Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTLSCIQQPHQHLQANLEGGVLTLAINRPEAKNALYGELYLWIAKALDEADQNKDVRAVVLRGAEHDFTAGNDMKDFMGFVQNPNAGPAGQVPPFVLLKSAARLSKPLIIAVKGVAIGIGVTILLQADLVFADNTALFQIPFVSLGLSPEGGASQLLVKQAGYHKATELLFTAKKFNAEAAVQAGLVNEIVE------DAYATAQHLTALPLASLKQTKALMKHDLD-QIIECIDHETEIFMQRVQSPEMLEAVQAFMQKRKPDFSQFNGFVAQTF 2QQ3 Chain:K ((3-257)) --------EFVSIAARQEGAVGIIELARPDVLNALSRQMVAEIVAAVEAFDRNEKVRVIVLTGRGRAFAAGADIQEMAKDDPI-R---LEWLNQFADWDRLSIVKTPMIAAVNGLALGGGFELALSCDLIVASSAAEFGFPEVNLGVMPGAGGTQRLTKLIGPKRALEWLWTGARMSAKEAEQLGIVNRVVSPELLMEETMRLAGRLAEQPPLALRLIKEAVQKAVDYPLYEGMQFERKNFYLLFASEDQKEGMAAFLEKRKPRFQG---------

General information: TITO was launched using: RESULT: Template: 2QQ3.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain K - contact count / total energy / energy per contact / energy per residue : 1217 -114921 -94.43 -463.39 target 2D structure prediction score : 0.63 Monomeric hydrophicity matching model chain K : 0.73 3D Compatibility (PKB) : -94.43 2D Compatibility (Sec. Struct. Predict.) : 0.63 1D Compatibility (Hydrophobicity) : 0.73 QMean score : 0.536

(partial model without unconserved sides chains): PDB file : Tito_2QQ3.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2QQ3-query.scw PDB file : Tito_Scwrl_2QQ3.pdb: