| Chain sequence(s) | MARCSNSMALLFSFGLLWLCSGVLGTDTEERLVEHLLDPSRYNKLIRPATNGSELVTVQLMVSLAQLISVHEREQIMTTNVWLTQEWEDYRLTWKPEDFDNMKKVRLPSKHIWLPDVVLYNNADGMYEVSFYSNAVVSYDGSIFWLPPAIYKSACKIEVKHFPFDQQNCTMKFRSWTYDRTEIDLVLKSDVASLDDFTPSGEWDIIALPGRRNENPDDSTYVDITYDFIIRRKPLFYTINLIIPCVLITSLAILVFYLPSDCGEKMTLCISVLLALTVFLLLISKIVPPTSLDVPLVGKYLMFTMVLVTFSIVTSVCVLNVHHRSPTTHTMAPWVKVVFLEKLPTLLFLQQPRHRCARQRLRLRRRQREREGAGTLFFREGPAADPCTCFVNPASMQGLAGAFQAEPAAAGLGRSMGPCSCGLREAVDGVRFIADHMRSEDDDQSVREDWKYVAMVIDRLFLWIFVFVCVFGTIGMFLQPLFQNYTATTFLHSDHSAPSSK input PDB |
| Selected Chain(s) | A |
| Distance of aggregation | 10 Å |
| FoldX usage | Yes |
| pH calculations | Yes |
| Dynamic mode | No |
| Automated mutations | No |
| Downloads | Download all the data |
| Simulation log |
[INFO] Logger: Verbosity set to: 2 - [INFO] (00:00:01)
[WARNING] runJob: Working directory already exists (possibly overwriting previous results -ow
to prevent this behavior) (00:00:01)
[INFO] runJob: Starting aggrescan3d job on: input.pdb with A chain(s) selected (00:00:01)
[INFO] runJob: Creating pdb object from: input.pdb (00:00:01)
[INFO] PDB-Info: The input structure is partially or entirely disordered. Average score is
recommended for pH analysis. (00:00:04)
[INFO] FoldX: Starting FoldX energy minimization (00:00:04)
[INFO] Analysis: Starting Aggrescan4D on folded.pdb (00:18:33)
[INFO] agg3D: Running pKa-ANI on
/STORAGE/DATA/lcbio/aggreskan/89599b1a70736e/tmp/folded.pdb (00:18:33)
[INFO] Main: Simulation completed successfully. (00:27:43)
|
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 | M | A | 0.7149 | |
| 2 | A | A | -0.3138 | |
| 3 | R | A | -1.5443 | |
| 4 | C | A | -0.3462 | |
| 5 | S | A | -0.6319 | |
| 6 | N | A | -1.0463 | |
| 7 | S | A | 0.2710 | |
| 8 | M | A | 1.5295 | |
| 9 | A | A | 1.6187 | |
| 10 | L | A | 2.7107 | |
| 11 | L | A | 3.7457 | |
| 12 | F | A | 4.2412 | |
| 13 | S | A | 3.6978 | |
| 14 | F | A | 4.3708 | |
| 15 | G | A | 3.8413 | |
| 16 | L | A | 4.5094 | |
| 17 | L | A | 4.2861 | |
| 18 | W | A | 3.8725 | |
| 19 | L | A | 3.8573 | |
| 20 | C | A | 3.2907 | |
| 21 | S | A | 2.1212 | |
| 22 | G | A | 1.6722 | |
| 23 | V | A | 2.3453 | |
| 24 | L | A | 1.3246 | |
| 25 | G | A | -0.6629 | |
| 26 | T | A | -1.2415 | |
| 27 | D | A | -2.3718 | |
| 28 | T | A | -2.8185 | |
| 29 | E | A | -3.7437 | |
| 30 | E | A | -3.9042 | |
| 31 | R | A | -3.1296 | |
| 32 | L | A | 0.0000 | |
| 33 | V | A | -2.1587 | |
| 34 | E | A | -3.0349 | |
| 35 | H | A | -2.4868 | |
| 36 | L | A | 0.0000 | |
| 37 | L | A | -1.7092 | |
| 38 | D | A | -2.2749 | |
| 39 | P | A | -1.9012 | |
| 40 | S | A | -1.6729 | |
| 41 | R | A | -2.5754 | |
| 42 | Y | A | 0.0000 | |
| 43 | N | A | -1.3050 | |
| 44 | K | A | -0.7847 | |
| 45 | L | A | 1.4186 | |
| 46 | I | A | 1.7564 | |
| 47 | R | A | 0.6176 | |
| 48 | P | A | 0.0000 | |
| 49 | A | A | -0.7190 | |
| 50 | T | A | -0.8957 | |
| 51 | N | A | -1.8219 | |
| 52 | G | A | -1.4943 | |
| 53 | S | A | -1.2705 | |
| 54 | E | A | -1.4734 | |
| 55 | L | A | -0.6566 | |
| 56 | V | A | 0.0000 | |
| 57 | T | A | -0.6765 | |
| 58 | V | A | 0.0000 | |
| 59 | Q | A | -1.0617 | |
| 60 | L | A | 0.0000 | |
| 61 | M | A | -0.2083 | |
| 62 | V | A | 0.0000 | |
| 63 | S | A | 0.0000 | |
| 64 | L | A | 0.0000 | |
| 65 | A | A | -0.7923 | |
| 66 | Q | A | -0.4728 | |
| 67 | L | A | 0.0000 | |
| 68 | I | A | 0.5279 | |
| 69 | S | A | -0.1490 | |
| 70 | V | A | 0.0000 | |
| 71 | H | A | -1.6995 | |
| 72 | E | A | -2.0327 | |
| 73 | R | A | -2.6473 | |
| 74 | E | A | -2.8793 | |
| 75 | Q | A | -2.2011 | |
| 76 | I | A | -1.4897 | |
| 77 | M | A | 0.0000 | |
| 78 | T | A | -0.0425 | |
| 79 | T | A | 0.0000 | |
| 80 | N | A | -0.0932 | |
| 81 | V | A | 0.0000 | |
| 82 | W | A | 0.2827 | |
| 83 | L | A | 0.0000 | |
| 84 | T | A | 0.0000 | |
| 85 | Q | A | 0.0000 | |
| 86 | E | A | -0.7892 | |
| 87 | W | A | 0.0000 | |
| 88 | E | A | -2.0604 | |
| 89 | D | A | 0.0000 | |
| 90 | Y | A | -0.1533 | |
| 91 | R | A | -0.7327 | |
| 92 | L | A | 0.0000 | |
| 93 | T | A | -0.8022 | |
| 94 | W | A | 0.0000 | |
| 95 | K | A | -3.5170 | |
| 96 | P | A | -3.8569 | |
| 97 | E | A | -4.3127 | |
| 98 | D | A | -3.8772 | |
| 99 | F | A | 0.0000 | |
| 100 | D | A | -3.7439 | |
| 101 | N | A | -3.8380 | |
| 102 | M | A | -3.1275 | |
| 103 | K | A | -3.1379 | |
| 104 | K | A | -2.9910 | |
| 105 | V | A | 0.0000 | |
| 106 | R | A | -2.5282 | |
| 107 | L | A | 0.0000 | |
| 108 | P | A | -1.5172 | |
| 109 | S | A | 0.0000 | |
| 110 | K | A | -2.1302 | |
| 111 | H | A | -1.7986 | |
| 112 | I | A | 0.0000 | |
| 113 | W | A | 0.0000 | |
| 114 | L | A | -0.2583 | |
| 115 | P | A | 0.0000 | |
| 116 | D | A | -0.7883 | |
| 117 | V | A | 0.0000 | |
| 118 | V | A | 0.0000 | |
| 119 | L | A | 0.0000 | |
| 120 | Y | A | 0.2964 | |
| 121 | N | A | -0.4508 | |
| 122 | N | A | -0.4311 | |
| 123 | A | A | -0.7653 | |
| 124 | D | A | -0.9135 | |
| 125 | G | A | -0.6302 | |
| 126 | M | A | 0.1699 | |
| 127 | Y | A | -0.3151 | |
| 128 | E | A | -0.9889 | |
| 129 | V | A | 0.4593 | |
| 130 | S | A | 1.1123 | |
| 131 | F | A | 2.2841 | |
| 132 | Y | A | 1.4479 | |
| 133 | S | A | 0.2005 | |
| 134 | N | A | -1.4324 | |
| 135 | A | A | 0.0000 | |
| 136 | V | A | -0.9428 | |
| 137 | V | A | 0.0000 | |
| 138 | S | A | 0.0000 | |
| 139 | Y | A | -1.4985 | |
| 140 | D | A | -2.3175 | |
| 141 | G | A | 0.0000 | |
| 142 | S | A | -1.1998 | |
| 143 | I | A | 0.0000 | |
| 144 | F | A | 0.1357 | |
| 145 | W | A | 0.0000 | |
| 146 | L | A | 0.8331 | |
| 147 | P | A | 0.0000 | |
| 148 | P | A | 1.0144 | |
| 149 | A | A | 0.0000 | |
| 150 | I | A | 0.6769 | |
| 151 | Y | A | 0.0000 | |
| 152 | K | A | -0.6812 | |
| 153 | S | A | 0.0000 | |
| 154 | A | A | -0.9907 | |
| 155 | C | A | 0.0000 | |
| 156 | K | A | -2.3528 | |
| 157 | I | A | 0.0000 | |
| 158 | E | A | -1.7472 | |
| 159 | V | A | 0.0000 | |
| 160 | K | A | -1.2564 | |
| 161 | H | A | -1.1509 | |
| 162 | F | A | 0.0000 | |
| 163 | P | A | 0.0000 | |
| 164 | F | A | -0.4121 | |
| 165 | D | A | 0.0000 | |
| 166 | Q | A | -2.2608 | |
| 167 | Q | A | 0.0000 | |
| 168 | N | A | -1.9564 | |
| 169 | C | A | 0.0000 | |
| 170 | T | A | -0.7175 | |
| 171 | M | A | 0.0000 | |
| 172 | K | A | -0.7543 | |
| 173 | F | A | 0.0000 | |
| 174 | R | A | -0.1938 | |
| 175 | S | A | 0.0000 | |
| 176 | W | A | 0.8130 | |
| 177 | T | A | 0.1473 | |
| 178 | Y | A | -0.3501 | |
| 179 | D | A | -0.7468 | |
| 180 | R | A | -1.4567 | |
| 181 | T | A | -0.9505 | |
| 182 | E | A | -1.1045 | |
| 183 | I | A | 0.0000 | |
| 184 | D | A | -0.7084 | |
| 185 | L | A | 0.0000 | |
| 186 | V | A | -0.4711 | |
| 187 | L | A | -0.9093 | |
| 188 | K | A | -1.3632 | |
| 189 | S | A | -1.0405 | |
| 190 | D | A | -1.5820 | |
| 191 | V | A | 0.6028 | |
| 192 | A | A | 0.0000 | |
| 193 | S | A | -0.1695 | |
| 194 | L | A | -0.4155 | |
| 195 | D | A | -2.1999 | |
| 196 | D | A | -2.3278 | |
| 197 | F | A | -1.0682 | |
| 198 | T | A | -0.6580 | |
| 199 | P | A | -0.8623 | |
| 200 | S | A | -1.0562 | |
| 201 | G | A | -1.3616 | |
| 202 | E | A | -1.5205 | |
| 203 | W | A | 0.0000 | |
| 204 | D | A | -2.5083 | |
| 205 | I | A | -0.5225 | |
| 206 | I | A | 0.2349 | |
| 207 | A | A | 0.4070 | |
| 208 | L | A | 0.0000 | |
| 209 | P | A | -0.2419 | |
| 210 | G | A | -1.1282 | |
| 211 | R | A | -2.1147 | |
| 212 | R | A | -2.0168 | |
| 213 | N | A | -1.9974 | |
| 214 | E | A | -3.0038 | |
| 215 | N | A | -2.4377 | |
| 216 | P | A | -2.1713 | |
| 217 | D | A | -2.7968 | |
| 218 | D | A | -2.4778 | |
| 219 | S | A | -1.7873 | |
| 220 | T | A | -1.3885 | |
| 221 | Y | A | -1.4463 | |
| 222 | V | A | 0.0000 | |
| 223 | D | A | 0.0000 | |
| 224 | I | A | 0.0000 | |
| 225 | T | A | 0.0000 | |
| 226 | Y | A | 0.0000 | |
| 227 | D | A | -0.5109 | |
| 228 | F | A | 0.0000 | |
| 229 | I | A | -0.6034 | |
| 230 | I | A | 0.0000 | |
| 231 | R | A | -2.2965 | |
| 232 | R | A | 0.0000 | |
| 233 | K | A | -1.6612 | |
| 234 | P | A | 0.5510 | |
| 235 | L | A | 1.9170 | |
| 236 | F | A | 2.3252 | |
| 237 | Y | A | 1.4964 | |
| 238 | T | A | 1.6305 | |
| 239 | I | A | 2.1479 | |
| 240 | N | A | 0.5379 | |
| 241 | L | A | 0.0000 | |
| 242 | I | A | 0.0000 | |
| 243 | I | A | 2.1105 | |
| 244 | P | A | 1.3942 | |
| 245 | C | A | 0.0000 | |
| 246 | V | A | 1.9454 | |
| 247 | L | A | 2.3967 | |
| 248 | I | A | 1.6671 | |
| 249 | T | A | 1.3682 | |
| 250 | S | A | 1.3332 | |
| 251 | L | A | 1.4640 | |
| 252 | A | A | 1.4099 | |
| 253 | I | A | 1.5490 | |
| 254 | L | A | 1.6387 | |
| 255 | V | A | 0.0000 | |
| 256 | F | A | 0.0000 | |
| 257 | Y | A | 1.6125 | |
| 258 | L | A | 0.0000 | |
| 259 | P | A | -0.6205 | |
| 260 | S | A | 0.0000 | |
| 261 | D | A | -2.1749 | |
| 262 | C | A | -1.1153 | |
| 263 | G | A | -1.3819 | |
| 264 | E | A | -1.6787 | |
| 265 | K | A | 0.0000 | |
| 266 | M | A | 0.5919 | |
| 267 | T | A | -0.0190 | |
| 268 | L | A | 0.5361 | |
| 269 | C | A | 0.0000 | |
| 270 | I | A | 1.7994 | |
| 271 | S | A | 1.1145 | |
| 272 | V | A | 0.0000 | |
| 273 | L | A | 1.8938 | |
| 274 | L | A | 2.3180 | |
| 275 | A | A | 1.6582 | |
| 276 | L | A | 0.0000 | |
| 277 | T | A | 2.1408 | |
| 278 | V | A | 3.0746 | |
| 279 | F | A | 2.1438 | |
| 280 | L | A | 1.9291 | |
| 281 | L | A | 2.2845 | |
| 282 | L | A | 1.5413 | |
| 283 | I | A | 0.0000 | |
| 284 | S | A | -0.2033 | |
| 285 | K | A | -1.1823 | |
| 286 | I | A | -0.6826 | |
| 287 | V | A | 0.0000 | |
| 288 | P | A | 0.0000 | |
| 289 | P | A | -0.7685 | |
| 290 | T | A | -0.2316 | |
| 291 | S | A | 0.3843 | |
| 292 | L | A | 0.9365 | |
| 293 | D | A | -0.2711 | |
| 294 | V | A | 0.0811 | |
| 295 | P | A | 0.0000 | |
| 296 | L | A | 0.0000 | |
| 297 | V | A | 0.0000 | |
| 298 | G | A | 0.0000 | |
| 299 | K | A | -0.3844 | |
| 300 | Y | A | 0.0000 | |
| 301 | L | A | 0.0000 | |
| 302 | M | A | 1.2558 | |
| 303 | F | A | 1.4157 | |
| 304 | T | A | 0.0000 | |
| 305 | M | A | 1.8734 | |
| 306 | V | A | 2.7568 | |
| 307 | L | A | 2.2266 | |
| 308 | V | A | 0.0000 | |
| 309 | T | A | 2.2534 | |
| 310 | F | A | 2.9502 | |
| 311 | S | A | 0.0000 | |
| 312 | I | A | 2.6495 | |
| 313 | V | A | 3.1936 | |
| 314 | T | A | 0.0000 | |
| 315 | S | A | 0.0000 | |
| 316 | V | A | 2.4968 | |
| 317 | C | A | 1.4487 | |
| 318 | V | A | 0.0000 | |
| 319 | L | A | -0.0725 | |
| 320 | N | A | -0.9308 | |
| 321 | V | A | 0.0000 | |
| 322 | H | A | -1.5857 | |
| 323 | H | A | -2.2552 | |
| 324 | R | A | -1.7762 | |
| 325 | S | A | -1.5499 | |
| 326 | P | A | -1.1609 | |
| 327 | T | A | -0.5122 | |
| 328 | T | A | -0.6333 | |
| 329 | H | A | -0.8672 | |
| 330 | T | A | -0.3458 | |
| 331 | M | A | -0.0008 | |
| 332 | A | A | 0.2439 | |
| 333 | P | A | 0.4534 | |
| 334 | W | A | 1.4265 | |
| 335 | V | A | 0.6469 | |
| 336 | K | A | -0.2696 | |
| 337 | V | A | 0.2684 | |
| 338 | V | A | 0.1258 | |
| 339 | F | A | -0.0735 | |
| 340 | L | A | 0.0000 | |
| 341 | E | A | -2.1269 | |
| 342 | K | A | -1.7315 | |
| 343 | L | A | 0.1647 | |
| 344 | P | A | 0.0000 | |
| 345 | T | A | 0.2731 | |
| 346 | L | A | 1.7259 | |
| 347 | L | A | 1.7085 | |
| 348 | F | A | 2.2357 | |
| 349 | L | A | 0.7305 | |
| 350 | Q | A | -1.2687 | |
| 351 | Q | A | -2.1039 | |
| 352 | P | A | -2.2212 | |
| 353 | R | A | -2.9534 | |
| 354 | H | A | -2.6336 | |
| 355 | R | A | -2.3996 | |
| 356 | C | A | -1.3864 | |
| 357 | A | A | -1.1423 | |
| 358 | R | A | -1.4088 | |
| 359 | Q | A | -1.6226 | |
| 360 | R | A | -2.1594 | |
| 361 | L | A | -0.7894 | |
| 362 | R | A | -1.6897 | |
| 363 | L | A | -1.9463 | |
| 364 | R | A | -3.6654 | |
| 365 | R | A | -4.0123 | |
| 366 | R | A | -4.6335 | |
| 367 | Q | A | -4.5645 | |
| 368 | R | A | -5.2458 | |
| 369 | E | A | -4.5361 | |
| 370 | R | A | -4.7475 | |
| 371 | E | A | -4.1841 | |
| 372 | G | A | -2.2995 | |
| 373 | A | A | -0.8237 | |
| 374 | G | A | -0.2631 | |
| 375 | T | A | 0.5126 | |
| 376 | L | A | 1.8258 | |
| 377 | F | A | 2.6350 | |
| 378 | F | A | 1.8504 | |
| 379 | R | A | -1.0937 | |
| 380 | E | A | -1.9111 | |
| 381 | G | A | -1.7241 | |
| 382 | P | A | -1.0901 | |
| 383 | A | A | -0.6894 | |
| 384 | A | A | -0.9328 | |
| 385 | D | A | -1.7217 | |
| 386 | P | A | -0.8206 | |
| 387 | C | A | 0.5301 | |
| 388 | T | A | 0.9766 | |
| 389 | C | A | 1.8425 | |
| 390 | F | A | 2.3393 | |
| 391 | V | A | 1.2799 | |
| 392 | N | A | -0.3550 | |
| 393 | P | A | -0.4236 | |
| 394 | A | A | -0.5948 | |
| 395 | S | A | -0.3587 | |
| 396 | M | A | 0.1402 | |
| 397 | Q | A | -0.7911 | |
| 398 | G | A | -0.1850 | |
| 399 | L | A | 1.0501 | |
| 400 | A | A | 0.5822 | |
| 401 | G | A | 0.0843 | |
| 402 | A | A | 0.8396 | |
| 403 | F | A | 1.3114 | |
| 404 | Q | A | -0.6196 | |
| 405 | A | A | -1.0587 | |
| 406 | E | A | -2.1353 | |
| 407 | P | A | -1.0763 | |
| 408 | A | A | -0.3783 | |
| 409 | A | A | -0.0301 | |
| 410 | A | A | 0.1315 | |
| 411 | G | A | 0.2302 | |
| 412 | L | A | 0.6512 | |
| 413 | G | A | -0.5945 | |
| 414 | R | A | -1.6392 | |
| 415 | S | A | -0.7136 | |
| 416 | M | A | 0.2572 | |
| 417 | G | A | -0.2054 | |
| 418 | P | A | 0.0956 | |
| 419 | C | A | 0.7215 | |
| 420 | S | A | 0.1729 | |
| 421 | C | A | -0.0180 | |
| 422 | G | A | -0.3371 | |
| 423 | L | A | 0.4143 | |
| 424 | R | A | -1.3783 | |
| 425 | E | A | -1.9247 | |
| 426 | A | A | -0.0758 | |
| 427 | V | A | 0.7078 | |
| 428 | D | A | 0.0018 | |
| 429 | G | A | 0.8271 | |
| 430 | V | A | 1.7183 | |
| 431 | R | A | 0.1818 | |
| 432 | F | A | 1.8944 | |
| 433 | I | A | 2.3700 | |
| 434 | A | A | 0.2683 | |
| 435 | D | A | -1.5108 | |
| 436 | H | A | -1.2072 | |
| 437 | M | A | -0.9556 | |
| 438 | R | A | -2.2759 | |
| 439 | S | A | -2.9014 | |
| 440 | E | A | -3.8628 | |
| 441 | D | A | -3.9450 | |
| 442 | D | A | -3.6515 | |
| 443 | D | A | -3.4775 | |
| 444 | Q | A | -3.5246 | |
| 445 | S | A | -2.6601 | |
| 446 | V | A | -1.9177 | |
| 447 | R | A | -3.0675 | |
| 448 | E | A | -2.0368 | |
| 449 | D | A | 0.0000 | |
| 450 | W | A | 0.0000 | |
| 451 | K | A | -1.7084 | |
| 452 | Y | A | -0.5811 | |
| 453 | V | A | 0.0000 | |
| 454 | A | A | 0.0000 | |
| 455 | M | A | 0.3564 | |
| 456 | V | A | 0.0000 | |
| 457 | I | A | 0.0000 | |
| 458 | D | A | 0.0000 | |
| 459 | R | A | 0.7850 | |
| 460 | L | A | 1.2645 | |
| 461 | F | A | 1.5859 | |
| 462 | L | A | 1.9691 | |
| 463 | W | A | 2.2914 | |
| 464 | I | A | 2.5703 | |
| 465 | F | A | 0.0000 | |
| 466 | V | A | 2.6689 | |
| 467 | F | A | 3.3073 | |
| 468 | V | A | 2.8303 | |
| 469 | C | A | 2.4642 | |
| 470 | V | A | 2.7735 | |
| 471 | F | A | 3.2669 | |
| 472 | G | A | 2.0158 | |
| 473 | T | A | 1.9449 | |
| 474 | I | A | 2.1056 | |
| 475 | G | A | 1.1035 | |
| 476 | M | A | 0.6551 | |
| 477 | F | A | 1.0681 | |
| 478 | L | A | 1.2390 | |
| 479 | Q | A | -0.1255 | |
| 480 | P | A | 0.0000 | |
| 481 | L | A | 1.5358 | |
| 482 | F | A | 1.8745 | |
| 483 | Q | A | -0.0204 | |
| 484 | N | A | 0.1706 | |
| 485 | Y | A | 1.6843 | |
| 486 | T | A | 1.0813 | |
| 487 | A | A | 0.8175 | |
| 488 | T | A | 0.5392 | |
| 489 | T | A | 0.7038 | |
| 490 | F | A | 1.4753 | |
| 491 | L | A | 0.3783 | |
| 492 | H | A | -1.0168 | |
| 493 | S | A | -1.0791 | |
| 494 | D | A | -2.0994 | |
| 495 | H | A | -1.9546 | |
| 496 | S | A | -1.4730 | |
| 497 | A | A | -0.9736 | |
| 498 | P | A | -0.7917 | |
| 499 | S | A | -0.8919 | |
| 500 | S | A | -1.2195 | |
| 501 | K | A | -1.8903 |
Calculations for various pH values
This page contains details and comparisons for all models calculated at different pH points.
pH |
Average A3D Score |
Max A3D Score |
|||
| 4.0 | 0.1814 | 7.8868 | View | CSV | PDB |
| 4.5 | 0.1115 | 7.8868 | View | CSV | PDB |
| 5.0 | 0.0268 | 7.8868 | View | CSV | PDB |
| 5.5 | -0.0581 | 7.8868 | View | CSV | PDB |
| 6.0 | -0.1316 | 7.8868 | View | CSV | PDB |
| 6.5 | -0.1868 | 7.8868 | View | CSV | PDB |
| 7.0 | -0.2229 | 7.8868 | View | CSV | PDB |
| 7.5 | -0.2446 | 7.8868 | View | CSV | PDB |
| 8.0 | -0.2569 | 7.8868 | View | CSV | PDB |
| 8.5 | -0.2604 | 7.8868 | View | CSV | PDB |
| 9.0 | -0.2533 | 7.8868 | 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