Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTILTKLTQKDFEEILLRYSI-GKYKAHEHISYALQNTVFILNTTKGKYVLKIFEKSEADFVKFQIRITDYLYHKKVPVARIVKLKNGRNLLMYRNKLMAIQKFVGGN-PAKKLN----KELAGNLAKNLALMSKHLLKLKLKGI--F-M-WSNDHEFETNTDIENIEKVNFVGYEKKLLEEIGKLDRNNLRRSVIHGDFHEMNLLTENNELRAIIDWDDAHEDYISYEIAVYLVSYFDAVSIKRSKEYIELFFKEFQRYIKLNEEEIKAVYYFMKQRLIGVIFWHQNQKKIHKNFEKRLDRSMKKLITRYVALENITLDEFMQLAERKSTSQKHHRAELKNKKNLYSVIVQD 3DXQ Chain:B ((2-256)) -------MTDEARAKLAAIPMLAGYTGPLERLGGLTNLVFRA----GDLCLRIP------NRANEAVAAREAAKAGVS-PEVLHVDP--------ATGVMVTRYIAGAQTMSPEKFKTRPGSPARAGEAFRKLHGSGAVFPFRFELFAMIDDYLKV-LSTKNV--TLP-AGYHDVVREAGGVRSALAAHPLPLAACHCDPLCENFLDTG-ERMWIVDWEYSGMNDPLWDLGDLSVEGKF------NANQDEELMRAYFGGEA-RPAERGRVVIYKAMCDLLWTLW--------------------------------------------------------------------

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 B - contact count / total energy / energy per contact / energy per residue : 1084 -6621 -6.11 -27.93 target 2D structure prediction score : 0.51 Monomeric hydrophicity matching model chain B : 0.62 3D Compatibility (PKB) : -6.11 2D Compatibility (Sec. Struct. Predict.) : 0.51 1D Compatibility (Hydrophobicity) : 0.62 QMean score : 0.255

(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: