| Chain sequence(s) |
A: GVNAVHWFRKGLRLHDNPALKECIQGADTIRCVYILDPWFAGSSNVGINRWRFLLQCLEDLDANLRKLNSRLFVIRGQPADVFPRLFKEWNITKLSIEYDSEPFGKERDAAIKKLATEAGVEVIVRISHTLYDLDKIIELNGGQPPLTYKRFQTLVSKMEPLEMPADTITSDVIGKCMTPLSDDHDEKYGVPSLEELGFDTDGLSSAVWPGGETEALTRLERHLERKAWVANFERPRMNANSLLASPTGLSPYLRFGCLSCRLFYFKLTDLYKKVKKNSSPPLSLYGQLLWREFFYTAATNNPRFDKMEGNPICVQIPWDKNPEALAKWAEGRTGFPWIDAIMTQLRQEGWIHHLARHAVACFLTRGDLWISWEEGMKVFEELLLDADWSINAGSWMWLSCSSFFQQFFHCYCPVGFGRRTDPNGDYIRRYLPVLRGFPAKYIYDPWNAPEGIQKVAKCLIGVNYPKPMVNHAEASRLNIERMKQIYQQLSRYR
input PDB |
| Selected Chain(s) | A |
| Distance of aggregation | 10 Å |
| FoldX usage | Yes |
| pH calculations | Yes |
| alphaCutter usage | No |
| Dynamic mode | No |
| Automated mutations | No |
| Downloads | Download all the data |
| Simulation log |
[INFO] Logger: Verbosity set to: 2 - [INFO] (00:00:04)
[WARNING] runJob: Working directory already exists (possibly overwriting previous results -ow
to prevent this behavior) (00:00:04)
[INFO] runJob: Starting aggrescan3d job on: input.pdb with A chain(s) selected (00:00:04)
[INFO] runJob: Creating pdb object from: input.pdb (00:00:04)
[INFO] PDB-Info: The input structure is globular. Max score is recommended for pH analysis. (00:00:07)
[INFO] FoldX: Starting FoldX energy minimization (00:00:07)
[INFO] Analysis: Starting Aggrescan4D on folded.pdb (00:14:45)
[INFO] agg3D: Running pKa-ANI on
/STORAGE/DATA/lcbio/aggreskan/ad9ec4a185ef734/tmp/folded.pdb (00:14:45)
[INFO] Main: Simulation completed successfully. (00:21:44)
|
The table below lists A4D score for protein residues. Residues with A4D score > 0.0000 are marked by yellow rows.
| residue index | residue name | chain | Aggrescan4D score | mutation |
|---|---|---|---|---|
| 2 | G | A | -0.5344 | |
| 3 | V | A | -0.1766 | |
| 4 | N | A | -0.4792 | |
| 5 | A | A | 0.0000 | |
| 6 | V | A | 0.0000 | |
| 7 | H | A | 0.0000 | |
| 8 | W | A | 0.0000 | |
| 9 | F | A | 0.0000 | |
| 10 | R | A | 0.0000 | |
| 11 | K | A | -0.3528 | |
| 12 | G | A | 0.0000 | |
| 13 | L | A | 0.0000 | |
| 14 | R | A | 0.0000 | |
| 15 | L | A | 0.0000 | |
| 16 | H | A | 0.0000 | |
| 17 | D | A | 0.0000 | |
| 18 | N | A | 0.0000 | |
| 19 | P | A | -1.1945 | |
| 20 | A | A | 0.0000 | |
| 21 | L | A | 0.0000 | |
| 22 | K | A | -1.8704 | |
| 23 | E | A | -2.2831 | |
| 24 | C | A | 0.0000 | |
| 25 | I | A | 0.0000 | |
| 26 | Q | A | -2.2501 | |
| 27 | G | A | -1.5089 | |
| 28 | A | A | 0.0000 | |
| 29 | D | A | -0.9370 | |
| 30 | T | A | -0.2804 | |
| 31 | I | A | 0.0000 | |
| 32 | R | A | 0.0072 | |
| 33 | C | A | 0.0000 | |
| 34 | V | A | 0.0000 | |
| 35 | Y | A | 0.1630 | |
| 36 | I | A | -0.0389 | |
| 37 | L | A | 0.0000 | |
| 38 | D | A | 0.1838 | |
| 39 | P | A | 0.4016 | |
| 40 | W | A | 1.4179 | |
| 41 | F | A | 1.2321 | |
| 42 | A | A | 0.4918 | |
| 43 | G | A | -0.0498 | |
| 44 | S | A | 0.1604 | |
| 45 | S | A | 0.0803 | |
| 46 | N | A | -0.6581 | |
| 47 | V | A | -0.2817 | |
| 48 | G | A | -0.2009 | |
| 49 | I | A | 0.1446 | |
| 50 | N | A | -0.2836 | |
| 51 | R | A | -0.3061 | |
| 52 | W | A | 0.0000 | |
| 53 | R | A | -0.2476 | |
| 54 | F | A | 0.0000 | |
| 55 | L | A | 0.0000 | |
| 56 | L | A | 0.0000 | |
| 57 | Q | A | -1.1526 | |
| 58 | C | A | 0.0000 | |
| 59 | L | A | 0.0000 | |
| 60 | E | A | -2.0148 | |
| 61 | D | A | -1.4845 | |
| 62 | L | A | 0.0000 | |
| 63 | D | A | 0.0000 | |
| 64 | A | A | -1.6257 | |
| 65 | N | A | -1.7443 | |
| 66 | L | A | 0.0000 | |
| 67 | R | A | -3.1160 | |
| 68 | K | A | -2.9691 | |
| 69 | L | A | -2.0496 | |
| 70 | N | A | -2.1304 | |
| 71 | S | A | 0.0000 | |
| 72 | R | A | 0.0000 | |
| 73 | L | A | 0.0000 | |
| 74 | F | A | 0.0000 | |
| 75 | V | A | 0.0000 | |
| 76 | I | A | -0.3481 | |
| 77 | R | A | -0.9227 | |
| 78 | G | A | -0.6199 | |
| 79 | Q | A | -0.9210 | |
| 80 | P | A | -0.8050 | |
| 81 | A | A | -1.0236 | |
| 82 | D | A | -2.0083 | |
| 83 | V | A | 0.0000 | |
| 84 | F | A | 0.0000 | |
| 85 | P | A | -2.0561 | |
| 86 | R | A | -3.3065 | |
| 87 | L | A | 0.0000 | |
| 88 | F | A | 0.0000 | |
| 89 | K | A | -3.6267 | |
| 90 | E | A | -3.5253 | |
| 91 | W | A | 0.0000 | |
| 92 | N | A | -2.6630 | |
| 93 | I | A | 0.0000 | |
| 94 | T | A | -1.1259 | |
| 95 | K | A | -0.9337 | |
| 96 | L | A | 0.0000 | |
| 97 | S | A | 0.0000 | |
| 98 | I | A | 0.0000 | |
| 99 | E | A | 0.0000 | |
| 100 | Y | A | -0.1850 | |
| 101 | D | A | 0.0000 | |
| 102 | S | A | 0.0000 | |
| 103 | E | A | 0.0000 | |
| 104 | P | A | 0.0000 | |
| 105 | F | A | 0.5614 | |
| 106 | G | A | 0.0000 | |
| 107 | K | A | -1.1189 | |
| 108 | E | A | -1.7542 | |
| 109 | R | A | -1.2114 | |
| 110 | D | A | 0.0000 | |
| 111 | A | A | -1.5621 | |
| 112 | A | A | -1.4093 | |
| 113 | I | A | 0.0000 | |
| 114 | K | A | -2.0710 | |
| 115 | K | A | -2.4712 | |
| 116 | L | A | -1.4762 | |
| 117 | A | A | 0.0000 | |
| 118 | T | A | -2.1848 | |
| 119 | E | A | -2.4332 | |
| 120 | A | A | -1.9825 | |
| 121 | G | A | -1.6917 | |
| 122 | V | A | 0.0000 | |
| 123 | E | A | -1.9254 | |
| 124 | V | A | -0.9323 | |
| 125 | I | A | -0.6206 | |
| 126 | V | A | -0.4332 | |
| 127 | R | A | -1.2867 | |
| 128 | I | A | -0.3566 | |
| 129 | S | A | 0.0000 | |
| 130 | H | A | -0.3385 | |
| 131 | T | A | 0.0000 | |
| 132 | L | A | 0.0000 | |
| 133 | Y | A | 0.0000 | |
| 134 | D | A | -2.2738 | |
| 135 | L | A | 0.0000 | |
| 136 | D | A | -3.5175 | |
| 137 | K | A | -2.9612 | |
| 138 | I | A | 0.0000 | |
| 139 | I | A | 0.0000 | |
| 140 | E | A | -3.0162 | |
| 141 | L | A | -1.6187 | |
| 142 | N | A | -1.7222 | |
| 143 | G | A | -1.6518 | |
| 144 | G | A | -2.1222 | |
| 145 | Q | A | -2.1937 | |
| 146 | P | A | -1.5251 | |
| 147 | P | A | 0.0000 | |
| 148 | L | A | 0.0879 | |
| 149 | T | A | -0.4281 | |
| 150 | Y | A | -0.9939 | |
| 151 | K | A | -2.2869 | |
| 152 | R | A | -2.0900 | |
| 153 | F | A | 0.0000 | |
| 154 | Q | A | -1.4552 | |
| 155 | T | A | -1.4387 | |
| 156 | L | A | 0.0000 | |
| 157 | V | A | 0.0000 | |
| 158 | S | A | -1.3851 | |
| 159 | K | A | -2.1805 | |
| 160 | M | A | -1.9215 | |
| 161 | E | A | -2.5236 | |
| 162 | P | A | -1.5834 | |
| 163 | L | A | -0.9314 | |
| 164 | E | A | -1.5333 | |
| 165 | M | A | 0.0040 | |
| 166 | P | A | -0.2771 | |
| 167 | A | A | -1.1509 | |
| 168 | D | A | -1.7501 | |
| 169 | T | A | -1.1763 | |
| 170 | I | A | 0.0000 | |
| 171 | T | A | -1.1420 | |
| 172 | S | A | -1.5673 | |
| 173 | D | A | -2.0333 | |
| 174 | V | A | -1.4138 | |
| 175 | I | A | -1.2774 | |
| 176 | G | A | -1.8671 | |
| 177 | K | A | -2.1904 | |
| 178 | C | A | 0.0000 | |
| 179 | M | A | -0.0175 | |
| 180 | T | A | 0.0000 | |
| 181 | P | A | 0.3787 | |
| 182 | L | A | 0.1256 | |
| 183 | S | A | -1.8413 | |
| 184 | D | A | -3.2410 | |
| 185 | D | A | -4.1525 | |
| 186 | H | A | 0.0000 | |
| 187 | D | A | -4.0172 | |
| 188 | E | A | -4.3269 | |
| 189 | K | A | -3.8344 | |
| 190 | Y | A | 0.0000 | |
| 191 | G | A | -2.1434 | |
| 192 | V | A | -1.1673 | |
| 193 | P | A | 0.0000 | |
| 194 | S | A | -1.4887 | |
| 195 | L | A | 0.0000 | |
| 196 | E | A | -3.2671 | |
| 197 | E | A | -2.8432 | |
| 198 | L | A | -1.3717 | |
| 199 | G | A | -1.6812 | |
| 200 | F | A | -1.6928 | |
| 201 | D | A | -2.7309 | |
| 202 | T | A | -1.9167 | |
| 203 | D | A | -2.4734 | |
| 204 | G | A | -1.3344 | |
| 205 | L | A | -0.6728 | |
| 206 | S | A | -0.3885 | |
| 207 | S | A | -0.0266 | |
| 208 | A | A | 0.0449 | |
| 209 | V | A | 0.4656 | |
| 210 | W | A | 0.0000 | |
| 211 | P | A | -0.1438 | |
| 212 | G | A | -0.5869 | |
| 213 | G | A | 0.0000 | |
| 214 | E | A | 0.0000 | |
| 215 | T | A | -0.1574 | |
| 216 | E | A | -0.3532 | |
| 217 | A | A | 0.0000 | |
| 218 | L | A | -0.0209 | |
| 219 | T | A | -0.6014 | |
| 220 | R | A | 0.0000 | |
| 221 | L | A | 0.0000 | |
| 222 | E | A | -1.9859 | |
| 223 | R | A | -2.1035 | |
| 224 | H | A | -1.5464 | |
| 225 | L | A | -1.2434 | |
| 226 | E | A | -1.2591 | |
| 227 | R | A | -1.1813 | |
| 228 | K | A | -0.7269 | |
| 229 | A | A | 0.2238 | |
| 230 | W | A | 1.3882 | |
| 231 | V | A | 1.5685 | |
| 232 | A | A | 0.4061 | |
| 233 | N | A | -0.8620 | |
| 234 | F | A | -1.3764 | |
| 235 | E | A | -3.1456 | |
| 236 | R | A | -3.5344 | |
| 237 | P | A | -2.5052 | |
| 238 | R | A | -2.7345 | |
| 239 | M | A | -1.7769 | |
| 240 | N | A | -1.8722 | |
| 241 | A | A | -1.5955 | |
| 242 | N | A | -1.6222 | |
| 243 | S | A | -1.1799 | |
| 244 | L | A | 0.0000 | |
| 245 | L | A | -0.1684 | |
| 246 | A | A | 0.0694 | |
| 247 | S | A | -0.2830 | |
| 248 | P | A | -0.5889 | |
| 249 | T | A | -1.0442 | |
| 250 | G | A | -0.3340 | |
| 251 | L | A | 0.0000 | |
| 252 | S | A | -0.3480 | |
| 253 | P | A | 0.0000 | |
| 254 | Y | A | 0.0000 | |
| 255 | L | A | 0.0000 | |
| 256 | R | A | -0.3560 | |
| 257 | F | A | 0.0000 | |
| 258 | G | A | 0.0000 | |
| 259 | C | A | 0.0000 | |
| 260 | L | A | 0.0000 | |
| 261 | S | A | 0.0000 | |
| 262 | C | A | 0.0000 | |
| 263 | R | A | 0.0000 | |
| 264 | L | A | 0.4482 | |
| 265 | F | A | 0.0000 | |
| 266 | Y | A | -0.1212 | |
| 267 | F | A | -0.1046 | |
| 268 | K | A | -1.0109 | |
| 269 | L | A | 0.0000 | |
| 270 | T | A | -1.4753 | |
| 271 | D | A | -2.8821 | |
| 272 | L | A | -1.9738 | |
| 273 | Y | A | 0.0000 | |
| 274 | K | A | -3.4965 | |
| 275 | K | A | -3.3810 | |
| 276 | V | A | -2.0075 | |
| 277 | K | A | -3.0313 | |
| 278 | K | A | -3.6371 | |
| 279 | N | A | -3.0258 | |
| 280 | S | A | -2.0337 | |
| 281 | S | A | -1.1223 | |
| 282 | P | A | -1.1744 | |
| 283 | P | A | -0.3359 | |
| 284 | L | A | -0.0724 | |
| 285 | S | A | -0.9642 | |
| 286 | L | A | 0.0000 | |
| 287 | Y | A | 0.0000 | |
| 288 | G | A | -1.2173 | |
| 289 | Q | A | -1.6511 | |
| 290 | L | A | 0.0000 | |
| 291 | L | A | 0.0000 | |
| 292 | W | A | -0.0222 | |
| 293 | R | A | -0.2404 | |
| 294 | E | A | 0.0000 | |
| 295 | F | A | 0.0000 | |
| 296 | F | A | 0.0000 | |
| 297 | Y | A | 0.0000 | |
| 298 | T | A | 0.0000 | |
| 299 | A | A | 0.0000 | |
| 300 | A | A | 0.0000 | |
| 301 | T | A | 0.0000 | |
| 302 | N | A | -1.9653 | |
| 303 | N | A | 0.0000 | |
| 304 | P | A | -1.1170 | |
| 305 | R | A | -2.2968 | |
| 306 | F | A | 0.0000 | |
| 307 | D | A | -1.4067 | |
| 308 | K | A | -1.9727 | |
| 309 | M | A | -1.6371 | |
| 310 | E | A | -2.4875 | |
| 311 | G | A | -1.8684 | |
| 312 | N | A | 0.0000 | |
| 313 | P | A | -1.0655 | |
| 314 | I | A | -0.1958 | |
| 315 | C | A | 0.0000 | |
| 316 | V | A | 0.0000 | |
| 317 | Q | A | -1.3871 | |
| 318 | I | A | 0.0000 | |
| 319 | P | A | -0.6684 | |
| 320 | W | A | -0.9159 | |
| 321 | D | A | -1.8051 | |
| 322 | K | A | -2.6787 | |
| 323 | N | A | -2.1608 | |
| 324 | P | A | -2.0031 | |
| 325 | E | A | -2.4130 | |
| 326 | A | A | -1.6577 | |
| 327 | L | A | -1.4205 | |
| 328 | A | A | -1.6532 | |
| 329 | K | A | -2.0509 | |
| 330 | W | A | 0.0000 | |
| 331 | A | A | -1.7091 | |
| 332 | E | A | -2.4336 | |
| 333 | G | A | 0.0000 | |
| 334 | R | A | -1.9427 | |
| 335 | T | A | 0.0000 | |
| 336 | G | A | 0.0000 | |
| 337 | F | A | 0.0000 | |
| 338 | P | A | 0.0000 | |
| 339 | W | A | 0.0000 | |
| 340 | I | A | 0.0000 | |
| 341 | D | A | 0.0000 | |
| 342 | A | A | 0.0000 | |
| 343 | I | A | 0.0000 | |
| 344 | M | A | 0.0000 | |
| 345 | T | A | -1.1554 | |
| 346 | Q | A | 0.0000 | |
| 347 | L | A | 0.0000 | |
| 348 | R | A | -1.8180 | |
| 349 | Q | A | -1.4535 | |
| 350 | E | A | 0.0000 | |
| 351 | G | A | 0.0000 | |
| 352 | W | A | -0.2476 | |
| 353 | I | A | 0.0000 | |
| 354 | H | A | -0.3838 | |
| 355 | H | A | -0.7770 | |
| 356 | L | A | -0.1792 | |
| 357 | A | A | 0.0000 | |
| 358 | R | A | -0.5657 | |
| 359 | H | A | -0.4080 | |
| 360 | A | A | 0.0000 | |
| 361 | V | A | 0.0000 | |
| 362 | A | A | 0.0000 | |
| 363 | C | A | 0.0000 | |
| 364 | F | A | 0.0000 | |
| 365 | L | A | 0.0000 | |
| 366 | T | A | 0.0000 | |
| 367 | R | A | 0.0000 | |
| 368 | G | A | 0.0000 | |
| 369 | D | A | 0.0000 | |
| 370 | L | A | -0.1468 | |
| 371 | W | A | 0.0000 | |
| 372 | I | A | 0.0000 | |
| 373 | S | A | -0.8180 | |
| 374 | W | A | 0.0000 | |
| 375 | E | A | -1.2228 | |
| 376 | E | A | -1.5869 | |
| 377 | G | A | 0.0000 | |
| 378 | M | A | -1.2859 | |
| 379 | K | A | -2.1473 | |
| 380 | V | A | -1.4544 | |
| 381 | F | A | 0.0000 | |
| 382 | E | A | -1.5168 | |
| 383 | E | A | -1.2350 | |
| 384 | L | A | 0.0000 | |
| 385 | L | A | 0.0000 | |
| 386 | L | A | 0.0000 | |
| 387 | D | A | -0.3109 | |
| 388 | A | A | 0.0000 | |
| 389 | D | A | 0.0000 | |
| 390 | W | A | 0.1366 | |
| 391 | S | A | 0.0000 | |
| 392 | I | A | 0.3388 | |
| 393 | N | A | 0.0000 | |
| 394 | A | A | 0.0000 | |
| 395 | G | A | 0.0000 | |
| 396 | S | A | 0.0604 | |
| 397 | W | A | 0.0000 | |
| 398 | M | A | 0.0000 | |
| 399 | W | A | 0.3187 | |
| 400 | L | A | 0.0000 | |
| 401 | S | A | 0.0000 | |
| 402 | C | A | 0.0000 | |
| 403 | S | A | 0.0000 | |
| 404 | S | A | 0.0000 | |
| 405 | F | A | 0.0000 | |
| 406 | F | A | 1.9791 | |
| 407 | Q | A | 0.9529 | |
| 408 | Q | A | 0.5389 | |
| 409 | F | A | 1.6992 | |
| 410 | F | A | 0.7822 | |
| 411 | H | A | -0.1720 | |
| 412 | C | A | 0.1227 | |
| 413 | Y | A | 0.2209 | |
| 414 | C | A | 0.3238 | |
| 415 | P | A | 0.0000 | |
| 416 | V | A | -0.0210 | |
| 417 | G | A | 0.0000 | |
| 418 | F | A | -0.3441 | |
| 419 | G | A | 0.0000 | |
| 420 | R | A | -1.8937 | |
| 421 | R | A | -2.3433 | |
| 422 | T | A | -1.6009 | |
| 423 | D | A | 0.0000 | |
| 424 | P | A | -2.1559 | |
| 425 | N | A | -2.5411 | |
| 426 | G | A | 0.0000 | |
| 427 | D | A | -3.1020 | |
| 428 | Y | A | 0.0000 | |
| 429 | I | A | 0.0000 | |
| 430 | R | A | -2.5111 | |
| 431 | R | A | -2.6069 | |
| 432 | Y | A | 0.0000 | |
| 433 | L | A | 0.0000 | |
| 434 | P | A | -1.0402 | |
| 435 | V | A | -0.5704 | |
| 436 | L | A | 0.0000 | |
| 437 | R | A | -2.5482 | |
| 438 | G | A | -1.3380 | |
| 439 | F | A | 0.0000 | |
| 440 | P | A | -1.0905 | |
| 441 | A | A | -1.8836 | |
| 442 | K | A | -2.1506 | |
| 443 | Y | A | -1.1672 | |
| 444 | I | A | 0.0000 | |
| 445 | Y | A | 0.0000 | |
| 446 | D | A | -0.8725 | |
| 447 | P | A | 0.0000 | |
| 448 | W | A | -1.0150 | |
| 449 | N | A | -1.5596 | |
| 450 | A | A | 0.0000 | |
| 451 | P | A | -1.4268 | |
| 452 | E | A | -2.1418 | |
| 453 | G | A | -1.2399 | |
| 454 | I | A | -0.4970 | |
| 455 | Q | A | -1.4102 | |
| 456 | K | A | -1.8822 | |
| 457 | V | A | 0.1883 | |
| 458 | A | A | -0.9855 | |
| 459 | K | A | -1.9364 | |
| 460 | C | A | 0.0000 | |
| 461 | L | A | -0.4732 | |
| 462 | I | A | 0.0000 | |
| 463 | G | A | -0.3136 | |
| 464 | V | A | 0.9800 | |
| 465 | N | A | -0.3802 | |
| 466 | Y | A | 0.0000 | |
| 467 | P | A | -1.0306 | |
| 468 | K | A | -1.6743 | |
| 469 | P | A | -1.1189 | |
| 470 | M | A | -0.6414 | |
| 471 | V | A | -0.7084 | |
| 472 | N | A | -1.6816 | |
| 473 | H | A | -1.2099 | |
| 474 | A | A | -1.5182 | |
| 475 | E | A | -2.4221 | |
| 476 | A | A | -1.2569 | |
| 477 | S | A | 0.0000 | |
| 478 | R | A | -1.8349 | |
| 479 | L | A | -0.2488 | |
| 480 | N | A | 0.0000 | |
| 481 | I | A | -0.3162 | |
| 482 | E | A | -1.7718 | |
| 483 | R | A | -1.5574 | |
| 484 | M | A | 0.0000 | |
| 485 | K | A | -2.0126 | |
| 486 | Q | A | -2.6254 | |
| 487 | I | A | 0.0000 | |
| 488 | Y | A | -1.4713 | |
| 489 | Q | A | -2.4322 | |
| 490 | Q | A | -2.4053 | |
| 491 | L | A | -1.7251 | |
| 492 | S | A | -1.9028 | |
| 493 | R | A | -2.6733 | |
| 494 | Y | A | -1.7870 | |
| 495 | R | A | -2.4074 |
Calculations for various pH values
This page contains details and comparisons for all models calculated at different pH points.
Please find suggestions on interpreting the results below. More details can be found in the Tutorial.
The input structure is globular. Max score is recommended for pH analysis.
pH |
Average A4D Score |
Max A4D Score |
|||
| 4.0 | -0.683 | 4.6106 | View | CSV | PDB |
| 4.5 | -0.7426 | 4.6106 | View | CSV | PDB |
| 5.0 | -0.8162 | 4.6106 | View | CSV | PDB |
| 5.5 | -0.8898 | 4.6106 | View | CSV | PDB |
| 6.0 | -0.9475 | 4.6106 | View | CSV | PDB |
| 6.5 | -0.9772 | 4.6106 | View | CSV | PDB |
| 7.0 | -0.9776 | 4.6106 | View | CSV | PDB |
| 7.5 | -0.9573 | 4.6106 | View | CSV | PDB |
| 8.0 | -0.9252 | 4.6106 | View | CSV | PDB |
| 8.5 | -0.8849 | 4.6106 | View | CSV | PDB |
| 9.0 | -0.8363 | 4.6106 | View | CSV | PDB |
ALA alanine
ARG arginine
ASN asparagine
ASP aspartic acid
CYS cysteine
GLN glutamine
GLU glutamic acid
GLY glycine
HIS histidine
ILE isoleucine
LEU leucine
LYS lysine
MET methionine
PHE phenylalanine
PRO proline
SER serine
THR threonine
TRP tryptophan
TYR tyrosine
VAL valine