Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence ------------------------------MGSMDQSIAVKSPLTYA-----EALANTIM-NTYTVEELPPANRWHYHQGVFLCGVLRLWEATGEKRYFEYAKAYADLLIDDNGNLLFRRDE----------------LDAIQAGLIL-FPLYEQTKDERYVKAAKR-LRSLYGTLNRTSEGGFWHKDGYPYQMWLDG-L-YMGGPFA-LKYANLKQETELFDQVVLQESLMRKH-TKDAKTGLFYHAWDEAKKMPWANEETGCSPEFWARSIGWYVMSLADMIEELPKKHPNRHVW-KNTLQDMIKSICRYQDKETGLWYQIVDKGDRSDNWLESSGSCLYMYAIAKGINKGYL-DRAYETTLLKAYQGLIQHKTETSEDGAFLVKDICVGTS-AGFYDYYVSRERSTNDLHGAGAFILAMTE-LEPLFRSAGK------------------------ 3K11 Chain:A ((6-444)) INDSNTPLHLLQPAYQGTYGDLTPEQVKKDIDRVFAYIDKETPARVVDKNTGKVITDYTAMGDEAQLERGAFRLASYEWGVTYSALIAAAETTGDKRYTDYVQNRFRFLAEVAPHFKRVYEEKGKTDSQLLQILTPHALDDAGAVCTAMIKLRLKDESLPVDGLIQNYFDFIINKEYRLADGTFARNRPQRNTLWLDDMFMGIPAVAQMSRYD-KEAKNKYLAEAVKQFLQFADRMF-IPEKGLYRHGWV--------ESSTDHPAFCWARANGWALLTACELLDVLPEDYPQRPKVMD-YFRAHVRGVTALQS-GEGFWHQLLDC---NDSYLETSATAIYVYCLAHAINKGWIDAIAYGPVAQLGWHAVAG---KINEEGQ--VEGTCVGTGMAFDPAFYYYRPVNVYAAHGYGPVLWAGAEMIRLLNTQHPQMNDSAVQYYQEKQKTTAPIFAVDS

General information: TITO was launched using: RESULT: Template: 3K11.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 : 1671 11600 6.94 32.86 target 2D structure prediction score : 0.56 Monomeric hydrophicity matching model chain A : 0.69 3D Compatibility (PKB) : 6.94 2D Compatibility (Sec. Struct. Predict.) : 0.56 1D Compatibility (Hydrophobicity) : 0.69 QMean score : 0.428

(partial model without unconserved sides chains): PDB file : Tito_3K11.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3K11-query.scw PDB file : Tito_Scwrl_3K11.pdb: