| Chain sequence(s) |
A: MKFGIYFAYWEKEWNADYEHYIRKAADLGFDVMELSCAPMEHYTDAYMARLRDTAAHYGVRLTAGYGPTPQRNLSSSDPAVAKAAKAYFIDLMQRLQKMGIDSIGGGLNSYWPVDYSKPVDKARDWAIGVENVREVAKVAADCGVDFCIECLNRFEGYLTNTAAEGVRFCEEVGLPNVKLLLDTFHMNIEEDSFYSAIVTAGSRLGRLHTGEANRRVPGKGRMPWFEIGNALHAIGFDGDVVMEPFVQQGGTIGSAIKVWRDLSEGADAEVLDRDAKDALAFSRMVLGRQHAV
B: MKFGIYFAYWEKEWNADYEHYIRKAADLGFDVMELSCAPMEHYTDAYMARLRDTAAHYGVRLTAGYGPTPQRNLSSSDPAVAKAAKAYFIDLMQRLQKMGIDSIGGGLNSYWPVDYSKPVDKARDWAIGVENVREVAKVAADCGVDFCIECLNRFEGYLTNTAAEGVRFCEEVGLPNVKLLLDTFHMNIEEDSFYSAIVTAGSRLGRLHTGEANRRVPGKGRMPWFEIGNALHAIGFDGDVVMEPFVQQGGTIGSAIKVWRDLSEGADAEVLDRDAKDALAFSRMVLGRQHAV 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] (00:00:00)
[WARNING] runJob: Working directory already exists (possibly overwriting previous results -ow
to prevent this behavior) (00:00:00)
[INFO] runJob: Starting aggrescan3d job on: input.pdb with all chain(s) selected (00:00:00)
[INFO] runJob: Creating pdb object from: input.pdb (00:00:00)
[INFO] FoldX: Starting FoldX energy minimalization (00:00:00)
[INFO] Analysis: Starting Aggrescan3D on folded.pdb (00:08:33)
[INFO] Main: Simulation completed successfully. (00:08:38)
|
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 | -1.7238 | |
| 2 | K | A | -1.5543 | |
| 3 | F | A | 0.0000 | |
| 4 | G | A | 0.0000 | |
| 5 | I | A | 0.0000 | |
| 6 | Y | A | 0.0000 | |
| 7 | F | A | 0.0000 | |
| 8 | A | A | 0.0000 | |
| 9 | Y | A | 0.0000 | |
| 10 | W | A | -0.4600 | |
| 11 | E | A | -1.6817 | |
| 12 | K | A | -2.2110 | |
| 13 | E | A | -2.1503 | |
| 14 | W | A | -1.2888 | |
| 15 | N | A | -2.0743 | |
| 16 | A | A | -2.0320 | |
| 17 | D | A | -2.5063 | |
| 18 | Y | A | 0.0000 | |
| 19 | E | A | -2.7316 | |
| 20 | H | A | -2.2435 | |
| 21 | Y | A | 0.0000 | |
| 22 | I | A | 0.0000 | |
| 23 | R | A | -3.0229 | |
| 24 | K | A | -2.2312 | |
| 25 | A | A | 0.0000 | |
| 26 | A | A | -1.9537 | |
| 27 | D | A | -2.6100 | |
| 28 | L | A | 0.0000 | |
| 29 | G | A | -1.3536 | |
| 30 | F | A | 0.0000 | |
| 31 | D | A | -0.8890 | |
| 32 | V | A | 0.0000 | |
| 33 | M | A | 0.0000 | |
| 34 | E | A | 0.0000 | |
| 35 | L | A | 0.0000 | |
| 36 | S | A | 0.0000 | |
| 37 | C | A | 0.0000 | |
| 38 | A | A | -0.5143 | |
| 39 | P | A | -0.8082 | |
| 40 | M | A | 0.0000 | |
| 41 | E | A | -1.5482 | |
| 42 | H | A | -1.5251 | |
| 43 | Y | A | -0.9991 | |
| 44 | T | A | -1.3049 | |
| 45 | D | A | -2.1764 | |
| 46 | A | A | -1.2032 | |
| 47 | Y | A | -1.3010 | |
| 48 | M | A | 0.0000 | |
| 49 | A | A | -2.3255 | |
| 50 | R | A | -3.0524 | |
| 51 | L | A | 0.0000 | |
| 52 | R | A | -3.2136 | |
| 53 | D | A | -3.3546 | |
| 54 | T | A | 0.0000 | |
| 55 | A | A | 0.0000 | |
| 56 | A | A | -1.8101 | |
| 57 | H | A | -1.8095 | |
| 58 | Y | A | -1.4244 | |
| 59 | G | A | -1.1906 | |
| 60 | V | A | 0.0000 | |
| 61 | R | A | -1.2920 | |
| 62 | L | A | 0.0000 | |
| 63 | T | A | 0.0000 | |
| 64 | A | A | 0.0000 | |
| 65 | G | A | 0.0000 | |
| 66 | Y | A | 0.0000 | |
| 67 | G | A | -0.1170 | |
| 68 | P | A | 0.0000 | |
| 69 | T | A | -0.5997 | |
| 70 | P | A | -0.9190 | |
| 71 | Q | A | -1.6903 | |
| 72 | R | A | -1.1677 | |
| 73 | N | A | 0.0000 | |
| 74 | L | A | 0.0000 | |
| 75 | S | A | 0.0000 | |
| 76 | S | A | -1.0012 | |
| 77 | S | A | -1.0150 | |
| 78 | D | A | -1.7958 | |
| 79 | P | A | -1.3098 | |
| 80 | A | A | -1.1216 | |
| 81 | V | A | -1.3545 | |
| 82 | A | A | 0.0000 | |
| 83 | K | A | -2.1476 | |
| 84 | A | A | -1.0737 | |
| 85 | A | A | 0.0000 | |
| 86 | K | A | -1.1551 | |
| 87 | A | A | -0.5380 | |
| 88 | Y | A | 0.0000 | |
| 89 | F | A | 0.0000 | |
| 90 | I | A | -0.1074 | |
| 91 | D | A | -0.9456 | |
| 92 | L | A | 0.0000 | |
| 93 | M | A | 0.0000 | |
| 94 | Q | A | -1.5526 | |
| 95 | R | A | -1.6915 | |
| 96 | L | A | 0.0000 | |
| 97 | Q | A | -2.1511 | |
| 98 | K | A | -2.1396 | |
| 99 | M | A | 0.0000 | |
| 100 | G | A | -1.9482 | |
| 101 | I | A | 0.0000 | |
| 102 | D | A | -1.4892 | |
| 103 | S | A | 0.0000 | |
| 104 | I | A | 0.0000 | |
| 105 | G | A | 0.0000 | |
| 106 | G | A | 0.0000 | |
| 107 | G | A | 0.0000 | |
| 108 | L | A | 0.0000 | |
| 109 | N | A | 0.0000 | |
| 110 | S | A | 0.0000 | |
| 111 | Y | A | -0.1943 | |
| 112 | W | A | 0.0038 | |
| 113 | P | A | -0.0437 | |
| 114 | V | A | -0.2322 | |
| 115 | D | A | -0.9458 | |
| 116 | Y | A | -0.7558 | |
| 117 | S | A | -1.1782 | |
| 118 | K | A | -1.9329 | |
| 119 | P | A | -1.1465 | |
| 120 | V | A | -0.6515 | |
| 121 | D | A | -1.2797 | |
| 122 | K | A | -0.7943 | |
| 123 | A | A | -0.6530 | |
| 124 | R | A | -1.1024 | |
| 125 | D | A | 0.0000 | |
| 126 | W | A | 0.0000 | |
| 127 | A | A | -0.6060 | |
| 128 | I | A | -0.4302 | |
| 129 | G | A | 0.0000 | |
| 130 | V | A | 0.0000 | |
| 131 | E | A | -2.1669 | |
| 132 | N | A | 0.0000 | |
| 133 | V | A | 0.0000 | |
| 134 | R | A | -2.3709 | |
| 135 | E | A | -2.7020 | |
| 136 | V | A | 0.0000 | |
| 137 | A | A | 0.0000 | |
| 138 | K | A | -2.4768 | |
| 139 | V | A | -1.4327 | |
| 140 | A | A | 0.0000 | |
| 141 | A | A | -1.6485 | |
| 142 | D | A | -2.2817 | |
| 143 | C | A | -1.7638 | |
| 144 | G | A | -1.7147 | |
| 145 | V | A | 0.0000 | |
| 146 | D | A | -1.0494 | |
| 147 | F | A | 0.0000 | |
| 148 | C | A | 0.0000 | |
| 149 | I | A | 0.0000 | |
| 150 | E | A | 0.0000 | |
| 151 | C | A | 0.0000 | |
| 152 | L | A | 0.0000 | |
| 153 | N | A | 0.0000 | |
| 154 | R | A | 0.0000 | |
| 155 | F | A | 0.0000 | |
| 156 | E | A | 0.0000 | |
| 157 | G | A | 0.0000 | |
| 158 | Y | A | 0.0000 | |
| 159 | L | A | 0.0000 | |
| 160 | T | A | 0.0000 | |
| 161 | N | A | 0.0000 | |
| 162 | T | A | -0.3351 | |
| 163 | A | A | 0.0000 | |
| 164 | A | A | -0.2495 | |
| 165 | E | A | -0.8265 | |
| 166 | G | A | 0.0000 | |
| 167 | V | A | -1.2344 | |
| 168 | R | A | -2.2958 | |
| 169 | F | A | 0.0000 | |
| 170 | C | A | 0.0000 | |
| 171 | E | A | -2.9092 | |
| 172 | E | A | -2.4538 | |
| 173 | V | A | 0.0000 | |
| 174 | G | A | -1.6219 | |
| 175 | L | A | -1.2102 | |
| 176 | P | A | -0.8918 | |
| 177 | N | A | 0.0000 | |
| 178 | V | A | 0.0000 | |
| 179 | K | A | -0.7767 | |
| 180 | L | A | 0.0000 | |
| 181 | L | A | 0.0000 | |
| 182 | L | A | 0.0000 | |
| 183 | D | A | 0.0000 | |
| 184 | T | A | 0.0000 | |
| 185 | F | A | 0.0000 | |
| 186 | H | A | 0.0000 | |
| 187 | M | A | 0.0000 | |
| 188 | N | A | 0.0000 | |
| 189 | I | A | 0.0000 | |
| 190 | E | A | 0.0000 | |
| 191 | E | A | 0.0000 | |
| 192 | D | A | -1.6512 | |
| 193 | S | A | -0.6650 | |
| 194 | F | A | 0.0000 | |
| 195 | Y | A | 0.3177 | |
| 196 | S | A | 0.1743 | |
| 197 | A | A | 0.0000 | |
| 198 | I | A | 0.0000 | |
| 199 | V | A | 0.9307 | |
| 200 | T | A | 0.4889 | |
| 201 | A | A | 0.0000 | |
| 202 | G | A | 0.1246 | |
| 203 | S | A | -0.4694 | |
| 204 | R | A | -0.5696 | |
| 205 | L | A | 0.0000 | |
| 206 | G | A | -0.6795 | |
| 207 | R | A | 0.0000 | |
| 208 | L | A | 0.0000 | |
| 209 | H | A | 0.0000 | |
| 210 | T | A | 0.0000 | |
| 211 | G | A | 0.0000 | |
| 212 | E | A | 0.0000 | |
| 213 | A | A | 0.0000 | |
| 214 | N | A | 0.0000 | |
| 215 | R | A | 0.0000 | |
| 216 | R | A | -0.8097 | |
| 217 | V | A | 0.0000 | |
| 218 | P | A | 0.0000 | |
| 219 | G | A | -1.3266 | |
| 220 | K | A | -1.8829 | |
| 221 | G | A | -1.6437 | |
| 222 | R | A | -1.2601 | |
| 223 | M | A | 0.0000 | |
| 224 | P | A | -0.1216 | |
| 225 | W | A | 0.0000 | |
| 226 | F | A | 0.8937 | |
| 227 | E | A | -0.4848 | |
| 228 | I | A | 0.0000 | |
| 229 | G | A | 0.0000 | |
| 230 | N | A | -0.8702 | |
| 231 | A | A | 0.0000 | |
| 232 | L | A | 0.0000 | |
| 233 | H | A | -1.1985 | |
| 234 | A | A | -0.0241 | |
| 235 | I | A | -0.0910 | |
| 236 | G | A | -1.0558 | |
| 237 | F | A | 0.0000 | |
| 238 | D | A | -2.3413 | |
| 239 | G | A | -1.2393 | |
| 240 | D | A | 0.0000 | |
| 241 | V | A | 0.0000 | |
| 242 | V | A | 0.0000 | |
| 243 | M | A | 0.0000 | |
| 244 | E | A | -0.2086 | |
| 245 | P | A | 0.0000 | |
| 246 | F | A | 0.0000 | |
| 247 | V | A | 0.0000 | |
| 248 | Q | A | -1.6432 | |
| 249 | Q | A | -1.6279 | |
| 250 | G | A | -1.3882 | |
| 251 | G | A | -1.3351 | |
| 252 | T | A | -1.0123 | |
| 253 | I | A | 0.0000 | |
| 254 | G | A | 0.0000 | |
| 255 | S | A | -0.6461 | |
| 256 | A | A | -0.1750 | |
| 257 | I | A | 0.0000 | |
| 258 | K | A | -0.3695 | |
| 259 | V | A | 0.0000 | |
| 260 | W | A | 0.0000 | |
| 261 | R | A | -1.4966 | |
| 262 | D | A | -2.5308 | |
| 263 | L | A | 0.0000 | |
| 264 | S | A | -1.9388 | |
| 265 | E | A | -2.6792 | |
| 266 | G | A | -2.0356 | |
| 267 | A | A | -2.1542 | |
| 268 | D | A | -2.4048 | |
| 269 | A | A | -1.7872 | |
| 270 | E | A | -2.5165 | |
| 271 | V | A | -1.7497 | |
| 272 | L | A | 0.0000 | |
| 273 | D | A | -2.5445 | |
| 274 | R | A | -3.1109 | |
| 275 | D | A | -2.4656 | |
| 276 | A | A | 0.0000 | |
| 277 | K | A | -2.8683 | |
| 278 | D | A | -2.8650 | |
| 279 | A | A | 0.0000 | |
| 280 | L | A | 0.0000 | |
| 281 | A | A | -0.6936 | |
| 282 | F | A | -0.3337 | |
| 283 | S | A | 0.0000 | |
| 284 | R | A | -0.7349 | |
| 285 | M | A | 0.2491 | |
| 286 | V | A | 0.0000 | |
| 287 | L | A | 0.0000 | |
| 288 | G | A | 0.0000 | |
| 289 | R | A | -2.8976 | |
| 290 | Q | A | -1.9094 | |
| 291 | H | A | -0.6425 | |
| 292 | A | A | 0.5601 | |
| 293 | V | A | 1.7855 | |
| 1 | M | B | -1.5865 | |
| 2 | K | B | -1.1843 | |
| 3 | F | B | 0.0000 | |
| 4 | G | B | 0.0000 | |
| 5 | I | B | 0.0000 | |
| 6 | Y | B | 0.0000 | |
| 7 | F | B | 0.0000 | |
| 8 | A | B | 0.0000 | |
| 9 | Y | B | 0.0000 | |
| 10 | W | B | -0.4682 | |
| 11 | E | B | -1.6535 | |
| 12 | K | B | -2.3488 | |
| 13 | E | B | -2.2071 | |
| 14 | W | B | -1.3176 | |
| 15 | N | B | -2.0904 | |
| 16 | A | B | -2.0447 | |
| 17 | D | B | -2.5246 | |
| 18 | Y | B | 0.0000 | |
| 19 | E | B | -2.5227 | |
| 20 | H | B | -1.9336 | |
| 21 | Y | B | 0.0000 | |
| 22 | I | B | 0.0000 | |
| 23 | R | B | -1.9249 | |
| 24 | K | B | -1.6805 | |
| 25 | A | B | 0.0000 | |
| 26 | A | B | -1.5491 | |
| 27 | D | B | -2.2982 | |
| 28 | L | B | 0.0000 | |
| 29 | G | B | -1.2610 | |
| 30 | F | B | 0.0000 | |
| 31 | D | B | -0.7856 | |
| 32 | V | B | 0.0000 | |
| 33 | M | B | 0.0000 | |
| 34 | E | B | 0.0000 | |
| 35 | L | B | 0.0000 | |
| 36 | S | B | 0.0000 | |
| 37 | C | B | 0.0000 | |
| 38 | A | B | -0.5061 | |
| 39 | P | B | -0.7848 | |
| 40 | M | B | 0.0000 | |
| 41 | E | B | -1.4201 | |
| 42 | H | B | -1.5111 | |
| 43 | Y | B | -1.0114 | |
| 44 | T | B | -1.3415 | |
| 45 | D | B | -2.3103 | |
| 46 | A | B | -1.2807 | |
| 47 | Y | B | -1.4552 | |
| 48 | M | B | 0.0000 | |
| 49 | A | B | -2.4972 | |
| 50 | R | B | -3.1207 | |
| 51 | L | B | 0.0000 | |
| 52 | R | B | -3.3823 | |
| 53 | D | B | -3.3736 | |
| 54 | T | B | -2.4620 | |
| 55 | A | B | 0.0000 | |
| 56 | A | B | -1.7746 | |
| 57 | H | B | -1.6481 | |
| 58 | Y | B | -1.0956 | |
| 59 | G | B | -1.0231 | |
| 60 | V | B | 0.0000 | |
| 61 | R | B | -1.1375 | |
| 62 | L | B | 0.0000 | |
| 63 | T | B | 0.0000 | |
| 64 | A | B | 0.0000 | |
| 65 | G | B | 0.0000 | |
| 66 | Y | B | 0.0000 | |
| 67 | G | B | -0.1384 | |
| 68 | P | B | 0.0000 | |
| 69 | T | B | -0.6087 | |
| 70 | P | B | -0.9310 | |
| 71 | Q | B | -1.6862 | |
| 72 | R | B | -1.1817 | |
| 73 | N | B | 0.0000 | |
| 74 | L | B | 0.0000 | |
| 75 | S | B | 0.0000 | |
| 76 | S | B | -0.9903 | |
| 77 | S | B | -1.0104 | |
| 78 | D | B | -1.7283 | |
| 79 | P | B | -1.2788 | |
| 80 | A | B | -1.1010 | |
| 81 | V | B | -1.3376 | |
| 82 | A | B | 0.0000 | |
| 83 | K | B | -2.1383 | |
| 84 | A | B | -1.1211 | |
| 85 | A | B | 0.0000 | |
| 86 | K | B | -1.1268 | |
| 87 | A | B | -0.5843 | |
| 88 | Y | B | 0.0000 | |
| 89 | F | B | 0.0000 | |
| 90 | I | B | -0.2931 | |
| 91 | D | B | -0.7926 | |
| 92 | L | B | 0.0000 | |
| 93 | M | B | 0.0000 | |
| 94 | Q | B | -1.9464 | |
| 95 | R | B | -2.0172 | |
| 96 | L | B | 0.0000 | |
| 97 | Q | B | -2.9387 | |
| 98 | K | B | -2.9334 | |
| 99 | M | B | 0.0000 | |
| 100 | G | B | -2.2939 | |
| 101 | I | B | 0.0000 | |
| 102 | D | B | -1.7079 | |
| 103 | S | B | 0.0000 | |
| 104 | I | B | 0.0000 | |
| 105 | G | B | 0.0000 | |
| 106 | G | B | 0.0000 | |
| 107 | G | B | 0.0000 | |
| 108 | L | B | 0.0000 | |
| 109 | N | B | 0.0000 | |
| 110 | S | B | 0.0000 | |
| 111 | Y | B | -0.2089 | |
| 112 | W | B | -0.0225 | |
| 113 | P | B | -0.0761 | |
| 114 | V | B | -0.2640 | |
| 115 | D | B | -0.9853 | |
| 116 | Y | B | -0.7805 | |
| 117 | S | B | -1.1862 | |
| 118 | K | B | -1.9495 | |
| 119 | P | B | -1.1658 | |
| 120 | V | B | -0.6938 | |
| 121 | D | B | -1.3178 | |
| 122 | K | B | -0.8065 | |
| 123 | A | B | -0.6459 | |
| 124 | R | B | -1.1078 | |
| 125 | D | B | 0.0000 | |
| 126 | W | B | 0.0000 | |
| 127 | A | B | -0.6403 | |
| 128 | I | B | -0.4725 | |
| 129 | G | B | 0.0000 | |
| 130 | V | B | 0.0000 | |
| 131 | E | B | -2.1971 | |
| 132 | N | B | 0.0000 | |
| 133 | V | B | 0.0000 | |
| 134 | R | B | -2.0615 | |
| 135 | E | B | -2.1322 | |
| 136 | V | B | 0.0000 | |
| 137 | A | B | 0.0000 | |
| 138 | K | B | -2.0706 | |
| 139 | V | B | -1.3534 | |
| 140 | A | B | 0.0000 | |
| 141 | A | B | -1.6116 | |
| 142 | D | B | -2.3200 | |
| 143 | C | B | -2.0360 | |
| 144 | G | B | -1.8513 | |
| 145 | V | B | 0.0000 | |
| 146 | D | B | -1.1402 | |
| 147 | F | B | 0.0000 | |
| 148 | C | B | 0.0000 | |
| 149 | I | B | 0.0000 | |
| 150 | E | B | 0.0000 | |
| 151 | C | B | 0.0000 | |
| 152 | L | B | 0.0000 | |
| 153 | N | B | 0.0000 | |
| 154 | R | B | 0.0000 | |
| 155 | F | B | 0.0000 | |
| 156 | E | B | 0.0000 | |
| 157 | G | B | 0.0000 | |
| 158 | Y | B | 0.0000 | |
| 159 | L | B | 0.0000 | |
| 160 | T | B | 0.0000 | |
| 161 | N | B | 0.0000 | |
| 162 | T | B | 0.0000 | |
| 163 | A | B | 0.0000 | |
| 164 | A | B | -0.2853 | |
| 165 | E | B | -0.8803 | |
| 166 | G | B | 0.0000 | |
| 167 | V | B | -1.2978 | |
| 168 | R | B | -2.4290 | |
| 169 | F | B | 0.0000 | |
| 170 | C | B | 0.0000 | |
| 171 | E | B | -2.9475 | |
| 172 | E | B | -2.5063 | |
| 173 | V | B | 0.0000 | |
| 174 | G | B | -1.6257 | |
| 175 | L | B | -1.0699 | |
| 176 | P | B | -0.8923 | |
| 177 | N | B | -1.0899 | |
| 178 | V | B | 0.0000 | |
| 179 | K | B | -0.8003 | |
| 180 | L | B | 0.0000 | |
| 181 | L | B | 0.0000 | |
| 182 | L | B | 0.0000 | |
| 183 | D | B | 0.0000 | |
| 184 | T | B | 0.0000 | |
| 185 | F | B | 0.0000 | |
| 186 | H | B | 0.0000 | |
| 187 | M | B | 0.0000 | |
| 188 | N | B | 0.0000 | |
| 189 | I | B | 0.0000 | |
| 190 | E | B | 0.0000 | |
| 191 | E | B | 0.0000 | |
| 192 | D | B | -1.4327 | |
| 193 | S | B | -0.5490 | |
| 194 | F | B | 0.0000 | |
| 195 | Y | B | 0.4887 | |
| 196 | S | B | 0.2153 | |
| 197 | A | B | 0.0000 | |
| 198 | I | B | 0.0000 | |
| 199 | V | B | 0.9660 | |
| 200 | T | B | 0.4845 | |
| 201 | A | B | 0.0000 | |
| 202 | G | B | 0.1225 | |
| 203 | S | B | -0.2900 | |
| 204 | R | B | -0.5842 | |
| 205 | L | B | 0.0000 | |
| 206 | G | B | -0.6978 | |
| 207 | R | B | 0.0000 | |
| 208 | L | B | 0.0000 | |
| 209 | H | B | 0.0000 | |
| 210 | T | B | 0.0000 | |
| 211 | G | B | 0.0000 | |
| 212 | E | B | 0.0000 | |
| 213 | A | B | 0.0000 | |
| 214 | N | B | 0.0000 | |
| 215 | R | B | 0.0000 | |
| 216 | R | B | -0.8453 | |
| 217 | V | B | 0.0000 | |
| 218 | P | B | 0.0000 | |
| 219 | G | B | -1.3348 | |
| 220 | K | B | -1.9287 | |
| 221 | G | B | -1.7378 | |
| 222 | R | B | -1.3287 | |
| 223 | M | B | 0.0000 | |
| 224 | P | B | 0.0604 | |
| 225 | W | B | 0.0000 | |
| 226 | F | B | 1.5565 | |
| 227 | E | B | -0.0414 | |
| 228 | I | B | 0.0000 | |
| 229 | G | B | 0.0000 | |
| 230 | N | B | -0.4714 | |
| 231 | A | B | 0.0000 | |
| 232 | L | B | 0.0000 | |
| 233 | H | B | -1.0285 | |
| 234 | A | B | 0.0898 | |
| 235 | I | B | -0.0329 | |
| 236 | G | B | -1.0097 | |
| 237 | F | B | 0.0000 | |
| 238 | D | B | -2.2523 | |
| 239 | G | B | -1.1587 | |
| 240 | D | B | 0.0000 | |
| 241 | V | B | 0.0000 | |
| 242 | V | B | 0.0000 | |
| 243 | M | B | 0.0000 | |
| 244 | E | B | -0.2253 | |
| 245 | P | B | 0.0000 | |
| 246 | F | B | 0.0000 | |
| 247 | V | B | 0.0000 | |
| 248 | Q | B | -1.7173 | |
| 249 | Q | B | -1.8764 | |
| 250 | G | B | -1.5832 | |
| 251 | G | B | -1.4690 | |
| 252 | T | B | -1.0815 | |
| 253 | I | B | 0.0000 | |
| 254 | G | B | 0.0000 | |
| 255 | S | B | -0.6927 | |
| 256 | A | B | -0.1689 | |
| 257 | I | B | 0.0000 | |
| 258 | K | B | -0.3809 | |
| 259 | V | B | 0.0000 | |
| 260 | W | B | -0.6942 | |
| 261 | R | B | -1.3143 | |
| 262 | D | B | -2.1903 | |
| 263 | L | B | 0.0000 | |
| 264 | S | B | -1.8487 | |
| 265 | E | B | -2.6441 | |
| 266 | G | B | -1.9363 | |
| 267 | A | B | -2.0826 | |
| 268 | D | B | -2.3879 | |
| 269 | A | B | -1.7756 | |
| 270 | E | B | -2.4990 | |
| 271 | V | B | -1.5293 | |
| 272 | L | B | 0.0000 | |
| 273 | D | B | -2.5403 | |
| 274 | R | B | -3.1084 | |
| 275 | D | B | -2.4671 | |
| 276 | A | B | 0.0000 | |
| 277 | K | B | -2.8896 | |
| 278 | D | B | -2.9029 | |
| 279 | A | B | 0.0000 | |
| 280 | L | B | 0.0000 | |
| 281 | A | B | -0.7578 | |
| 282 | F | B | -0.3270 | |
| 283 | S | B | 0.0000 | |
| 284 | R | B | -0.6863 | |
| 285 | M | B | 0.6323 | |
| 286 | V | B | 0.6741 | |
| 287 | L | B | 0.0000 | |
| 288 | G | B | 0.0000 | |
| 289 | R | B | -2.8084 | |
| 290 | Q | B | -1.8731 | |
| 291 | H | B | -0.3664 | |
| 292 | A | B | 0.7430 | |
| 293 | V | B | 2.0351 |
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