Project name: MPV_mut_sd [mutate: TC91A, NC117A, TC91C, NC117C, TC91B, NC117B, DP149A, DP149C, DP149B, DP425A, DP425C, DP425B, EP95A, EP95C, EP95B, RP127A, RP127C, RP127B, HN332A, HN332C, HN332B]
Status: done
Started: 2025-12-11 17:11:16
| Chain sequence(s) |
A: LKESYLEESCSTITEGYLSVLRTGWYTNVFTLEVGDVENLTCADGPSLIKTELDLTKSALRELKTVSADQLGGGGSATAAAVTAGVAIAKTIRLESEVTAIKNALKKTNEAVSTLGNGVRVLATAVRELKDFVSKNLTRAINKNKCDIDDLKMAVSFSQFNRRFLNVVRQFSDNAGITPAISLDLMTDAELARAVSNMPTSAGQIKLMLENRAMVRRKGFGILIGVYGSSVIYMVQLPIFGVIDTPCWIVKAAPSCSEKKGNYACLLREDQGWYCQNAGSTVYYPNEKDCETRGDHVFCDTAAGINVAEQSKECNINISTTNYPCKVSTGRHPISMVALSPLGALVACYKGVSCSIGSNRVGIIKQLNKGCSYITNQDADTVTIDNTVYQLSKVEGEQHVIKGRPVSSSFDPVKFPEDQFNVALDQVFENIENSQALVDQSNRILSSAEKGNT
C: LKESYLEESCSTITEGYLSVLRTGWYTNVFTLEVGDVENLTCADGPSLIKTELDLTKSALRELKTVSADQLGGGGSATAAAVTAGVAIAKTIRLESEVTAIKNALKKTNEAVSTLGNGVRVLATAVRELKDFVSKNLTRAINKNKCDIDDLKMAVSFSQFNRRFLNVVRQFSDNAGITPAISLDLMTDAELARAVSNMPTSAGQIKLMLENRAMVRRKGFGILIGVYGSSVIYMVQLPIFGVIDTPCWIVKAAPSCSEKKGNYACLLREDQGWYCQNAGSTVYYPNEKDCETRGDHVFCDTAAGINVAEQSKECNINISTTNYPCKVSTGRHPISMVALSPLGALVACYKGVSCSIGSNRVGIIKQLNKGCSYITNQDADTVTIDNTVYQLSKVEGEQHVIKGRPVSSSFDPVKFPEDQFNVALDQVFENIENSQALVDQSNRILSSAEKGNT B: LKESYLEESCSTITEGYLSVLRTGWYTNVFTLEVGDVENLTCADGPSLIKTELDLTKSALRELKTVSADQLGGGGSATAAAVTAGVAIAKTIRLESEVTAIKNALKKTNEAVSTLGNGVRVLATAVRELKDFVSKNLTRAINKNKCDIDDLKMAVSFSQFNRRFLNVVRQFSDNAGITPAISLDLMTDAELARAVSNMPTSAGQIKLMLENRAMVRRKGFGILIGVYGSSVIYMVQLPIFGVIDTPCWIVKAAPSCSEKKGNYACLLREDQGWYCQNAGSTVYYPNEKDCETRGDHVFCDTAAGINVAEQSKECNINISTTNYPCKVSTGRHPISMVALSPLGALVACYKGVSCSIGSNRVGIIKQLNKGCSYITNQDADTVTIDNTVYQLSKVEGEQHVIKGRPVSSSFDPVKFPEDQFNVALDQVFENIENSQALVDQSNRILSSAEKGNT input PDB |
| Selected Chain(s) | A,C,B |
| Distance of aggregation | 10 Å |
| FoldX usage | Yes |
| pH calculations | No |
| alphaCutter usage | No |
| Dynamic mode | Yes |
| Automated mutations | No |
| Mutated residues | HN332C,TC91C,DP149A,EP95C,NC117A,RP127C,HN332A,DP149C,EP95B,DP149B,NC117B,EP95A,HN332B,DP425A,RP127B,NC117C,TC91B,TC91A,DP425B,DP425C,RP127A |
| Energy difference between WT (input) and mutated protein (by FoldX) | 12.7817 kcal/mol
CAUTION: Your mutation/s can destabilize the protein structure |
| 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 all chain(s) selected (00:00:02)
[INFO] runJob: Creating pdb object from: input.pdb (00:00:02)
[INFO] FoldX: Starting FoldX energy minimization (00:00:04)
[INFO] FoldX: Building mutant model (00:35:12)
[INFO] CABS: Running CABS flex simulation (00:43:48)
[INFO] Analysis: Starting Aggrescan4D on model_8.pdb (09:22:41)
[INFO] Analysis: Starting Aggrescan4D on model_6.pdb (09:23:10)
[INFO] Analysis: Starting Aggrescan4D on model_11.pdb (09:23:40)
[INFO] Analysis: Starting Aggrescan4D on model_7.pdb (09:24:09)
[INFO] Analysis: Starting Aggrescan4D on model_3.pdb (09:24:38)
[INFO] Analysis: Starting Aggrescan4D on model_5.pdb (09:25:07)
[INFO] Analysis: Starting Aggrescan4D on model_1.pdb (09:25:39)
[INFO] Analysis: Starting Aggrescan4D on model_0.pdb (09:26:13)
[INFO] Analysis: Starting Aggrescan4D on model_2.pdb (09:26:45)
[INFO] Analysis: Starting Aggrescan4D on model_4.pdb (09:27:14)
[INFO] Analysis: Starting Aggrescan4D on model_10.pdb (09:27:43)
[INFO] Analysis: Starting Aggrescan4D on model_9.pdb (09:28:13)
[INFO] Analysis: Starting Aggrescan4D on input.pdb (09:28:42)
[INFO] Analysis: Starting Aggrescan4D on folded.pdb (09:29:44)
[INFO] Main: Simulation completed successfully. (09:30:12)
|
Note Your prediction results will be deleted after 360 days.
Drag cursor over the plot to display residue labels.
Show buried residues
- Minimal score value
- -4.3349
- Maximal score value
- 1.6489
- Average score
- -0.6446
- Total score value
- -875.9951
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 | L | A | 0.0895 | |
| 2 | K | A | -1.3139 | |
| 3 | E | A | 0.0000 | |
| 4 | S | A | -0.2006 | |
| 5 | Y | A | 0.0000 | |
| 6 | L | A | 0.0000 | |
| 7 | E | A | -1.2591 | |
| 8 | E | A | -1.3547 | |
| 9 | S | A | 0.0000 | |
| 10 | C | A | 0.0000 | |
| 11 | S | A | 0.0000 | |
| 12 | T | A | 0.0000 | |
| 13 | I | A | 0.0000 | |
| 14 | T | A | 0.0000 | |
| 15 | E | A | -0.5091 | |
| 16 | G | A | -0.1145 | |
| 17 | Y | A | -0.3337 | |
| 18 | L | A | -0.5042 | |
| 19 | S | A | 0.0000 | |
| 20 | V | A | 0.0000 | |
| 21 | L | A | 0.0000 | |
| 22 | R | A | -0.1521 | |
| 23 | T | A | 0.2879 | |
| 24 | G | A | 0.2251 | |
| 25 | W | A | 0.0584 | |
| 26 | Y | A | -0.3548 | |
| 27 | T | A | 0.0000 | |
| 28 | N | A | 0.0000 | |
| 29 | V | A | 0.0000 | |
| 30 | F | A | 0.0000 | |
| 31 | T | A | 0.0000 | |
| 32 | L | A | 0.0000 | |
| 33 | E | A | -0.8871 | |
| 34 | V | A | 0.0000 | |
| 35 | G | A | -1.1377 | |
| 36 | D | A | -1.7667 | |
| 37 | V | A | 0.0000 | |
| 38 | E | A | -1.8300 | |
| 39 | N | A | -2.1075 | |
| 40 | L | A | 0.0000 | |
| 41 | T | A | -2.5604 | |
| 42 | C | A | 0.0000 | |
| 43 | A | A | -2.6057 | |
| 44 | D | A | -3.3820 | |
| 45 | G | A | -2.6062 | |
| 46 | P | A | -1.5804 | |
| 47 | S | A | -1.1959 | |
| 48 | L | A | 0.0000 | |
| 49 | I | A | 0.0000 | |
| 50 | K | A | -2.5566 | |
| 51 | T | A | -1.4580 | |
| 52 | E | A | 0.0000 | |
| 53 | L | A | 0.0000 | |
| 54 | D | A | -2.3408 | |
| 55 | L | A | 0.0000 | |
| 56 | T | A | 0.0000 | |
| 57 | K | A | -2.0754 | |
| 58 | S | A | -1.6450 | |
| 59 | A | A | 0.0000 | |
| 60 | L | A | -1.4370 | |
| 61 | R | A | -2.6125 | |
| 62 | E | A | -1.8180 | |
| 63 | L | A | 0.0000 | |
| 64 | K | A | -2.3928 | |
| 65 | T | A | -1.5698 | |
| 66 | V | A | 0.0000 | |
| 67 | S | A | -0.8034 | |
| 68 | A | A | -0.6350 | |
| 69 | D | A | -1.5172 | |
| 70 | Q | A | -1.0968 | |
| 71 | L | A | 0.0000 | |
| 72 | G | A | 0.0000 | |
| 73 | G | A | 0.0000 | |
| 74 | G | A | 0.0000 | |
| 75 | G | A | 0.0000 | |
| 76 | S | A | -0.3985 | |
| 77 | A | A | -0.1629 | |
| 78 | T | A | 0.0308 | |
| 79 | A | A | 0.1588 | |
| 80 | A | A | 0.1755 | |
| 81 | A | A | 0.4025 | |
| 82 | V | A | 0.6777 | |
| 83 | T | A | 0.0000 | |
| 84 | A | A | 0.0000 | |
| 85 | G | A | 0.0000 | |
| 86 | V | A | 0.0000 | |
| 87 | A | A | -0.6678 | |
| 88 | I | A | 0.0000 | |
| 89 | A | A | 0.0000 | |
| 90 | K | A | -1.3422 | |
| 91 | C | A | -0.5249 | mutated: TC91A |
| 92 | I | A | 0.0000 | |
| 93 | R | A | -1.3818 | |
| 94 | L | A | 0.3263 | |
| 95 | P | A | -0.1295 | mutated: EP95A |
| 96 | S | A | -0.2557 | |
| 97 | E | A | -0.4107 | |
| 98 | V | A | -0.4151 | |
| 99 | T | A | -0.6382 | |
| 100 | A | A | -0.8703 | |
| 101 | I | A | 0.0000 | |
| 102 | K | A | -1.8462 | |
| 103 | N | A | -2.5678 | |
| 104 | A | A | -1.9035 | |
| 105 | L | A | 0.0000 | |
| 106 | K | A | -3.4103 | |
| 107 | K | A | -3.3542 | |
| 108 | T | A | -2.1556 | |
| 109 | N | A | -2.1481 | |
| 110 | E | A | -1.1388 | |
| 111 | A | A | -0.1845 | |
| 112 | V | A | 1.3432 | |
| 113 | S | A | 0.3098 | |
| 114 | T | A | -0.4795 | |
| 115 | L | A | 0.0000 | |
| 116 | G | A | -1.1678 | |
| 117 | C | A | -0.9536 | mutated: NC117A |
| 118 | G | A | -1.0393 | |
| 119 | V | A | -0.9397 | |
| 120 | R | A | -1.4810 | |
| 121 | V | A | 0.0000 | |
| 122 | L | A | -0.0315 | |
| 123 | A | A | 0.0000 | |
| 124 | T | A | 0.0000 | |
| 125 | A | A | -1.4918 | |
| 126 | V | A | -0.6325 | |
| 127 | P | A | -0.6557 | mutated: RP127A |
| 128 | E | A | -0.8157 | |
| 129 | L | A | 0.0000 | |
| 130 | K | A | -1.3857 | |
| 131 | D | A | -1.5923 | |
| 132 | F | A | 0.0000 | |
| 133 | V | A | 0.0000 | |
| 134 | S | A | -1.6891 | |
| 135 | K | A | -1.8496 | |
| 136 | N | A | -1.7373 | |
| 137 | L | A | 0.0000 | |
| 138 | T | A | -2.3371 | |
| 139 | R | A | -2.8582 | |
| 140 | A | A | -2.6099 | |
| 141 | I | A | 0.0000 | |
| 142 | N | A | -3.8438 | |
| 143 | K | A | -4.3349 | |
| 144 | N | A | -3.9654 | |
| 145 | K | A | -4.2659 | |
| 146 | C | A | 0.0000 | |
| 147 | D | A | -3.3319 | |
| 148 | I | A | 0.0000 | |
| 149 | P | A | -1.3667 | mutated: DP149A |
| 150 | D | A | -1.8005 | |
| 151 | L | A | 0.0000 | |
| 152 | K | A | -1.6959 | |
| 153 | M | A | 0.0000 | |
| 154 | A | A | 0.0000 | |
| 155 | V | A | 0.0000 | |
| 156 | S | A | 0.0000 | |
| 157 | F | A | 0.0000 | |
| 158 | S | A | -0.2758 | |
| 159 | Q | A | -0.4223 | |
| 160 | F | A | 0.0000 | |
| 161 | N | A | 0.0000 | |
| 162 | R | A | -0.7594 | |
| 163 | R | A | -0.5813 | |
| 164 | F | A | 0.0000 | |
| 165 | L | A | -0.2775 | |
| 166 | N | A | -0.4470 | |
| 167 | V | A | 0.0000 | |
| 168 | V | A | 0.0000 | |
| 169 | R | A | -0.6464 | |
| 170 | Q | A | 0.0000 | |
| 171 | F | A | 0.0000 | |
| 172 | S | A | 0.0000 | |
| 173 | D | A | -0.8559 | |
| 174 | N | A | -0.6236 | |
| 175 | A | A | -0.4218 | |
| 176 | G | A | 0.0000 | |
| 177 | I | A | 0.4257 | |
| 178 | T | A | 0.0000 | |
| 179 | P | A | -0.0635 | |
| 180 | A | A | -0.4031 | |
| 181 | I | A | 0.0000 | |
| 182 | S | A | 0.0000 | |
| 183 | L | A | 0.0000 | |
| 184 | D | A | -0.3914 | |
| 185 | L | A | -0.1618 | |
| 186 | M | A | 0.0000 | |
| 187 | T | A | -0.4414 | |
| 188 | D | A | -0.6207 | |
| 189 | A | A | -0.2756 | |
| 190 | E | A | 0.0000 | |
| 191 | L | A | 0.0000 | |
| 192 | A | A | -0.5296 | |
| 193 | R | A | -1.1192 | |
| 194 | A | A | 0.0000 | |
| 195 | V | A | 0.0000 | |
| 196 | S | A | -0.9984 | |
| 197 | N | A | -1.4602 | |
| 198 | M | A | 0.0000 | |
| 199 | P | A | -0.5470 | |
| 200 | T | A | -0.2798 | |
| 201 | S | A | -0.1936 | |
| 202 | A | A | -0.3339 | |
| 203 | G | A | -0.6363 | |
| 204 | Q | A | 0.0000 | |
| 205 | I | A | -0.4596 | |
| 206 | K | A | -1.5548 | |
| 207 | L | A | -0.7549 | |
| 208 | M | A | 0.0000 | |
| 209 | L | A | -0.3192 | |
| 210 | E | A | -1.6480 | |
| 211 | N | A | 0.0000 | |
| 212 | R | A | -1.1993 | |
| 213 | A | A | 0.0000 | |
| 214 | M | A | 0.0000 | |
| 215 | V | A | 0.0000 | |
| 216 | R | A | 0.0000 | |
| 217 | R | A | -1.5578 | |
| 218 | K | A | -0.8095 | |
| 219 | G | A | 0.0000 | |
| 220 | F | A | 0.6033 | |
| 221 | G | A | 0.0000 | |
| 222 | I | A | 0.0000 | |
| 223 | L | A | 0.0000 | |
| 224 | I | A | 0.0000 | |
| 225 | G | A | -0.2272 | |
| 226 | V | A | 0.0711 | |
| 227 | Y | A | 0.8663 | |
| 228 | G | A | -0.2160 | |
| 229 | S | A | -0.5398 | |
| 230 | S | A | 0.0000 | |
| 231 | V | A | 0.0000 | |
| 232 | I | A | 0.0000 | |
| 233 | Y | A | 0.0000 | |
| 234 | M | A | 0.0000 | |
| 235 | V | A | 0.0000 | |
| 236 | Q | A | 0.0000 | |
| 237 | L | A | 0.0000 | |
| 238 | P | A | 0.0000 | |
| 239 | I | A | 0.0000 | |
| 240 | F | A | 0.0000 | |
| 241 | G | A | -0.0546 | |
| 242 | V | A | 0.0566 | |
| 243 | I | A | -0.2114 | |
| 244 | D | A | -1.2147 | |
| 245 | T | A | -0.6310 | |
| 246 | P | A | -0.4999 | |
| 247 | C | A | 0.0000 | |
| 248 | W | A | -0.2478 | |
| 249 | I | A | 0.0000 | |
| 250 | V | A | -0.3819 | |
| 251 | K | A | 0.0000 | |
| 252 | A | A | 0.0000 | |
| 253 | A | A | 0.0000 | |
| 254 | P | A | 0.0000 | |
| 255 | S | A | 0.0000 | |
| 256 | C | A | -0.6614 | |
| 257 | S | A | 0.0000 | |
| 258 | E | A | -3.5096 | |
| 259 | K | A | -3.8626 | |
| 260 | K | A | -3.2513 | |
| 261 | G | A | -2.4385 | |
| 262 | N | A | -2.2812 | |
| 263 | Y | A | 0.0000 | |
| 264 | A | A | 0.0000 | |
| 265 | C | A | 0.0000 | |
| 266 | L | A | 0.0000 | |
| 267 | L | A | -0.1514 | |
| 268 | R | A | 0.0000 | |
| 269 | E | A | -1.3027 | |
| 270 | D | A | -2.3225 | |
| 271 | Q | A | 0.0000 | |
| 272 | G | A | -0.7424 | |
| 273 | W | A | 0.0000 | |
| 274 | Y | A | 0.0000 | |
| 275 | C | A | 0.0000 | |
| 276 | Q | A | -0.7998 | |
| 277 | N | A | -0.6923 | |
| 278 | A | A | -0.3617 | |
| 279 | G | A | -0.6939 | |
| 280 | S | A | -0.7856 | |
| 281 | T | A | -0.5857 | |
| 282 | V | A | 0.0000 | |
| 283 | Y | A | -0.0968 | |
| 284 | Y | A | -0.2729 | |
| 285 | P | A | -0.9408 | |
| 286 | N | A | -1.6388 | |
| 287 | E | A | 0.0000 | |
| 288 | K | A | -2.1558 | |
| 289 | D | A | -1.4124 | |
| 290 | C | A | 0.0000 | |
| 291 | E | A | -1.0132 | |
| 292 | T | A | 0.0000 | |
| 293 | R | A | -1.2878 | |
| 294 | G | A | -1.7716 | |
| 295 | D | A | -1.9014 | |
| 296 | H | A | -1.3290 | |
| 297 | V | A | 0.0000 | |
| 298 | F | A | 0.0000 | |
| 299 | C | A | 0.0000 | |
| 300 | D | A | -0.7122 | |
| 301 | T | A | 0.0000 | |
| 302 | A | A | 0.1533 | |
| 303 | A | A | -0.0682 | |
| 304 | G | A | 0.0000 | |
| 305 | I | A | 0.0000 | |
| 306 | N | A | -0.5531 | |
| 307 | V | A | 0.0000 | |
| 308 | A | A | -0.6582 | |
| 309 | E | A | -1.2201 | |
| 310 | Q | A | -1.6657 | |
| 311 | S | A | 0.0000 | |
| 312 | K | A | -1.2325 | |
| 313 | E | A | -1.2353 | |
| 314 | C | A | -0.4378 | |
| 315 | N | A | 0.0000 | |
| 316 | I | A | 0.8406 | |
| 317 | N | A | 0.6837 | |
| 318 | I | A | 1.6489 | |
| 319 | S | A | 0.3191 | |
| 320 | T | A | -0.1098 | |
| 321 | T | A | -0.4485 | |
| 322 | N | A | -0.6368 | |
| 323 | Y | A | 0.0000 | |
| 324 | P | A | -0.3222 | |
| 325 | C | A | 0.0000 | |
| 326 | K | A | -1.4269 | |
| 327 | V | A | 0.0000 | |
| 328 | S | A | 0.0000 | |
| 329 | T | A | 0.0000 | |
| 330 | G | A | 0.0000 | |
| 331 | R | A | 0.0000 | |
| 332 | N | A | -0.1876 | mutated: HN332A |
| 333 | P | A | 0.0000 | |
| 334 | I | A | 0.0000 | |
| 335 | S | A | 0.0000 | |
| 336 | M | A | 0.1425 | |
| 337 | V | A | 0.0000 | |
| 338 | A | A | 0.0000 | |
| 339 | L | A | 0.0000 | |
| 340 | S | A | 0.0000 | |
| 341 | P | A | 0.1949 | |
| 342 | L | A | -0.3634 | |
| 343 | G | A | 0.0000 | |
| 344 | A | A | 0.0000 | |
| 345 | L | A | 0.0000 | |
| 346 | V | A | 0.0000 | |
| 347 | A | A | 0.0000 | |
| 348 | C | A | 0.0000 | |
| 349 | Y | A | -1.0588 | |
| 350 | K | A | -1.1907 | |
| 351 | G | A | -0.7519 | |
| 352 | V | A | -0.4102 | |
| 353 | S | A | -1.0968 | |
| 354 | C | A | 0.0000 | |
| 355 | S | A | -0.4932 | |
| 356 | I | A | 0.0000 | |
| 357 | G | A | -0.2932 | |
| 358 | S | A | -0.9226 | |
| 359 | N | A | -1.8201 | |
| 360 | R | A | -2.5480 | |
| 361 | V | A | -0.8556 | |
| 362 | G | A | -0.4651 | |
| 363 | I | A | 0.1767 | |
| 364 | I | A | 1.3628 | |
| 365 | K | A | -0.0710 | |
| 366 | Q | A | -1.3937 | |
| 367 | L | A | -1.4310 | |
| 368 | N | A | -2.4293 | |
| 369 | K | A | -2.4266 | |
| 370 | G | A | -1.6740 | |
| 371 | C | A | -0.8174 | |
| 372 | S | A | -0.7313 | |
| 373 | Y | A | -0.0601 | |
| 374 | I | A | 0.0000 | |
| 375 | T | A | 0.0000 | |
| 376 | N | A | -2.4410 | |
| 377 | Q | A | -1.8789 | |
| 378 | D | A | -2.2447 | |
| 379 | A | A | 0.0000 | |
| 380 | D | A | -1.3657 | |
| 381 | T | A | -0.7147 | |
| 382 | V | A | 0.0000 | |
| 383 | T | A | -0.3209 | |
| 384 | I | A | 0.0000 | |
| 385 | D | A | -0.5659 | |
| 386 | N | A | -0.2684 | |
| 387 | T | A | 0.0000 | |
| 388 | V | A | 0.1102 | |
| 389 | Y | A | 0.0000 | |
| 390 | Q | A | 0.0000 | |
| 391 | L | A | 0.0000 | |
| 392 | S | A | -1.4175 | |
| 393 | K | A | -2.6636 | |
| 394 | V | A | 0.0000 | |
| 395 | E | A | -2.6286 | |
| 396 | G | A | -2.0708 | |
| 397 | E | A | -2.4788 | |
| 398 | Q | A | -1.6146 | |
| 399 | H | A | -0.6239 | |
| 400 | V | A | 0.9938 | |
| 401 | I | A | 0.4508 | |
| 402 | K | A | -1.4381 | |
| 403 | G | A | -0.9351 | |
| 404 | R | A | -1.1370 | |
| 405 | P | A | 0.0000 | |
| 406 | V | A | 0.2294 | |
| 407 | S | A | 0.0000 | |
| 408 | S | A | -1.2351 | |
| 409 | S | A | -0.7396 | |
| 410 | F | A | 0.0000 | |
| 411 | D | A | -2.2370 | |
| 412 | P | A | -0.9198 | |
| 413 | V | A | -0.5734 | |
| 414 | K | A | -1.0819 | |
| 415 | F | A | 0.0000 | |
| 416 | P | A | -0.6596 | |
| 417 | E | A | -0.5868 | |
| 418 | D | A | -0.4078 | |
| 419 | Q | A | 0.0000 | |
| 420 | F | A | 0.1417 | |
| 421 | N | A | -0.3429 | |
| 422 | V | A | 0.0000 | |
| 423 | A | A | 0.0000 | |
| 424 | L | A | 0.0000 | |
| 425 | P | A | 0.3994 | mutated: DP425A |
| 426 | Q | A | 0.0000 | |
| 427 | V | A | 0.0000 | |
| 428 | F | A | 0.4280 | |
| 429 | E | A | -0.9301 | |
| 430 | N | A | -0.7924 | |
| 431 | I | A | -0.8063 | |
| 432 | E | A | -1.5794 | |
| 433 | N | A | -1.4088 | |
| 434 | S | A | -1.0999 | |
| 435 | Q | A | -1.3921 | |
| 436 | A | A | -1.0899 | |
| 437 | L | A | -0.0857 | |
| 438 | V | A | -0.1681 | |
| 439 | D | A | -2.1319 | |
| 440 | Q | A | -1.4845 | |
| 441 | S | A | -1.1440 | |
| 442 | N | A | -2.0637 | |
| 443 | R | A | -2.5730 | |
| 444 | I | A | 0.0000 | |
| 445 | L | A | -1.1604 | |
| 446 | S | A | -1.9332 | |
| 447 | S | A | -1.9491 | |
| 448 | A | A | -2.5436 | |
| 449 | E | A | -3.1485 | |
| 450 | K | A | -3.0289 | |
| 451 | G | A | 0.0000 | |
| 452 | N | A | -2.8612 | |
| 453 | T | A | -1.7659 | |
| 1 | L | B | -1.8349 | |
| 2 | K | B | -2.2133 | |
| 3 | E | B | 0.0000 | |
| 4 | S | B | 0.0000 | |
| 5 | Y | B | 0.0000 | |
| 6 | L | B | 0.0000 | |
| 7 | E | B | -1.8122 | |
| 8 | E | B | 0.0000 | |
| 9 | S | B | 0.0000 | |
| 10 | C | B | 0.0000 | |
| 11 | S | B | 0.0000 | |
| 12 | T | B | 0.0000 | |
| 13 | I | B | 0.0000 | |
| 14 | T | B | 0.0000 | |
| 15 | E | B | -1.0426 | |
| 16 | G | B | -0.9921 | |
| 17 | Y | B | 0.0000 | |
| 18 | L | B | -0.5210 | |
| 19 | S | B | 0.0000 | |
| 20 | V | B | 0.0000 | |
| 21 | L | B | 0.0000 | |
| 22 | R | B | 0.0000 | |
| 23 | T | B | -0.1136 | |
| 24 | G | B | -0.1344 | |
| 25 | W | B | -0.1400 | |
| 26 | Y | B | 0.0000 | |
| 27 | T | B | 0.0000 | |
| 28 | N | B | 0.0000 | |
| 29 | V | B | 0.0000 | |
| 30 | F | B | 0.0000 | |
| 31 | T | B | 0.0000 | |
| 32 | L | B | 0.0000 | |
| 33 | E | B | -0.7208 | |
| 34 | V | B | 0.0000 | |
| 35 | G | B | -1.4429 | |
| 36 | D | B | -2.3120 | |
| 37 | V | B | 0.0000 | |
| 38 | E | B | -2.4340 | |
| 39 | N | B | -2.5690 | |
| 40 | L | B | 0.0000 | |
| 41 | T | B | -2.7150 | |
| 42 | C | B | 0.0000 | |
| 43 | A | B | -3.0422 | |
| 44 | D | B | -3.4877 | |
| 45 | G | B | -2.8491 | |
| 46 | P | B | -1.6151 | |
| 47 | S | B | -1.2933 | |
| 48 | L | B | -0.8068 | |
| 49 | I | B | 0.0000 | |
| 50 | K | B | -2.4437 | |
| 51 | T | B | -1.3093 | |
| 52 | E | B | 0.0000 | |
| 53 | L | B | 0.0000 | |
| 54 | D | B | -2.0861 | |
| 55 | L | B | -1.1651 | |
| 56 | T | B | 0.0000 | |
| 57 | K | B | -2.0888 | |
| 58 | S | B | -1.5582 | |
| 59 | A | B | 0.0000 | |
| 60 | L | B | -1.2589 | |
| 61 | R | B | -2.2958 | |
| 62 | E | B | 0.0000 | |
| 63 | L | B | 0.0000 | |
| 64 | K | B | -2.1611 | |
| 65 | T | B | 0.0000 | |
| 66 | V | B | 0.0000 | |
| 67 | S | B | -0.8387 | |
| 68 | A | B | 0.0000 | |
| 69 | D | B | -2.0135 | |
| 70 | Q | B | -1.1733 | |
| 71 | L | B | -0.8056 | |
| 72 | G | B | -0.1950 | |
| 73 | G | B | 0.0000 | |
| 74 | G | B | 0.0000 | |
| 75 | G | B | 0.0000 | |
| 76 | S | B | -0.7864 | |
| 77 | A | B | -0.2908 | |
| 78 | T | B | 0.0000 | |
| 79 | A | B | 0.1384 | |
| 80 | A | B | 0.1822 | |
| 81 | A | B | 0.3178 | |
| 82 | V | B | 0.6766 | |
| 83 | T | B | 0.0000 | |
| 84 | A | B | -0.0400 | |
| 85 | G | B | 0.0000 | |
| 86 | V | B | 0.0000 | |
| 87 | A | B | 0.0000 | |
| 88 | I | B | 0.0000 | |
| 89 | A | B | 0.0000 | |
| 90 | K | B | -1.9241 | |
| 91 | C | B | 0.0000 | mutated: TC91B |
| 92 | I | B | 0.0000 | |
| 93 | R | B | -1.2538 | |
| 94 | L | B | -0.2914 | |
| 95 | P | B | -0.4646 | mutated: EP95B |
| 96 | S | B | -0.3898 | |
| 97 | E | B | -0.4299 | |
| 98 | V | B | 0.0000 | |
| 99 | T | B | -0.5122 | |
| 100 | A | B | -0.5943 | |
| 101 | I | B | 0.0000 | |
| 102 | K | B | -1.4311 | |
| 103 | N | B | -2.4070 | |
| 104 | A | B | -1.9161 | |
| 105 | L | B | 0.0000 | |
| 106 | K | B | -3.6242 | |
| 107 | K | B | -3.5033 | |
| 108 | T | B | -2.6345 | |
| 109 | N | B | -3.1757 | |
| 110 | E | B | -2.5546 | |
| 111 | A | B | -0.7697 | |
| 112 | V | B | 1.3293 | |
| 113 | S | B | 0.4761 | |
| 114 | T | B | -0.0542 | |
| 115 | L | B | 0.0000 | |
| 116 | G | B | -0.8114 | |
| 117 | C | B | 0.0000 | mutated: NC117B |
| 118 | G | B | -0.9920 | |
| 119 | V | B | 0.0000 | |
| 120 | R | B | -0.3656 | |
| 121 | V | B | 0.0000 | |
| 122 | L | B | -0.0213 | |
| 123 | A | B | 0.0000 | |
| 124 | T | B | -0.9679 | |
| 125 | A | B | -1.0943 | |
| 126 | V | B | -0.3814 | |
| 127 | P | B | -0.3431 | mutated: RP127B |
| 128 | E | B | -0.5846 | |
| 129 | L | B | 0.0000 | |
| 130 | K | B | -1.3481 | |
| 131 | D | B | -1.3150 | |
| 132 | F | B | 0.0000 | |
| 133 | V | B | 0.0000 | |
| 134 | S | B | -1.7636 | |
| 135 | K | B | -2.1938 | |
| 136 | N | B | -1.7509 | |
| 137 | L | B | 0.0000 | |
| 138 | T | B | -2.3946 | |
| 139 | R | B | -2.7976 | |
| 140 | A | B | -2.2651 | |
| 141 | I | B | 0.0000 | |
| 142 | N | B | -3.5783 | |
| 143 | K | B | -3.8660 | |
| 144 | N | B | -3.8673 | |
| 145 | K | B | -4.2597 | |
| 146 | C | B | 0.0000 | |
| 147 | D | B | -3.3258 | |
| 148 | I | B | 0.0000 | |
| 149 | P | B | -1.4156 | mutated: DP149B |
| 150 | D | B | -1.8607 | |
| 151 | L | B | 0.0000 | |
| 152 | K | B | -1.0436 | |
| 153 | M | B | 0.0000 | |
| 154 | A | B | 0.0000 | |
| 155 | V | B | 0.0000 | |
| 156 | S | B | 0.0000 | |
| 157 | F | B | 0.0000 | |
| 158 | S | B | -0.2302 | |
| 159 | Q | B | -0.2972 | |
| 160 | F | B | 0.0000 | |
| 161 | N | B | 0.0000 | |
| 162 | R | B | -0.5084 | |
| 163 | R | B | -0.5839 | |
| 164 | F | B | 0.0000 | |
| 165 | L | B | 0.0000 | |
| 166 | N | B | -0.6409 | |
| 167 | V | B | 0.0000 | |
| 168 | V | B | 0.0000 | |
| 169 | R | B | -0.6419 | |
| 170 | Q | B | -0.5979 | |
| 171 | F | B | 0.0000 | |
| 172 | S | B | 0.0000 | |
| 173 | D | B | -0.8193 | |
| 174 | N | B | -0.6350 | |
| 175 | A | B | 0.0000 | |
| 176 | G | B | 0.0000 | |
| 177 | I | B | 0.4692 | |
| 178 | T | B | 0.0000 | |
| 179 | P | B | -0.3278 | |
| 180 | A | B | 0.0000 | |
| 181 | I | B | 0.0000 | |
| 182 | S | B | -0.3569 | |
| 183 | L | B | -0.1022 | |
| 184 | D | B | -0.4340 | |
| 185 | L | B | -0.1283 | |
| 186 | M | B | 0.0000 | |
| 187 | T | B | -0.2915 | |
| 188 | D | B | -0.9176 | |
| 189 | A | B | -0.8145 | |
| 190 | E | B | -1.0725 | |
| 191 | L | B | 0.0000 | |
| 192 | A | B | -1.1361 | |
| 193 | R | B | -2.2410 | |
| 194 | A | B | 0.0000 | |
| 195 | V | B | 0.0000 | |
| 196 | S | B | -1.4118 | |
| 197 | N | B | -1.5470 | |
| 198 | M | B | 0.0000 | |
| 199 | P | B | -0.5383 | |
| 200 | T | B | -0.3155 | |
| 201 | S | B | -0.1557 | |
| 202 | A | B | -0.4051 | |
| 203 | G | B | -0.5885 | |
| 204 | Q | B | 0.0000 | |
| 205 | I | B | -0.5346 | |
| 206 | K | B | -1.6955 | |
| 207 | L | B | -0.9018 | |
| 208 | M | B | 0.0000 | |
| 209 | L | B | -0.9027 | |
| 210 | E | B | -2.0740 | |
| 211 | N | B | -1.0990 | |
| 212 | R | B | -1.1237 | |
| 213 | A | B | 0.0000 | |
| 214 | M | B | -0.6350 | |
| 215 | V | B | 0.0000 | |
| 216 | R | B | 0.0000 | |
| 217 | R | B | -1.1978 | |
| 218 | K | B | -0.8097 | |
| 219 | G | B | 0.0000 | |
| 220 | F | B | 0.3550 | |
| 221 | G | B | 0.0000 | |
| 222 | I | B | 0.0000 | |
| 223 | L | B | 0.0000 | |
| 224 | I | B | 0.0000 | |
| 225 | G | B | 0.0000 | |
| 226 | V | B | 0.5422 | |
| 227 | Y | B | 0.8324 | |
| 228 | G | B | 0.1514 | |
| 229 | S | B | -0.3479 | |
| 230 | S | B | 0.0000 | |
| 231 | V | B | 0.0000 | |
| 232 | I | B | 0.0000 | |
| 233 | Y | B | 0.0000 | |
| 234 | M | B | 0.0000 | |
| 235 | V | B | 0.0000 | |
| 236 | Q | B | 0.0000 | |
| 237 | L | B | 0.0000 | |
| 238 | P | B | 0.0000 | |
| 239 | I | B | 0.0000 | |
| 240 | F | B | 0.0000 | |
| 241 | G | B | 0.0263 | |
| 242 | V | B | 0.1874 | |
| 243 | I | B | 0.2344 | |
| 244 | D | B | -1.2814 | |
| 245 | T | B | 0.0000 | |
| 246 | P | B | -0.6717 | |
| 247 | C | B | 0.0000 | |
| 248 | W | B | -0.0585 | |
| 249 | I | B | 0.0000 | |
| 250 | V | B | 0.0000 | |
| 251 | K | B | 0.0000 | |
| 252 | A | B | 0.0000 | |
| 253 | A | B | 0.0000 | |
| 254 | P | B | 0.0000 | |
| 255 | S | B | 0.0000 | |
| 256 | C | B | -0.6249 | |
| 257 | S | B | -1.6612 | |
| 258 | E | B | -2.7473 | |
| 259 | K | B | -3.1236 | |
| 260 | K | B | -2.7521 | |
| 261 | G | B | -1.9990 | |
| 262 | N | B | -2.8922 | |
| 263 | Y | B | 0.0000 | |
| 264 | A | B | 0.0000 | |
| 265 | C | B | 0.0000 | |
| 266 | L | B | 0.0000 | |
| 267 | L | B | -0.1235 | |
| 268 | R | B | 0.0000 | |
| 269 | E | B | -1.4155 | |
| 270 | D | B | -1.2786 | |
| 271 | Q | B | -1.0140 | |
| 272 | G | B | 0.0000 | |
| 273 | W | B | 0.0000 | |
| 274 | Y | B | 0.0000 | |
| 275 | C | B | 0.0000 | |
| 276 | Q | B | -0.9513 | |
| 277 | N | B | -1.3126 | |
| 278 | A | B | -0.5773 | |
| 279 | G | B | -0.8482 | |
| 280 | S | B | -0.8238 | |
| 281 | T | B | 0.0000 | |
| 282 | V | B | 0.0000 | |
| 283 | Y | B | 0.0054 | |
| 284 | Y | B | 0.0000 | |
| 285 | P | B | -1.1557 | |
| 286 | N | B | -1.7410 | |
| 287 | E | B | -1.6679 | |
| 288 | K | B | -1.9694 | |
| 289 | D | B | -1.8511 | |
| 290 | C | B | 0.0000 | |
| 291 | E | B | -1.0933 | |
| 292 | T | B | 0.0000 | |
| 293 | R | B | -1.3779 | |
| 294 | G | B | -1.7544 | |
| 295 | D | B | -2.2854 | |
| 296 | H | B | -1.3953 | |
| 297 | V | B | 0.0000 | |
| 298 | F | B | -0.4265 | |
| 299 | C | B | 0.0000 | |
| 300 | D | B | -0.6665 | |
| 301 | T | B | 0.0000 | |
| 302 | A | B | 0.0000 | |
| 303 | A | B | -0.0702 | |
| 304 | G | B | 0.0000 | |
| 305 | I | B | 0.3315 | |
| 306 | N | B | 0.0000 | |
| 307 | V | B | 0.0000 | |
| 308 | A | B | -0.7002 | |
| 309 | E | B | -1.3569 | |
| 310 | Q | B | -1.6489 | |
| 311 | S | B | -1.3295 | |
| 312 | K | B | -1.1885 | |
| 313 | E | B | -1.8180 | |
| 314 | C | B | 0.0000 | |
| 315 | N | B | 0.0000 | |
| 316 | I | B | -0.5615 | |
| 317 | N | B | -1.2300 | |
| 318 | I | B | 0.0000 | |
| 319 | S | B | -0.2620 | |
| 320 | T | B | -0.6349 | |
| 321 | T | B | -1.0880 | |
| 322 | N | B | -2.0143 | |
| 323 | Y | B | 0.0000 | |
| 324 | P | B | 0.0000 | |
| 325 | C | B | 0.0000 | |
| 326 | K | B | -1.5759 | |
| 327 | V | B | 0.0000 | |
| 328 | S | B | 0.0000 | |
| 329 | T | B | 0.0000 | |
| 330 | G | B | 0.0000 | |
| 331 | R | B | 0.0000 | |
| 332 | N | B | -0.5476 | mutated: HN332B |
| 333 | P | B | 0.0000 | |
| 334 | I | B | 0.0000 | |
| 335 | S | B | 0.0000 | |
| 336 | M | B | 0.1346 | |
| 337 | V | B | 0.0000 | |
| 338 | A | B | 0.0000 | |
| 339 | L | B | 0.0000 | |
| 340 | S | B | 0.0000 | |
| 341 | P | B | 0.0000 | |
| 342 | L | B | -1.0239 | |
| 343 | G | B | 0.0000 | |
| 344 | A | B | 0.0000 | |
| 345 | L | B | 0.0000 | |
| 346 | V | B | 0.0000 | |
| 347 | A | B | 0.0000 | |
| 348 | C | B | 0.0000 | |
| 349 | Y | B | 0.0000 | |
| 350 | K | B | -2.5822 | |
| 351 | G | B | -1.7371 | |
| 352 | V | B | 0.0000 | |
| 353 | S | B | -1.6712 | |
| 354 | C | B | 0.0000 | |
| 355 | S | B | -0.6683 | |
| 356 | I | B | 0.0000 | |
| 357 | G | B | 0.5657 | |
| 358 | S | B | 0.0000 | |
| 359 | N | B | -0.4203 | |
| 360 | R | B | -1.3745 | |
| 361 | V | B | 0.7183 | |
| 362 | G | B | 0.6352 | |
| 363 | I | B | 1.5671 | |
| 364 | I | B | 1.3742 | |
| 365 | K | B | -1.0014 | |
| 366 | Q | B | -1.6175 | |
| 367 | L | B | -1.6044 | |
| 368 | N | B | -2.7827 | |
| 369 | K | B | -2.5960 | |
| 370 | G | B | -1.3821 | |
| 371 | C | B | -0.2576 | |
| 372 | S | B | -0.0255 | |
| 373 | Y | B | 0.6829 | |
| 374 | I | B | 0.4553 | |
| 375 | T | B | -0.5613 | |
| 376 | N | B | 0.0000 | |
| 377 | Q | B | -1.1592 | |
| 378 | D | B | -0.5663 | |
| 379 | A | B | 0.0000 | |
| 380 | D | B | 0.0000 | |
| 381 | T | B | 0.1681 | |
| 382 | V | B | 0.0000 | |
| 383 | T | B | 0.3416 | |
| 384 | I | B | 0.0000 | |
| 385 | D | B | -1.2254 | |
| 386 | N | B | -0.4778 | |
| 387 | T | B | 0.0000 | |
| 388 | V | B | 1.4131 | |
| 389 | Y | B | 0.0000 | |
| 390 | Q | B | 0.1854 | |
| 391 | L | B | 0.0000 | |
| 392 | S | B | 0.0000 | |
| 393 | K | B | -1.1729 | |
| 394 | V | B | 0.0000 | |
| 395 | E | B | -2.5133 | |
| 396 | G | B | -2.3241 | |
| 397 | E | B | -2.6853 | |
| 398 | Q | B | -2.0726 | |
| 399 | H | B | -1.0790 | |
| 400 | V | B | 0.5313 | |
| 401 | I | B | -0.1513 | |
| 402 | K | B | -1.9687 | |
| 403 | G | B | -2.1419 | |
| 404 | R | B | -2.5610 | |
| 405 | P | B | -1.6114 | |
| 406 | V | B | 0.0000 | |
| 407 | S | B | 0.0000 | |
| 408 | S | B | -1.0426 | |
| 409 | S | B | -0.8391 | |
| 410 | F | B | -0.4063 | |
| 411 | D | B | -2.2105 | |
| 412 | P | B | -0.9084 | |
| 413 | V | B | 0.0000 | |
| 414 | K | B | 0.0000 | |
| 415 | F | B | 1.1568 | |
| 416 | P | B | 0.2148 | |
| 417 | E | B | 0.0000 | |
| 418 | D | B | 0.0000 | |
| 419 | Q | B | 0.0000 | |
| 420 | F | B | 0.0734 | |
| 421 | N | B | -0.6717 | |
| 422 | V | B | 0.0000 | |
| 423 | A | B | 0.0000 | |
| 424 | L | B | 0.0000 | |
| 425 | P | B | 0.0381 | mutated: DP425B |
| 426 | Q | B | 0.0327 | |
| 427 | V | B | 0.0000 | |
| 428 | F | B | 1.2705 | |
| 429 | E | B | -0.2589 | |
| 430 | N | B | 0.0000 | |
| 431 | I | B | 0.0000 | |
| 432 | E | B | -1.5108 | |
| 433 | N | B | -0.7997 | |
| 434 | S | B | 0.0000 | |
| 435 | Q | B | -1.7965 | |
| 436 | A | B | -1.1972 | |
| 437 | L | B | -0.5040 | |
| 438 | V | B | -0.7314 | |
| 439 | D | B | -2.4020 | |
| 440 | Q | B | -1.6368 | |
| 441 | S | B | -1.3023 | |
| 442 | N | B | -1.9494 | |
| 443 | R | B | -2.5874 | |
| 444 | I | B | 0.0000 | |
| 445 | L | B | -0.9885 | |
| 446 | S | B | -1.6090 | |
| 447 | S | B | -2.0574 | |
| 448 | A | B | -2.0387 | |
| 449 | E | B | -2.7279 | |
| 450 | K | B | -2.9518 | |
| 451 | G | B | -2.4555 | |
| 452 | N | B | -2.6322 | |
| 453 | T | B | -1.3729 | |
| 1 | L | C | -1.8743 | |
| 2 | K | C | -2.9115 | |
| 3 | E | C | 0.0000 | |
| 4 | S | C | -0.7253 | |
| 5 | Y | C | 0.0000 | |
| 6 | L | C | 0.0000 | |
| 7 | E | C | -2.8161 | |
| 8 | E | C | -3.1510 | |
| 9 | S | C | 0.0000 | |
| 10 | C | C | 0.0000 | |
| 11 | S | C | 0.0000 | |
| 12 | T | C | 0.0000 | |
| 13 | I | C | 0.0000 | |
| 14 | T | C | 0.0000 | |
| 15 | E | C | -1.0388 | |
| 16 | G | C | -0.8158 | |
| 17 | Y | C | -0.5005 | |
| 18 | L | C | -0.2521 | |
| 19 | S | C | 0.0000 | |
| 20 | V | C | 0.0000 | |
| 21 | L | C | 0.0000 | |
| 22 | R | C | 0.0000 | |
| 23 | T | C | 0.0311 | |
| 24 | G | C | 0.0746 | |
| 25 | W | C | -0.0950 | |
| 26 | Y | C | 0.0000 | |
| 27 | T | C | 0.0000 | |
| 28 | N | C | 0.0000 | |
| 29 | V | C | 0.0000 | |
| 30 | F | C | 0.0000 | |
| 31 | T | C | 0.0000 | |
| 32 | L | C | 0.0000 | |
| 33 | E | C | -0.8795 | |
| 34 | V | C | 0.0000 | |
| 35 | G | C | -1.7641 | |
| 36 | D | C | -2.5554 | |
| 37 | V | C | 0.0000 | |
| 38 | E | C | 0.0000 | |
| 39 | N | C | -2.4333 | |
| 40 | L | C | 0.0000 | |
| 41 | T | C | -2.4550 | |
| 42 | C | C | 0.0000 | |
| 43 | A | C | -2.5447 | |
| 44 | D | C | -2.8524 | |
| 45 | G | C | -1.2733 | |
| 46 | P | C | -1.1090 | |
| 47 | S | C | 0.0000 | |
| 48 | L | C | 0.0000 | |
| 49 | I | C | 0.0000 | |
| 50 | K | C | -1.5486 | |
| 51 | T | C | 0.0000 | |
| 52 | E | C | 0.0000 | |
| 53 | L | C | 0.0000 | |
| 54 | D | C | -1.2534 | |
| 55 | L | C | -0.4288 | |
| 56 | T | C | 0.0000 | |
| 57 | K | C | -1.4503 | |
| 58 | S | C | -1.0402 | |
| 59 | A | C | 0.0000 | |
| 60 | L | C | -1.3023 | |
| 61 | R | C | -2.4693 | |
| 62 | E | C | 0.0000 | |
| 63 | L | C | 0.0000 | |
| 64 | K | C | -2.3818 | |
| 65 | T | C | 0.0000 | |
| 66 | V | C | 0.0000 | |
| 67 | S | C | -0.8139 | |
| 68 | A | C | 0.0000 | |
| 69 | D | C | -1.0276 | |
| 70 | Q | C | -0.3845 | |
| 71 | L | C | -0.2340 | |
| 72 | G | C | 0.0000 | |
| 73 | G | C | -0.8327 | |
| 74 | G | C | -1.3767 | |
| 75 | G | C | -1.4234 | |
| 76 | S | C | -0.8328 | |
| 77 | A | C | -0.1509 | |
| 78 | T | C | 0.0000 | |
| 79 | A | C | -0.1190 | |
| 80 | A | C | 0.2240 | |
| 81 | A | C | 0.2880 | |
| 82 | V | C | 0.5003 | |
| 83 | T | C | 0.2101 | |
| 84 | A | C | 0.0000 | |
| 85 | G | C | 0.0000 | |
| 86 | V | C | -0.2233 | |
| 87 | A | C | -0.7083 | |
| 88 | I | C | 0.0000 | |
| 89 | A | C | 0.0000 | |
| 90 | K | C | -1.8113 | |
| 91 | C | C | -0.8120 | mutated: TC91C |
| 92 | I | C | 0.0000 | |
| 93 | R | C | -1.0574 | |
| 94 | L | C | -0.1364 | |
| 95 | P | C | -0.4426 | mutated: EP95C |
| 96 | S | C | -0.5105 | |
| 97 | E | C | -0.7170 | |
| 98 | V | C | 0.0000 | |
| 99 | T | C | -0.8198 | |
| 100 | A | C | -0.9532 | |
| 101 | I | C | 0.0000 | |
| 102 | K | C | -1.9049 | |
| 103 | N | C | -2.6963 | |
| 104 | A | C | -2.3532 | |
| 105 | L | C | 0.0000 | |
| 106 | K | C | -3.9460 | |
| 107 | K | C | -3.5875 | |
| 108 | T | C | -2.8314 | |
| 109 | N | C | -3.3949 | |
| 110 | E | C | -2.6595 | |
| 111 | A | C | 0.0000 | |
| 112 | V | C | 1.0658 | |
| 113 | S | C | 0.3591 | |
| 114 | T | C | -0.3847 | |
| 115 | L | C | 0.0000 | |
| 116 | G | C | -0.9409 | |
| 117 | C | C | -1.2651 | mutated: NC117C |
| 118 | G | C | -1.3658 | |
| 119 | V | C | -0.9924 | |
| 120 | R | C | -1.4685 | |
| 121 | V | C | 0.0000 | |
| 122 | L | C | -0.2278 | |
| 123 | A | C | 0.0000 | |
| 124 | T | C | -1.2104 | |
| 125 | A | C | -1.6939 | |
| 126 | V | C | -0.7790 | |
| 127 | P | C | -1.2811 | mutated: RP127C |
| 128 | E | C | -1.3326 | |
| 129 | L | C | 0.0000 | |
| 130 | K | C | -2.4939 | |
| 131 | D | C | -2.5037 | |
| 132 | F | C | -2.0397 | |
| 133 | V | C | 0.0000 | |
| 134 | S | C | -2.6421 | |
| 135 | K | C | -3.0774 | |
| 136 | N | C | -2.6786 | |
| 137 | L | C | 0.0000 | |
| 138 | T | C | -2.7253 | |
| 139 | R | C | -3.2559 | |
| 140 | A | C | -2.6860 | |
| 141 | I | C | 0.0000 | |
| 142 | N | C | -4.0626 | |
| 143 | K | C | -4.2596 | |
| 144 | N | C | -3.8593 | |
| 145 | K | C | -4.0506 | |
| 146 | C | C | 0.0000 | |
| 147 | D | C | -3.3083 | |
| 148 | I | C | 0.0000 | |
| 149 | P | C | -1.5307 | mutated: DP149C |
| 150 | D | C | -1.4740 | |
| 151 | L | C | 0.0000 | |
| 152 | K | C | -1.3149 | |
| 153 | M | C | -0.6567 | |
| 154 | A | C | 0.0000 | |
| 155 | V | C | -0.2647 | |
| 156 | S | C | -0.1570 | |
| 157 | F | C | 0.0000 | |
| 158 | S | C | -0.0436 | |
| 159 | Q | C | 0.0000 | |
| 160 | F | C | 0.0000 | |
| 161 | N | C | 0.0000 | |
| 162 | R | C | 0.0000 | |
| 163 | R | C | -0.3969 | |
| 164 | F | C | 0.0000 | |
| 165 | L | C | 0.0317 | |
| 166 | N | C | -0.2740 | |
| 167 | V | C | 0.0000 | |
| 168 | V | C | 0.0000 | |
| 169 | R | C | -0.4866 | |
| 170 | Q | C | -0.5757 | |
| 171 | F | C | 0.0000 | |
| 172 | S | C | 0.0000 | |
| 173 | D | C | -0.9406 | |
| 174 | N | C | -0.7890 | |
| 175 | A | C | 0.0000 | |
| 176 | G | C | 0.0000 | |
| 177 | I | C | 0.2241 | |
| 178 | T | C | 0.0000 | |
| 179 | P | C | -0.1558 | |
| 180 | A | C | 0.0000 | |
| 181 | I | C | 0.0000 | |
| 182 | S | C | 0.0000 | |
| 183 | L | C | -0.3130 | |
| 184 | D | C | -0.2952 | |
| 185 | L | C | 0.0000 | |
| 186 | M | C | 0.0000 | |
| 187 | T | C | -0.5176 | |
| 188 | D | C | -0.8539 | |
| 189 | A | C | -0.5074 | |
| 190 | E | C | -0.6422 | |
| 191 | L | C | 0.0000 | |
| 192 | A | C | -1.0120 | |
| 193 | R | C | -1.1867 | |
| 194 | A | C | 0.0000 | |
| 195 | V | C | 0.0000 | |
| 196 | S | C | -1.1564 | |
| 197 | N | C | -1.3484 | |
| 198 | M | C | 0.0000 | |
| 199 | P | C | -0.8059 | |
| 200 | T | C | -0.5001 | |
| 201 | S | C | -0.4849 | |
| 202 | A | C | -0.6756 | |
| 203 | G | C | -0.5772 | |
| 204 | Q | C | -0.6067 | |
| 205 | I | C | -0.9318 | |
| 206 | K | C | -1.8976 | |
| 207 | L | C | -1.0993 | |
| 208 | M | C | 0.0000 | |
| 209 | L | C | -1.1288 | |
| 210 | E | C | -2.3401 | |
| 211 | N | C | -1.7866 | |
| 212 | R | C | -1.4618 | |
| 213 | A | C | 0.0000 | |
| 214 | M | C | 0.0000 | |
| 215 | V | C | 0.0000 | |
| 216 | R | C | 0.0000 | |
| 217 | R | C | -1.0615 | |
| 218 | K | C | -0.5534 | |
| 219 | G | C | 0.0000 | |
| 220 | F | C | 0.5268 | |
| 221 | G | C | 0.0000 | |
| 222 | I | C | 0.0000 | |
| 223 | L | C | 0.0000 | |
| 224 | I | C | 0.0000 | |
| 225 | G | C | 0.0000 | |
| 226 | V | C | -0.2906 | |
| 227 | Y | C | 0.0492 | |
| 228 | G | C | -0.3157 | |
| 229 | S | C | -0.5844 | |
| 230 | S | C | 0.0000 | |
| 231 | V | C | 0.0000 | |
| 232 | I | C | 0.0000 | |
| 233 | Y | C | 0.0000 | |
| 234 | M | C | 0.0000 | |
| 235 | V | C | 0.0000 | |
| 236 | Q | C | 0.0000 | |
| 237 | L | C | 0.0000 | |
| 238 | P | C | 0.0000 | |
| 239 | I | C | 0.0000 | |
| 240 | F | C | 0.0000 | |
| 241 | G | C | -0.0705 | |
| 242 | V | C | 0.0989 | |
| 243 | I | C | -0.4300 | |
| 244 | D | C | -1.4615 | |
| 245 | T | C | 0.0000 | |
| 246 | P | C | -0.4336 | |
| 247 | C | C | 0.0000 | |
| 248 | W | C | 0.1088 | |
| 249 | I | C | 0.0000 | |
| 250 | V | C | 0.0000 | |
| 251 | K | C | 0.0000 | |
| 252 | A | C | 0.0000 | |
| 253 | A | C | 0.0000 | |
| 254 | P | C | 0.0000 | |
| 255 | S | C | 0.0000 | |
| 256 | C | C | -0.3685 | |
| 257 | S | C | -1.8239 | |
| 258 | E | C | -3.2250 | |
| 259 | K | C | -3.8722 | |
| 260 | K | C | -3.7784 | |
| 261 | G | C | -2.6438 | |
| 262 | N | C | -3.3259 | |
| 263 | Y | C | 0.0000 | |
| 264 | A | C | 0.0000 | |
| 265 | C | C | 0.0000 | |
| 266 | L | C | 0.0000 | |
| 267 | L | C | -0.1906 | |
| 268 | R | C | 0.0000 | |
| 269 | E | C | -1.3776 | |
| 270 | D | C | -1.0408 | |
| 271 | Q | C | 0.0000 | |
| 272 | G | C | 0.0000 | |
| 273 | W | C | 0.0000 | |
| 274 | Y | C | 0.0000 | |
| 275 | C | C | 0.0000 | |
| 276 | Q | C | -0.6656 | |
| 277 | N | C | -0.6741 | |
| 278 | A | C | -0.5099 | |
| 279 | G | C | -0.5539 | |
| 280 | S | C | 0.0000 | |
| 281 | T | C | 0.0000 | |
| 282 | V | C | 0.0000 | |
| 283 | Y | C | 0.0244 | |
| 284 | Y | C | -0.3399 | |
| 285 | P | C | -0.8013 | |
| 286 | N | C | -1.3842 | |
| 287 | E | C | -1.6544 | |
| 288 | K | C | -2.2859 | |
| 289 | D | C | -1.5779 | |
| 290 | C | C | -0.9161 | |
| 291 | E | C | -0.7029 | |
| 292 | T | C | -0.6423 | |
| 293 | R | C | -1.0212 | |
| 294 | G | C | -1.2303 | |
| 295 | D | C | -1.0965 | |
| 296 | H | C | -0.8622 | |
| 297 | V | C | 0.0000 | |
| 298 | F | C | 0.0000 | |
| 299 | C | C | 0.0000 | |
| 300 | D | C | -0.6896 | |
| 301 | T | C | 0.0000 | |
| 302 | A | C | -0.0499 | |
| 303 | A | C | -0.2579 | |
| 304 | G | C | -0.2095 | |
| 305 | I | C | 0.2263 | |
| 306 | N | C | 0.0000 | |
| 307 | V | C | 0.0000 | |
| 308 | A | C | -0.6175 | |
| 309 | E | C | -0.8969 | |
| 310 | Q | C | -0.6727 | |
| 311 | S | C | -0.6266 | |
| 312 | K | C | -0.5651 | |
| 313 | E | C | 0.0000 | |
| 314 | C | C | 0.0000 | |
| 315 | N | C | -0.1822 | |
| 316 | I | C | 0.0000 | |
| 317 | N | C | -0.5878 | |
| 318 | I | C | 1.1060 | |
| 319 | S | C | 0.2140 | |
| 320 | T | C | -0.0812 | |
| 321 | T | C | -0.2751 | |
| 322 | N | C | -0.5127 | |
| 323 | Y | C | 0.5786 | |
| 324 | P | C | 0.0000 | |
| 325 | C | C | 0.0000 | |
| 326 | K | C | -0.8099 | |
| 327 | V | C | 0.0000 | |
| 328 | S | C | -0.3393 | |
| 329 | T | C | 0.0000 | |
| 330 | G | C | -0.2437 | |
| 331 | R | C | 0.0000 | |
| 332 | N | C | -0.8874 | mutated: HN332C |
| 333 | P | C | 0.0000 | |
| 334 | I | C | 0.4723 | |
| 335 | S | C | 0.0000 | |
| 336 | M | C | 0.3806 | |
| 337 | V | C | 0.0000 | |
| 338 | A | C | 0.0000 | |
| 339 | L | C | 0.0000 | |
| 340 | S | C | 0.0000 | |
| 341 | P | C | 0.0000 | |
| 342 | L | C | 0.0000 | |
| 343 | G | C | 0.0000 | |
| 344 | A | C | 0.0000 | |
| 345 | L | C | 0.0000 | |
| 346 | V | C | 0.0000 | |
| 347 | A | C | 0.0000 | |
| 348 | C | C | 0.0000 | |
| 349 | Y | C | -1.6460 | |
| 350 | K | C | -2.8476 | |
| 351 | G | C | -1.3985 | |
| 352 | V | C | -0.7105 | |
| 353 | S | C | -1.1259 | |
| 354 | C | C | 0.0000 | |
| 355 | S | C | -0.6396 | |
| 356 | I | C | 0.0000 | |
| 357 | G | C | -0.5316 | |
| 358 | S | C | -0.9879 | |
| 359 | N | C | -0.9079 | |
| 360 | R | C | -1.1572 | |
| 361 | V | C | 0.7993 | |
| 362 | G | C | 0.3281 | |
| 363 | I | C | 0.9524 | |
| 364 | I | C | 0.9876 | |
| 365 | K | C | -1.3700 | |
| 366 | Q | C | -1.5399 | |
| 367 | L | C | -1.4944 | |
| 368 | N | C | -2.2156 | |
| 369 | K | C | -1.7717 | |
| 370 | G | C | -1.7110 | |
| 371 | C | C | 0.0000 | |
| 372 | S | C | -0.9139 | |
| 373 | Y | C | -0.4651 | |
| 374 | I | C | 0.0000 | |
| 375 | T | C | -1.3213 | |
| 376 | N | C | -2.1982 | |
| 377 | Q | C | -2.4800 | |
| 378 | D | C | -2.5202 | |
| 379 | A | C | 0.0000 | |
| 380 | D | C | 0.0000 | |
| 381 | T | C | -0.9822 | |
| 382 | V | C | 0.0000 | |
| 383 | T | C | -0.4827 | |
| 384 | I | C | 0.0000 | |
| 385 | D | C | -1.1694 | |
| 386 | N | C | -0.9867 | |
| 387 | T | C | 0.0000 | |
| 388 | V | C | -0.0951 | |
| 389 | Y | C | 0.0000 | |
| 390 | Q | C | -0.3033 | |
| 391 | L | C | 0.0000 | |
| 392 | S | C | 0.0000 | |
| 393 | K | C | -1.3229 | |
| 394 | V | C | 0.0000 | |
| 395 | E | C | -2.6186 | |
| 396 | G | C | -2.7388 | |
| 397 | E | C | -3.2657 | |
| 398 | Q | C | -1.9867 | |
| 399 | H | C | -0.9270 | |
| 400 | V | C | 0.7187 | |
| 401 | I | C | -0.0774 | |
| 402 | K | C | -2.2410 | |
| 403 | G | C | 0.0000 | |
| 404 | R | C | -2.4462 | |
| 405 | P | C | 0.0000 | |
| 406 | V | C | -0.1769 | |
| 407 | S | C | 0.0000 | |
| 408 | S | C | -1.0838 | |
| 409 | S | C | -0.3951 | |
| 410 | F | C | 0.0000 | |
| 411 | D | C | -2.3611 | |
| 412 | P | C | -1.0799 | |
| 413 | V | C | 0.0000 | |
| 414 | K | C | 0.0000 | |
| 415 | F | C | -0.1944 | |
| 416 | P | C | -0.1894 | |
| 417 | E | C | 0.0066 | |
| 418 | D | C | 0.0000 | |
| 419 | Q | C | 0.0000 | |
| 420 | F | C | 0.0322 | |
| 421 | N | C | -0.3750 | |
| 422 | V | C | 0.0000 | |
| 423 | A | C | 0.0000 | |
| 424 | L | C | 0.5322 | |
| 425 | P | C | 0.5107 | mutated: DP425C |
| 426 | Q | C | 0.0000 | |
| 427 | V | C | 0.0000 | |
| 428 | F | C | 1.1866 | |
| 429 | E | C | -0.7547 | |
| 430 | N | C | 0.0000 | |
| 431 | I | C | -0.3351 | |
| 432 | E | C | -0.7449 | |
| 433 | N | C | -1.1396 | |
| 434 | S | C | 0.0000 | |
| 435 | Q | C | -1.3184 | |
| 436 | A | C | -1.0383 | |
| 437 | L | C | -0.5629 | |
| 438 | V | C | -1.0437 | |
| 439 | D | C | -2.6415 | |
| 440 | Q | C | -1.9892 | |
| 441 | S | C | 0.0000 | |
| 442 | N | C | -2.7731 | |
| 443 | R | C | -2.9637 | |
| 444 | I | C | 0.0000 | |
| 445 | L | C | -2.0205 | |
| 446 | S | C | -2.3138 | |
| 447 | S | C | -2.4322 | |
| 448 | A | C | 0.0000 | |
| 449 | E | C | -3.4908 | |
| 450 | K | C | -3.0917 | |
| 451 | G | C | 0.0000 | |
| 452 | N | C | -2.6365 | |
| 453 | T | C | -1.7149 |
3Dmol can be expensive computationally for big molecules. If you experience lag or delay click on the "Play the video" button instead.
CABS-flex predictions of flexibility of input structure
In dynamic mode, A4D analysis is performed on the set of models reflecting fluctuations of the input structure (predicted
by CABS-flex method, models are numbered from 0 to 11) and the input model.
Their A4D scores are provided below in the table.
The right panel presents comparison of the most aggregation prone model (with the highest A4D score, -0.6446 in this case) with the input model
(the most aggregation prone model in blue, input in red) and RMSF plot which shows the extent of residue fluctuations in Angstroms (predicted by CABS-flex).
Model |
Average A4D Score |
|||
| model_0 | -0.6446 | View | CSV | PDB |
| model_2 | -0.6555 | View | CSV | PDB |
| input | -0.6598 | View | CSV | PDB |
| model_8 | -0.663 | View | CSV | PDB |
| model_1 | -0.6632 | View | CSV | PDB |
| model_4 | -0.6759 | View | CSV | PDB |
| CABS_average | -0.6797 | View | CSV | PDB |
| model_10 | -0.6843 | View | CSV | PDB |
| model_3 | -0.6889 | View | CSV | PDB |
| model_7 | -0.6897 | View | CSV | PDB |
| model_9 | -0.69 | View | CSV | PDB |
| model_5 | -0.6919 | View | CSV | PDB |
| model_6 | -0.6956 | View | CSV | PDB |
| model_11 | -0.7142 | 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