Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MEKARISIRQLFVMIIIFELGSSLLITPG-SMAGRDAWIAVLLGCAI-GLFLFYLYQGIYQCYP-NSSPKEYMDDMLGTKLSWLFSFLYILYFAYI---AARVLRDFGEMLLTFAYHDT-----PIIIVNALLMVVSIYAVRKGIEVLARAAELLFGAMYLLGAIGLVLIIVSGTIDPHNLKPVLA-NGISPVLHSVFTQTMYVPFG-EVVLFVMIFPNLNDRKDV-KKMGMIAMAISGLIVALTVAINISVLDVDLTLRSQ---FPLLSTIQTIKVE--EFLDRLDVFFMLALIIGGFFKVSLYLYATVVGTSTLFKEKNPSQLAYPMGLGILILSITIATNFSEHLNEGLNVVPLYIHLPFQLLFPLFLFIVAVWKKKRREKSKGEEAKK 4DJK Chain:A ((12-345)) ----QLTLLGFFAITASMVM--AVYEYPTFATSGFSLVFFLLLGGILWFIPVGLCAAEMATVDGW--GVFAWVSNTLGPRWGFAAISFGYLQIAIGFIPMLYFVLGALSYILKW--PALNEDPITKTIAALIILWALALTQFGGTKYTARIAKVGFFAGILLPAF-ILIALAAIYLH-----TFFPDFSKVGTLVVFVAF-ILSYMGVE--ASATHVNEMSNPGRDYPLAMLLLMVAAICLSSVGGLSIAMVIPGNEINLSAGVMQTFTVLMSHVA-PEIEWTV---RVISALLLLGVLAEIASWIVGPSRGMYVTAQ--------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4DJK.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 : 1084 -200993 -185.42 -728.23 target 2D structure prediction score : 0.56 Monomeric hydrophicity matching model chain A : 0.63 3D Compatibility (PKB) : -185.42 2D Compatibility (Sec. Struct. Predict.) : 0.56 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.259

(partial model without unconserved sides chains): PDB file : Tito_4DJK.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4DJK-query.scw PDB file : Tito_Scwrl_4DJK.pdb: