Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSSTLNTRLIWIDLEMTGLDTDNDQIIEIATIITDDHLNVLAEGPVLAIHQPDRILNAMDEWNTRQHGQSGLIERVRRSKLTARDAELQTLEFLKKWVNPKVSPMCGNSICQDRRFLHRLMPELEQYFHYRNLDVSTVKELSKRWRPEIMSGLKKNASHLAMDDIRDSISELKYYREYFFIMNTDGKD 5CY4 Chain:B ((10-191)) -SSTLNTRLIWIDLEMTGLDTDNDQIIEIATIITDDHLNVLAEGPVLAIHQPDRILNAMDEWNTRQHGQSGLIERVRRSKLTARDAELQTLEFLKKWVNPKVSPMCGNSICQDRRFLHRLMPELEQYFHYRNLDVSTVKELSKRWRPEIMSGL-----HLAMDDIRDSISELKYYREYFFIMN-----

General information: TITO was launched using: RESULT: Template: 5CY4.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 802 -91833 -114.50 -518.83 target 2D structure prediction score : 0.63 Monomeric hydrophicity matching model chain B : 0.98 3D Compatibility (PKB) : -114.50 2D Compatibility (Sec. Struct. Predict.) : 0.63 1D Compatibility (Hydrophobicity) : 0.98 QMean score : 0.576

(partial model without unconserved sides chains): PDB file : Tito_5CY4.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5CY4-query.scw PDB file : Tito_Scwrl_5CY4.pdb: