Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKKVRKSFVLLLTGLLAVLILSACGQKTQQDIVAGLDEKAKEYTSYKAKAKMTIETGSEPQVYNVEIWHKKPSLYRVYLENPKKDQNQVILRNENGVFVLTPSLNKSFRFQSDWPNNSSQVYLFESLVKDVQNDSDAVFTAKEKKYVFETKTNYQHNKMLPTQEITFNKKDMSPSSVKVMDTDRKVMVKVEFSSFEFNKQFDKESFDEKKNMTLSQMDVATSAKPSDTFAVKTPLELPLGVKLLEEKDISTEDGKRIIMTYGGEKSFTLIQEKAQIAKASSSVTLNGEPVNLGYTIGALSDASLSWTYDGVDYLLSSKDLSKEEMVTVAKSMQGQSSK 1IWL Chain:A ((1-177)) ------------------------------DAASDLKSRLDKVSSFHASFTQKVTD---VQEGQGDLWVKRPNLFNWHMTQPD---ESILVSDGKTLWFYNPFVEQATATWLKDATGNTPFMLIARNQSSDWQQYNIKQN--GDDFVL--TPKASN-GNLKQFTINVGRD-GTIHQFSAVEQDDQ-RSSYQLKSQQ-NGAVDAAKFTFTPPQGVTV--------------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 1IWL.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 : 879 -27059 -30.78 -157.32 target 2D structure prediction score : 0.73 Monomeric hydrophicity matching model chain A : 0.60 3D Compatibility (PKB) : -30.78 2D Compatibility (Sec. Struct. Predict.) : 0.73 1D Compatibility (Hydrophobicity) : 0.60 QMean score : 0.394

(partial model without unconserved sides chains): PDB file : Tito_1IWL.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1IWL-query.scw PDB file : Tito_Scwrl_1IWL.pdb: