Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MPFFVLSCTDNEGTLEKRLAVRPQHIERLQKLDDEGRLVAAGAMPKDPNDPQVGFYGSTMIVEFDTRE----ALDEWLKEEPFLKEGIYSHVDVKPFNKAFPKG 4H80 Chain:A ((39-105)) ------------------LQFRIQQLEALQRLIQEQEQELVGALAADLHKNEWNAYYEEVVYVLEEIEYMIQKLPEWAADEPVEK-------------------

General information: TITO was launched using: RESULT: Template: 4H80.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain A - contact count / total energy / energy per contact / energy per residue : 107 -8002 -74.78 -127.01 target 2D structure prediction score : 0.29 Monomeric hydrophicity matching model chain A : 0.65 3D Compatibility (PKB) : -74.78 2D Compatibility (Sec. Struct. Predict.) : 0.29 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.192

(partial model without unconserved sides chains): PDB file : Tito_4H80.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4H80-query.scw PDB file : Tito_Scwrl_4H80.pdb: