Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSDCIFCKIIAGEIPASKVYEDEQVLAFLDISQVTLGHTLVVPKEHYRNLLEMDATSASQLFAQVPKVAQKVMKVTKAA--GMNIISNCEEVAGQTVFHTHVHLVPRYSADDDLKIDFIAHEPDFDKLAQVAETIKNA 3N1T Chain:B ((4-105)) --ETIFSKIIRREIPSDIVYQDDLVTAFRDISPQAPTHILIIPNILIPTVNDVSAEH-EQALGRMITVAAKIAEQEGIAEDGYRLIMNTNRHGGQEVYHIAMHLL---------------------------------

General information: TITO was launched using: RESULT: Template: 3N1T.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 381 -69193 -181.61 -691.93 target 2D structure prediction score : 0.47 Monomeric hydrophicity matching model chain B : 0.73 3D Compatibility (PKB) : -181.61 2D Compatibility (Sec. Struct. Predict.) : 0.47 1D Compatibility (Hydrophobicity) : 0.73 QMean score : 0.466

(partial model without unconserved sides chains): PDB file : Tito_3N1T.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3N1T-query.scw PDB file : Tito_Scwrl_3N1T.pdb: