Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MFHISTLDQIKIAYIGGGSQGWARSLMSDLSIDERMSGTVALYDLDFEAAQKNE-VIGNHSG-NGR-WRYEAVSTLKKALSAADIVIISILPGSLDDMEVDVHLPERCGIYQSVGDTVGPGGIIRGLRAVPIFAEIARAIRDYAPESWVINYTNPMSVCTRVLYKVF--PGIKAIGCCH--EVFGTQKLLAEMVTERLGIEVPRREDIRVNVLGINHFTWITKASYRHIDLLPIFREFSAHYGESGYELEGECWRDSVFCSAHRVAFDLFETYGAIPAAGDRHLAEFLPGPYLKQPEVWKFHLTPISFRKQDRAEKRQETERLIVQQRGVAEKASGEEGVNIIAALLGLGELVTNVNMPNQGQVLNLPIQAIVETNAFITRNRVQPILSGALPKGVEMLAARHISNQEAVADAGLTKDTGLAFQAFLNDPLVQIDRSDAEQLFNDMLQCIMQS 3P7M Chain:A ((3-303)) ------MARKKITLVGAGNIGGT--LAHLALI-KQL-GDVVLFDIAQGMPNGKALDLLQTCPIEGVDFKVRGTNDY-KDLENSDVVIVTAGVPRKPGMSRDDL-------L---------------GINIKVMQTVGEGIKHNCPNAFVICITNPLDIMVNMLQKFSGVPDNKIVGMAGVLDSARFRTFLADEL------NVSV-QQVQAYVMGGHG-----------DTMVPLTKMSNVAG--------------------VSLE--QLVKEGKLKQ-------ERLD-AIVSR----------TRSGGGEIVAL------LKTGS---AYYAPAAAGIQMAESFLKDKKMILPCAAKVKAGMYGLDEDLFVGVPTEISANGVRPIE-VEISDKEREQLQV---------------------------------------------------

General information: TITO was launched using: RESULT: Template: 3P7M.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 : 1591 -212606 -133.63 -723.15 target 2D structure prediction score : 0.58 Monomeric hydrophicity matching model chain A : 0.63 3D Compatibility (PKB) : -133.63 2D Compatibility (Sec. Struct. Predict.) : 0.58 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.404

(partial model without unconserved sides chains): PDB file : Tito_3P7M.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3P7M-query.scw PDB file : Tito_Scwrl_3P7M.pdb: