Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSTPEQLPALSAAGSPSSGGASSHHSPHEASLSFPASVIPGDASAESPRAWSMPRSSTASEESAATSQLQQKPDAPESRLGGRKVVYFVDHSVTSIAYAEGHLMRPSRVRALHALVHSLGLDNAECMTVCHARPATAEEMGAFHRSAYLECLRQAPVICGNPLDEMSLAFQKEFDVPFASQNGDCPLFPEVWALVSSQAGASLACAEALVRGDATVAMNWAGGMHHAAAAHASGFCFVNDIVLCIRRLLRHYQ--RVLYVDLDVHHGDGVEGAFYGNHRVMTLSLHQFGNG-FFPGTG--DYPTRETADSFAINVP----LPTRTGDAAYLLSFRTALSSVVQCFDPEAMVVQCGADTIAGDLIGRLCVTTLAHTQCVADVLSLERPTVLLGGGGYHVFHTARCWAIHTATALGRTAAQLPLYIPRTDPYYMDYRRECTPKRPTLHVFLDPDVDDPLPLGDSLAFWRQLCRSIQWQMRAARLVRQGFFRTLQLCRQRRAALLRQFATQEAGRESGIGVSGPKRPRSANATDRDAKEGVEDRVVSA 3C0Z Chain:C ((189-325)) --------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------HHADHSTAMGFCFFNSVAIACRQLQQQSKASKILIVDWDVHHGNGTQQTFYQDPSVLYISLHRHDDGNFFPGSGAVDEVGAGSGEGFNVNVAWAGGLDPPMGDPEYLAAFRIVVMPIAREFSPDLVLVSAGFDAAEG----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 3C0Z.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain C - contact count / total energy / energy per contact / energy per residue : 589 -20153 -34.21 -157.44 target 2D structure prediction score : 0.66 Monomeric hydrophicity matching model chain C : 0.59 3D Compatibility (PKB) : -34.21 2D Compatibility (Sec. Struct. Predict.) : 0.66 1D Compatibility (Hydrophobicity) : 0.59 QMean score : 0.427

(partial model without unconserved sides chains): PDB file : Tito_3C0Z.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3C0Z-query.scw PDB file : Tito_Scwrl_3C0Z.pdb: