Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence -------------------------MDITFNTGLMGSGKSKKLIDDYLIDPKEKVALSVSLTEDTFSRGKIESRDGRSLRSINLN----------RDQFKQNISLLEIIIFMTNTQTIY---IDESQFLPKETVEKFVSLSESYHVPIHFY--GLDLTFTG-ELFDSSSHLLTILPSENINRISRGCEASKCSKIAQYNARIVDGKVSRSGETFVEEK--SYYLALCSDHYYNDEKII------------------------------------------------------------------- 3VRH Chain:A ((1-309)) MKCKFCSREAYIKIHYPKMYLCEEHFKEYFERKVSRTIERYKLLT-----KDERILVAVSGGKDSAVTAYVLKKLGYNIECLHINLGISGYSEKSEEYAKKQCKLIGAPLHIVRIKEILGYGIGEVK--TRRPPCSYCGLTKRYIMNKFAYDNGFDAIATGHNLDDEASFLLNNILHWNTEYLAKGGPILPQQGKFIKKVKPLYEVTEREVVAYALAVGLEYIVEECPYTTLDMKGVLNELEEKRPGTKFNFVRGYLKKKKLFEPKECKICRMPSSGDICAFCKFWGLKKEINFKVSSTDEEPFG

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 : 875 -61191 -69.93 -325.48 target 2D structure prediction score : 0.39 Monomeric hydrophicity matching model chain A : 0.63 3D Compatibility (PKB) : -69.93 2D Compatibility (Sec. Struct. Predict.) : 0.39 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.107

(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: