R | A | -2.0629 | |
| 327 | I | A | 0.0000 | |
| 328 | E | A | -4.0193 | |
| 329 | R | A | -4.0153 | |
| 330 | A | A | 0.0000 | |
| 331 | V | A | -3.1597 | |
| 332 | E | A | -4.0588 | |
| 333 | E | A | -4.0422 | |
| 334 | K | A | -3.7137 | |
| 335 | A | A | 0.0000 | |
| 336 | C | A | 0.0000 | |
| 337 | N | A | -1.0946 | |
| 338 | C | A | 0.0000 | |
| 339 | L | A | 0.0000 | |
| 340 | L | A | 0.0000 | |
| 341 | L | A | 0.0000 | |
| 342 | K | A | 0.0000 | |
| 343 | V | A | 0.0000 | |
| 344 | N | A | 0.0000 | |
| 345 | Q | A | 0.0000 | |
| 346 | I | A | 0.0000 | |
| 347 | G | A | 0.0000 | |
| 348 | S | A | 0.0000 | |
| 349 | V | A | 0.0000 | |
| 350 | T | A | -1.1821 | |
| 351 | E | A | -1.1424 | |
| 352 | A | A | 0.0000 | |
| 353 | I | A | 0.0000 | |
| 354 | Q | A | -1.4374 | |
| 355 | A | A | 0.0000 | |
| 356 | C | A | 0.0000 | |
| 357 | K | A | -2.1752 | |
| 358 | L | A | -1.8357 | |
| 359 | A | A | 0.0000 | |
| 360 | Q | A | -2.5539 | |
| 361 | E | A | -2.7682 | |
| 362 | N | A | -2.4639 | |
| 363 | G | A | -1.9600 | |
| 364 | W | A | 0.0000 | |
| 365 | G | A | 0.0000 | |
| 366 | V | A | 0.0000 | |
| 367 | M | A | 0.0000 | |
| 368 | V | A | 0.0000 | |
| 369 | S | A | 0.0000 | |
| 370 | H | A | 0.0000 | |
| 371 | R | A | 0.0000 | |
| 372 | S | A | 0.0000 | |
| 373 | G | A | 0.0000 | |
| 374 | E | A | 0.0000 | |
| 375 | T | A | 0.0000 | |
| 376 | E | A | -0.5063 | |
| 377 | D | A | -0.4948 | |
| 378 | T | A | -0.2385 | |
| 379 | F | A | 0.0000 | |
| 380 | I | A | 0.0000 | |
| 381 | A | A | 0.0000 | |
| 382 | D | A | 0.0000 | |
| 383 | L | A | 0.0000 | |
| 384 | V | A | 0.0000 | |
| 385 | V | A | 0.0000 | |
| 386 | G | A | 0.0000 | |
| 387 | L | A | 0.0000 | |
| 388 | C | A | -0.5063 | |
| 389 | T | A | 0.0000 | |
| 390 | G | A | 0.0000 | |
| 391 | Q | A | 0.0000 | |
| 392 | I | A | 0.0000 | |
| 393 | K | A | 0.0000 | |
| 394 | T | A | 0.0000 | |
| 395 | G | A | 0.0000 | |
| 396 | A | A | 0.0000 | |
| 397 | P | A | 0.0000 | |
| 398 | C | A | 0.0000 | |
| 399 | R | A | 0.0000 | |
| 400 | S | A | 0.0000 | |
| 401 | E | A | 0.0000 | |
| 402 | R | A | 0.0000 | |
| 403 | L | A | 0.0000 | |
| 404 | A | A | 0.0000 | |
| 405 | K | A | 0.0000 | |
| 406 | Y | A | 0.0000 | |
| 407 | N | A | 0.0000 | |
| 408 | Q | A | -0.3414 | |
| 409 | L | A | 0.0000 | |
| 410 | M | A | 0.0000 | |
| 411 | R | A | -1.1747 | |
| 412 | I | A | 0.0000 | |
| 413 | E | A | -2.1214 | |
| 414 | E | A | -2.2928 | |
| 415 | E | A | -2.8088 | |
| 416 | L | A | 0.0000 | |
| 417 | G | A | -2.9802 | |
| 418 | D | A | -3.5833 | |
| 419 | E | A | -3.8591 | |
| 420 | A | A | -3.1984 | |
| 421 | R | A | -3.1317 | |
| 422 | F | A | -1.4048 | |
| 423 | A | A | 0.0000 | |
| 424 | G | A | -1.4463 | |
| 425 | H | A | -1.6739 | |
| 426 | N | A | -1.3301 | |
| 427 | F | A | 0.0000 | |
| 428 | R | A | -1.8505 | |
| 429 | N | A | -1.6947 | |
| 430 | P | A | 0.0000 | |
| 431 | S | A | -0.4056 | |
| 432 | V | A | 1.0827 | |
| 433 | L | A | -0.2619 | |
| 434 | H | A | -1.1233 | |
| 1 | S | B | -0.8448 | |
| 2 | I | B | 0.0000 | |
| 3 | E | B | -2.4397 | |
| 4 | K | B | -2.0695 | |
| 5 | I | B | 0.0000 | |
| 6 | W | B | -0.1597 | |
| 7 | A | B | 0.0000 | |
| 8 | R | B | 0.0000 | |
| 9 | E | B | -0.3092 | |
| 10 | I | B | 0.0000 | |
| 11 | L | B | 0.0000 | |
| 12 | D | B | 0.0000 | |
| 13 | S | B | 0.0000 | |
| 14 | R | B | -0.7007 | |
| 15 | G | B | 0.0000 | |
| 16 | N | B | 0.0000 | |
| 17 | P | B | 0.0000 | |
| 18 | T | B | 0.0000 | |
| 19 | V | B | 0.0000 | |
| 20 | E | B | 0.0000 | |
| 21 | V | B | 0.0000 | |
| 22 | D | B | 0.0000 | |
| 23 | L | B | 0.0000 | |
| 24 | Y | B | -0.5186 | |
| 25 | T | B | 0.0000 | |
| 26 | A | B | -0.6415 | |
| 27 | K | B | -1.1338 | |
| 28 | G | B | -0.0939 | |
| 29 | L | B | 0.5218 | |
| 30 | F | B | 0.1956 | |
| 31 | R | B | -0.6057 | |
| 32 | A | B | 0.0000 | |
| 33 | A | B | 0.0000 | |
| 34 | V | B | 0.0000 | |
| 35 | P | B | -0.2168 | |
| 36 | S | B | -0.2704 | |
| 37 | G | B | -0.2029 | |
| 38 | A | B | -0.1797 | |
| 39 | S | B | -0.3678 | |
| 40 | T | B | 0.1822 | |
| 41 | G | B | 0.7371 | |
| 42 | I | B | 1.8052 | |
| 43 | Y | B | 0.5516 | |
| 44 | E | B | 0.0164 | |
| 45 | A | B | 0.0000 | |
| 46 | L | B | -0.1314 | |
| 47 | E | B | 0.0000 | |
| 48 | L | B | -0.6130 | |
| 49 | R | B | -1.1495 | |
| 50 | D | B | -1.7594 | |
| 51 | G | B | -2.0664 | |
| 52 | D | B | -2.5217 | |
| 53 | K | B | -2.8350 | |
| 54 | Q | B | -2.3852 | |
| 55 | R | B | -1.8252 | |
| 56 | Y | B | 0.0000 | |
| 57 | L | B | -1.0335 | |
| 58 | G | B | -2.0888 | |
| 59 | K | B | -1.6817 | |
| 60 | G | B | 0.0000 | |
| 61 | V | B | 0.0000 | |
| 62 | L | B | -0.7672 | |
| 63 | K | B | -2.0080 | |
| 64 | A | B | 0.0000 | |
| 65 | V | B | -0.9925 | |
| 66 | D | B | -2.1910 | |
| 67 | H | B | -1.5236 | |
| 68 | I | B | 0.0000 | |
| 69 | N | B | -1.2254 | |
| 70 | S | B | -0.8900 | |
| 71 | T | B | -0.5494 | |
| 72 | I | B | 0.0000 | |
| 73 | A | B | 0.0000 | |
| 74 | P | B | -0.5745 | |
| 75 | A | B | 0.0528 | |
| 76 | L | B | 0.0000 | |
| 77 | I | B | -0.4399 | |
| 78 | S | B | -0.3119 | |
| 79 | S | B | -0.3073 | |
| 80 | G | B | -0.5623 | |
| 81 | L | B | -0.3364 | |
| 82 | S | B | -0.3772 | |
| 83 | V | B | 0.0000 | |
| 84 | V | B | -0.8352 | |
| 85 | E | B | -1.2444 | |
| 86 | Q | B | 0.0000 | |
| 87 | E | B | -2.5662 | |
| 88 | K | B | -2.6382 | |
| 89 | L | B | 0.0000 | |
| 90 | D | B | 0.0000 | |
| 91 | N | B | -2.1114 | |
| 92 | L | B | -1.1535 | |
| 93 | M | B | 0.0000 | |
| 94 | L | B | -1.2426 | |
| 95 | E | B | -1.9310 | |
| 96 | L | B | -0.6720 | |
| 97 | D | B | 0.0000 | |
| 98 | G | B | -1.5835 | |
| 99 | T | B | -1.7377 | |
| 100 | E | B | -2.1344 | |
| 101 | N | B | -1.0243 | |
| 102 | K | B | 0.0000 | |
| 103 | S | B | -1.1532 | |
| 104 | K | B | -1.5067 | |
| 105 | F | B | 0.0000 | |
| 106 | G | B | 0.0000 | |
| 107 | A | B | 0.0000 | |
| 108 | N | B | 0.0000 | |
| 109 | A | B | 0.0000 | |
| 110 | I | B | 0.0000 | |
| 111 | L | B | 0.0000 | |
| 112 | G | B | 0.0000 | |
| 113 | V | B | 0.0000 | |
| 114 | S | B | 0.0000 | |
| 115 | L | B | 0.0000 | |
| 116 | A | B | 0.0000 | |
| 117 | V | B | 0.0000 | |
| 118 | C | B | 0.0000 | |
| 119 | K | B | -0.1996 | |
| 120 | A | B | 0.0000 | |
| 121 | G | B | 0.0000 | |
| 122 | A | B | 0.0000 | |
| 123 | A | B | -1.5793 | |
| 124 | E | B | -2.1369 | |
| 125 | R | B | -2.7908 | |
| 126 | E | B | -2.7730 | |
| 127 | L | B | -1.2518 | |
| 128 | P | B | -0.9222 | |
| 129 | L | B | -0.5361 | |
| 130 | Y | B | 0.0000 | |
| 131 | R | B | -1.6538 | |
| 132 | H | B | 0.0000 | |
| 133 | I | B | 0.0000 | |
| 134 | A | B | 0.0000 | |
| 135 | Q | B | -1.6705 | |
| 136 | L | B | -0.9701 | |
| 137 | A | B | 0.0000 | |
| 138 | G | B | -1.3290 | |
| 139 | N | B | -1.5769 | |
| 140 | S | B | -1.7304 | |
| 141 | D | B | -2.2472 | |
| 142 | L | B | -1.3996 | |
| 143 | I | B | 0.0000 | |
| 144 | L | B | 0.0000 | |
| 145 | P | B | 0.0000 | |
| 146 | V | B | 0.0000 | |
| 147 | P | B | 0.0000 | |
| 148 | A | B | 0.0000 | |
| 149 | F | B | 0.0000 | |
| 150 | N | B | 0.0000 | |
| 151 | V | B | 0.0000 | |
| 152 | I | B | 0.0000 | |
| 153 | N | B | 0.0000 | |
| 154 | G | B | 0.0000 | |
| 155 | G | B | 0.0000 | |
| 156 | S | B | -0.7410 | |
| 157 | H | B | -0.5062 | |
| 158 | A | B | 0.0000 | |
| 159 | G | B | -1.8612 | |
| 160 | N | B | 0.0000 | |
| 161 | K | B | -1.3345 | |
| 162 | L | B | 0.0000 | |
| 163 | A | B | 0.0000 | |
| 164 | M | B | 0.0000 | |
| 165 | Q | B | -0.3860 | |
| 166 | E | B | 0.0000 | |
| 167 | F | B | 0.0000 | |
| 168 | M | B | 0.0000 | |
| 169 | I | B | 0.0000 | |
| 170 | L | B | 0.0000 | |
| 171 | P | B | 0.0000 | |
| 172 | V | B | 0.0000 | |
| 173 | G | B | -1.4267 | |
| 174 | A | B | 0.0000 | |
| 175 | E | B | -2.2987 | |
| 176 | S | B | -1.6087 | |
| 177 | F | B | 0.0000 | |
| 178 | R | B | -1.3443 | |
| 179 | D | B | -1.2706 | |
| 180 | A | B | 0.0000 | |
| 181 | M | B | 0.0000 | |
| 182 | R | B | -0.5175 | |
| 183 | L | B | 0.0000 | |
| 184 | G | B | 0.0000 | |
| 185 | A | B | 0.0000 | |
| 186 | E | B | 0.0000 | |
| 187 | V | B | 0.0000 | |
| 188 | Y | B | 0.0000 | |
| 189 | H | B | -0.3579 | |
| 190 | T | B | -1.0865 | |
| 191 | L | B | 0.0000 | |
| 192 | K | B | -1.3371 | |
| 193 | G | B | -1.6805 | |
| 194 | V | B | 0.0000 | |
| 195 | I | B | 0.0000 | |
| 196 | K | B | -3.0485 | |
| 197 | D | B | -3.3071 | |
| 198 | K | B | -2.9009 | |
| 199 | Y | B | -2.0859 | |
| 200 | G | B | -2.1331 | |
| 201 | K | B | -2.4158 | |
| 202 | D | B | -2.4081 | |
| 203 | A | B | 0.0000 | |
| 204 | T | B | 0.0000 | |
| 205 | N | B | 0.0000 | |
| 206 | V | B | 0.0000 | |
| 207 | G | B | -0.6254 | |
| 208 | D | B | -0.8213 | |
| 209 | E | B | 0.0000 | |
| 210 | G | B | 0.0000 | |
| 211 | G | B | 0.0000 | |
| 212 | F | B | 0.0000 | |
| 213 | A | B | -0.6906 | |
| 214 | P | B | 0.0000 | |
| 215 | N | B | -1.8016 | |
| 216 | I | B | 0.0000 | |
| 217 | L | B | -1.0133 | |
| 218 | E | B | -2.1833 | |
| 219 | N | B | 0.0000 | |
| 220 | S | B | -1.6696 | |
| 221 | E | B | -1.8857 | |
| 222 | A | B | 0.0000 | |
| 223 | L | B | 0.0000 | |
| 224 | E | B | -2.8077 | |
| 225 | L | B | 0.0000 | |
| 226 | V | B | 0.0000 | |
| 227 | K | B | -2.7060 | |
| 228 | E | B | -3.2980 | |
| 229 | A | B | 0.0000 | |
| 230 | I | B | 0.0000 | |
| 231 | D | B | -3.7890 | |
| 232 | K | B | -3.2266 | |
| 233 | A | B | -1.9780 | |
| 234 | G | B | -2.1829 | |
| 235 | Y | B | 0.0000 | |
| 236 | T | B | -2.4584 | |
| 237 | E | B | -2.4317 | |
| 238 | K | B | -1.9923 | |
| 239 | I | B | 0.0000 | |
| 240 | V | B | -0.3254 | |
| 241 | I | B | 0.0000 | |
| 242 | G | B | 0.0000 | |
| 243 | M | B | 0.0000 | |
| 244 | D | B | 0.0000 | |
| 245 | V | B | 0.0000 | |
| 246 | A | B | -0.5475 | |
| 247 | A | B | 0.0000 | |
| 248 | S | B | -1.0503 | |
| 249 | E | B | -1.1806 | |
| 250 | F | B | 0.0000 | |
| 251 | Y | B | -0.8910 | |
| 252 | R | B | -1.7657 | |
| 253 | D | B | -2.4520 | |
| 254 | G | B | -1.7889 | |
| 255 | K | B | -1.9453 | |
| 256 | Y | B | 0.0000 | |
| 257 | D | B | 0.0000 | |
| 258 | L | B | -0.2151 | |
| 259 | D | B | -0.7414 | |
| 260 | F | B | -0.6556 | |
| 261 | K | B | -0.6827 | |
| 262 | S | B | -0.6818 | |
| 263 | P | B | -0.6689 | |
| 264 | T | B | -0.8774 | |
| 265 | D | B | -1.4011 | |
| 266 | P | B | -1.3441 | |
| 267 | S | B | -0.8083 | |
| 268 | R | B | -0.8298 | |
| 269 | Y | B | -0.9047 | |
| 270 | I | B | -0.7313 | |
| 271 | T | B | -1.2472 | |
| 272 | G | B | -1.6467 | |
| 273 | D | B | -2.6212 | |
| 274 | Q | B | -2.0534 | |
| 275 | L | B | 0.0000 | |
| 276 | G | B | -1.5958 | |
| 277 | A | B | -1.2530 | |
| 278 | L | B | -0.9994 | |
| 279 | Y | B | 0.0000 | |
| 280 | Q | B | -1.9495 | |
| 281 | D | B | -2.5597 | |
| 282 | F | B | 0.0000 | |
| 283 | V | B | -1.5390 | |
| 284 | R | B | -3.0989 | |
| 285 | D | B | -3.1756 | |
| 286 | Y | B | -1.7284 | |
| 287 | P | B | -0.7653 | |
| 288 | V | B | 0.0000 | |
| 289 | V | B | 0.3817 | |
| 290 | S | B | 0.0000 | |
| 291 | I | B | 0.0000 | |
| 292 | E | B | 0.0000 | |
| 293 | D | B | 0.0000 | |
| 294 | P | B | 0.0000 | |
| 295 | F | B | 0.0000 | |
| 296 | D | B | 0.0000 | |
| 297 | Q | B | -1.5723 | |
| 298 | D | B | -2.1600 | |
| 299 | D | B | -1.3612 | |
| 300 | W | B | 0.0000 | |
| 301 | A | B | -0.8995 | |
| 302 | A | B | -1.2491 | |
| 303 | W | B | 0.0000 | |
| 304 | S | B | -2.0183 | |
| 305 | K | B | -2.5380 | |
| 306 | F | B | 0.0000 | |
| 307 | T | B | -1.3026 | |
| 308 | A | B | -1.4181 | |
| 309 | N | B | -1.6774 | |
| 310 | V | B | -0.7407 | |
| 311 | G | B | -0.4446 | |
| 312 | I | B | 0.0000 | |
| 313 | Q | B | 0.0000 | |
| 314 | I | B | 0.0000 | |
| 315 | V | B | 0.0000 | |
| 316 | G | B | 0.0000 | |
| 317 | D | B | -0.6142 | |
| 318 | D | B | -1.1337 | |
| 319 | L | B | 0.0000 | |
| 320 | T | B | 0.0000 | |
| 321 | V | B | 0.0000 | |
| 322 | T | B | 0.0000 | |
| 323 | N | B | -1.2575 | |
| 324 | P | B | -1.8084 | |
| 325 | K | B | -2.6242 | |
| 326 | R | B | 0.0000 | |
| 327 | I | B | 0.0000 | |
| 328 | E | B | -3.7669 | |
| 329 | R | B | -3.5119 | |
| 330 | A | B | 0.0000 | |
| 331 | V | B | -2.9887 | |
| 332 | E | B | -3.6326 | |
| 333 | E | B | -3.2936 | |
| 334 | K | B | -3.2844 | |
| 335 | A | B | 0.0000 | |
| 336 | C | B | 0.0000 | |
| 337 | N | B | -0.9550 | |
| 338 | C | B | 0.0000 | |
| 339 | L | B | 0.0000 | |
| 340 | L | B | 0.0000 | |
| 341 | L | B | 0.0000 | |
| 342 | K | B | 0.0000 | |
| 343 | V | B | 0.0000 | |
| 344 | N | B | 0.0000 | |
| 345 | Q | B | 0.0000 | |
| 346 | I | B | 0.0000 | |
| 347 | G | B | 0.0000 | |
| 348 | S | B | 0.0000 | |
| 349 | V | B | 0.0000 | |
| 350 | T | B | -1.2731 | |
| 351 | E | B | -1.2684 | |
| 352 | A | B | 0.0000 | |
| 353 | I | B | 0.0000 | |
| 354 | Q | B | -1.6102 | |
| 355 | A | B | 0.0000 | |
| 356 | C | B | 0.0000 | |
| 357 | K | B | -2.1127 | |
| 358 | L | B | -1.7799 | |
| 359 | A | B | 0.0000 | |
| 360 | Q | B | -2.4426 | |
| 361 | E | B | -2.8237 | |
| 362 | N | B | -2.6408 | |
| 363 | G | B | -1.9668 | |
| 364 | W | B | 0.0000 | |
| 365 | G | B | 0.0000 | |
| 366 | V | B | 0.0000 | |
| 367 | M | B | 0.0000 | |
| 368 | V | B | 0.0000 | |
| 369 | S | B | 0.0000 | |
| 370 | H | B | 0.0000 | |
| 371 | R | B | -0.4030 | |
| 372 | S | B | -0.4831 | |
| 373 | G | B | 0.0000 | |
| 374 | E | B | 0.0000 | |
| 375 | T | B | 0.0000 | |
| 376 | E | B | -0.4485 | |
| 377 | D | B | -0.4906 | |
| 378 | T | B | -0.1540 | |
| 379 | F | B | 0.0000 | |
| 380 | I | B | 0.1435 | |
| 381 | A | B | 0.0000 | |
| 382 | D | B | 0.0000 | |
| 383 | L | B | 0.0000 | |
| 384 | V | B | 0.0000 | |
| 385 | V | B | 0.0000 | |
| 386 | G | B | 0.0000 | |
| 387 | L | B | 0.0000 | |
| 388 | C | B | -0.4265 | |
| 389 | T | B | 0.0000 | |
| 390 | G | B | 0.0000 | |
| 391 | Q | B | 0.0000 | |
| 392 | I | B | 0.0000 | |
| 393 | K | B | 0.0000 | |
| 394 | T | B | 0.0000 | |
| 395 | G | B | 0.0000 | |
| 396 | A | B | 0.0000 | |
| 397 | P | B | 0.0000 | |
| 398 | C | B | 0.0000 | |
| 399 | R | B | 0.0000 | |
| 400 | S | B | 0.0000 | |
| 401 | E | B | 0.0000 | |
| 402 | R | B | 0.0000 | |
| 403 | L | B | 0.0000 | |
| 404 | A | B | 0.0000 | |
| 405 | K | B | 0.0000 | |
| 406 | Y | B | 0.0000 | |
| 407 | N | B | 0.0000 | |
| 408 | Q | B | -0.1892 | |
| 409 | L | B | 0.0000 | |
| 410 | M | B | 0.0000 | |
| 411 | R | B | 0.0000 | |
| 412 | I | B | 0.0000 | |
| 413 | E | B | 0.0000 | |
| 414 | E | B | -1.9729 | |
| 415 | E | B | -2.5616 | |
| 416 | L | B | -2.3559 | |
| 417 | G | B | -2.7878 | |
| 418 | D | B | -3.4486 | |
| 419 | E | B | -3.7409 | |
| 420 | A | B | -2.9665 | |
| 421 | R | B | -2.6860 | |
| 422 | F | B | -1.1419 | |
| 423 | A | B | 0.0000 | |
| 424 | G | B | 0.0000 | |
| 425 | H | B | -1.4748 | |
| 426 | N | B | -0.8383 | |
| 427 | F | B | 0.0000 | |
| 428 | R | B | -1.4209 | |
| 429 | N | B | -1.1500 | |
| 430 | P | B | -0.2648 | |
| 431 | S | B | 0.2728 | |
| 432 | V | B | 2.0332 | |
| 433 | L | B | 1.6161 |
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