Crambin Homologues in the H0P Lattice Model

Abstract

Abstract To compare folding behavior among lattice proteins which have similar corresponding structures in nature, Crambin homologues are tested in the semi-flexible H0P lattice model using replica-exchange Wang-Landau sampling. Our simulation shows that, at low temperature, these lattice homologues have two common signals in their specific heat curves, implying similarity in the thermodynamic behaviors; while the structural behaviors are more diverse, showing the different stability of their ground state structures at very low temperature. The ground state structures of different homologues can also vary dramatically.