Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKKLLMLTTGGTIASVEGENGLAPGVKADELLSYVSKLDN-----------------------DYTMET-QSLMNIDSTNMQPEYWVEIAEAVKENYDAYDGFVITHGTDTMAYTSAALSYMLQHAKKPIVITGSQIPITFQKTDAKKNITDAIRFACE-GVGGVYVVFDGRVIQGTRAIKLRTKSYDAFESINYPYIAFINEDGIEYNKQVTEPE-NDTFTVDTSLCTDVCLLKLHPGLKPEMFDALKSM-YKGIVIESYGSGGVPFEGRDILSKVNELIESGIVVVITTQCLEEGEDMSIYEVGRRVNQDLIIRSRNMNTEAIVPKLMWALGQSS-DLPVVKRIMETPIADDVVL 5DNC Chain:A ((31-382)) ERHLLLIYTGGALGMQSKGGVLVPGPGLVTLLRTLPMFHDKEFAQAQGLPDHALALPPASHGPRVLYTVLECQPLLDSSDMTIDDWIRIAKIIERHYEQYQGFVVIHGTDTMASGASMLSFMLENLHKPVILTGAQVPIRVLWNDARENLLGALLVAGQYIIPEVCLFMNSQLFRGNRVTKVDSQKFEAFCSPNLSPLATVGADVTIAWDLVRKVKWKDPLVVHSNMEHDVALLRLYPGIPASLVRAFLQPPLKGVVLETFGSGNGPSK-PDLLQELRAAAQRGLIMVNCSQCLRGSVT-PGYAT--SLAGANIVSGLDMTSEAALAKLSYVLGLPELSLERRQELLAKDLRGEMT-

General information: TITO was launched using: RESULT: Template: 5DNC.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 : 1778 -4217 -2.37 -13.02 target 2D structure prediction score : 0.67 Monomeric hydrophicity matching model chain A : 0.77 3D Compatibility (PKB) : -2.37 2D Compatibility (Sec. Struct. Predict.) : 0.67 1D Compatibility (Hydrophobicity) : 0.77 QMean score : 0.506

(partial model without unconserved sides chains): PDB file : Tito_5DNC.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5DNC-query.scw PDB file : Tito_Scwrl_5DNC.pdb: