Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MEHDIAALLHKAAPRSEIAEVLPRSGGQLATVFEVRRIAAAPLIIKLYSPEWA-WKQAKEIHVYDLLAPHLGTAIPQVVHAEPEGETHAFTVMTMLTGVPLCETTA---------PDYQVVYKQLGELLTAIHRIPQPAYGYLTDEVLEPLPSNDAYMRRQFAKKLQEFEEL-GGDRALHARLTEYVEQHSGLFASSSRPVLCHNDFHEGNVLVDPDTWQVQGIVDVENAIAADPLIDLAKTQYYSIKNDQAKLSGLLTGYGELPSDWVERTAVYRLYHALELWDWFRLIGVIDPLESIAADLVSLLGTSRVAGRPDAVR 5UXD Chain:A ((8-252)) --DALLDLAARHGLDLDGGTLRTEEIGLDFRVAFARAHDGGDWVLRLPRRPDVLERAAVEGRLLAMLAPHLDVAVPDWRIST-----SELIAYPLLPGSPGLTVAADGEVSWHVDMASTVYARSLGSVVAQLHAVDAEAAAATGIEV--RSPA---QVRGAWRQDLARVGAEFEIAPALRERWEAWLADD--G-CWPGHSVLTHGELYPAHTLVEDE--RITAVLDWTTAAVGDPAKDLMFHQV-SAP--SAIFEVALQAYAEGG-------------------------------------------------------

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 : 940 -37623 -40.02 -160.78 target 2D structure prediction score : 0.59 Monomeric hydrophicity matching model chain A : 0.66 3D Compatibility (PKB) : -40.02 2D Compatibility (Sec. Struct. Predict.) : 0.59 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.291

(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: