Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MEQKKSTQKRNQLLAAALDVFSLYGFSGASLDEIAQLADMHKSNIFYYYENKESLYVE-VLTTVLQ--KWLAPLQTLEAELEPAEALSHYLIQKIELSRSQPKASRLFALEIIQGAPHILPILKGPLKKLFKR----KAKVIQTWQEQGKISPDIDPELLILNIWG----LTQNYADFATQMEMVTGKTLRNRSMFQRSIEHTVHMML--YGVLPR 3BHQ Chain:A ((7-208)) --ETRSARKDREIIQAATAAFISKGYDGTSMEEIATKAGASKQTVYKHFTDKETLFGEVVLSTASQVNDIIESVTTLLSEAIFMEGGLQQLARRLIAVLMDEELLKLRRL-IIANADRMPQLGRAWYEKGFERMLASTASCFQKLTNRGLIQTG-DPYLAASHLFGMLLWIPMNEAMF-------TGSNRRSKAELERHADASVEAFLAVYGV---

General information: TITO was launched using: RESULT: Template: 3BHQ.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 : 694 -44076 -63.51 -233.20 target 2D structure prediction score : 0.66 Monomeric hydrophicity matching model chain A : 0.70 3D Compatibility (PKB) : -63.51 2D Compatibility (Sec. Struct. Predict.) : 0.66 1D Compatibility (Hydrophobicity) : 0.70 QMean score : 0.453

(partial model without unconserved sides chains): PDB file : Tito_3BHQ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3BHQ-query.scw PDB file : Tito_Scwrl_3BHQ.pdb: