Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MDQKDFRENLELKPVTQEHIDQFNELLSYVFQVTEADIEESGFENKRAFIRSKKPILEVSKVFGWFHENKLISQIAIYPCEVNIHGA-RYKMGGVTGVGTYPEYANHGLMQDLIIVALDNMRKNKQWISYLYPYSIPYYRRKGWEIMSDKLSFKIRDTQLPKQI--PV----SGMVERLP-V-DHPDVFSVYDKFAQQNHGALFRSDFHWEEYWRFENED-ERTAAVYYDSNHEPRGVLFYWVAE---EIFHVKEMFYLDQEARNGLWNFISAHFSMIYWVHGDIYKNEPLAFLIEDSQI--KEQIEPYFMARIVDVKEFLQRFPFVGT--ADAFHFIIEDPVAPWNNGVFALTWDEQGQVRVLNEPIGKSVRLDIQTLTCLMMNYRRASYLARIERLE-TDEETLKSLERIIPNMEAYFSDYF 5EC4 Chain:A ((23-418)) ---------VTLCSPTEDDWPGMFLLAAASFTDFIGPES-------ATAWR---TLVPTDGAVVVRDGSEVVGMALYMDLRLTVPGEVVLPTAGLSFVAVAPTHRRRGLLRAMCAELHRRIADSGYPVAALHASEGGIYGRFGYGPATTLHELTVDRRFARFHADAPGGGLGGSSVRLVRPTEHRGEFEAIYERWRQQVPGGLLRPQVLWDELLAEAKAAPGG-DRESFA-LLHPDGYALYRVDRTDLKLARVSELRAVTADAHCALWRALIGLDSME-RISIITHPQDPLPHLLTDTRLARTTWRQDGLWLRIMNVPAALEARGYAHEVGEFSTVLEVSD------GGRFALKIGDG-RARCTPTDAAAEIEMDRDVLGSLYLGAHRASTLAAANRLRTKDSQLLRRLDAAFASDVPVQT---

General information: TITO was launched using: RESULT: Template: 5EC4.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 : 1868 -57843 -30.97 -154.66 target 2D structure prediction score : 0.54 Monomeric hydrophicity matching model chain A : 0.69 3D Compatibility (PKB) : -30.97 2D Compatibility (Sec. Struct. Predict.) : 0.54 1D Compatibility (Hydrophobicity) : 0.69 QMean score : 0.398

(partial model without unconserved sides chains): PDB file : Tito_5EC4.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5EC4-query.scw PDB file : Tito_Scwrl_5EC4.pdb: