Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MELNLKEDWSKKMKTALNRTPASFPVRRMDYNFEDTPRYWCNHEPSLTHYFTGLSTLFPEGESYFVRSVRALRAKAKENEILDREIGAFIGQEAM---HSKEHHA-FHVSAQQ-YGLNPESLE------KATGIVLKAIEKVFSKKWNLLVTVGLEHYTAVLV---VSMMQSVNELMTENTIRNLWLWHSV-EETEHKAVAYDLYQHLYGNGLDAYIPRVGIFTFSLVLITAFSTIYHIVLMKRDKQLTNFKTWRNFFKFASKQYKVLIPKFLEYYRFDFHPNQTDEKALVAATKVKLGINDRSLLLS 3B5P Chain:A ((71-199)) ------------------------------------------------------------------------------WNGVAQELQENIDEEMGSTTGGISHYTLLADGLEEGLGVAVKNTMPSVATSKLLRTVLS-LFD-RQVDYVLGATYAIEATSIPELTLIVKLVEWLHEGAIPKDLQYFFSKHLDEW-IEHEAGLRTSVAAYI---------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 3B5P.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 : 244 -5368 -22.00 -47.50 target 2D structure prediction score : 0.55 Monomeric hydrophicity matching model chain A : 0.55 3D Compatibility (PKB) : -22.00 2D Compatibility (Sec. Struct. Predict.) : 0.55 1D Compatibility (Hydrophobicity) : 0.55 QMean score : 0.191

(partial model without unconserved sides chains): PDB file : Tito_3B5P.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3B5P-query.scw PDB file : Tito_Scwrl_3B5P.pdb: