Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MAIQLKLRKKELILNSRILLSSPHMGGTEEKYVAKAFKDNWIAPLGENVDKFEESITKYTGSKGGASALSSGTAAIHLALRLLNVGKNDIVFAPSFTFIATVNPILYQGAVPVFIDSEPNTWNMSPVALESALEEAERNNQLPKAIIVVNLYGQMADYERILAIANQFNVPVIEDAAESLGSTYKGISSGLFGTIGIYSFNGNKIITT-SGGGALVSSDKKYVEHSRFLATQARDQAPYYQHSEIGYNYRLSNISAGIGRGQMEVLNDRVAKRREIFNRYKEAFSGIDRIEMMPEVDGMVPNRWLSTLTINDYNSIDQVVNVINKLNEKNIETRALWK-PLHLQPVFQGVKMYYHDNNLSVSEKLFNSGLCLPSGSNMTDSEQEFVIDEFKKIFK 5U23 Chain:D ((40-381)) -----------------------------ITKFKEILESGWY-ILGKQCEKFENNFAKYCGVKHCI-GVANGLDALRLIIKAYDFKENDEIIVPANTYIASILAITDNKCKPILIEPDINTYNINPDLIEEKIT------KKTKAIMVVHLYGQVCDMEKIQLLANKYNLKIIEDCAQAHGAIYKDKRVGNLGDAAGFSFYPGKNLGALGDAGCICTNDDNFASKIRALANYGSHKK--YENLYTGLNSRLDEIQAAFLDIKLKYLDEDNNKRKNIANFYLQNIKNEN-IILPS--NKFDHVWHLFVVKTK------LRDELQHYLNNHDIQTIIHYPIPPHKQKCYKDLN----HLKLPITENIHQEVLSLPISPTMKENDFKKVADILNKWK-

General information: TITO was launched using: RESULT: Template: 5U23.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain D - contact count / total energy / energy per contact / energy per residue : 1977 -98386 -49.77 -289.37 target 2D structure prediction score : 0.65 Monomeric hydrophicity matching model chain D : 0.73 3D Compatibility (PKB) : -49.77 2D Compatibility (Sec. Struct. Predict.) : 0.65 1D Compatibility (Hydrophobicity) : 0.73 QMean score : 0.569

(partial model without unconserved sides chains): PDB file : Tito_5U23.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5U23-query.scw PDB file : Tito_Scwrl_5U23.pdb: