Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MHSQPLLDCWNLDQILDDLNAHGFAIVNQAYSAEYHTQVAKECSHH--FDEFREAGIQNGVVSTIRSDHILWINESLPVA-EQHVETLTSFCQHLNQAFFLGIKEVEAHFACYNPGEFYALHRDNPQQKNDRIMSTVYYLHPQWQDDWGGQLRLQDKNDIWHIITPEPNRLVIFQSN-LLHEVLVSKQQRLSITAWLRSGNSIWV 4J25 Chain:G ((32-222)) -----------LAAVVDDLATHGWSQQAHFLPADLVRALAAECRRRDAE-ELNPA------RETIRGDQIQWIDPGQAEACDQYLAAMDQLRLAINQGLFLGLEDFECHFALYPPGAFYRRHLDRFRDDDRRMVSAVLYLNEGWQPHDGGQLRMFLADGVEHDVEPVAGCLVVFLSGEVPHEVLPAGRERLSLTGWFR-------

General information: TITO was launched using: RESULT: Template: 4J25.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain G - contact count / total energy / energy per contact / energy per residue : 840 -29037 -34.57 -164.98 target 2D structure prediction score : 0.61 Monomeric hydrophicity matching model chain G : 0.76 3D Compatibility (PKB) : -34.57 2D Compatibility (Sec. Struct. Predict.) : 0.61 1D Compatibility (Hydrophobicity) : 0.76 QMean score : 0.365

(partial model without unconserved sides chains): PDB file : Tito_4J25.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4J25-query.scw PDB file : Tito_Scwrl_4J25.pdb: