Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKTLEPWLHRYWNI-GPARMQALASGHTNKTYLVECD-AGRAVLRVSWSGKPVGQVDREAAILGHLGETRAAPMLPALPRLRPTVDAQSGVRLPDGSWLHLFEHIDGSP-GLP-------------PEAETGAIDAMRALAHLHAALAAIP-VTE-S-----APLAWLSARHARVAARAAPPLPGNLSDRYGTMIRRIGAHLDAAARWLTGTVHWLHGDYHAGNLLYVGGAVNGVLDFDDVGQGAQWLEAAFALFALSRDAGRDDRFVFDARRWDAGLQAYAATRPDAVPDWMHDHRDALMALFCADQTLIHLEAAQRGLWVPGPGIGFLGGWRQLLDGAAP 5UXD Chain:A ((9-253)) --ALLDLAARHGLDLDGGTLRTEEIGLDFRVAFARAHDGGDWVLRLPRRPDVLERAAVEGRLLAMLAPH---LDVA-VPDWRIST-----------SELIAYPLLPGSPGLTVAADGEVSWHVDMASTVYARSL--GSVVAQLHAVDAEAAAATGIEVRSPAQVRGAWRQDLARVGA----E-FEIAPALRERWEAW----LADDG-CWPGHSVLTHGELYPAHTLVEDERITAVLDWTTAAVGDPAKDLMFHQVSA------------PSAIFEVALQAYAEGGG--------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 5UXD.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 : 870 -25833 -29.69 -116.36 target 2D structure prediction score : 0.68 Monomeric hydrophicity matching model chain A : 0.62 3D Compatibility (PKB) : -29.69 2D Compatibility (Sec. Struct. Predict.) : 0.68 1D Compatibility (Hydrophobicity) : 0.62 QMean score : 0.263

(partial model without unconserved sides chains): PDB file : Tito_5UXD.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5uxd-query.scw PDB file : Tito_Scwrl_5UXD.pdb: