Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTVYHFVGIKGTGMSPLAQILHDNGYTVQGSDIEKFIFTQTALEKRNITILPFSAENIKPGMTVIAGNAFPDTHPEIEKAMSEGIPVIRYHKFLGDYMKKFTSVAVTGAHGKTSTTGLLAHVIQNA-KPTSFLI---GDGTGQ---GNE------NSEYFVFEACEYRRH-----FLSYQPDYAIMTNIDFDHPDYFSSIDDVFDAFQEMALQVNK--GIIACGDDEHLPKIHAN--V-PVVYYGTGE-ENDFQARNIVKS-TEGTTFDVFVRNTFYDTFYIPAYGHHNVLNSLAVIALCHYEEIDSSIIKHALKSFGGVKRRFNEKQ-LGDQVLIDD-YAHHPTEIKVTIEAARQKYPDREIVAVFQPHTFTRTQQFLDEFAESLS-GADCVYLCDIFGSARENAGKLTIGDLQGKIHNAKLI--EEDDTSVL-KAHDKAVLIFMGAGDIQKYMRAYENVMA 4CVK Chain:A ((102-448)) ----------------------------------------------------------------------------------------------------GPLAAMTGSSGKTTVKEMLASILRTQAGDAESVLATRGNLNNDLGVPLTLLQLAPQHRSAVIELGASRIGEIAYTVELTRPHVAIITNA-------FGGPEKIVEAKGEILEGLAADGTAVLNLDDKAFDTWKARASGRPLLTFSLDRPQADFRAADLQRDARGCMGFRLQGV-AGEAQVQLNLLGRHNVANALAAAAAAHALGVPLDGIVAGLQALQPVKGRAVAQLTASGLRVIDDSYNANPASMLAAIDILSGF-SGRTVLVLGDMG----AEQAHREVGAYAAGKVSALYAVGPLM-AH-----AVQ-AFGA---TGRHFADQASLIGALATEDPTTTILIKGSRSAAM-DKVVA----

General information: TITO was launched using: RESULT: Template: 4CVK.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 : 1681 -34091 -20.28 -112.14 target 2D structure prediction score : 0.62 Monomeric hydrophicity matching model chain A : 0.64 3D Compatibility (PKB) : -20.28 2D Compatibility (Sec. Struct. Predict.) : 0.62 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.488

(partial model without unconserved sides chains): PDB file : Tito_4CVK.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4CVK-query.scw PDB file : Tito_Scwrl_4CVK.pdb: