Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSAYQLPTVWQDEASNQGAFTGLNRPTAGARFEQNLPKGEQAFQLYSLGTPNGVKVTILLEELLEAGFKEAAYDLYKIAIMDGDQFGSDFVKLNPNSKIPALLDQSGT--EDVRVFESAHILLYLAEKFGAFLPSNPVEKVEVLNWLFWQAGA-APFLGG-GFGHFFNYAPEKLEYPINRFTMEVKRQLDLLDKELAQKPYIAGNDYTIADIAIWSWYGQLVQGNLYQGSAKFLDASSYQNLVKWAEKIANRPAVKRGLEVTYTEIK 4NAX Chain:B ((16-231)) -------------------------------------KHPERLQLYSLPTPNGVKVSIMLEEI------GLAYEAHKVSFDNDDQLSPEFISLSANNKIPAILDPNGPGGQPLPLFESGAILQYLAEKSGQLLSQDPAQRYQTLQWLMFQMGGIGPMFGQVGFFHFFAGKEYEDKRPRDRYVNESKRLLGVLDRHLKGRQWMA-EEYSIADIAIFPWVRNLVE---RYNARDLVGFDQFKEVQRVLANFLERPAVQHGLKIPG----

General information: TITO was launched using: RESULT: Template: 4NAX.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 1026 -30654 -29.88 -144.59 target 2D structure prediction score : 0.66 Monomeric hydrophicity matching model chain B : 0.77 3D Compatibility (PKB) : -29.88 2D Compatibility (Sec. Struct. Predict.) : 0.66 1D Compatibility (Hydrophobicity) : 0.77 QMean score : 0.537

(partial model without unconserved sides chains): PDB file : Tito_4NAX.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4NAX-query.scw PDB file : Tito_Scwrl_4NAX.pdb: