Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MFMFEKPHGMRDTLPGLYETKKKVRRSLTDLIDKWGYQFMETPTLEFYDTV-GVQSAIEEQQLFKLLDQDGKTLVLRPDMTGPIARVAASKLLKHGHPLRVGYAANVFRAQEREGGRPAEFEQVGVELIGD-GTTSADAEVIALVVGALKNAGLASFKIAIGHAGIADALFVEVLGNVERADVLRRFL---YEKNYVGYREHVKSLPLSSIDKSRLLELLELRGG-IEVCGRAEEIVD---SAQGKSVVD-----ELKALW-------DILEDYGCTENV-RLDLNMVSHMSYYTGILFEVYAENVGFVIGSGGRYNKLLGHFDSPAPATGFGLRIDRLIEALHMKDEPCEIDAVIFSKEQRAQAIAYANEERMKGNKVVLQDLSGIENIDQMTKSFANVTYFIGARKEEQNG 3RAC Chain:A ((24-368)) ----DRPPGMQDGYPDFAKRRRAVETRLLSFVEDAGYEPVTSGLFEYVDTLLRARSPESSRDWIRLFDGGGDAVALRPEMTPSIARMAAPRVAAGRTPIRWCYCERVYRRT------AAESTQVGIERIGEEASVDVDMDVLRLLHEASAAAGVRHHRIVVSHARLVPRL-LDALGIS--ASLSRAFLACLTSGNYVQFRELWQLHAAKDVDL--LANLLTWSPAERDAAKRSREASDRELEALLRDAVDPRAAADVRDAWRYLCRLAEALHDSGLASDVVTFDLALHRELDYYTGLVFEMFAPGVGAPIAQGGRYDELLAQFGAGAPAVGFAFEVERVMAVLEAQEE-----------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 3RAC.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 : 1394 -4773 -3.42 -15.35 target 2D structure prediction score : 0.51 Monomeric hydrophicity matching model chain A : 0.75 3D Compatibility (PKB) : -3.42 2D Compatibility (Sec. Struct. Predict.) : 0.51 1D Compatibility (Hydrophobicity) : 0.75 QMean score : 0.418

(partial model without unconserved sides chains): PDB file : Tito_3RAC.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3RAC-query.scw PDB file : Tito_Scwrl_3RAC.pdb: