Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSLSIGQLSKKADVPIDTIRYYEKVGVLDRIQRSENNYRVYTDQTLADLLFIKHCRELDISLSDIKTLKEMKAQPKRACTEVDNLVNKYLIEVSEKIERLLLLKETLIDLKQHCSTDRTVDECGILKELQNHP 5GPE Chain:A ((2-128)) --MRIGELGKKADCLVQTVRFYESEGLLPEP------FRLYDEVHLQRLLFIRRCRAKDMTLDEIRQLLNLRDRPELGCGEVNALVDAHIAQVRTKMKELRALERELMDLRRSCDSARTSRECGILNSL----

General information: TITO was launched using: RESULT: Template: 5GPE.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 : 283 -43492 -153.68 -359.43 target 2D structure prediction score : 0.74 Monomeric hydrophicity matching model chain A : 0.83 3D Compatibility (PKB) : -153.68 2D Compatibility (Sec. Struct. Predict.) : 0.74 1D Compatibility (Hydrophobicity) : 0.83 QMean score : 0.631

(partial model without unconserved sides chains): PDB file : Tito_5GPE.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5GPE-query.scw PDB file : Tito_Scwrl_5GPE.pdb: