Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKVNGIHHVSALTADAQKNLDFYKKVLGLKLVKKSVNQDEPTMYHLFYGDEVANPGTELTFFEIPRIAPFHAGTNSISSIGLRVPGTEALHYWKERFEEQQVTHSGIS-K----RAGRDILAFQDHEGQRLVLTADEEGKGYGLPVKQSG---IPEEFSFRGLGPVELTVPYAEPTLHVLTNILGFTEISREPV---EG-QGTAVILESGEGGAATEIHLIERNDLPRERQGKGSVHHVAFRVRDEEELAGWHRIISREGFSNSGIV-ER--YYFKALYFREPNGILFELSTDGPGFMVDENLDELGQTIALPPYLEHRRAEIEAKLKPIQ 2WL9 Chain:A ((2-276)) AKVTELGYLGLSVSNLDAWRDYAAGIMGMQVVDDGED------DRIYLRMDR--WHHRIVLHAD--------GSDDLAYIGWRVAGPVELDELAEQLKNAGIPFEVASDADAAERRVLGLVKLHDPGGNPTEIFYGPQVDTS-SPFHPGRPMFGKFVTEGQGLGHIIIREDDVEEATRFYR-LLGLEGAVEYKFALPNGAVGTPVFMHCN--DRHHSLAFGVG-------PMDKRINHLMIEYTHLDDLGYAHDLVRQQKIDVTLQIGKHSNDEALTFYCANPSGWLWEPGWGSRPAPAQQE-----------------------------

General information: TITO was launched using: RESULT: Template: 2WL9.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 : 1450 -126872 -87.50 -487.97 target 2D structure prediction score : 0.69 Monomeric hydrophicity matching model chain A : 0.69 3D Compatibility (PKB) : -87.50 2D Compatibility (Sec. Struct. Predict.) : 0.69 1D Compatibility (Hydrophobicity) : 0.69 QMean score : 0.443

(partial model without unconserved sides chains): PDB file : Tito_2WL9.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2WL9-query.scw PDB file : Tito_Scwrl_2WL9.pdb: