Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence --------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------MGGIPKRRAEAQRRSMLKNLQLISFTDQSAEEQEMCVRQLYDTDISTLEECLLQVTHVCITHPNPNAQELLHNFMLWLAGRSLNIALRLAWTVDAVSAFYSSTGFAGRLK---HIHDKLESYAINQGQPAVPSDSTSGGDGSRTSSDPEEGLGDVDASVV-----QRKEVRLKLYNDERTFVTTLTNLSNTLRFFPDR---------------NYRKDELRRGLRVLNQRLE-----SMRLVHPLCTSSESVQWIVNISVEDCTVFSSRERAPCLIRYEVIVDDTATMQDPTVTRLRQPDGRFRVRADSDEIFVPAPPPGSEPRAAPLVEASGSGAVEDASP---------EALQCLHAVFGESKK-----ARMARVRKSSPWGAHPNWSMNAMIVKAGDDLRQEELALQLIHTFQCIWQEAGLTVRVKPYAALPTHRDCGLLEVIEDSASMDSIKKA--TRVSSIYNYYLKAYDGE---DSVLYRKAQQNFVESMAGYSIISYILQIKDRHNGNLMIRRDGSLVHIDFGFLFVTSPGGLNFESAPFKLSQELIDVMGGA---SSDAFNYFRILVYEALAAARERCEDILALVSILTPNNAMPCFGADPGAAVRQLRGRFRDDLLSEADYAVYAKELIVNSADNWRTRRYDQFQSLQNGIL 1E8X Chain:A ((1-951)) AASEETLAFQRQLNALIGYDVTDVSNVHDDELEFTRRRLVTPRMAEVAGRDPKLYAMHPWVTSKPLPEYLLKKITNNCVFIVIHRSTTSQTIKVSADDTPGTILQSFFTKMANERDFVLRVCGRDEYLVGETPIKNFQWVRQCLKNGEEIHLVLDTPPDPALDEVRKECDRKFRVKIRGIDIPVLPRTADLTVFVEANIQYGQQVLCQRRTSPKPFTEEVLWNVWLEFSIKIKDLPKGALLNLQIYCQLLYYVNLLLIDHRFLLRHGEYVLHMWQLSGFNADKLTSATNPDKENSMSISILLDNHPIALEMPNQLRKQLEAIIATDPLNPLTAEDKELLWHFRYESLKDPKAYPKLFSSVKWGQQEIVAKTYQLLAKREVWDQSALDVGLTMQLLDCNFSDENVRAIAVQKLESLEDDDVLHYLLQLVQAVKFEPYHDSALARFLLKRGLRNKRIGHFLFWFLRSEIAQSRHYQQRFAVILEAYLRGCGTAMLHDFTQQVQVIDMLQKVTIDIKSLSAEKYDVSSQVISQLKQKLENLQNLNLPQSFRVPYDPGLKAGALVIEKCKVMASKKKPLWLEFKCADPTALSNETIGIIFKHGDDLRQDMLILQILRIMESIWETESLDLCLLPYGCISTGDKIGMIEIVKDATTIAKIQQSTVGNTGAFKDEVLSHWLKEKCPIEEKFQAAVERFVYSCAGYCVATFVLGIGDRHNDNIMISETGNLFHIDFGHV-------------PFVLTPDFLFVMGTSGKKTSLHFQKFQDVCVKAYLALRHHTNLLIILFSMMLMTGMPQL---TSKEDIEYIRDALTVGK-SEEDAKKYFLDQIEVCRDKGWTVQFNWFLHLVL---

General information: TITO was launched using: RESULT: Template: 1E8X.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 : 2821 14508 5.14 24.55 target 2D structure prediction score : 0.50 Monomeric hydrophicity matching model chain A : 0.62 3D Compatibility (PKB) : 5.14 2D Compatibility (Sec. Struct. Predict.) : 0.50 1D Compatibility (Hydrophobicity) : 0.62 QMean score : 0.203

(partial model without unconserved sides chains): PDB file : Tito_1E8X.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1E8X-query.scw PDB file : Tito_Scwrl_1E8X.pdb: