Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRRLLPIKKLLGSTAGFRLASTKSSGTERLERLVEEVNGIKSKLKVLEESKAANGLVDLYASRKMKRLDIKRILSIFNDR-AYHAPIFCHKALPIILAHFITGLDKLPSGLNAMPSILAVRATLLRSFQKLINCKIP--ATDDQVQHFRRVLEDIDEEHAERDLLQTMAFGILELKEYVSSHRRALVDLKKTSERWASIPMTEENVLTYAEIQDIQAPLDSVNRCMITYNFISRMFL-NHDPDMTMGSNPRR---IGMVDLEMNLEHVVRNAVDEAKQICTDHYGDCPDTEF---EFTSDSKAFRFPYMSTTIRYIILELMKNAFRATVDSHMKRNDVGMVTCADMPPVRVLINLQEGTEHACICISDEGMGMTDEALAMAMAYSYTSVSKPALQLGDSGEGCASTAPSPLAGYGYGLPMSRVYAQSLGGDLFLQTMEGYGTRAYYYIKIADAQPLCDEETK 2E0A Chain:B ((4-353)) -----------------------------------------------------PREVEHFSRYSPSPLSMKQLLD-FGS-CERTSFAFLRQELPVRLANILKEIDILPTQLVNTSSVQLVKSWYIQSLMDLVEFHEKSPDDQKALSDFVDTLIKVRNRHHN--VVPTMAQGIIEYKDACTVD--------------------------PVTNQNLQYFLDRFYMNRIS----TRMLMNQHILIFSDS-QTGNPSHIGSIDPNCDVVAVVQDAFECSRMLCDQYYLSSPELKLTQVNGKFPDQPIHIVYVPSHLHHMLFELFKNAMRATVEHQEN--------QPSLTPIEVIVV--LGKEDLTIKISDRGGGVPLRIIDRLFSYTYSTAP--------------------LAGFGYGLPISRLYAKYFQGDLNLYSLSGYGTDAIIYLKALSSE--------

General information: TITO was launched using: RESULT: Template: 2E0A.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 1501 -55790 -37.17 -171.13 target 2D structure prediction score : 0.71 Monomeric hydrophicity matching model chain B : 0.71 3D Compatibility (PKB) : -37.17 2D Compatibility (Sec. Struct. Predict.) : 0.71 1D Compatibility (Hydrophobicity) : 0.71 QMean score : 0.521

(partial model without unconserved sides chains): PDB file : Tito_2E0A.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2E0A-query.scw PDB file : Tito_Scwrl_2E0A.pdb: