Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MDVRKSLQTILLKEAISMKERERILDLVKKGILSTEEGLDLLESMATEKDEKQIKKEADKVTASHKEKDQASQLIDKLENGEEEISEPVDPKERERQDQENLEKILDELATEANKTSARLDEVNAQFADNKAARNEKQEALMQLNTKEELGELTEEELAQRQTLEAEIKELEASGDTLLEEQLKLEAELKDIRKNQWSEKKETFTDKFELPDDWKDQATDTLNQVGEKMSEAGSQLGKFLKKTFQTVSETVNDNMEWKDVSLRVPGIATTKFEHEFYYEAPAASILDIKAANGNVTLKTWDSNDVKVEAKIKLYGKMGAEPFEAFSERSQIEVNEDHISFQIPNK----RVRADLVFYLPKRVYDHAAIKLLNGNIMIE-TLEAKDIYTKS-TNGNIIVDQLTATMLEVEG-VNGNIDIRNGNILDSIIE-TVNGTVTFGATAENLSVSLV-NGDVRLTIKEDNLKKVEASSVNGNVKVALPDGIGLEGHAKTSLGSINSRLSNYEVVREKKERTNQMLQFRRVSDGEIAQVQLSTTTGSIYLKDTDK 4YGU Chain:D ((10-180)) -------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------RKVDAFSSIEITS-VGTIHFTQSDTYSFRIEGREK------------YVKNTETTVKDGRLLIGFKDKKNKSKDGVTIWISAPD--LKEVEF-TGVGEFNCEKPLKLDEVSFEVKGVGEVNVADLTCNVLKVALRGVGSADI-HVVCDYLSAQMGGVGSVTLSGSAGRADISKGGIGGVNTDNL---------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4YGU.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain D - contact count / total energy / energy per contact / energy per residue : 887 -12799 -14.43 -81.01 target 2D structure prediction score : 0.52 Monomeric hydrophicity matching model chain D : 0.65 3D Compatibility (PKB) : -14.43 2D Compatibility (Sec. Struct. Predict.) : 0.52 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.420

(partial model without unconserved sides chains): PDB file : Tito_4YGU.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4YGU-query.scw PDB file : Tito_Scwrl_4YGU.pdb: