Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence -----MPGTPMTVI--PTIDIVDALAAEYAAKSPREILELA--LSQQGEIAISFSG-AEDVVLIDMASRLGKPFRVFSLDTGR--LHPETYQFFETVRKHYNINIEICFPDAEAVQSMVNEKGLFSFFKDGHQECCGIRKVQPLRKKLAT--LDGWITGQRKDQSPGTRTEIPVVQADAGFS-------GPGKQLIKYNPLANWSSADVWSYIRMMEIPY--------NPLHERGFVSIGCEPCTRPVLPNQHEREGRWWWEEATQKECGLHAGNLKK------------------------- 3VRH Chain:A ((1-309)) MKCKFCSREAYIKIHYPKMYLCEEHFKEYFERKVSRTIERYKLLTKDERILVAVSGGKDSAVTAYVLKKLGYNIECLHINLGISGYSEKSEEYAKKQCKLIGAPLHIVRIKEILGYGIGEVKT-----RRPPCSYCGLTKRYIMNKFAYDNGFDAIATGHNLDDEASFLLNNILHWNTEYLAKGGPILPQQGKFIKKVKPLYEVTEREVVAYALAVGLEYIVEECPYTTLDMKGVLNELEEKRPGTKFNFVRGYLKKKKLFEPKECKICRMPSSGDICAFCKFWGLKKEINFKVSSTDEEPFG

General information: TITO was launched using: RESULT: Template: 3VRH.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 : 1193 28206 23.64 115.60 target 2D structure prediction score : 0.56 Monomeric hydrophicity matching model chain A : 0.63 3D Compatibility (PKB) : 23.64 2D Compatibility (Sec. Struct. Predict.) : 0.56 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.302

(partial model without unconserved sides chains): PDB file : Tito_3VRH.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3VRH-query.scw PDB file : Tito_Scwrl_3VRH.pdb: