Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSLLNDILEFNKTFTEQREYEKYQTSKFPDKKMAILSCMDTRLVELLPHAMNLRNGDVKIIKSAGALVTHPFGSIMRSILVAVYELNADEVCVIGHHDCGMSKISSKSMLEKIKARGIPEERIETIKYSGVDFDQWFKSFDSVEASVKDSVDVIKHHPLFPENVPVHGLVIDPKTGKLDLIVNGYNN 4YF4 Chain:A ((35-168)) ----------------------------PSKHIAIVACMDARLD--VYRMLGIKEGEAHVIRNAGCVVTD---DVIRSLAISQRLLGTREIILLHHTDCGMLTFTDDDF-----KRAIQDE-------TGIRPTWSPESYPDAVEDVRQSLRRIEVNPFVTKHTSLRGFVFDVATGKLN--------

General information: TITO was launched using: RESULT: Template: 4YF4.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 : 584 -94933 -162.56 -708.45 target 2D structure prediction score : 0.59 Monomeric hydrophicity matching model chain A : 0.74 3D Compatibility (PKB) : -162.56 2D Compatibility (Sec. Struct. Predict.) : 0.59 1D Compatibility (Hydrophobicity) : 0.74 QMean score : 0.582

(partial model without unconserved sides chains): PDB file : Tito_4YF4.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4YF4-query.scw PDB file : Tito_Scwrl_4YF4.pdb: