Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKERFQMKKYQWGIVGLGTIAHEFAESFNQE---TSELTAVASRTSEKAENFAHRYNIPKAYGSYQEMLDDAEIDIVYIAVPNRQHIDHILAALEAGKHVLCEKAITMNKKELADAMRLAEEKNLILAEAMTIFNMPLYQQLRSIMDTGKLGALKMIQAPFGSYKEPDPKNRFFNPELAGGALLDIGTYAVSFARFFLSS-QPEVV-ASTMVPFETGVDEQSVTILRNKENELAAVSLTFQAKMPKVGIVAFENGYVTIADYP-RADRAEILFTDGTKEF--I---ESGNTSEAMNYEIKNMVHMIEGDLP--N-RSLFLTKDVIEILDQMQVLWKNM 3OHS Chain:X ((2-327)) --------ALRWGIVSVGLISSDFTAVLQTLPRSEHQVVAVAARDLSRAKEFAQKHDIPKAYGSYEELAKDPNVEVAYVGTQHPQHKAAVMLCLAAGKAVLCEKPMGVNAAEVREMVTEARSRGLFLMEAIWTRFFPASEALRSVLAQGTLGDLRVARAEFGKNL--THVPRAVDWAQAGGALLDLGIYCVQFISMVFGGQKPEKISVMGRRH-ETGVDDTVTVLLQYPGEVHGSFTCSITAQLSNTASVSGTKGMAQLLNPCWCPTELVVKGEHKEFLLPPVPKNCNFDNGAGMSYEAKHVRECLRKGLKESPVIPLVESELLADILEEVRRAIGV-

General information: TITO was launched using: RESULT: Template: 3OHS.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain X - contact count / total energy / energy per contact / energy per residue : 1811 -13690 -7.56 -43.88 target 2D structure prediction score : 0.69 Monomeric hydrophicity matching model chain X : 0.75 3D Compatibility (PKB) : -7.56 2D Compatibility (Sec. Struct. Predict.) : 0.69 1D Compatibility (Hydrophobicity) : 0.75 QMean score : 0.527

(partial model without unconserved sides chains): PDB file : Tito_3OHS.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3OHS-query.scw PDB file : Tito_Scwrl_3OHS.pdb: