Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MAENQEVYDVTIIGGGPIGLFTAFYCGMRELKTKVIEFLPKLGGKVSLFFPEKIIRDIGGIP-GIAGKQLIEQLKEQAATFDPDIVLNQRVTGFERLDDGTIVLTGSEGKKHYTRTVILACGMGTLEVNEFDSEDAARYAGKNLH-YGVEKLDAFKGKRVVISGGGDTAVDWANELEPIAASVTVVHRREEFGGMESS-VTKMKQSSVRVLTPYRLEQLNGDE---EGIKSVTVCHTESGQRKDIEIDELIINHGFKIDLGPMMEWGLEIE-EGRVKADR-HMRTNLPGVFVAGDAAFYESKLRLIAGGFTEGPTAVNSAKAYLDPKAENMAMYSTHHKKLVHK 4JNQ Chain:A ((22-338)) --MTQRHAPVIVIGSGPAGYTAAIYAARAMLKPVVIAGLQ-QGGQLMITTDV---ENYPGYAEPVQGPWMMEQMARQAENVGAQIVHD-IITEVETTV-RPFRLKGDSGTIYTCDALIIATGAQ---AKWLGLESEQTFMGGGVSACATCDGFFYRGKDVVVVGGGNTAVEEALYLSHIAKSVTIVHRRDGFRAEKIMQDRLLSRENVSVVWNSVIDEILGTEARGATVTGVRLKNIVTGETQERATHGVFIAIGHAPAVSLFEG-KLKQKPNGYLWTAPDSTATDVPGIFAAGDVTDD--IYRQAVTAAGMGCMAALEAERWLAAQE----------------

General information: TITO was launched using: RESULT: Template: 4JNQ.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 : 1844 -216260 -117.28 -706.73 target 2D structure prediction score : 0.52 Monomeric hydrophicity matching model chain A : 0.71 3D Compatibility (PKB) : -117.28 2D Compatibility (Sec. Struct. Predict.) : 0.52 1D Compatibility (Hydrophobicity) : 0.71 QMean score : 0.522

(partial model without unconserved sides chains): PDB file : Tito_4JNQ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4JNQ-query.scw PDB file : Tito_Scwrl_4JNQ.pdb: