Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSAPTEEMISVQKLVERLNAEYA--FEVDYIGADLGGFSSQNNQLTLKDKRRMVLKRCDQSQWD---P-RNVDIATILAHHSSLIYAPLATVGGSSTFKFDGWVYAVFPYVDGE-KLHQHSLDAETLKSAARALYAFHHIAHFAGSHAAQRPNVSDFEREVTSVLEPTLSLSTDHADIIIRSIEAKRHILHSFSSDLSSINVGASSVIHGDFHNENILYRSDHVVAILDFEMLHWGNVEDDIISFIALGCCNNGFSEENLRMANIFVKEYLSLHGENLDLHTALLRFIHLKSSSLFLQKMLIYTGNMLYAQIIERDNKLFPSIMKKHREISKTLSSL 4R78 Chain:A ((23-254)) -----------KIIKEKISSLLSQEEEVLSVEQL-GGMTNQNYLAKTTNK-QYIVKFFGKGTEKLINRQDEKYNLELLKDLGLDVKNYLFDI---------EAGIKVNEYIESAITLDSTS-IKTKFDKIAPILQTIHTSAKE-LRGEFAP---FEEIKKYESLIE-E-QIPYANY----ESVRNA---VFSLEKRLA-DLGVDRKSCHIDLVPENFIESPQGRLYLIDWEYSSMNDPMWDLAALFLESEFT-------SQEEETFLSHYESDQTP-------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4R78.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 : 927 8872 9.57 39.43 target 2D structure prediction score : 0.60 Monomeric hydrophicity matching model chain A : 0.60 3D Compatibility (PKB) : 9.57 2D Compatibility (Sec. Struct. Predict.) : 0.60 1D Compatibility (Hydrophobicity) : 0.60 QMean score : 0.225

(partial model without unconserved sides chains): PDB file : Tito_4R78.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4r78-query.scw PDB file : Tito_Scwrl_4R78.pdb: