Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence -----MTRKISKIGASLL----------VLAVATTIDYRQSEAKTIGN--------VVYRETAKSMLKKAMDNQPESSYWFPEDS--LAWSFGKDTDTKYNTSVV--------PLAERVSKATLPNMNVTQTEEVKVVALSAM---NSSINGNASRG------IDIFYA------NVFSYWQYID--QLVYGGALLVKDHRIAKSSCDGCSP-- 5HGZ Chain:A ((2-212)) MTEEERSSALSEVSLRLLCHDDIDTVKHLCGDWFPIEYPDSWYRDITSNKKFFSLAATYRGAIVGMIVAEIKNRTK---IHKEDGDILASNFSVDTQVAYILSLGVVKEFRKHGIGSLLLESLKDHISTTAQDHCKAIYLHVLTTNNTAINFYENRDFKQHHYLPYYYSIRGVLKDGFTYVLYINGGHPPWTILDYIQHLGSALASLSPCSIPH

General information: TITO was launched using: RESULT: Template: 5HGZ.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 : 601 30637 50.98 192.69 target 2D structure prediction score : 0.40 Monomeric hydrophicity matching model chain A : 0.70 3D Compatibility (PKB) : 50.98 2D Compatibility (Sec. Struct. Predict.) : 0.40 1D Compatibility (Hydrophobicity) : 0.70 QMean score : -0.009

(partial model without unconserved sides chains): PDB file : Tito_5HGZ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5HGZ-query.scw PDB file : Tito_Scwrl_5HGZ.pdb: