Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRILFIGDVVGSP---------------GRDMVKEYVPKLKTKYKPHFTIINGENAAHGKGL----TEKIYHSLIQSGADAITMGNHTWDKKEIFDFIDDVPNLVRPANFPE-------G------TPGKGITYVKANGKELAVINLQGRTFLP---P-----LDDPFLKADELIAEAA-KRTPYIFIDFHAEATSEKLALGWYTDGRASAVVGTHTHVQTADNR------------IL---PKGTAYITDVGMTGPYDGILGMDRETIIKRFKTNLPVRFTVAEGKTTLSGVVIDIDDQTKKAVKIERILINDDHMFFE 2Z1A Chain:A ((30-289)) LTLVHTNDTHAHLEPVELTLSGEKTPVGGVARRVALFDRVWARAKNPLFLDAGDVFQGTLYFNQYRGLADRYFMHRLRYRAMALGNHEFDLGPG--PL---ADFLKGARFKVVSANVDASREPRLKGLFAPYAVVVVGGERVGIIGLTTPDTREISNPGPTVAFLDPYESAQKAVYELLAKGVNKIVVLSHLGYGEDL-KLARRL-VGVQVIVGGHSHTLLGSFPHKELSPAGPYPTVVKNPEGKDVLVVQAWEWGKVVGLLEVTFD-----------------------------------------------------

General information: TITO was launched using: RESULT: Template: 2Z1A.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 : 1164 -139893 -120.18 -685.75 target 2D structure prediction score : 0.75 Monomeric hydrophicity matching model chain A : 0.62 3D Compatibility (PKB) : -120.18 2D Compatibility (Sec. Struct. Predict.) : 0.75 1D Compatibility (Hydrophobicity) : 0.62 QMean score : 0.571

(partial model without unconserved sides chains): PDB file : Tito_2Z1A.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2Z1A-query.scw PDB file : Tito_Scwrl_2Z1A.pdb: