| Chain sequence(s) |
A: ARPCIPKSFGYSSVVCVCNATYCDSFDPPTFPALGTFSRYESTRSGRRMELSMGPIQANHTGTGLLLTLQPEQKFQKVKGFGGAMTDAAALNILALSPPAQNLLLKSYFSEEGIGYNIIRVPMASCDFSIRTYTYADTPDDFQLHNFSLPEEDTKLKIPLIHRALQLAQRPVSLLASPWTSPTWLKTNGAVNGKGSLKGQPGDIYHQTWARYFVKFLDAYAEHKLQFWAVTAENEPSAGLLSGYPFQCLGFTPEHQRDFIARDLGPTLANSTHHNVRLLMLDDQRLLLPHWAKVVLTDPEAAKYVHGIAVHWYLDFLAPAKATLGETHRLFPNTMLFASEACVGSKFWEQSVRLGSWDRGMQYSHSIITNLLYHVVGWTDWNLALNPEGGPNWVRNFVDSPIIVDITKDTFYKQPMFYHLGHFSKFIPEGSQRVGLVASQKNDLDAVALMHPDGSAVVVVLNRSSKDVPLTIKDPAVGFLETISPGYSIHTYLWHRQ
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] (00:00:02)
[WARNING] runJob: Working directory already exists (possibly overwriting previous results -ow
to prevent this behavior) (00:00:02)
[INFO] runJob: Starting aggrescan3d job on: input.pdb with A chain(s) selected (00:00:02)
[INFO] runJob: Creating pdb object from: input.pdb (00:00:02)
[INFO] PDB-Info: The input structure is globular. Max score is recommended for pH analysis. (00:00:03)
[INFO] FoldX: Starting FoldX energy minimization (00:00:03)
[INFO] Analysis: Starting Aggrescan4D on folded.pdb (00:03:50)
[INFO] agg3D: Running pKa-ANI on
/STORAGE/DATA/lcbio/aggreskan/23aef2bb8bda5a2/tmp/folded.pdb (00:03:50)
[INFO] Main: Simulation completed successfully. (00:06:37)
|
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 |
|---|---|---|---|---|
| 1 | A | A | -1.4792 | |
| 2 | R | A | -1.5913 | |
| 3 | P | A | -1.2522 | |
| 4 | C | A | -0.2608 | |
| 5 | I | A | 0.5708 | |
| 6 | P | A | -0.1164 | |
| 7 | K | A | -0.2588 | |
| 8 | S | A | -0.1703 | |
| 9 | F | A | 0.4432 | |
| 10 | G | A | 0.0050 | |
| 11 | Y | A | 0.3750 | |
| 12 | S | A | -0.3960 | |
| 13 | S | A | 0.0000 | |
| 14 | V | A | 0.0000 | |
| 15 | V | A | 0.0000 | |
| 16 | C | A | 0.0000 | |
| 17 | V | A | 0.3481 | |
| 18 | C | A | 0.0000 | |
| 19 | N | A | -0.9167 | |
| 20 | A | A | -0.5325 | |
| 21 | T | A | -0.0285 | |
| 22 | Y | A | 0.0710 | |
| 23 | C | A | 0.0000 | |
| 24 | D | A | -0.8951 | |
| 25 | S | A | -1.4862 | |
| 26 | F | A | -2.0729 | |
| 27 | D | A | -2.5676 | |
| 28 | P | A | -1.6752 | |
| 29 | P | A | -0.8453 | |
| 30 | T | A | 0.2790 | |
| 31 | F | A | 1.4012 | |
| 32 | P | A | 0.0000 | |
| 33 | A | A | 1.0334 | |
| 34 | L | A | 1.3731 | |
| 35 | G | A | 0.4025 | |
| 36 | T | A | 0.4891 | |
| 37 | F | A | 0.0000 | |
| 38 | S | A | 0.0000 | |
| 39 | R | A | 0.0777 | |
| 40 | Y | A | -0.1442 | |
| 41 | E | A | -0.6938 | |
| 42 | S | A | -1.0628 | |
| 43 | T | A | -1.2237 | |
| 44 | R | A | -1.3058 | |
| 45 | S | A | -1.1912 | |
| 46 | G | A | -1.3789 | |
| 47 | R | A | -1.9724 | |
| 48 | R | A | 0.0000 | |
| 49 | M | A | -1.0778 | |
| 50 | E | A | -1.6578 | |
| 51 | L | A | 0.4354 | |
| 52 | S | A | 0.4321 | |
| 53 | M | A | 0.9302 | |
| 54 | G | A | -0.2557 | |
| 55 | P | A | -0.3858 | |
| 56 | I | A | 0.0000 | |
| 57 | Q | A | -1.4079 | |
| 58 | A | A | -0.9294 | |
| 59 | N | A | -1.5729 | |
| 60 | H | A | -1.2863 | |
| 61 | T | A | -0.6648 | |
| 62 | G | A | -0.8206 | |
| 63 | T | A | -0.4189 | |
| 64 | G | A | -0.5597 | |
| 65 | L | A | -0.5079 | |
| 66 | L | A | -0.1855 | |
| 67 | L | A | 0.0000 | |
| 68 | T | A | 0.3358 | |
| 69 | L | A | 0.0000 | |
| 70 | Q | A | -1.3399 | |
| 71 | P | A | -1.8542 | |
| 72 | E | A | -2.9270 | |
| 73 | Q | A | -2.8328 | |
| 74 | K | A | -2.7379 | |
| 75 | F | A | -0.8815 | |
| 76 | Q | A | -1.0026 | |
| 77 | K | A | -2.0976 | |
| 78 | V | A | 0.0000 | |
| 79 | K | A | -0.9483 | |
| 80 | G | A | 0.0000 | |
| 81 | F | A | 0.0000 | |
| 82 | G | A | 0.0000 | |
| 83 | G | A | 0.0000 | |
| 84 | A | A | 0.0000 | |
| 85 | M | A | 0.0000 | |
| 86 | T | A | 0.0000 | |
| 87 | D | A | 0.0000 | |
| 88 | A | A | 0.0000 | |
| 89 | A | A | 0.0000 | |
| 90 | A | A | 0.0000 | |
| 91 | L | A | 0.8990 | |
| 92 | N | A | 0.0000 | |
| 93 | I | A | 0.0000 | |
| 94 | L | A | 0.5029 | |
| 95 | A | A | 0.4746 | |
| 96 | L | A | 0.0000 | |
| 97 | S | A | -0.6332 | |
| 98 | P | A | -0.4266 | |
| 99 | P | A | -0.4457 | |
| 100 | A | A | 0.0000 | |
| 101 | Q | A | 0.0000 | |
| 102 | N | A | -0.5863 | |
| 103 | L | A | -0.3065 | |
| 104 | L | A | 0.0000 | |
| 105 | L | A | 0.0000 | |
| 106 | K | A | -1.2490 | |
| 107 | S | A | 0.0000 | |
| 108 | Y | A | 0.0000 | |
| 109 | F | A | 0.0000 | |
| 110 | S | A | 0.0000 | |
| 111 | E | A | -3.1866 | |
| 112 | E | A | -2.6769 | |
| 113 | G | A | 0.0000 | |
| 114 | I | A | 0.0000 | |
| 115 | G | A | -1.3527 | |
| 116 | Y | A | 0.0000 | |
| 117 | N | A | 0.0000 | |
| 118 | I | A | 0.0000 | |
| 119 | I | A | 0.0000 | |
| 120 | R | A | 0.0000 | |
| 121 | V | A | 0.0000 | |
| 122 | P | A | 0.0000 | |
| 123 | M | A | 0.0000 | |
| 124 | A | A | 0.0000 | |
| 125 | S | A | -0.2728 | |
| 126 | C | A | -0.2452 | |
| 127 | D | A | -0.6672 | |
| 128 | F | A | 0.0000 | |
| 129 | S | A | 0.0000 | |
| 130 | I | A | 0.3407 | |
| 131 | R | A | -1.2715 | |
| 132 | T | A | -0.7213 | |
| 133 | Y | A | 0.0000 | |
| 134 | T | A | -0.3436 | |
| 135 | Y | A | 0.0000 | |
| 136 | A | A | 0.0000 | |
| 137 | D | A | -2.5718 | |
| 138 | T | A | -1.8363 | |
| 139 | P | A | -1.7085 | |
| 140 | D | A | -2.2704 | |
| 141 | D | A | -2.1375 | |
| 142 | F | A | -1.2207 | |
| 143 | Q | A | -1.8966 | |
| 144 | L | A | 0.0000 | |
| 145 | H | A | -2.1754 | |
| 146 | N | A | -2.3755 | |
| 147 | F | A | -1.4427 | |
| 148 | S | A | -0.9778 | |
| 149 | L | A | -0.5357 | |
| 150 | P | A | -1.1040 | |
| 151 | E | A | -2.3483 | |
| 152 | E | A | 0.0000 | |
| 153 | D | A | 0.0000 | |
| 154 | T | A | -1.4723 | |
| 155 | K | A | -2.2048 | |
| 156 | L | A | -0.7645 | |
| 157 | K | A | 0.0000 | |
| 158 | I | A | 0.0000 | |
| 159 | P | A | -0.5224 | |
| 160 | L | A | 0.0000 | |
| 161 | I | A | 0.0000 | |
| 162 | H | A | -0.9170 | |
| 163 | R | A | -0.9103 | |
| 164 | A | A | 0.0000 | |
| 165 | L | A | -0.4059 | |
| 166 | Q | A | -1.2124 | |
| 167 | L | A | -0.9941 | |
| 168 | A | A | -1.3147 | |
| 169 | Q | A | -2.2817 | |
| 170 | R | A | -1.9546 | |
| 171 | P | A | -0.9044 | |
| 172 | V | A | -0.2747 | |
| 173 | S | A | 0.0000 | |
| 174 | L | A | 0.0000 | |
| 175 | L | A | 0.0000 | |
| 176 | A | A | 0.0000 | |
| 177 | S | A | 0.0000 | |
| 178 | P | A | 0.0000 | |
| 179 | W | A | -0.0060 | |
| 180 | T | A | 0.0003 | |
| 181 | S | A | 0.0000 | |
| 182 | P | A | 0.0000 | |
| 183 | T | A | -0.2044 | |
| 184 | W | A | -0.5663 | |
| 185 | L | A | 0.0000 | |
| 186 | K | A | 0.0000 | |
| 187 | T | A | -1.1118 | |
| 188 | N | A | -1.6726 | |
| 189 | G | A | -0.8945 | |
| 190 | A | A | -0.6167 | |
| 191 | V | A | -0.0793 | |
| 192 | N | A | -0.7422 | |
| 193 | G | A | -0.8624 | |
| 194 | K | A | -1.4951 | |
| 195 | G | A | 0.0000 | |
| 196 | S | A | -0.9004 | |
| 197 | L | A | 0.0000 | |
| 198 | K | A | -1.1468 | |
| 199 | G | A | -1.4067 | |
| 200 | Q | A | -1.8512 | |
| 201 | P | A | -1.8494 | |
| 202 | G | A | -1.8560 | |
| 203 | D | A | -1.6189 | |
| 204 | I | A | -0.2206 | |
| 205 | Y | A | -0.4530 | |
| 206 | H | A | 0.0000 | |
| 207 | Q | A | -0.8714 | |
| 208 | T | A | 0.0000 | |
| 209 | W | A | 0.0000 | |
| 210 | A | A | 0.0000 | |
| 211 | R | A | -0.8637 | |
| 212 | Y | A | 0.0000 | |
| 213 | F | A | 0.0000 | |
| 214 | V | A | 0.0000 | |
| 215 | K | A | -0.9928 | |
| 216 | F | A | 0.0000 | |
| 217 | L | A | 0.0000 | |
| 218 | D | A | -1.4240 | |
| 219 | A | A | -1.1396 | |
| 220 | Y | A | 0.0000 | |
| 221 | A | A | -2.1758 | |
| 222 | E | A | -2.7943 | |
| 223 | H | A | -2.3187 | |
| 224 | K | A | -2.8554 | |
| 225 | L | A | 0.0000 | |
| 226 | Q | A | -1.8794 | |
| 227 | F | A | 0.0000 | |
| 228 | W | A | -0.4454 | |
| 229 | A | A | 0.0000 | |
| 230 | V | A | 0.0000 | |
| 231 | T | A | 0.0000 | |
| 232 | A | A | -0.0529 | |
| 233 | E | A | 0.0000 | |
| 234 | N | A | -0.3039 | |
| 235 | E | A | -0.4214 | |
| 236 | P | A | 0.0000 | |
| 237 | S | A | -0.0250 | |
| 238 | A | A | 0.0303 | |
| 239 | G | A | 0.0000 | |
| 240 | L | A | 0.0857 | |
| 241 | L | A | 0.5378 | |
| 242 | S | A | -0.1443 | |
| 243 | G | A | -0.3430 | |
| 244 | Y | A | 0.0070 | |
| 245 | P | A | -0.2047 | |
| 246 | F | A | 0.0658 | |
| 247 | Q | A | -0.2961 | |
| 248 | C | A | 0.0000 | |
| 249 | L | A | 0.0000 | |
| 250 | G | A | 0.0000 | |
| 251 | F | A | 0.0000 | |
| 252 | T | A | -0.5072 | |
| 253 | P | A | 0.0000 | |
| 254 | E | A | -1.6185 | |
| 255 | H | A | -1.2239 | |
| 256 | Q | A | 0.0000 | |
| 257 | R | A | -1.6818 | |
| 258 | D | A | -2.0691 | |
| 259 | F | A | 0.0000 | |
| 260 | I | A | 0.0000 | |
| 261 | A | A | -2.0666 | |
| 262 | R | A | -2.6032 | |
| 263 | D | A | 0.0000 | |
| 264 | L | A | 0.0000 | |
| 265 | G | A | 0.0000 | |
| 266 | P | A | -0.9335 | |
| 267 | T | A | -1.0433 | |
| 268 | L | A | 0.0000 | |
| 269 | A | A | -1.2357 | |
| 270 | N | A | -1.5530 | |
| 271 | S | A | -1.2962 | |
| 272 | T | A | -0.9786 | |
| 273 | H | A | -1.4894 | |
| 274 | H | A | -2.0127 | |
| 275 | N | A | -1.8643 | |
| 276 | V | A | -1.2649 | |
| 277 | R | A | -1.1907 | |
| 278 | L | A | 0.0000 | |
| 279 | L | A | 0.0000 | |
| 280 | M | A | 0.0000 | |
| 281 | L | A | 0.0000 | |
| 282 | D | A | 0.0000 | |
| 283 | D | A | 0.0000 | |
| 284 | Q | A | 0.3179 | |
| 285 | R | A | 0.0000 | |
| 286 | L | A | 1.3941 | |
| 287 | L | A | 0.3305 | |
| 288 | L | A | 0.0000 | |
| 289 | P | A | -0.7822 | |
| 290 | H | A | -1.0922 | |
| 291 | W | A | 0.0000 | |
| 292 | A | A | 0.0000 | |
| 293 | K | A | -1.0601 | |
| 294 | V | A | -0.9508 | |
| 295 | V | A | 0.0000 | |
| 296 | L | A | 0.0000 | |
| 297 | T | A | -0.7569 | |
| 298 | D | A | -1.6188 | |
| 299 | P | A | -1.6642 | |
| 300 | E | A | -2.5555 | |
| 301 | A | A | 0.0000 | |
| 302 | A | A | -1.6863 | |
| 303 | K | A | -2.2207 | |
| 304 | Y | A | -1.1909 | |
| 305 | V | A | 0.0000 | |
| 306 | H | A | -1.2088 | |
| 307 | G | A | 0.0000 | |
| 308 | I | A | 0.0000 | |
| 309 | A | A | 0.0000 | |
| 310 | V | A | 0.0000 | |
| 311 | H | A | 0.0000 | |
| 312 | W | A | 0.7025 | |
| 313 | Y | A | 1.1195 | |
| 314 | L | A | 1.8288 | |
| 315 | D | A | 1.5752 | |
| 316 | F | A | 2.8079 | |
| 317 | L | A | 2.6738 | |
| 318 | A | A | 1.2212 | |
| 319 | P | A | 0.0784 | |
| 320 | A | A | -0.7790 | |
| 321 | K | A | -2.0289 | |
| 322 | A | A | -1.1148 | |
| 323 | T | A | 0.0000 | |
| 324 | L | A | 0.0000 | |
| 325 | G | A | -1.7600 | |
| 326 | E | A | -2.0812 | |
| 327 | T | A | 0.0000 | |
| 328 | H | A | -1.8615 | |
| 329 | R | A | -2.1274 | |
| 330 | L | A | -0.9077 | |
| 331 | F | A | -0.9287 | |
| 332 | P | A | -1.1303 | |
| 333 | N | A | -1.3789 | |
| 334 | T | A | -0.8815 | |
| 335 | M | A | -0.5807 | |
| 336 | L | A | 0.0000 | |
| 337 | F | A | 0.0000 | |
| 338 | A | A | 0.0000 | |
| 339 | S | A | 0.0000 | |
| 340 | E | A | 0.0000 | |
| 341 | A | A | 0.0000 | |
| 342 | C | A | 0.0000 | |
| 343 | V | A | 0.0000 | |
| 344 | G | A | -0.6475 | |
| 345 | S | A | -0.5714 | |
| 346 | K | A | -0.5545 | |
| 347 | F | A | 1.1921 | |
| 348 | W | A | 0.9439 | |
| 349 | E | A | -0.8004 | |
| 350 | Q | A | -1.5091 | |
| 351 | S | A | -1.3088 | |
| 352 | V | A | 0.0000 | |
| 353 | R | A | -0.9734 | |
| 354 | L | A | 0.0000 | |
| 355 | G | A | 0.0000 | |
| 356 | S | A | 0.0000 | |
| 357 | W | A | 0.0000 | |
| 358 | D | A | -1.8891 | |
| 359 | R | A | 0.0000 | |
| 360 | G | A | 0.0000 | |
| 361 | M | A | -1.1538 | |
| 362 | Q | A | -1.2168 | |
| 363 | Y | A | 0.0000 | |
| 364 | S | A | 0.0000 | |
| 365 | H | A | -0.8778 | |
| 366 | S | A | 0.0000 | |
| 367 | I | A | 0.0000 | |
| 368 | I | A | 0.0000 | |
| 369 | T | A | -0.2640 | |
| 370 | N | A | 0.0000 | |
| 371 | L | A | 0.0000 | |
| 372 | L | A | 0.1979 | |
| 373 | Y | A | -0.1515 | |
| 374 | H | A | -0.0930 | |
| 375 | V | A | 0.0000 | |
| 376 | V | A | 0.0000 | |
| 377 | G | A | 0.0000 | |
| 378 | W | A | 0.0000 | |
| 379 | T | A | 0.0000 | |
| 380 | D | A | 0.0000 | |
| 381 | W | A | 0.0000 | |
| 382 | N | A | 0.0000 | |
| 383 | L | A | 0.0000 | |
| 384 | A | A | 0.0000 | |
| 385 | L | A | 0.0000 | |
| 386 | N | A | -0.7929 | |
| 387 | P | A | -1.1453 | |
| 388 | E | A | -2.4035 | |
| 389 | G | A | 0.0000 | |
| 390 | G | A | 0.0000 | |
| 391 | P | A | -0.4288 | |
| 392 | N | A | 0.0000 | |
| 393 | W | A | -0.0602 | |
| 394 | V | A | -0.2846 | |
| 395 | R | A | -2.0697 | |
| 396 | N | A | -1.5554 | |
| 397 | F | A | -1.2750 | |
| 398 | V | A | 0.0000 | |
| 399 | D | A | 0.0000 | |
| 400 | S | A | 0.0000 | |
| 401 | P | A | 0.0000 | |
| 402 | I | A | 0.0000 | |
| 403 | I | A | 0.0000 | |
| 404 | V | A | 0.0000 | |
| 405 | D | A | -0.5804 | |
| 406 | I | A | 0.6226 | |
| 407 | T | A | -0.5035 | |
| 408 | K | A | -2.0667 | |
| 409 | D | A | -2.0637 | |
| 410 | T | A | 0.0000 | |
| 411 | F | A | 0.0000 | |
| 412 | Y | A | 0.0000 | |
| 413 | K | A | 0.0000 | |
| 414 | Q | A | 0.0000 | |
| 415 | P | A | 0.0000 | |
| 416 | M | A | 0.0000 | |
| 417 | F | A | 0.0000 | |
| 418 | Y | A | 0.0000 | |
| 419 | H | A | 0.0000 | |
| 420 | L | A | 0.0000 | |
| 421 | G | A | 0.0000 | |
| 422 | H | A | 0.0000 | |
| 423 | F | A | 0.0000 | |
| 424 | S | A | -0.4040 | |
| 425 | K | A | -1.0191 | |
| 426 | F | A | 0.0000 | |
| 427 | I | A | 0.0000 | |
| 428 | P | A | -1.0443 | |
| 429 | E | A | -1.1129 | |
| 430 | G | A | -1.3089 | |
| 431 | S | A | 0.0000 | |
| 432 | Q | A | -1.2913 | |
| 433 | R | A | 0.0000 | |
| 434 | V | A | 0.0000 | |
| 435 | G | A | 0.0000 | |
| 436 | L | A | 0.7223 | |
| 437 | V | A | 1.5791 | |
| 438 | A | A | 0.1517 | |
| 439 | S | A | -0.5302 | |
| 440 | Q | A | -1.5479 | |
| 441 | K | A | -2.6933 | |
| 442 | N | A | -2.2924 | |
| 443 | D | A | -2.7451 | |
| 444 | L | A | -1.7331 | |
| 445 | D | A | -1.3218 | |
| 446 | A | A | -0.2466 | |
| 447 | V | A | 0.0000 | |
| 448 | A | A | 0.0000 | |
| 449 | L | A | 0.0000 | |
| 450 | M | A | -0.6501 | |
| 451 | H | A | 0.0000 | |
| 452 | P | A | -1.4541 | |
| 453 | D | A | -2.1790 | |
| 454 | G | A | -1.3999 | |
| 455 | S | A | 0.0000 | |
| 456 | A | A | 0.0000 | |
| 457 | V | A | 0.0000 | |
| 458 | V | A | 0.0000 | |
| 459 | V | A | 0.0000 | |
| 460 | V | A | 0.0000 | |
| 461 | L | A | 0.0000 | |
| 462 | N | A | 0.0000 | |
| 463 | R | A | -2.3642 | |
| 464 | S | A | -1.9485 | |
| 465 | S | A | -1.7013 | |
| 466 | K | A | -2.8438 | |
| 467 | D | A | -2.5645 | |
| 468 | V | A | -1.0485 | |
| 469 | P | A | -0.6977 | |
| 470 | L | A | 0.0000 | |
| 471 | T | A | 0.0000 | |
| 472 | I | A | 0.0000 | |
| 473 | K | A | -0.6157 | |
| 474 | D | A | 0.0000 | |
| 475 | P | A | -0.3994 | |
| 476 | A | A | -0.2216 | |
| 477 | V | A | 0.0177 | |
| 478 | G | A | -0.5419 | |
| 479 | F | A | -0.8540 | |
| 480 | L | A | 0.0000 | |
| 481 | E | A | -1.4097 | |
| 482 | T | A | -0.3378 | |
| 483 | I | A | 0.0764 | |
| 484 | S | A | 0.0000 | |
| 485 | P | A | -1.1459 | |
| 486 | G | A | -1.4376 | |
| 487 | Y | A | -0.9725 | |
| 488 | S | A | 0.0000 | |
| 489 | I | A | 0.0000 | |
| 490 | H | A | 0.0000 | |
| 491 | T | A | 0.0000 | |
| 492 | Y | A | 0.0000 | |
| 493 | L | A | 0.0000 | |
| 494 | W | A | 0.0000 | |
| 495 | H | A | -0.2214 | |
| 496 | R | A | -0.7019 | |
| 497 | Q | A | -1.4141 |
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 | -0.2497 | 5.9484 | View | CSV | PDB |
| 4.5 | -0.2856 | 5.9095 | View | CSV | PDB |
| 5.0 | -0.3291 | 5.868 | View | CSV | PDB |
| 5.5 | -0.3722 | 5.8256 | View | CSV | PDB |
| 6.0 | -0.4064 | 5.783 | View | CSV | PDB |
| 6.5 | -0.4256 | 5.7404 | View | CSV | PDB |
| 7.0 | -0.4293 | 5.6982 | View | CSV | PDB |
| 7.5 | -0.4224 | 5.6573 | View | CSV | PDB |
| 8.0 | -0.4092 | 5.6199 | View | CSV | PDB |
| 8.5 | -0.391 | 5.5905 | View | CSV | PDB |
| 9.0 | -0.3673 | 5.5724 | View | CSV | PDB |