Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MEPSLDMITDESLRTAAAIDFVCQHFSLG-ELVGIGDRLKGSYNINLKITTTNGEFVVRFISSSVS---EAHLQYVSKLLAKLENEGIPVPLPVQDEKGMSFVELDGKRVQVTPFVQGRSF-L--CREQQVHSSASMLRRFHHILGDEPPGPLPEW--S---FYHKSSDLRERLNRLREL----PTIPSKEHAEVSRVMNRVLHKY-DKDASLLPRTIIHGDWHFWNQKYIR--NEVSCVLDFDFVRNGTRLFDIAYSIWVIYLLLP---------NY-AS-TFDASFLDGYGK--L---SDIEIYLLPAAVSRISLFFLCQSIHSADPAVKWKHQYRKQMPFLDWMEKEGKSRIRSLASAVQA 4WH3 Chain:A ((6-301)) ----------------EVLFGIASHFALEGAVTGIEPYGDGHINTTYLVTTDGPRYILQQMNTSIFPDTVNLMRNVELVTSTLKAQGKETLDIVPTTSGATWAEIDGGAWRVYKFIEHTVSYNLVPNPDVFREAGSAFGDFQNFLSEFDASQLTETIAHFHDTPHRFEDFK---AALAADKLGRAAACQPEIDFYLSHADQYAVVMDGLRDGSIPLRVTHNDTKLNNILMDATTGKARAIIDLDTIMPGSMLFDFGDSIRFGASTALEDEKDLSKVHFSTELF--RAYTEGFVGELRGSITAREAELLPFSGNLLTM-----------------------------------------------

General information: TITO was launched using: RESULT: Template: 4WH3.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 : 1072 958 0.89 3.67 target 2D structure prediction score : 0.59 Monomeric hydrophicity matching model chain A : 0.65 3D Compatibility (PKB) : 0.89 2D Compatibility (Sec. Struct. Predict.) : 0.59 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.330

(partial model without unconserved sides chains): PDB file : Tito_4WH3.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4wh3-query.scw PDB file : Tito_Scwrl_4WH3.pdb: