Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTEYAIRLKDITKSYNMYAKPSDRFREALNPFKKSYHDVFYALKNVNVEIKKGEMIGFVGENGSGKSTMLKIITGVLTPTSGTMEIEGKISAL---------------LELGSGFNPEYSGYENIYLNGMVLGFSREEVDEMVDDIIEFADIGDHIYQPVKTYSSGMFVRLAFAVAINVNPDILIVDEALAVGDLEFQLKCMEKFTEIKN-SGKTILFVSHDISSIRRFCDRSYWLKNGEVVEYGDTMEVTTNYENFLKKKSVKTVDRNKNQVERFAAPDIVDVTKAELLDKDKNPVDMLEQGEKLYVKVTYEVKDDTIKNPVLGIALRTVDNFYVCGLNTLLDGIKIPWKKGENIFYLEYEKLGLLAGEYYFDVAVFEENATVPLVYKTKYMNLFVSGSYIGEGIVVLDHKWEEGTHSNEI 1OXU Chain:C ((1-231)) --MVRIIVKNVSKVFKK--------------------GKVVALDNVNINIENGERFGILGPSGAGKTTFMRIIAGLDVPSTGELYFDDRLVASNGKLIVPPEDRKIGMVFQTWALYPNLTAFENIAFPLTNMKMSKEEIRKRVEEVAKILDIHHVLNHFPRELSGGQQQRVALARALVKDPSLLLLDEPFSNLDARMRDSARALVKEVQSRLGVTLLVVSHDPADIFAIADRVGVLVKGKLVQVGKPEDLYDN-------------------------------------------------------------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 1OXU.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain C - contact count / total energy / energy per contact / energy per residue : 1100 -40615 -36.92 -188.91 target 2D structure prediction score : 0.54 Monomeric hydrophicity matching model chain C : 0.65 3D Compatibility (PKB) : -36.92 2D Compatibility (Sec. Struct. Predict.) : 0.54 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.444

(partial model without unconserved sides chains): PDB file : Tito_1OXU.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1OXU-query.scw PDB file : Tito_Scwrl_1OXU.pdb: