Table 4.
Molecular docking of epitopes with BF2*2101, BF2*0401
| Epitope | Receptor | No. Cluster | HADDACK Score | H-bond |
|---|---|---|---|---|
| LSGEFDATY | BF2*2101 (3BEW) | 1 | −126.90 ± 8.00 | 5 |
| LYLTELTTV | 3 | 96.20 ± 5.600 | 7 | |
| LTTPYMALK | 1 | 107.10 ± 3.60 | 10 | |
| SIAATNEAV | 2 | 88.90 ± 5.90 | 6 | |
| LTQLTIQAL | 2 | 102.20 ± 6.70 | 10 | |
| MRATYLETL | 1 | 125.60 ± 2.90 | 11 | |
| LYCTRIVTF | 1 | 130.60 ± 8.10 | 8 | |
| TARELDCIK | 2 | 95.20 ± 5.60 | 9 | |
| DCIKITQQV | 2 | 103.20 ± 3.9 | 11 | |
| QQVGVELNL | 1 | 101.60 ± 3.90 | 7 | |
| YSKTEGALT | 2 | 87.90 ± 6.50 | 7 | |
| ISQNYGEAV | 3 | 93.80 ± 10.30 | 15 | |
| YLETLSVST | 1 | 86.40 ± 2.20 | 4 | |
| LSGEFDATY | BF2*0401 (4G42) | 1 | 115.10 ± 3.90 | 9 |
| LYLTELTTV | 1 | 117.80 ± 3.9 | 10 | |
| LTTPPYMALK | 1 | 98.50 ± 5.90 | 10 | |
| SIAATNEAV | 1 | 100.00 ± 1.80 | 7 | |
| LTQLTIQAL | 1 | 96.60 ± 3.30 | 10 | |
| MRATYLETL | 1 | 114.60 ± 5.00 | 11 | |
| LYCTRIVTF | 1 | 124.40 ± 5.50 | 7 | |
| TARELDCIK | 1 | 102.70 ± 3.70 | 11 | |
| DCIKITQQV | 2 | 92.40 ± 2.00 | 9 | |
| QQVGVELNL | 1 | 1020 ± 7.10 | 13 | |
| YSKTEGALT | 1 | 85.40 ± 1.00 | 9 | |
| ISQNYGEAV | 1 | 95.10 ± 0.40 | 12 | |
| YLETLSVST | 1 | 105.60 ± 5.00 | 14 |