Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRRLLPIKKLLGSTAGFRLASTKSSGTERLERLVEEVNGIKSKLKVLEESKAANGLVDLYASRKMKRLDIKRILSIFNDR---AYHAPIFCHKALPIILAHFITGLDKLPSGLNAMPSILAVRATLLRSFQKLINCKIP--ATDDQVQHFRRVLEDIDEEHAERDLLQTMAFGILELKEYVSSHRRALVDLKKTSERWASIPMTEENVLTYAEIQDIQAPLDSVNRCMITYNFISRM-FLNHDPDMTMGSNPRR---IGMVDLEMNLEHVVRNAVDEAKQICTDHYGDCPDTEFEF---TSDSKAFRFPYMSTTIRYIILELMKNAFRATVDSHMKRNDVGMVTCADMPPVRVLINLQEGTEHACICISDEGMGMTDEALAMAMAYSYTSVSKPALQLGDSGEGCASTAPSPLAGYGYGLPMSRVYAQSLGGDLFLQTMEGYGTRAYYYIKIADAQPLCDEETK 3D2R Chain:B ((3-361)) ----------------------------------------------------VPREVEHFSRYSPSPLSMKQLLD-FGSENACERTSFAFLRQELPVRLANILKEIDILPTQLVNTSSVQLVKSWYIQSLMDLVEFHEKSPDDQKALSDFVDTLIKVRNRHHN--VVPTMAQGIIEYK-ACTVD--------------------------PVTNQNLQYFLDRFYMNRIS----TRMLMNQHILIFSDS-QTGNPSHIGSIDPNCDVVAVVQDAFECSRMLCDQYYLSSPELKLTQVNGKFPDQPIHIVYVPSHLHHMLFELFKNAMRATVEHQEN--------QPSLTPIEVIVV--LGKEDLTIKISDRGGGVPLRIIDRLFSYTYSTAPTP-----------------PLAGFGYGLPISRLYAKYFQGDLNLYSLSGYGTDAIIYLKALSSES-------

General information: TITO was launched using: RESULT: Template: 3D2R.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 : 1541 -40786 -26.47 -123.22 target 2D structure prediction score : 0.70 Monomeric hydrophicity matching model chain B : 0.71 3D Compatibility (PKB) : -26.47 2D Compatibility (Sec. Struct. Predict.) : 0.70 1D Compatibility (Hydrophobicity) : 0.71 QMean score : 0.517

(partial model without unconserved sides chains): PDB file : Tito_3D2R.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3D2R-query.scw PDB file : Tito_Scwrl_3D2R.pdb: