Table 2 Binding energy score of hotspot residues involved in compounds binding.
Residue | BBB_26582140 | BBD_30878599 | BBC_29956160 |
|---|---|---|---|
Ala1477 | − 1.52 | − 1.08 | − 0.51 |
Arg1578 | − 1.05 | − 0.68 | − 1.32 |
Tyr1582 | − 8.64 | − 1.34 | − 0.96 |
Tyr1637 | − 0.53 | − 0.86 | − 1.24 |
Asn1640 | − 1.86 | − 4.50 | − 4.25 |
Arg1641 | 0.20 | − 0.36 | − 1.07 |
Asp1644 | − 4.36 | − 3.85 | − 3.88 |
Ala1667 | − 2.87 | − 3.99 | − 1.30 |
His1699 | − 3.59 | − 1.55 | − 1.11 |
Phe1670 | − 1.67 | − 1.29 | − 1.01 |
