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. 2025 Jun 17;15:1592072. doi: 10.3389/fonc.2025.1592072

Table 2.

Docking scores of the lead epitopes with HLA Class I alleles.

Amino acid Balanced Electrostatic favoured Hydrophobic-favoured VdW+Elec
HLA-A*:0201
E1 -1043.3 -1027.4 -1764.9 -128.7
E2 -651.1 -743.3 -1031.6 -128.5
E3 -819.1 -861.2 -1217.9 -122.4
E4 -684.2 -682.8 -1054.8 -103.9
E5 -628.2 -630.0 -892.8 -154.0
E6 -547.0 -579.6 -727.1 -124.0
E7 -633.0 -638.2 -901.1 -143.9
E8 -651.7 -711.7 -1020.6 -144.5
E9 -583.9 -628.1 -801.1 -132.0
E10 -682.1 -726.5 -1020.3 -134.9
E11 -731.0 -733.3 -1172.5 -92.4
E12 -762.7 -748.3 -1085.8 -164.1
E13 -754.2 -754.3 -1201.9 -114.9
E14 -626.6 -626.2 -967.4 -135.0
E15 -746.2 -744.8 -1234.1 -154.4
HLA-A*:0301
E1 -942 -981.7 -1607.2 -143.2
E2 -641.4 -675.2 -993.5 -126.2
E3 -718.0 -695.0 -1015.3 -109.4
E4 -643.1 -652.8 -1060.0 -87.8
E5 -594.8 -613.7 -778.7 -141.5
E6 -474.5 -517.9 -613.9 -146.6
E7 -542.7 -597.5 -752.5 -160.5
E8 -650.0 -709.3 -891.1 -161.3
E9 -469.6 -471.6 --609.4 -114.1
E10 -724.4 -749.8 -1014.8 -151.9
E11 -655.0 -660.5 -1110.0 -99.8
E12 -758.1 -816.5 -1097.1 -193.2
E13 -628.6 -704.8 -1010.2 -144.4
E14 -605.7 -660.2 -828.1 -163.1
E15 -713.8 -769.2 -1088.4 -187.4
HLA-B*07:02
E1 -1106.3 -1025.0 -1787.1 -148.4
E2 -718.5 -741.2 -1083.8 -146.3
E3 -761.9 -751.9 -1120.2 -106.5
E4 -746.5 -748.2 -1170.7 -92.7
E5 -650.1 -643.3 -884.8 -158.3
E6 -520.8 -562.8 -605.1 -168.6
E7 -652.8 -671.3 -890.7 -162.3
E8 -739.7 -775.0 -974.0 -161.1
E9 -567.5 -580.3 -748.6 -135.5
E10 -778.7 -813.2 -1134.9 -167.3
E11 -802.7 -807.1 -1217.3 -99.5
E12 -789.6 -836.3 -1231.6 -184.7
E13 -805.8 -841.4 -1201.3 -132.9
E14 -690.5 -737.2 -951.9 -161.6
E15 -725.1 -774.3 -1119.8 -192.2
VACCINE-1 -1346.5 -1472.6 -1596.2 -261.7
VACCINE-2 -1116.4 -1218.2 -1203.9 -259.8