Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSLHGKRKEIYKYEAPWTVYAMNWSVRPDKRFRLALGSFVEEYNNKVQLVGLDEESSEFICRNTFDHPYPTTKLMWIPDTKGVYPDLLATS-GDYLRVWRVGETETRLECLLNNNKNSDFCAPLTSFDWNEVDPYLLGTSSIDTTCTIWGLETGQVLGRVNLVSGHVKTQLIAHDKEVYDIAFSRAGGGRDMFASVGADGSVRMFDLRHLEHSTIIYEDPQHHPLLRLCWNK-QDPNYLATMAMDGMEVVILDVRVPCTPVARLNNHRACVNGIAWAPHSSCHICTAADDHQALIWDIQQMPRAIEDPILAYT-AEGEINNVQWASTQPDWIAICYNNCLEILRV 4J73 Chain:A ((12-300)) --------------RSDRVKGIDFH--PTEP-WVLTTLY----SGRVEIWNYETQ--VEV-RSIQVTETPVRAGKFIARKNW----IIVGSDDFRIRVFNYNTGEKVVD--FE-----AHPDYIRSIAVHP-TKPYVLSGSDDLTVKLWNWENNWALE----------QTFEGHEHFVMCVAFNPKD--PSTFASGCLDRTVKVWSLGQSTPNFTLT-TGQERGVNYVDYYPLPDKPYMITASDDL-TIKIWDYQTK-SCVATLEGHMSNVSFAVFHPTLP-IIISGSEDGTLKIWNSSTYKV-----EKTLNVGLERSWCIATH----NYIASGFDNGFTVLSL

General information: TITO was launched using: RESULT: Template: 4J73.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 : 1759 -75445 -42.89 -268.49 target 2D structure prediction score : 0.62 Monomeric hydrophicity matching model chain A : 0.67 3D Compatibility (PKB) : -42.89 2D Compatibility (Sec. Struct. Predict.) : 0.62 1D Compatibility (Hydrophobicity) : 0.67 QMean score : 0.393

(partial model without unconserved sides chains): PDB file : Tito_4J73.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4J73-query.scw PDB file : Tito_Scwrl_4J73.pdb: