Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNNIKESVQKLLG--EELIVFELKGKGACNNAYYVETQSGKKFIIKEERPNGELKEQNSLAVEAHVIKQLSNLNFSAPLAK-VYFISKEPNMFGYVYIEGD-LLIDAWKKLTEEERIGICQNLGVFHAELEQRVTEAMAREMGVQINTYIGLHPEVEEEYSKILTFTDIPNGWKTLAQKTKTIFDK-TLELGVFQFLHNDAHHENIIVKD-GEITGIIDFGDSEYGEIAREFSRYIRD--F-PDHAEYIIKAYEKASGHKLSRERLISNSFLSGLMDNVEDYRKGGEDCIRAEKAVSKYEDIFT 4R78 Chain:A ((24-274)) --IIKEKISSLLSQEEEVLSVEQL--GGMTNQNYLAKTTNKQYIVKFFGKGTE--KLINRQDEKYNLELLKDLGLDVKNYLFDIE----AGIKVNEYIESAITLDSTS-------IKTKFDKIAPILQTIHTSAKELRGEF--APFEEIKKYESLIEEQ-------IPYA-NYESVRNAVFSLEKRLADLGVDRKSCHIDLVPENFIESPQGRL-YLIDWEYSSMNDPMWDLAALFLESEFTSQEEETFLSHYESDQT-PVSHEKI-AIYKILQDTIWSLW-----------------------

General information: TITO was launched using: RESULT: Template: 4R78.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 : 1071 34241 31.97 141.49 target 2D structure prediction score : 0.64 Monomeric hydrophicity matching model chain A : 0.63 3D Compatibility (PKB) : 31.97 2D Compatibility (Sec. Struct. Predict.) : 0.64 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.319

(partial model without unconserved sides chains): PDB file : Tito_4R78.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4r78-query.scw PDB file : Tito_Scwrl_4R78.pdb: