Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MALTEYKIKVVDANNQPLLNFPMATRYVGSDKKNNKLT-------SDTDGVLTFQSDGRAVEVFVLAPIDKNGQPDMTKFKEDNDNDNAYYRITTINVSRNVPSSIKSPYLLTDYGIAKTKFIFYENEQDKKIYSVPLTVKVSYLVGE--TKTSPKFIEAIQEVKNG--------------------ELNITS--------ILHSRIQVHPFKPDNTPFK-------TPQGYTPRSTTPI-TLPVYFDIKSNNATT--EPDEPSIDQPVKKVLCTCNRDITEAEFKLITKNKIAVTFLNALNEQFKKLNMNICLEKAHFIAQTLHETASYTLLEEGLKPGVQEKDVYDGYKGRGLMQITYKKNYEAYGKAVGENFLGENKHRVAKEKKHAVGSAIWYWNHSKAGNLSIYAIKNDLIATTSLINGGYNGFDDRLQYYKKAVSAFNIKQCPNLEKKIINKLDDYTAFEDSYIYSKKAGESFGWGLWNDPKGGKHGKTANPVEAKKGYQRFLEMSKGVTFPFGYKLNKQKEKISRKRYGYSADSAKALAEKRVKEL 4ES8 Chain:A ((19-320)) -----------------------------EELPDDLMNFKGTWEVSADGSSGRFFSKG-ATDSYVFHLIPAKDVKK-PGWREHNEVKDSYIKIDKQSIAARYKTSTTAPYSVAFKVNTKSLIKDHDYKITFEQGQIASGITVDYRIGSAFNKTTDDSFKISDESKYASNVKIEGEEQGFKQREQGDKTISFRTLKEGPMSLVLLSKVEKKPQGDLDVEFKNLKIIDVTNPSQLDKGVAYVGNKNVQLTLKSDDGRTNFEGDEISLFNSRGELLQTVT--VTKDQ-----QNPISITLS---EDQAKSLKNKEKL-KVSIKQKQSKKTSKDFFFEVGIDPKVEAK-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4ES8.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 : 1291 109029 84.45 427.56 target 2D structure prediction score : 0.42 Monomeric hydrophicity matching model chain A : 0.62 3D Compatibility (PKB) : 84.45 2D Compatibility (Sec. Struct. Predict.) : 0.42 1D Compatibility (Hydrophobicity) : 0.62 QMean score : 0.230

(partial model without unconserved sides chains): PDB file : Tito_4ES8.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4ES8-query.scw PDB file : Tito_Scwrl_4ES8.pdb: