Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MEVARTINLIEEEIINDLKGKFGW--HIQSLEANNLGYGNMKWIMKTDSESYFVKKYCKVRYRRGLEDVHEALRYQDLMYRDGIPCQPVYAY-NNRYIHRLQSDEDYMITGVSKGELIQAGTANLQQMYSLGETTGRMHKWMSIHMPRRTVLH-WDLPSKHKMIARLELNLHETEE-------ANHGKYVLAIQKQMEILSGVDMDIFNECAKGWAHWDMHVDNLLFYK--DGVADIVDFDRVQFVYPDFDISRALLSCALKD---------DQMRLDAVEAYVEGYRV--HMSLSNEQLVRSIKLTWYKEFKWVHAMYCSEKTMGRFIDEMIWIGDNWNELNDIFKL 4WH3 Chain:A ((5-290)) -----------NEVLFGIASHFALEGAVTGIEPYGDGHINTTYLVTTDGPRYILQQMNTSIFPDTVNLMRNVELVTSTLKAQGKETLDIVPTTSGATWAEI-DGGAWRVYKFIEHTVSYNLVPNPDVFREAGSAFGDFQNFLSEFDASQLTETIAHFHD---TPHRFEDFKAALAADKLGRAAACQPEIDFYLSHADQYAVVMDGLRDGSIPLRVTHNDTKLNNILMDATTGKARAIIDLDTIMPGSMLFDFGDSIRFGASTALEDEKDLSKVHFSTELFRAYTEGFVGELRGSITAREAE-----------------------------------------------

General information: TITO was launched using: RESULT: Template: 4WH3.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 : 1076 -22474 -20.89 -85.78 target 2D structure prediction score : 0.51 Monomeric hydrophicity matching model chain A : 0.64 3D Compatibility (PKB) : -20.89 2D Compatibility (Sec. Struct. Predict.) : 0.51 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.251

(partial model without unconserved sides chains): PDB file : Tito_4WH3.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4wh3-query.scw PDB file : Tito_Scwrl_4WH3.pdb: