Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MALTEYKIKVVDANNQPLLNFPMATRYVGSDKKNNKLTSDTDGVLTFQSDGRAVEVFVLAPIDKNGQPDMTKFKEDNDNDNAYYRITTINVSRNVPSSIKSPYLLTDYGIAKTKFIFYENEQDKKIYSVPLTVKVSYLVGETKTSPKFIEAIQEVKNGELNITSILHSRIQVHPFKPDNTPFKTPQGYTPRSTTPITLPVYFDIKSNNATTEPDEPSIDQPVKKVLCTCNRDITEAEFKLITKNKIAVTFLNALNEQFKKLN------MN--ICLEKAHFIAQTLHETASYTLLEEGLKPG---------VQ-EKDVYDGYKGRGLMQITYKKNYEAYGKAVGENFLGENKHRVAKEKKHAVGSAIWYWNHSKAGN-LSIY---AIKNDLIATTSLINGGYN-------GFDDRLQYYKKAVSAFNIKQCPNLEKKIINKLDDYTAFEDSYIYSKKAGESFGWGLWNDPKGGKHGKTANPVEAKKGYQRFLEMSKGVTFPFGYKLNKQKEKISRKRYGYSADSAKALAEKRVKEL 2CJL Chain:A ((2-204)) ----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------VVSEAQFDQM-FPSRNSF----YTYSGLTAALSAYPGFSNTGSDTVKKQEAAAFLANVGHETGGLVYVVEQNTANYPHYCDASQPYGCPAGNDKYYGRGPVQLSWNFNYKAAGDALGIDLL-NNPDLVQNDSAVAWKTGLWYWNTQTGPGTMTPHDAMVNGAGFGETIRSINGSLECDGGNPGQVQSRIDNYERFTQLLGVEPGGNLSC----------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 2CJL.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 : 869 28865 33.22 165.89 target 2D structure prediction score : 0.55 Monomeric hydrophicity matching model chain A : 0.60 3D Compatibility (PKB) : 33.22 2D Compatibility (Sec. Struct. Predict.) : 0.55 1D Compatibility (Hydrophobicity) : 0.60 QMean score : 0.357

(partial model without unconserved sides chains): PDB file : Tito_2CJL.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2CJL-query.scw PDB file : Tito_Scwrl_2CJL.pdb: