Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSDRIREKLQILADAAKYDVSCSSSGSDRKNKNKGLGDASHSGICHSYTEDGRCVSLLKILFSNVCIFDCAYCVSRRSNDV-QRAAFTVQEVVDLTINFYRRN--YIEGLFLSSGIF-KSADHTMERMLQVVKKLRLEENFNGYIHLKTIPGASPELIHEAGLYADRMSINLEMPTEIGLKTFAPEKSHQEVQKDLGLVRDRLIQLKDERQIIKHVPKYVPAGQTTQMV-VGAHQESDQDVLFMADKHYKEFK-LKRVYFSGYIPINNENNYLPAVGSAPPLLRENRLYQSDWLMRFYGFEVNEIVNEKHPNLDLDVDPKLSWALRHPEQFPVDLNRADYQMILRVPGIGVKSAKKIVQARRFGKIHIDLLKKLGVAYQRAKFFIRCEDSPKFQKELSSSFIRQQILTQGSSKYVQQLSPQLSLGF 3C8F Chain:A ((8-211)) ------------------------------------------SFESCGTVDGPGI--RFITFFQGCLMRCLYCHNRDTWDTHGGKEVTVEDLMKEVVTYRHFMNASGGGVTASGGEAILQAEFVR----DWFRACKK-EGIHTCLDTNGFVRRYDPVIDELLEVTDLVMLDLKQMNDEIHQNLVGV-SNHRTLEFAKYLANK------------------NVKVWIRYVVVPGWSDDDDSAHRLGEFTRD-MGNVEKIELLPYHELGK-HKWVA--------------------------------------------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 3C8F.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 : 964 -15842 -16.43 -80.01 target 2D structure prediction score : 0.52 Monomeric hydrophicity matching model chain A : 0.61 3D Compatibility (PKB) : -16.43 2D Compatibility (Sec. Struct. Predict.) : 0.52 1D Compatibility (Hydrophobicity) : 0.61 QMean score : 0.306

(partial model without unconserved sides chains): PDB file : Tito_3C8F.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3C8F-query.scw PDB file : Tito_Scwrl_3C8F.pdb: