Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MMMKYEAVIIGGGPVGFMLASELAIAGVGTCVIERLEKPVPHSKALTLHPRTLELLEMRGILERFVSKGSKIPTG-HFSMLDTR-LDFSGLDTSCPYTLLLPQSKTEKLLEDHARSLGTEVFRGAEALAVTQNGEAVQTIFKDRDGSVRTITSKFAVGADGAGSTVRKQAKIEFPGTDSTVTAALGDVVL--------LSPPPSGVLSLC-TKEGGVMIVPLSPDRYRVVVISPYRTQTPKDVPVTEEELKADLLRICGTDFGLTDP-SWMSRFGNAARQAKRYRDGRIFLAGDAAHIHFPAGGQGLNVGLQDAMNLGWKLAAAIKGSAPSWLLDSYHDERHPAAEGLLRNTEAQTKLI-DFTQAGLHLRSMMSELLAFPDVNRYVAGQISALDVRY-------EADRTMPPNRLNGARLPDMKLILSDGNSE--RLYSFLQNGTFVLLSLRQEADDHIEVKGLRTVTASLAEPNEKLRNVHTILIRPDGHVAWAVDASAPDCSEVIQKGISRWFSVTSRV 4K5R Chain:A ((28-508)) ----------------LMLAGELRAGGVGALVLEKLVEPVGHDRAGALHIRTVETLDLRGLLDRFL-EGTQVAKGLPFAGIFTQGLDFGLVDTRHPYTALVPQSRTEALLAEHAREAGAEIRRGHEVTGLRQDAEAVEVTVAGPSGPYR-VRARYAVGCDGGRSTVRRLAGIGFPGTEATVRALIGYVTTPEREVPRRWERTPDGILVLAFPPEGGLG---------RVVVIE-Y------EGPVTLEDLGAAVARVRGTPLTLTEPVSWLSRFGDASRQAKRYRSGRVLLAGDAAHVHFPIGGQGLNTGLQDAVNLGWKLAARVRGWGSEELLDTYHDERHPVAERVLLNTRAQLALMRPDEQHTTPLRGFVEELLGTDEVNRYFTGMITGTDVRYATFAPAA--RPHPWAGRFAGG------LVLSGPSGEPVPVAELLRSARPLLLDLAGRADLREATRPWSDRVSVVAGEATVEPPAQALLVRPDGYVAWAGSPAA--TADELRASLARWF------

General information: TITO was launched using: RESULT: Template: 4K5R.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 : 2482 -237144 -95.55 -528.16 target 2D structure prediction score : 0.49 Monomeric hydrophicity matching model chain A : 0.80 3D Compatibility (PKB) : -95.55 2D Compatibility (Sec. Struct. Predict.) : 0.49 1D Compatibility (Hydrophobicity) : 0.80 QMean score : 0.494

(partial model without unconserved sides chains): PDB file : Tito_4K5R.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4K5R-query.scw PDB file : Tito_Scwrl_4K5R.pdb: