| Chain sequence(s) |
A: EKIRSKVIIKNELLKAALGEFLGTAILVLAINSVVAQSVLHVAPNKLININIGVGLGIAFGIAVTARISGGHINPAVSLMFLTFRQITALRFAVYFVAQLLGAFVDALITYIVYCDAIRTFDGGERAIFGSKATAHIFASYPATHLGIFNGLLDQIVATAVFCLLIAHTVDKRNHYPSWVQPFIIGTAFVLVGTAFALNAGYSCNPARDLGPRIFTLLAGYGWKVFSYNDYGWFWIPIVGPFIGALIGGWIYEIVVGFQTP
C: EKIRSKVIIKNELLKAALGEFLGTAILVLAINSVVAQSVLHVAPNKLININIGVGLGIAFGIAVTARISGGHINPAVSLMFLTFRQITALRFAVYFVAQLLGAFVDALITYIVYCDAIRTFDGGERAIFGSKATAHIFASYPATHLGIFNGLLDQIVATAVFCLLIAHTVDKRNHYPSWVQPFIIGTAFVLVGTAFALNAGYSCNPARDLGPRIFTLLAGYGWKVFSYNDYGWFWIPIVGPFIGALIGGWIYEIVVGFQTP B: EKIRSKVIIKNELLKAALGEFLGTAILVLAINSVVAQSVLHVAPNKLININIGVGLGIAFGIAVTARISGGHINPAVSLMFLTFRQITALRFAVYFVAQLLGAFVDALITYIVYCDAIRTFDGGERAIFGSKATAHIFASYPATHLGIFNGLLDQIVATAVFCLLIAHTVDKRNHYPSWVQPFIIGTAFVLVGTAFALNAGYSCNPARDLGPRIFTLLAGYGWKVFSYNDYGWFWIPIVGPFIGALIGGWIYEIVVGFQTP D: EKIRSKVIIKNELLKAALGEFLGTAILVLAINSVVAQSVLHVAPNKLININIGVGLGIAFGIAVTARISGGHINPAVSLMFLTFRQITALRFAVYFVAQLLGAFVDALITYIVYCDAIRTFDGGERAIFGSKATAHIFASYPATHLGIFNGLLDQIVATAVFCLLIAHTVDKRNHYPSWVQPFIIGTAFVLVGTAFALNAGYSCNPARDLGPRIFTLLAGYGWKVFSYNDYGWFWIPIVGPFIGALIGGWIYEIVVGFQTP input PDB |
| Selected Chain(s) | A,C,B,D |
| 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] (00:00:01)
[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 all chain(s) selected (00:00:01)
[INFO] runJob: Creating pdb object from: input.pdb (00:00:01)
[INFO] FoldX: Starting FoldX energy minimalization (00:00:02)
[INFO] Analysis: Starting Aggrescan3D on folded.pdb (00:15:40)
[INFO] Main: Simulation completed successfully. (00:16:00)
|
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 | |
| 2 | E | A | -2.8365 | |
| 3 | K | A | -2.5292 | |
| 4 | I | A | -0.6455 | |
| 5 | R | A | -1.2838 | |
| 6 | S | A | -1.3267 | |
| 7 | K | A | -1.5890 | |
| 8 | V | A | 0.1974 | |
| 9 | I | A | 0.1875 | |
| 10 | I | A | -0.6734 | |
| 11 | K | A | -2.2171 | |
| 12 | N | A | -2.4688 | |
| 13 | E | A | -2.4739 | |
| 14 | L | A | -0.6549 | |
| 15 | L | A | -0.1657 | |
| 16 | K | A | -0.7116 | |
| 17 | A | A | 0.0000 | |
| 18 | A | A | 0.7915 | |
| 19 | L | A | 0.9482 | |
| 20 | G | A | 0.0000 | |
| 21 | E | A | 0.0000 | |
| 22 | F | A | 1.5043 | |
| 23 | L | A | 0.0000 | |
| 24 | G | A | 0.0000 | |
| 25 | T | A | 0.0000 | |
| 26 | A | A | 0.0000 | |
| 27 | I | A | 0.0000 | |
| 28 | L | A | 0.0000 | |
| 29 | V | A | 0.0000 | |
| 30 | L | A | 0.0000 | |
| 31 | A | A | 0.0000 | |
| 32 | I | A | 0.0000 | |
| 33 | N | A | 0.0000 | |
| 34 | S | A | 0.0000 | |
| 35 | V | A | 0.0000 | |
| 36 | V | A | 0.0000 | |
| 37 | A | A | 0.0000 | |
| 38 | Q | A | 0.0000 | |
| 39 | S | A | 0.0000 | |
| 40 | V | A | 0.3629 | |
| 41 | L | A | 0.0671 | |
| 42 | H | A | -0.1988 | |
| 43 | V | A | 0.8298 | |
| 44 | A | A | 0.2167 | |
| 45 | P | A | 0.0000 | |
| 46 | N | A | 0.0000 | |
| 47 | K | A | -0.3550 | |
| 48 | L | A | 0.4271 | |
| 49 | I | A | 0.3317 | |
| 50 | N | A | 0.0000 | |
| 51 | I | A | 0.3749 | |
| 52 | N | A | 0.0000 | |
| 53 | I | A | 0.6699 | |
| 54 | G | A | 0.0000 | |
| 55 | V | A | 0.0000 | |
| 56 | G | A | 0.0000 | |
| 57 | L | A | 0.4389 | |
| 58 | G | A | 0.0000 | |
| 59 | I | A | 0.0000 | |
| 60 | A | A | 0.0000 | |
| 61 | F | A | 0.0000 | |
| 62 | G | A | 0.0000 | |
| 63 | I | A | 0.0000 | |
| 64 | A | A | 0.0000 | |
| 65 | V | A | 0.0000 | |
| 66 | T | A | 0.0000 | |
| 67 | A | A | -0.7984 | |
| 68 | R | A | -1.4865 | |
| 69 | I | A | -0.6390 | |
| 70 | S | A | -0.5986 | |
| 71 | G | A | -0.6510 | |
| 72 | G | A | 0.0000 | |
| 73 | H | A | -0.0925 | |
| 74 | I | A | 0.0000 | |
| 75 | N | A | 0.0000 | |
| 76 | P | A | 0.0000 | |
| 77 | A | A | 0.0000 | |
| 78 | V | A | 0.0000 | |
| 79 | S | A | 0.0000 | |
| 80 | L | A | 0.9277 | |
| 81 | M | A | 0.0000 | |
| 82 | F | A | -0.1759 | |
| 83 | L | A | 0.0000 | |
| 84 | T | A | -0.2835 | |
| 85 | F | A | -0.8766 | |
| 86 | R | A | -2.2915 | |
| 87 | Q | A | -1.7500 | |
| 88 | I | A | -0.5377 | |
| 89 | T | A | 0.0137 | |
| 90 | A | A | 0.6294 | |
| 91 | L | A | 1.7379 | |
| 92 | R | A | 1.2685 | |
| 93 | F | A | 1.5442 | |
| 94 | A | A | 1.5637 | |
| 95 | V | A | 1.9230 | |
| 96 | Y | A | 0.0000 | |
| 97 | F | A | 2.0194 | |
| 98 | V | A | 2.7875 | |
| 99 | A | A | 2.1105 | |
| 100 | Q | A | 0.0000 | |
| 101 | L | A | 1.9160 | |
| 102 | L | A | 2.2850 | |
| 103 | G | A | 0.0000 | |
| 104 | A | A | 0.0000 | |
| 105 | F | A | 1.5871 | |
| 106 | V | A | 1.5208 | |
| 107 | D | A | 0.0000 | |
| 108 | A | A | 0.0000 | |
| 109 | L | A | 1.5593 | |
| 110 | I | A | 1.3770 | |
| 111 | T | A | 0.0000 | |
| 112 | Y | A | 0.7377 | |
| 113 | I | A | 1.1393 | |
| 114 | V | A | 0.0000 | |
| 115 | Y | A | 0.0000 | |
| 116 | C | A | 0.0000 | |
| 117 | D | A | -0.7509 | |
| 118 | A | A | 0.0000 | |
| 119 | I | A | 0.0000 | |
| 120 | R | A | -2.7747 | |
| 121 | T | A | -1.7573 | |
| 122 | F | A | -1.5261 | |
| 123 | D | A | -2.2942 | |
| 124 | G | A | -2.1353 | |
| 125 | G | A | -2.5428 | |
| 126 | E | A | -3.3959 | |
| 127 | R | A | -2.6308 | |
| 128 | A | A | -1.3106 | |
| 129 | I | A | 0.0000 | |
| 130 | F | A | 0.3480 | |
| 131 | G | A | -0.4310 | |
| 132 | S | A | -0.8610 | |
| 133 | K | A | -1.6629 | |
| 134 | A | A | 0.0000 | |
| 135 | T | A | 0.0000 | |
| 136 | A | A | 0.0000 | |
| 137 | H | A | -0.0009 | |
| 138 | I | A | 0.0000 | |
| 139 | F | A | 0.0000 | |
| 140 | A | A | 0.0000 | |
| 141 | S | A | 0.0000 | |
| 142 | Y | A | 0.0000 | |
| 143 | P | A | 0.1385 | |
| 144 | A | A | -0.0311 | |
| 145 | T | A | -0.2544 | |
| 146 | H | A | -0.5561 | |
| 147 | L | A | 0.0000 | |
| 148 | G | A | 0.9615 | |
| 149 | I | A | 2.3436 | |
| 150 | F | A | 2.6512 | |
| 151 | N | A | 0.0000 | |
| 152 | G | A | 0.0000 | |
| 153 | L | A | 1.7138 | |
| 154 | L | A | 1.3724 | |
| 155 | D | A | 0.0000 | |
| 156 | Q | A | 0.0000 | |
| 157 | I | A | 1.2851 | |
| 158 | V | A | 0.7346 | |
| 159 | A | A | 0.0000 | |
| 160 | T | A | 0.0000 | |
| 161 | A | A | 0.0000 | |
| 162 | V | A | 0.4537 | |
| 163 | F | A | 0.0000 | |
| 164 | C | A | 0.0000 | |
| 165 | L | A | 0.0000 | |
| 166 | L | A | 0.0000 | |
| 167 | I | A | 0.0000 | |
| 168 | A | A | 0.0000 | |
| 169 | H | A | 0.0000 | |
| 170 | T | A | 0.0000 | |
| 171 | V | A | -0.2533 | |
| 172 | D | A | 0.0000 | |
| 173 | K | A | -2.1363 | |
| 174 | R | A | -2.0492 | |
| 175 | N | A | 0.0000 | |
| 176 | H | A | -1.1653 | |
| 177 | Y | A | 0.0000 | |
| 178 | P | A | 0.1133 | |
| 179 | S | A | -0.0493 | |
| 180 | W | A | 0.4634 | |
| 181 | V | A | 0.4659 | |
| 182 | Q | A | 0.1678 | |
| 183 | P | A | 0.0000 | |
| 184 | F | A | 0.6026 | |
| 185 | I | A | 0.0000 | |
| 186 | I | A | 0.3451 | |
| 187 | G | A | 0.0000 | |
| 188 | T | A | 0.3080 | |
| 189 | A | A | 0.0000 | |
| 190 | F | A | 0.0000 | |
| 191 | V | A | 0.0000 | |
| 192 | L | A | 0.0000 | |
| 193 | V | A | 0.0000 | |
| 194 | G | A | 0.0000 | |
| 195 | T | A | 0.0000 | |
| 196 | A | A | 0.0000 | |
| 197 | F | A | 0.0000 | |
| 198 | A | A | 0.0490 | |
| 199 | L | A | 0.0000 | |
| 200 | N | A | 0.0000 | |
| 201 | A | A | 0.0000 | |
| 202 | G | A | -0.1008 | |
| 203 | Y | A | 0.0000 | |
| 204 | S | A | 0.0000 | |
| 205 | C | A | 0.0000 | |
| 206 | N | A | 0.0000 | |
| 207 | P | A | 0.0000 | |
| 208 | A | A | 0.0000 | |
| 209 | R | A | 0.0000 | |
| 210 | D | A | 0.0000 | |
| 211 | L | A | 0.7591 | |
| 212 | G | A | 0.0000 | |
| 213 | P | A | 0.0000 | |
| 214 | R | A | 0.0000 | |
| 215 | I | A | 1.3612 | |
| 216 | F | A | 0.0000 | |
| 217 | T | A | 0.0000 | |
| 218 | L | A | 1.1768 | |
| 219 | L | A | 1.7821 | |
| 220 | A | A | 0.6591 | |
| 221 | G | A | -0.2937 | |
| 222 | Y | A | 0.0000 | |
| 223 | G | A | 0.4096 | |
| 224 | W | A | 0.9990 | |
| 225 | K | A | -0.4657 | |
| 226 | V | A | 0.0000 | |
| 227 | F | A | 0.6009 | |
| 228 | S | A | -0.3124 | |
| 229 | Y | A | -0.4095 | |
| 230 | N | A | -1.9023 | |
| 231 | D | A | -2.0091 | |
| 232 | Y | A | -0.4779 | |
| 233 | G | A | -0.0693 | |
| 234 | W | A | 0.0000 | |
| 235 | F | A | 1.3399 | |
| 236 | W | A | 1.4621 | |
| 237 | I | A | 0.0000 | |
| 238 | P | A | 0.0000 | |
| 239 | I | A | 1.6277 | |
| 240 | V | A | 2.4348 | |
| 241 | G | A | 0.0000 | |
| 242 | P | A | 0.0000 | |
| 243 | F | A | 1.9428 | |
| 244 | I | A | 2.3900 | |
| 245 | G | A | 0.0000 | |
| 246 | A | A | 0.0000 | |
| 247 | L | A | 2.1476 | |
| 248 | I | A | 2.0611 | |
| 249 | G | A | 0.0000 | |
| 250 | G | A | 0.0000 | |
| 251 | W | A | 2.1218 | |
| 252 | I | A | 1.8363 | |
| 253 | Y | A | 0.0000 | |
| 254 | E | A | 0.6843 | |
| 255 | I | A | 1.3730 | |
| 256 | V | A | 1.0223 | |
| 257 | V | A | 0.0000 | |
| 258 | G | A | 0.0000 | |
| 259 | F | A | 0.0000 | |
| 260 | Q | A | 0.0000 | |
| 261 | T | A | -0.4485 | |
| 262 | P | A | -0.4727 | |
| 2 | E | B | -2.9897 | |
| 3 | K | B | -2.7634 | |
| 4 | I | B | -1.1782 | |
| 5 | R | B | -1.6496 | |
| 6 | S | B | -1.5963 | |
| 7 | K | B | -1.8623 | |
| 8 | V | B | -0.2547 | |
| 9 | I | B | -0.0047 | |
| 10 | I | B | -0.7673 | |
| 11 | K | B | -2.2134 | |
| 12 | N | B | -2.4148 | |
| 13 | E | B | -2.3693 | |
| 14 | L | B | -0.4906 | |
| 15 | L | B | -0.1111 | |
| 16 | K | B | -0.6100 | |
| 17 | A | B | 0.0000 | |
| 18 | A | B | 0.8294 | |
| 19 | L | B | 0.9305 | |
| 20 | G | B | 0.0000 | |
| 21 | E | B | 0.0000 | |
| 22 | F | B | 1.4988 | |
| 23 | L | B | 0.0000 | |
| 24 | G | B | 0.0000 | |
| 25 | T | B | 0.0000 | |
| 26 | A | B | 0.0000 | |
| 27 | I | B | 0.0000 | |
| 28 | L | B | 0.0000 | |
| 29 | V | B | 0.0000 | |
| 30 | L | B | 0.0000 | |
| 31 | A | B | 0.0000 | |
| 32 | I | B | 0.0000 | |
| 33 | N | B | 0.0000 | |
| 34 | S | B | 0.0000 | |
| 35 | V | B | 0.0000 | |
| 36 | V | B | 0.0000 | |
| 37 | A | B | 0.0000 | |
| 38 | Q | B | 0.0000 | |
| 39 | S | B | 0.0000 | |
| 40 | V | B | 0.4503 | |
| 41 | L | B | 0.1001 | |
| 42 | H | B | -0.1177 | |
| 43 | V | B | 1.0480 | |
| 44 | A | B | 0.3155 | |
| 45 | P | B | 0.0000 | |
| 46 | N | B | 0.0000 | |
| 47 | K | B | -0.1181 | |
| 48 | L | B | 0.4863 | |
| 49 | I | B | 0.0000 | |
| 50 | N | B | 0.0000 | |
| 51 | I | B | 0.3422 | |
| 52 | N | B | 0.0000 | |
| 53 | I | B | 0.5749 | |
| 54 | G | B | 0.0000 | |
| 55 | V | B | 0.0000 | |
| 56 | G | B | 0.0000 | |
| 57 | L | B | 0.4290 | |
| 58 | G | B | 0.0000 | |
| 59 | I | B | 0.0000 | |
| 60 | A | B | 0.2364 | |
| 61 | F | B | 0.0000 | |
| 62 | G | B | 0.0000 | |
| 63 | I | B | 0.0000 | |
| 64 | A | B | 0.0000 | |
| 65 | V | B | 0.0000 | |
| 66 | T | B | 0.0000 | |
| 67 | A | B | -1.0234 | |
| 68 | R | B | -1.8962 | |
| 69 | I | B | -0.7815 | |
| 70 | S | B | -0.6898 | |
| 71 | G | B | -0.8260 | |
| 72 | G | B | 0.0000 | |
| 73 | H | B | -0.0848 | |
| 74 | I | B | 0.0000 | |
| 75 | N | B | 0.0000 | |
| 76 | P | B | 0.0000 | |
| 77 | A | B | 0.0000 | |
| 78 | V | B | 0.0000 | |
| 79 | S | B | 0.0000 | |
| 80 | L | B | 0.8683 | |
| 81 | M | B | 0.0000 | |
| 82 | F | B | -0.2194 | |
| 83 | L | B | 0.0000 | |
| 84 | T | B | -0.3689 | |
| 85 | F | B | -0.9399 | |
| 86 | R | B | -2.2932 | |
| 87 | Q | B | -1.7534 | |
| 88 | I | B | -0.5563 | |
| 89 | T | B | -0.0168 | |
| 90 | A | B | 0.5901 | |
| 91 | L | B | 1.6807 | |
| 92 | R | B | 1.1505 | |
| 93 | F | B | 1.4656 | |
| 94 | A | B | 1.4808 | |
| 95 | V | B | 1.7922 | |
| 96 | Y | B | 0.0000 | |
| 97 | F | B | 1.9740 | |
| 98 | V | B | 2.7368 | |
| 99 | A | B | 2.0765 | |
| 100 | Q | B | 0.0000 | |
| 101 | L | B | 1.8989 | |
| 102 | L | B | 2.2813 | |
| 103 | G | B | 0.0000 | |
| 104 | A | B | 0.0000 | |
| 105 | F | B | 1.5592 | |
| 106 | V | B | 1.5168 | |
| 107 | D | B | 0.0000 | |
| 108 | A | B | 0.0000 | |
| 109 | L | B | 1.5561 | |
| 110 | I | B | 1.3885 | |
| 111 | T | B | 0.0000 | |
| 112 | Y | B | 0.7874 | |
| 113 | I | B | 1.1740 | |
| 114 | V | B | 0.0000 | |
| 115 | Y | B | 0.0000 | |
| 116 | C | B | 0.0000 | |
| 117 | D | B | -0.6940 | |
| 118 | A | B | 0.0000 | |
| 119 | I | B | 0.0000 | |
| 120 | R | B | -2.6742 | |
| 121 | T | B | -1.7094 | |
| 122 | F | B | -1.5109 | |
| 123 | D | B | -2.3030 | |
| 124 | G | B | -2.1288 | |
| 125 | G | B | -2.5279 | |
| 126 | E | B | -3.4216 | |
| 127 | R | B | -2.7417 | |
| 128 | A | B | -1.4246 | |
| 129 | I | B | 0.0000 | |
| 130 | F | B | 0.2489 | |
| 131 | G | B | -0.4828 | |
| 132 | S | B | -0.8896 | |
| 133 | K | B | -1.7152 | |
| 134 | A | B | 0.0000 | |
| 135 | T | B | 0.0000 | |
| 136 | A | B | 0.0000 | |
| 137 | H | B | 0.0040 | |
| 138 | I | B | 0.0000 | |
| 139 | F | B | 0.0000 | |
| 140 | A | B | 0.0000 | |
| 141 | S | B | 0.0000 | |
| 142 | Y | B | 0.0000 | |
| 143 | P | B | 0.1342 | |
| 144 | A | B | -0.0386 | |
| 145 | T | B | -0.2602 | |
| 146 | H | B | -0.6069 | |
| 147 | L | B | 0.0000 | |
| 148 | G | B | 0.9425 | |
| 149 | I | B | 2.3095 | |
| 150 | F | B | 2.6371 | |
| 151 | N | B | 0.0000 | |
| 152 | G | B | 0.0000 | |
| 153 | L | B | 1.6424 | |
| 154 | L | B | 1.3275 | |
| 155 | D | B | 0.0000 | |
| 156 | Q | B | 0.0000 | |
| 157 | I | B | 1.1161 | |
| 158 | V | B | 0.6793 | |
| 159 | A | B | 0.0000 | |
| 160 | T | B | 0.0000 | |
| 161 | A | B | 0.0000 | |
| 162 | V | B | 0.4397 | |
| 163 | F | B | 0.0000 | |
| 164 | C | B | 0.0000 | |
| 165 | L | B | 0.0000 | |
| 166 | L | B | 0.0000 | |
| 167 | I | B | 0.0000 | |
| 168 | A | B | 0.0000 | |
| 169 | H | B | 0.0000 | |
| 170 | T | B | 0.0000 | |
| 171 | V | B | -0.4670 | |
| 172 | D | B | -1.2570 | |
| 173 | K | B | -2.2946 | |
| 174 | R | B | -2.0972 | |
| 175 | N | B | 0.0000 | |
| 176 | H | B | -1.4152 | |
| 177 | Y | B | 0.0000 | |
| 178 | P | B | -0.0433 | |
| 179 | S | B | -0.1908 | |
| 180 | W | B | 0.4900 | |
| 181 | V | B | 0.4138 | |
| 182 | Q | B | 0.0716 | |
| 183 | P | B | 0.0000 | |
| 184 | F | B | 0.5781 | |
| 185 | I | B | 0.0000 | |
| 186 | I | B | 0.3244 | |
| 187 | G | B | 0.0000 | |
| 188 | T | B | 0.3079 | |
| 189 | A | B | 0.0000 | |
| 190 | F | B | 0.0000 | |
| 191 | V | B | 0.0000 | |
| 192 | L | B | 0.0000 | |
| 193 | V | B | 0.0000 | |
| 194 | G | B | 0.0000 | |
| 195 | T | B | 0.0000 | |
| 196 | A | B | 0.0000 | |
| 197 | F | B | 0.0000 | |
| 198 | A | B | 0.0548 | |
| 199 | L | B | 0.0000 | |
| 200 | N | B | 0.0000 | |
| 201 | A | B | -0.1036 | |
| 202 | G | B | -0.0956 | |
| 203 | Y | B | 0.0000 | |
| 204 | S | B | 0.0000 | |
| 205 | C | B | 0.0000 | |
| 206 | N | B | 0.0000 | |
| 207 | P | B | 0.0000 | |
| 208 | A | B | 0.0000 | |
| 209 | R | B | 0.0000 | |
| 210 | D | B | 0.0000 | |
| 211 | L | B | 0.7357 | |
| 212 | G | B | 0.0000 | |
| 213 | P | B | 0.0000 | |
| 214 | R | B | 0.0000 | |
| 215 | I | B | 1.2946 | |
| 216 | F | B | 0.0000 | |
| 217 | T | B | 0.0000 | |
| 218 | L | B | 1.1454 | |
| 219 | L | B | 1.8121 | |
| 220 | A | B | 0.7006 | |
| 221 | G | B | -0.2063 | |
| 222 | Y | B | 0.0000 | |
| 223 | G | B | 0.3090 | |
| 224 | W | B | 0.8795 | |
| 225 | K | B | -0.7013 | |
| 226 | V | B | 0.0000 | |
| 227 | F | B | 0.4386 | |
| 228 | S | B | -0.4297 | |
| 229 | Y | B | -0.4414 | |
| 230 | N | B | -1.9320 | |
| 231 | D | B | -2.0529 | |
| 232 | Y | B | -0.6175 | |
| 233 | G | B | -0.1419 | |
| 234 | W | B | 0.0000 | |
| 235 | F | B | 1.2501 | |
| 236 | W | B | 1.3389 | |
| 237 | I | B | 0.0000 | |
| 238 | P | B | 0.0000 | |
| 239 | I | B | 1.4049 | |
| 240 | V | B | 1.9658 | |
| 241 | G | B | 0.0000 | |
| 242 | P | B | 0.0000 | |
| 243 | F | B | 1.6242 | |
| 244 | I | B | 1.9778 | |
| 245 | G | B | 0.0000 | |
| 246 | A | B | 0.0000 | |
| 247 | L | B | 1.4774 | |
| 248 | I | B | 1.6224 | |
| 249 | G | B | 0.0000 | |
| 250 | G | B | 0.0000 | |
| 251 | W | B | 2.2256 | |
| 252 | I | B | 2.0380 | |
| 253 | Y | B | 0.0000 | |
| 254 | E | B | 1.1215 | |
| 255 | I | B | 2.3717 | |
| 256 | V | B | 1.4789 | |
| 257 | V | B | 0.0000 | |
| 258 | G | B | 0.0000 | |
| 259 | F | B | 0.0000 | |
| 260 | Q | B | 0.0000 | |
| 261 | T | B | -0.4003 | |
| 262 | P | B | -0.4686 | |
| 2 | E | C | -2.8648 | |
| 3 | K | C | -2.5691 | |
| 4 | I | C | -0.6993 | |
| 5 | R | C | -1.3668 | |
| 6 | S | C | -1.5254 | |
| 7 | K | C | -1.7687 | |
| 8 | V | C | -0.0455 | |
| 9 | I | C | -0.0005 | |
| 10 | I | C | -0.8500 | |
| 11 | K | C | -2.2761 | |
| 12 | N | C | -2.4878 | |
| 13 | E | C | -2.4505 | |
| 14 | L | C | -0.6193 | |
| 15 | L | C | -0.1596 | |
| 16 | K | C | -0.6836 | |
| 17 | A | C | 0.0000 | |
| 18 | A | C | 0.8265 | |
| 19 | L | C | 1.0229 | |
| 20 | G | C | 0.0000 | |
| 21 | E | C | 0.0000 | |
| 22 | F | C | 1.4676 | |
| 23 | L | C | 0.0000 | |
| 24 | G | C | 0.0000 | |
| 25 | T | C | 0.0000 | |
| 26 | A | C | 0.0000 | |
| 27 | I | C | 0.0000 | |
| 28 | L | C | 0.0000 | |
| 29 | V | C | 0.0000 | |
| 30 | L | C | 0.0000 | |
| 31 | A | C | 0.0000 | |
| 32 | I | C | 0.0000 | |
| 33 | N | C | 0.0000 | |
| 34 | S | C | 0.0000 | |
| 35 | V | C | 0.0000 | |
| 36 | V | C | 0.0000 | |
| 37 | A | C | 0.0000 | |
| 38 | Q | C | 0.0000 | |
| 39 | S | C | 0.0000 | |
| 40 | V | C | 0.4804 | |
| 41 | L | C | 0.1197 | |
| 42 | H | C | -0.0999 | |
| 43 | V | C | 1.1218 | |
| 44 | A | C | 0.4021 | |
| 45 | P | C | 0.0000 | |
| 46 | N | C | 0.0000 | |
| 47 | K | C | -0.1039 | |
| 48 | L | C | 0.5045 | |
| 49 | I | C | 0.0000 | |
| 50 | N | C | 0.0000 | |
| 51 | I | C | 0.3464 | |
| 52 | N | C | 0.0000 | |
| 53 | I | C | 0.5271 | |
| 54 | G | C | 0.0000 | |
| 55 | V | C | 0.0000 | |
| 56 | G | C | 0.0000 | |
| 57 | L | C | 0.3868 | |
| 58 | G | C | 0.0000 | |
| 59 | I | C | 0.0000 | |
| 60 | A | C | 0.0000 | |
| 61 | F | C | 0.0000 | |
| 62 | G | C | 0.0000 | |
| 63 | I | C | 0.0000 | |
| 64 | A | C | 0.0000 | |
| 65 | V | C | 0.0000 | |
| 66 | T | C | 0.0000 | |
| 67 | A | C | -0.7228 | |
| 68 | R | C | -1.3098 | |
| 69 | I | C | -0.4803 | |
| 70 | S | C | -0.5051 | |
| 71 | G | C | -0.5988 | |
| 72 | G | C | 0.0000 | |
| 73 | H | C | 0.0000 | |
| 74 | I | C | 0.0000 | |
| 75 | N | C | 0.0000 | |
| 76 | P | C | 0.0000 | |
| 77 | A | C | 0.0000 | |
| 78 | V | C | 0.0000 | |
| 79 | S | C | 0.0000 | |
| 80 | L | C | 0.9822 | |
| 81 | M | C | 0.0000 | |
| 82 | F | C | -0.1155 | |
| 83 | L | C | 0.0000 | |
| 84 | T | C | -0.2201 | |
| 85 | F | C | -0.8412 | |
| 86 | R | C | -2.2953 | |
| 87 | Q | C | -1.7530 | |
| 88 | I | C | -0.5385 | |
| 89 | T | C | 0.0094 | |
| 90 | A | C | 0.6319 | |
| 91 | L | C | 1.7388 | |
| 92 | R | C | 1.2699 | |
| 93 | F | C | 1.5421 | |
| 94 | A | C | 1.5641 | |
| 95 | V | C | 1.9306 | |
| 96 | Y | C | 0.0000 | |
| 97 | F | C | 2.0116 | |
| 98 | V | C | 2.7695 | |
| 99 | A | C | 2.0882 | |
| 100 | Q | C | 0.0000 | |
| 101 | L | C | 1.8829 | |
| 102 | L | C | 2.2410 | |
| 103 | G | C | 0.0000 | |
| 104 | A | C | 0.0000 | |
| 105 | F | C | 1.5557 | |
| 106 | V | C | 1.5173 | |
| 107 | D | C | 0.0000 | |
| 108 | A | C | 0.0000 | |
| 109 | L | C | 1.5483 | |
| 110 | I | C | 1.3438 | |
| 111 | T | C | 0.0000 | |
| 112 | Y | C | 0.6753 | |
| 113 | I | C | 1.0233 | |
| 114 | V | C | 0.0000 | |
| 115 | Y | C | 0.0000 | |
| 116 | C | C | 0.0000 | |
| 117 | D | C | -0.8544 | |
| 118 | A | C | 0.0000 | |
| 119 | I | C | 0.0000 | |
| 120 | R | C | -3.1310 | |
| 121 | T | C | -1.9364 | |
| 122 | F | C | -1.6626 | |
| 123 | D | C | -2.4604 | |
| 124 | G | C | -2.2709 | |
| 125 | G | C | -2.7583 | |
| 126 | E | C | -3.7335 | |
| 127 | R | C | -3.2862 | |
| 128 | A | C | -1.6375 | |
| 129 | I | C | 0.0000 | |
| 130 | F | C | 0.1352 | |
| 131 | G | C | -0.4831 | |
| 132 | S | C | -0.8613 | |
| 133 | K | C | -1.7062 | |
| 134 | A | C | 0.0000 | |
| 135 | T | C | 0.0000 | |
| 136 | A | C | 0.0000 | |
| 137 | H | C | -0.0061 | |
| 138 | I | C | 0.0000 | |
| 139 | F | C | 0.0000 | |
| 140 | A | C | 0.0000 | |
| 141 | S | C | 0.0000 | |
| 142 | Y | C | 0.0000 | |
| 143 | P | C | 0.1728 | |
| 144 | A | C | -0.0150 | |
| 145 | T | C | -0.2450 | |
| 146 | H | C | -0.5635 | |
| 147 | L | C | 0.0000 | |
| 148 | G | C | 1.0588 | |
| 149 | I | C | 2.5615 | |
| 150 | F | C | 2.7408 | |
| 151 | N | C | 0.0000 | |
| 152 | G | C | 0.0000 | |
| 153 | L | C | 1.7725 | |
| 154 | L | C | 1.3732 | |
| 155 | D | C | 0.0000 | |
| 156 | Q | C | 0.0000 | |
| 157 | I | C | 1.1730 | |
| 158 | V | C | 0.7098 | |
| 159 | A | C | 0.0000 | |
| 160 | T | C | 0.0000 | |
| 161 | A | C | 0.0000 | |
| 162 | V | C | 0.3895 | |
| 163 | F | C | 0.0000 | |
| 164 | C | C | 0.0000 | |
| 165 | L | C | 0.0000 | |
| 166 | L | C | 0.0000 | |
| 167 | I | C | 0.0000 | |
| 168 | A | C | 0.0000 | |
| 169 | H | C | 0.0000 | |
| 170 | T | C | 0.0000 | |
| 171 | V | C | -0.4291 | |
| 172 | D | C | -1.2303 | |
| 173 | K | C | -2.2619 | |
| 174 | R | C | -2.1560 | |
| 175 | N | C | 0.0000 | |
| 176 | H | C | -1.2599 | |
| 177 | Y | C | 0.0000 | |
| 178 | P | C | 0.0455 | |
| 179 | S | C | -0.1713 | |
| 180 | W | C | 0.2789 | |
| 181 | V | C | 0.3019 | |
| 182 | Q | C | -0.0050 | |
| 183 | P | C | 0.0000 | |
| 184 | F | C | 0.4337 | |
| 185 | I | C | 0.0000 | |
| 186 | I | C | 0.0000 | |
| 187 | G | C | 0.0000 | |
| 188 | T | C | 0.2224 | |
| 189 | A | C | 0.0000 | |
| 190 | F | C | 0.0000 | |
| 191 | V | C | 0.0000 | |
| 192 | L | C | 0.0000 | |
| 193 | V | C | 0.0000 | |
| 194 | G | C | 0.0000 | |
| 195 | T | C | 0.0000 | |
| 196 | A | C | 0.0000 | |
| 197 | F | C | 0.0000 | |
| 198 | A | C | 0.1325 | |
| 199 | L | C | 0.0445 | |
| 200 | N | C | 0.0000 | |
| 201 | A | C | 0.0000 | |
| 202 | G | C | -0.0485 | |
| 203 | Y | C | 0.0000 | |
| 204 | S | C | 0.0000 | |
| 205 | C | C | 0.0000 | |
| 206 | N | C | 0.0000 | |
| 207 | P | C | 0.0000 | |
| 208 | A | C | 0.0000 | |
| 209 | R | C | 0.0000 | |
| 210 | D | C | 0.0000 | |
| 211 | L | C | 0.7396 | |
| 212 | G | C | 0.0000 | |
| 213 | P | C | 0.0000 | |
| 214 | R | C | 0.0000 | |
| 215 | I | C | 1.2937 | |
| 216 | F | C | 0.0000 | |
| 217 | T | C | 0.0000 | |
| 218 | L | C | 1.1573 | |
| 219 | L | C | 1.7942 | |
| 220 | A | C | 0.6214 | |
| 221 | G | C | -0.3630 | |
| 222 | Y | C | 0.0000 | |
| 223 | G | C | 0.2795 | |
| 224 | W | C | 0.9102 | |
| 225 | K | C | -0.5880 | |
| 226 | V | C | 0.0000 | |
| 227 | F | C | 0.5346 | |
| 228 | S | C | -0.3106 | |
| 229 | Y | C | -0.5003 | |
| 230 | N | C | -1.8920 | |
| 231 | D | C | -1.8766 | |
| 232 | Y | C | -0.1449 | |
| 233 | G | C | 0.1027 | |
| 234 | W | C | 0.0000 | |
| 235 | F | C | 1.3480 | |
| 236 | W | C | 1.4433 | |
| 237 | I | C | 0.0000 | |
| 238 | P | C | 0.0000 | |
| 239 | I | C | 1.5695 | |
| 240 | V | C | 2.3180 | |
| 241 | G | C | 0.0000 | |
| 242 | P | C | 0.0000 | |
| 243 | F | C | 1.7406 | |
| 244 | I | C | 1.9374 | |
| 245 | G | C | 0.0000 | |
| 246 | A | C | 0.0000 | |
| 247 | L | C | 2.2022 | |
| 248 | I | C | 1.7912 | |
| 249 | G | C | 0.0000 | |
| 250 | G | C | 0.0000 | |
| 251 | W | C | 2.0441 | |
| 252 | I | C | 1.5579 | |
| 253 | Y | C | 0.0000 | |
| 254 | E | C | 0.7491 | |
| 255 | I | C | 1.6250 | |
| 256 | V | C | 1.1262 | |
| 257 | V | C | 0.0000 | |
| 258 | G | C | 0.0000 | |
| 259 | F | C | 0.1191 | |
| 260 | Q | C | 0.0000 | |
| 261 | T | C | 0.0000 | |
| 262 | P | C | -0.4485 | |
| 2 | E | D | -2.8476 | |
| 3 | K | D | -2.5823 | |
| 4 | I | D | -0.7695 | |
| 5 | R | D | -1.4301 | |
| 6 | S | D | -1.5273 | |
| 7 | K | D | -1.7881 | |
| 8 | V | D | -0.2057 | |
| 9 | I | D | -0.0941 | |
| 10 | I | D | -0.8429 | |
| 11 | K | D | -2.2279 | |
| 12 | N | D | -2.3301 | |
| 13 | E | D | -2.2933 | |
| 14 | L | D | -0.3851 | |
| 15 | L | D | 0.0762 | |
| 16 | K | D | -0.5026 | |
| 17 | A | D | 0.0000 | |
| 18 | A | D | 0.9071 | |
| 19 | L | D | 1.0629 | |
| 20 | G | D | 0.0000 | |
| 21 | E | D | 0.0000 | |
| 22 | F | D | 1.5182 | |
| 23 | L | D | 0.0000 | |
| 24 | G | D | 0.0000 | |
| 25 | T | D | 0.0000 | |
| 26 | A | D | 0.0000 | |
| 27 | I | D | 0.0000 | |
| 28 | L | D | 0.0000 | |
| 29 | V | D | 0.0000 | |
| 30 | L | D | 0.0000 | |
| 31 | A | D | 0.0000 | |
| 32 | I | D | 0.0000 | |
| 33 | N | D | 0.0000 | |
| 34 | S | D | 0.0000 | |
| 35 | V | D | 0.0000 | |
| 36 | V | D | 0.0000 | |
| 37 | A | D | 0.0000 | |
| 38 | Q | D | 0.0000 | |
| 39 | S | D | 0.0000 | |
| 40 | V | D | 0.4083 | |
| 41 | L | D | 0.1040 | |
| 42 | H | D | -0.1403 | |
| 43 | V | D | 0.9673 | |
| 44 | A | D | 0.3384 | |
| 45 | P | D | 0.0000 | |
| 46 | N | D | 0.0000 | |
| 47 | K | D | -0.3128 | |
| 48 | L | D | 0.4262 | |
| 49 | I | D | 0.2602 | |
| 50 | N | D | 0.0000 | |
| 51 | I | D | 0.3587 | |
| 52 | N | D | 0.0000 | |
| 53 | I | D | 0.5885 | |
| 54 | G | D | 0.0000 | |
| 55 | V | D | 0.0000 | |
| 56 | G | D | 0.0000 | |
| 57 | L | D | 0.4254 | |
| 58 | G | D | 0.0000 | |
| 59 | I | D | 0.0000 | |
| 60 | A | D | 0.0000 | |
| 61 | F | D | 0.0000 | |
| 62 | G | D | 0.0000 | |
| 63 | I | D | 0.0000 | |
| 64 | A | D | 0.0000 | |
| 65 | V | D | 0.0000 | |
| 66 | T | D | 0.0000 | |
| 67 | A | D | -1.0424 | |
| 68 | R | D | -1.9298 | |
| 69 | I | D | -0.8158 | |
| 70 | S | D | -0.7025 | |
| 71 | G | D | -0.8364 | |
| 72 | G | D | 0.0000 | |
| 73 | H | D | -0.0850 | |
| 74 | I | D | 0.0000 | |
| 75 | N | D | 0.0000 | |
| 76 | P | D | 0.0000 | |
| 77 | A | D | 0.0000 | |
| 78 | V | D | 0.0000 | |
| 79 | S | D | 0.0000 | |
| 80 | L | D | 0.8435 | |
| 81 | M | D | 0.0000 | |
| 82 | F | D | -0.2352 | |
| 83 | L | D | 0.0000 | |
| 84 | T | D | -0.3825 | |
| 85 | F | D | -0.9603 | |
| 86 | R | D | -2.3072 | |
| 87 | Q | D | -1.7686 | |
| 88 | I | D | -0.5830 | |
| 89 | T | D | -0.0327 | |
| 90 | A | D | 0.5781 | |
| 91 | L | D | 1.6710 | |
| 92 | R | D | 1.1284 | |
| 93 | F | D | 1.4373 | |
| 94 | A | D | 1.4606 | |
| 95 | V | D | 1.7967 | |
| 96 | Y | D | 0.0000 | |
| 97 | F | D | 1.9323 | |
| 98 | V | D | 2.7088 | |
| 99 | A | D | 2.0808 | |
| 100 | Q | D | 0.0000 | |
| 101 | L | D | 1.8772 | |
| 102 | L | D | 2.2237 | |
| 103 | G | D | 0.0000 | |
| 104 | A | D | 0.0000 | |
| 105 | F | D | 1.5476 | |
| 106 | V | D | 1.4825 | |
| 107 | D | D | 0.0000 | |
| 108 | A | D | 0.0000 | |
| 109 | L | D | 1.5398 | |
| 110 | I | D | 1.3620 | |
| 111 | T | D | 0.0000 | |
| 112 | Y | D | 0.7251 | |
| 113 | I | D | 1.1140 | |
| 114 | V | D | 0.0000 | |
| 115 | Y | D | 0.0000 | |
| 116 | C | D | 0.0000 | |
| 117 | D | D | -0.7165 | |
| 118 | A | D | 0.0000 | |
| 119 | I | D | 0.0000 | |
| 120 | R | D | -3.0017 | |
| 121 | T | D | -1.8620 | |
| 122 | F | D | -1.6347 | |
| 123 | D | D | -2.4477 | |
| 124 | G | D | -2.2485 | |
| 125 | G | D | -2.6923 | |
| 126 | E | D | -3.6444 | |
| 127 | R | D | -3.1086 | |
| 128 | A | D | -1.5738 | |
| 129 | I | D | 0.0000 | |
| 130 | F | D | 0.1999 | |
| 131 | G | D | -0.4878 | |
| 132 | S | D | -0.8925 | |
| 133 | K | D | -1.7616 | |
| 134 | A | D | 0.0000 | |
| 135 | T | D | 0.0000 | |
| 136 | A | D | 0.0000 | |
| 137 | H | D | 0.0019 | |
| 138 | I | D | 0.0000 | |
| 139 | F | D | 0.0000 | |
| 140 | A | D | 0.0000 | |
| 141 | S | D | 0.0000 | |
| 142 | Y | D | 0.0000 | |
| 143 | P | D | 0.1221 | |
| 144 | A | D | -0.0413 | |
| 145 | T | D | -0.2589 | |
| 146 | H | D | -0.5797 | |
| 147 | L | D | 0.0000 | |
| 148 | G | D | 0.9265 | |
| 149 | I | D | 2.2808 | |
| 150 | F | D | 2.6178 | |
| 151 | N | D | 0.0000 | |
| 152 | G | D | 0.0000 | |
| 153 | L | D | 1.6127 | |
| 154 | L | D | 1.3438 | |
| 155 | D | D | 0.0000 | |
| 156 | Q | D | 0.0000 | |
| 157 | I | D | 1.0645 | |
| 158 | V | D | 0.6810 | |
| 159 | A | D | 0.0000 | |
| 160 | T | D | 0.0000 | |
| 161 | A | D | 0.0000 | |
| 162 | V | D | 0.4331 | |
| 163 | F | D | 0.0000 | |
| 164 | C | D | 0.0000 | |
| 165 | L | D | 0.0000 | |
| 166 | L | D | 0.0000 | |
| 167 | I | D | 0.0000 | |
| 168 | A | D | 0.0000 | |
| 169 | H | D | 0.0000 | |
| 170 | T | D | 0.0000 | |
| 171 | V | D | -0.6665 | |
| 172 | D | D | -1.6801 | |
| 173 | K | D | -2.8183 | |
| 174 | R | D | -3.0467 | |
| 175 | N | D | 0.0000 | |
| 176 | H | D | -1.9593 | |
| 177 | Y | D | 0.0000 | |
| 178 | P | D | -0.0701 | |
| 179 | S | D | -0.2516 | |
| 180 | W | D | 0.4699 | |
| 181 | V | D | 0.4181 | |
| 182 | Q | D | 0.0730 | |
| 183 | P | D | 0.0000 | |
| 184 | F | D | 0.5616 | |
| 185 | I | D | 0.0000 | |
| 186 | I | D | 0.3181 | |
| 187 | G | D | 0.0000 | |
| 188 | T | D | 0.2965 | |
| 189 | A | D | 0.0000 | |
| 190 | F | D | 0.0000 | |
| 191 | V | D | 0.0000 | |
| 192 | L | D | 0.0000 | |
| 193 | V | D | 0.0000 | |
| 194 | G | D | 0.0000 | |
| 195 | T | D | 0.0000 | |
| 196 | A | D | 0.0000 | |
| 197 | F | D | 0.0000 | |
| 198 | A | D | 0.0532 | |
| 199 | L | D | 0.0000 | |
| 200 | N | D | 0.0000 | |
| 201 | A | D | -0.1063 | |
| 202 | G | D | -0.0971 | |
| 203 | Y | D | 0.0000 | |
| 204 | S | D | 0.0000 | |
| 205 | C | D | 0.0000 | |
| 206 | N | D | 0.0000 | |
| 207 | P | D | 0.0000 | |
| 208 | A | D | 0.0000 | |
| 209 | R | D | 0.0000 | |
| 210 | D | D | 0.0000 | |
| 211 | L | D | 0.7827 | |
| 212 | G | D | 0.0000 | |
| 213 | P | D | 0.0000 | |
| 214 | R | D | 0.0000 | |
| 215 | I | D | 1.3223 | |
| 216 | F | D | 0.0000 | |
| 217 | T | D | 0.0000 | |
| 218 | L | D | 1.1190 | |
| 219 | L | D | 1.7919 | |
| 220 | A | D | 0.6559 | |
| 221 | G | D | -0.2667 | |
| 222 | Y | D | 0.0000 | |
| 223 | G | D | 0.2906 | |
| 224 | W | D | 0.9144 | |
| 225 | K | D | -0.6466 | |
| 226 | V | D | 0.0000 | |
| 227 | F | D | 0.6379 | |
| 228 | S | D | -0.2795 | |
| 229 | Y | D | -0.3769 | |
| 230 | N | D | -1.8795 | |
| 231 | D | D | -1.9616 | |
| 232 | Y | D | -0.4144 | |
| 233 | G | D | 0.0034 | |
| 234 | W | D | 0.0000 | |
| 235 | F | D | 1.4393 | |
| 236 | W | D | 1.3976 | |
| 237 | I | D | 0.0000 | |
| 238 | P | D | 0.0000 | |
| 239 | I | D | 1.3964 | |
| 240 | V | D | 1.9330 | |
| 241 | G | D | 0.0000 | |
| 242 | P | D | 0.0000 | |
| 243 | F | D | 1.5771 | |
| 244 | I | D | 1.9316 | |
| 245 | G | D | 0.0000 | |
| 246 | A | D | 0.0000 | |
| 247 | L | D | 1.4653 | |
| 248 | I | D | 1.6225 | |
| 249 | G | D | 0.0000 | |
| 250 | G | D | 0.0000 | |
| 251 | W | D | 2.1175 | |
| 252 | I | D | 1.9078 | |
| 253 | Y | D | 0.0000 | |
| 254 | E | D | 0.9916 | |
| 255 | I | D | 2.1272 | |
| 256 | V | D | 1.3596 | |
| 257 | V | D | 0.0000 | |
| 258 | G | D | 0.1127 | |
| 259 | F | D | 0.2865 | |
| 260 | Q | D | 0.0000 | |
| 261 | T | D | 0.0000 | |
| 262 | P | D | -0.6338 |
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