Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MMQEETFYSVRMRASMNGSHEDGGKHISGGERLIPFHEMKHTVNALLEKGLSHSRGKPDFMQIQFEEVHESIKTIQPLPVHTNEVSCPEEGQKLARLLLEKEGVSRDVIEKAYEQIPEWSDVRGAVLFDIHTGK-RMDQTKEKGVRVSRMDWPDANFEKWALHSHVPAHSRIKEALALASKVSRHPAVV-AELCWSDDPDYITGYVAGKKMGYQR-ITAMKEYGTEEGCRVFFIDGSNDVNTYIHDLEKQPILIEWEEDHDS 3BBY Chain:A ((4-212)) ---------------------------------------KPAITLWSDAHFFSPYVLSAWVALQEKGLSFHIKTIDRVPLLQIDDFELSESSAIAEYLEDRF--APPTWERIYPLDLENRARARQIQAWLRSDLMPIREE---------------------RPTDVVFAGAKKAPLTAEGKASAEKLFAMAEHLLVLGQPNLFGEWCIADTDLALMINRLVLHG---------DEVPERLVDYATFQWQRASVQRFIALSAK

General information: TITO was launched using: RESULT: Template: 3BBY.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 : 910 -24059 -26.44 -127.97 target 2D structure prediction score : 0.40 Monomeric hydrophicity matching model chain A : 0.60 3D Compatibility (PKB) : -26.44 2D Compatibility (Sec. Struct. Predict.) : 0.40 1D Compatibility (Hydrophobicity) : 0.60 QMean score : 0.129

(partial model without unconserved sides chains): PDB file : Tito_3BBY.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3BBY-query.scw PDB file : Tito_Scwrl_3BBY.pdb: