Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MQIFYDKDCDLSIIQSKKVAIIGYGSQGHAHALNLKDS------GVDVTVGLRAGSASWKKAENAGLK-----VAEVPAAVKQADLVMILTPDEFQSQLYRDVIEPNIKEGATLAFAHGFSVLYNQVVP---RKDLDVIMVAPKAPGHTVRSEFQRG-----SGVPDLIAIHQDASGNARNVALSYASGVGGGRTGIIETSFREETETDLFGEQAVLCGGAVELVKMGFETLVEAGYAPEMAYFECLHELKLIVDLMFEGGIADMNYSVSNNAEYGEYVTGPEVINEQSREAMRNALKRIQSGEYAKMFIQEGALNYPSMTARRRQNAAHGIEQTGAKLRAMMPWIQANKIVDKEKN 3FR8 Chain:A ((55-278)) ----------------KQIGVIGWGSQGPAQAQNLRDSLAEAKSDIVVKIGLRKGSKSFDEARAAGFTEESGTLGDIWETVSGSDLVLLLISDAAQADNYEKIFS-HMKPNSILGLSHGFLLGHLQSAGLDFPKNISVIAVCPKGMGPSVRRLYVQGKEINGAGINSSFAVHQDVDGRATDVALGWSVALGSPFT--FATTLEQEYKSDIFGERGILLGAVHGIVEALFRRYTEQGMDEEMAY------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 3FR8.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 : 1056 10970 10.39 53.51 target 2D structure prediction score : 0.57 Monomeric hydrophicity matching model chain A : 0.71 3D Compatibility (PKB) : 10.39 2D Compatibility (Sec. Struct. Predict.) : 0.57 1D Compatibility (Hydrophobicity) : 0.71 QMean score : 0.400

(partial model without unconserved sides chains): PDB file : Tito_3FR8.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3FR8-query.scw PDB file : Tito_Scwrl_3FR8.pdb: