Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNTFVDAARSFRTQFDLNFSEKIIVDFFAGGGGASTGLEMGLNRPVYVAVNHNPKAISMHEANH---PHAKHYIQDVFAVDPIDICDGHQVGWFHASPDCTHHSQAAGGQPRKKEIRDLSWVVLKFAGKVKPDVISLENVKQILGWGPLIAKRDKATGRVITLDKININGKKVNRIAEPGERVPRHNQFLVPNPKK-----KGKTWKHFVRSLEQLGYEVEWQKN-------IIAADFGAPTKRERLFLIARCDGQPIVWPEKYFSKKPKGNLKKWRSTVECVDFSDLGNSIFDRPQGPLADATLKRIAKGIQKYVIETKEPFFVNSSTPFIGRDFRTSFGHDIREPLATTTAGYGGHSSLISPILVPFITEFANASQQRNWSIDEPLSTICAQVKGGHHGLVTAKLSKDNYKGALRVAAFLINYYGNGDARSITEPMDTITTKDRLVLVTVWIKGEPWAIVDICIRMLKPRELFRAQGVPDSYVIEYGSDGKPLSKKDQVFMVGNSVSPYPMAAIARANNPFITQQIKGAA 3LX6 Chain:A ((89-292)) -----------------------FIDLFAGIGGIRRGFESIGGQCVFTS-EWNKHAVRTYKANHYCDPATHHFNEDI-----RDITLSHQEGV----------SDEAAAEHIRQHIPEHDVLLAGFP--CQPFSLA--------------ACDTQGT---LFFDVVRIIDAR------------RPAMFVLENVKNLKSHDKGKTFRIIMQTLDELGYDVADAEDNGPDDPKIIDGKHFLPQHRERIVLVG-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 3LX6.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 : 709 -18660 -26.32 -112.41 target 2D structure prediction score : 0.47 Monomeric hydrophicity matching model chain A : 0.60 3D Compatibility (PKB) : -26.32 2D Compatibility (Sec. Struct. Predict.) : 0.47 1D Compatibility (Hydrophobicity) : 0.60 QMean score : 0.260

(partial model without unconserved sides chains): PDB file : Tito_3LX6.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3LX6-query.scw PDB file : Tito_Scwrl_3LX6.pdb: