Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKFERGIGFFALIFSILVIGAFIALSIYLIRLDNIIREKFEGQRWDIPAKVFARPLEIYNNAPITQANFTQELKLLGYKTSSNYDKSGTYVAQGSNMYVHTRGFDYGDSVEPEQVLELSFANDQVVEVRSTKPSSTGVARLEPLLIGGIYPQHNEDRVLIKLNSVPKPLIEALISTEDRNFYHHHGISIRGTARALVSNVTGG-RRQGGSTLTQQLVKNFYLTPERTLKRKVNEALMALLIELHYSKDEILEAYLNEVNLGQNGNYSINGYGLAAQFYFGLPLRELNVAQQAYLVGLVQGPSLYNPWKNPEGAKNRRDTVLNNMRVMGYLTQAEYE--TEIARPLNVLSK--------PSLGPAKFPDFLDIVRRQLRTE--YQESDLTN---QGLRIFTTLDPIAQTQVQNAFKASVERLANSNPARLKNLQGAVLIAHPENGELIAAVGST--QDFTGFNRALDAKRQVGSLLKPVI-YLSAIESGRYNWASQIEDAPISVPVDGGKSWTPKNYSGGGHGIVSLSEALANSYNLSAVRLGQEFGLSTFTNNLRKF----GVESTIPAYPSIFLG--AVNMSPMEVLGIYENFATGGFKYPTRAIRSVVDANGHLLDRYGLNVQETIDPSVGYIMNYGLQQVMSSGTGR---AAYNSLSPALKLAGKSGT--------------TNDTRDSWFAGYSGNHVAVVWLGLDDNKVTGLTGSSGALPVWINVMKQLRQTPVNLRQPDSVQWQWIDHASGDLSAQACDGAMYIPMLAHTVPHRATPCGAPYYQVDPTYTPQSDNTIPEPEDDNTDSYIRESENQMEQDLSNNTRIISSGSYNN 2OLU Chain:A ((39-573)) ---------------------------------------------------------------------------------------------------------------------------------------------------------------VNLKDVPKSMKDAVLATEDNRFYEHGALDY-------------GFGSEGASTLTQQVVKDAFLS----IGRKAQEAYLSYRLEQEYSKDDIFQVYLNKIYYSD----GVTGIKAAAKYYFNKDLKDLNLAEEAYLAGLPQVPNNYNIYDHPKAAEDRKNTVLYLMHYHKRITDKQWEDAKKIDLKANLVNRTPEERQNIDTNQDSEYNSYVNFVKSELMNNKAFKDENLGNVLQSGIKIYTNMDKDVQKTLQN-------DVDNGSFYKNKDQQVGATILDSKTGGLVAISGGRDFKDVVNRNQATDP-HPTGSSLKPFLAYGPAIENMKWATNHAIQDES-SYQVDGS---TFRNYDTKSHGTVSIYDALRQSFNIPALKAWQSVKQNAGNDAPKKFAAKLGLNYEGDIGPSEVLGGSASEFSPTQLASAFAAIANGGTYNNAHSIQKVVTRDGETIE-YDHTSHKAMSDYTAYMLAEMLK-----GTFKPYGSAYGHGVSGVNMGAKTGTGTYGAETYSQYNLPDNAAKDVWINGFTPQYTMSVWMGFSKVKQYG----------------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 2OLU.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 : 2270 132644 58.43 278.66 target 2D structure prediction score : 0.58 Monomeric hydrophicity matching model chain A : 0.68 3D Compatibility (PKB) : 58.43 2D Compatibility (Sec. Struct. Predict.) : 0.58 1D Compatibility (Hydrophobicity) : 0.68 QMean score : 0.428

(partial model without unconserved sides chains): PDB file : Tito_2OLU.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2OLU-query.scw PDB file : Tito_Scwrl_2OLU.pdb: