Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MIDITSDLKELNI--SYDKINVVRQGENSDTFLITTSKKKLIAKKFKNLNFKTITNTYLNKKILNQLVDKKLFPKVVYQSEEKDFLIYEYVESI-KSNKDK-----LFYKNLGMKIREIHEIKPCKN-NLTFEQQLNFYKMSLGK----VN-KEKVYTRIEDLLNDINIKKSKLVFSHNDLNANNILFNK-DICIIDYEYSSLNNKFCDLSKVIFEFQMTEEEIESLLKGYRINFD-DVTKKKIILWQRFNLYLDYIWSIIISSNENQLTKENIESFYLNKYIDFDLKN 3DXQ Chain:A ((6-264)) ---ARAKLAAIPMLAGYTGPLERLGGLTNLVFRA----GDLCLRIPGK-----YINRANEAVAAREAAKAGVSPEVLHVDPATGVMVTRYIAGAQTMSPEKFKTRPGSPARAGEAFRKLHGSGAVFPFRFELFAMIDDYLKVLS-NVTLPAGYHDVVREAGGVRSALAAHPLPLAACHCDPLCENFLDTGERMWIVDWEYSGMNDPLWDLGDLSVEGKFNANQDEELMRAYFGGEARPAERGRVVIYKAMCDLLWTLWGLIQLAND-----------------------

General information: TITO was launched using: RESULT: Template: 3DXQ.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 : 1090 32984 30.26 139.17 target 2D structure prediction score : 0.69 Monomeric hydrophicity matching model chain A : 0.66 3D Compatibility (PKB) : 30.26 2D Compatibility (Sec. Struct. Predict.) : 0.69 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.359

(partial model without unconserved sides chains): PDB file : Tito_3DXQ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3dxq-query.scw PDB file : Tito_Scwrl_3DXQ.pdb: