Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKEAEVLKYEAFTSSPGKGNPAGVVLQGDDYTEDEMQIIAERAGYSETSFIRKSES-ADLELRYFTPGHEMNLCGHATVASLYALCEKGMLESGKTYSIQTKAGILPVKISEKDGR-IHITLEQASPQFKPFTGDRKKLADALGITDEDFHEDLPIVFGSTGIWTAIVPLKSLEASKKMVPDNKQFPEVLVDLPKASVHPFTFETVHPDSDLHGRHFSSPYSGTIEDPVTGTASGVMGAYMKHYGNAEQHKFI-IEQGQEIGKDGKVEIEMNEAGGHVKVNMTGTAVYSETRILKI 1U1V Chain:A ((28-264)) ---------DAFASVPLEGNPVAVFFDADDLPPAQMQRIAREMNLSESTFVLKPRNGGDALIRIFTPVNELPFAGHPLLGTAIAL---GAHTDNHRLYLETQMGTIAFELERQNGSVIAASMDQPIPTWTAL-GRDAELLKALGISDSTF----PIEIYHNGPRHVFVGLPSIDALSALHPDHR----ALSNFHDMAINCFAGA----GRRWRSRMFSPAY-GVVEDAATGSAAGPLAIHLARHGQIEFGQPVEILQGVEIGR---------------------------------

General information: TITO was launched using: RESULT: Template: 1U1V.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 : 1266 -104546 -82.58 -446.78 target 2D structure prediction score : 0.70 Monomeric hydrophicity matching model chain A : 0.76 3D Compatibility (PKB) : -82.58 2D Compatibility (Sec. Struct. Predict.) : 0.70 1D Compatibility (Hydrophobicity) : 0.76 QMean score : 0.480

(partial model without unconserved sides chains): PDB file : Tito_1U1V.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1U1V-query.scw PDB file : Tito_Scwrl_1U1V.pdb: