Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence --------------------------------------------------------MKNLQNKLK-----HLEKDNHMSLSDEEQFDSLKSFAKKYGSAMISGILIALIAFFGWEYWQKRNLATSQTETAKVQQLMDEANATADNPNALASITASADKIVKD-DIDSVQAIQTQFVLAKLAYEKQDYAAAEKALKKVEN--SKVKDEGLIQVVKLRLADAQLAQNKYDEALKTLSGDVDPAFKATVEELRGDIFVAKKDID---SAKKAYQAAWDSLL-ERKQERQILQIKLESVGVLVEDPQIERPILETQVEES--------------------------------------------------- 3Q15 Chain:A ((6-378)) AIPSSRVGVKINEWYKMIRQFSVPDAEILKAEVEQDIQQMEEDQDLLIYYSLMCFRHQLMLDYLEPTVTELLETIETPQKKLTGLLKYYSLFFRGMYEFDQKEYVEAIGYYREAEKELPFV--SDDIEKAEFHFKVAEAYYHMKQTHVSMYHILQALDIYQNHPLYSIRTIQSLFVIAGNYDDFKHYDKALPHLEAALELAMDIQNDRFIAISLLNIANSYDRSGDDQMAVEHFQKAAKVSREKVPDLLPKVLFGLSWTLCKAGQTQKAFQFIEEGLDHITARSHKFYKELFLFLQAVYKETVDERKIHDLLSYFEKKNLHAYIEACARSAAAVFESSCHFEQAAAFYRKVLKAQEDILKGECLYAY

General information: TITO was launched using: RESULT: Template: 3Q15.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 : 1045 41986 40.18 170.67 target 2D structure prediction score : 0.63 Monomeric hydrophicity matching model chain A : 0.59 3D Compatibility (PKB) : 40.18 2D Compatibility (Sec. Struct. Predict.) : 0.63 1D Compatibility (Hydrophobicity) : 0.59 QMean score : 0.345

(partial model without unconserved sides chains): PDB file : Tito_3Q15.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3Q15-query.scw PDB file : Tito_Scwrl_3Q15.pdb: