Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MLNSEFQPNWLYPPSEVIKNFIQLNNIDTSAFDVSTKKIIDDLVNQNTKIDLYTSEVLKEAIGGTTQFWLNIQNQFTINSLRIQNSSVDNNFSEYRNLVNELKKLHWTPESKYDYLDQINLKSFFGISEFSLLTKKYIVQHNLRVKFKNIGQYNSSELNVATLIRKAELEAKKQPILSPWNKLLFIEKLQEIKKLSKVKGFKNFRNELLSICNQC-GVAFIVLDTLNKSPIRGISKFLDSNIGLIIVTTKYNKDDVFWQTFFHEAGHLVLHSKEMVFSDQGDL-NKEASHNLEEAQADEFMLTHILHPYTIEEVTNMFNTRIMYKSKTESWRNICQIARQVNISPSLLTGILKFQGIIPYSYFTNGHEKLYD 3DTE Chain:A ((10-176)) ------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------ALAAAKARMRELAASYGAG--L-PGRDTHSLMHGLDGITLTFMPMG---QRDGAY--DP-EHHVILINSQ-VRPERQRFTLAHEISHALLLGDDDLLSDLHDEYEGDRLEQVIETLCNVGAAA-LLMPAELID---DLLTR-----FGPTGRALAELARRADVSATSALYALAERTA---------------

General information: TITO was launched using: RESULT: Template: 3DTE.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 : 614 -18866 -30.73 -120.93 target 2D structure prediction score : 0.67 Monomeric hydrophicity matching model chain A : 0.58 3D Compatibility (PKB) : -30.73 2D Compatibility (Sec. Struct. Predict.) : 0.67 1D Compatibility (Hydrophobicity) : 0.58 QMean score : 0.509

(partial model without unconserved sides chains): PDB file : Tito_3DTE.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3DTE-query.scw PDB file : Tito_Scwrl_3DTE.pdb: