Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MQDSIEQYMQKVGQQARDASRVLTSASTSLKNHALSAIYTALENNQAAILAANQIDMEKGRSNQLDSALLDRLELTPARFKGMLQGLKDVIALVDP-IGEITDLAYRPTGIQIGKMRVPLGVVGMIYESR-P-NVTLEAASLAIKSGNAIILRGGSEALESNKAIAEAVKHGLKVAGLPEHSVQVIETSDRAAVGHLITMAEYVDVIVPRGGKSLIERVTNE------ARIPVIKHLDGNCHVFVEAQADLQKALPITLNAKTHR-YGVCNAMETLLVDEKIAEVFLPHIAELYAEKQVELRGCPE-----------------THRILGT-----------------TVKP-----ATEEDWYTEYLGPILAVKVVS--GIDEAIDHINKYGSHHTDAIVTENYTLARQFLARVDSSSVVVNASTRFAD--GFEYGLGAEIGISTDKIHARGPVGLEGLTSQKWIVLGDGQIRQ 3HAZ Chain:A ((545-987)) -ADATPDQAHAAVAAARAGFAGWSRTPAGIRAAALEQAAHLLESRSAHFIALLQREGGKTL----DDAL--------SELREAADFCRYYAAQGRKLFGSETAM-PGPTGESNALTMRGRGVFVAISPWNFPLAIFLGQVTAALMAGNSVVAKPAEQTPRIAREAVALLHEA----GIPKSALYLVTG-DGR-IGAALTAHPDIAGVVFTGSTEVARSINRALAAKDGPIVPLIAETGGINAMIADATALPEQVADDVVTSAFRSAGQRCSALRLLFVQEDVADRMIEMVAGAARELKI---GDPSDVATHVGPVIDVEAKQRLDAHIARMKTEARLHFAGPAPEGCFVAPHIFELTEAGQLTEEVFGPILHVVRYRPENLERVLRAIERTGYGLTLGVHSRIDDSIEAIIDRVQVGNIYVNRNMIGAVVGVQPFGGNGLSGTG---PKAGGPHYLARFATEQTVTINT-----

General information: TITO was launched using: RESULT: Template: 3HAZ.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 : 2140 -16443 -7.68 -42.16 target 2D structure prediction score : 0.60 Monomeric hydrophicity matching model chain A : 0.68 3D Compatibility (PKB) : -7.68 2D Compatibility (Sec. Struct. Predict.) : 0.60 1D Compatibility (Hydrophobicity) : 0.68 QMean score : 0.490

(partial model without unconserved sides chains): PDB file : Tito_3HAZ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3HAZ-query.scw PDB file : Tito_Scwrl_3HAZ.pdb: