Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MMKLLSFLKNKALGSSIDYKILPRKVKFDWKDTPIDWIPNQPFASYFINEINNILPAGEFWFC-RLYNKVLPR----ITDEKLKQDVQAFIRQEAMHANAHTSANKEYLSARNIDIQRNLD-I-----MNYLFTTALADKPFDKEVPQFLQEQWDLFRLGVIATVEHMTCVLGKYALYNKRWEELGADPEMVDLVKWHGSEEIEHRTVAFDLYRHLGGGYIPRYYLSLAVIVLVLGLWVDGAAHIMKQDPRFADAAKSRFFAAWVALEWYKISRKDNQVLPNPIWLIAQQIDYLMPWYDPVKEGSTEDAVSYLSQSPAAKRAELQAA 3CHH Chain:B ((90-250)) -----------------------------------------------WIGYNERVIATEQLIAEPAFDLVMHGVFPGSDDPLIRKSVQQAIVDESFHTYMHMLAIDRTRELR----KISERPPQPELVTYRRLRRVLAD-MPEQWE-------RDIAVLVWGAVAETCINALLALLARD----A-TIQPMHSLITTLHLRDETAHGSIVVEVVRELY--------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 3CHH.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 : 448 -27503 -61.39 -193.68 target 2D structure prediction score : 0.68 Monomeric hydrophicity matching model chain B : 0.55 3D Compatibility (PKB) : -61.39 2D Compatibility (Sec. Struct. Predict.) : 0.68 1D Compatibility (Hydrophobicity) : 0.55 QMean score : 0.339

(partial model without unconserved sides chains): PDB file : Tito_3CHH.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3CHH-query.scw PDB file : Tito_Scwrl_3CHH.pdb: