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Abbreviations:TCR,T cell receptor; MHC,major histocompatibility complex; CDRs:complementarity-determining regions; PDB,Brookhaven Protein Data Bank; EM,energy minimization; MD,molecular dynamics; SD,steepest descent;CG, conjugate gradient.ABSTRACT:αβT-cell receptors (TCRs)recognize peptide antigens presented by class Ⅰ or class Ⅱ major histocompatibility complex molecules (pMHC).Naturally selected TCRs are characterised by low binding affinities.