Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSTTPDLPKERVITQEEFDNAVKLGGKFAPVFKVDEKTVVKTSDMTQLGEAAAMKMVREKTTIPVPEDQNVYTDPTTGDVP----IVMDFIEGDCLLDVW-----DTYDNDQKQQIIEQLH-SYFAQLRELKGSFIGSVDGKFCF--DQVFDQDIGGHGPYEDEASFNEGLVKALKNT---MISGWGDTVCDMVLAMKDHEIVFTHGDISPRNILVKDCNIVSVLDWEYSGYYPEYWEYAKAFFRPAWEKSWIKDRAVNKILKPYPLENAICQHVFSFGAW 3ATT Chain:A ((81-264)) -----------------------------------------------------IRLVGELTDVPVPRVRWI---ETTGDVLGTPFFLMDYVEGVVPPDVMPYTFGDNWFADAPAERQRQLQDATVAALATLHS--IPNAQNTFSFLTDTTLHRHFNWVRSWYDFAVEGIGRSPLLERTFEWLQSHWPDDAAA-------REPVLLWGDARVGNVLYRDFQPVAVLDWEMVALGPRELDVAWMIF-------------------------------------

General information: TITO was launched using: RESULT: Template: 3ATT.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 : 496 -20051 -40.42 -122.26 target 2D structure prediction score : 0.53 Monomeric hydrophicity matching model chain A : 0.65 3D Compatibility (PKB) : -40.42 2D Compatibility (Sec. Struct. Predict.) : 0.53 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.231

(partial model without unconserved sides chains): PDB file : Tito_3ATT.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3att-query.scw PDB file : Tito_Scwrl_3ATT.pdb: