Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKTTEYVAEILNELHNSAAYISNEEADQLADHIL-SSHQIFTAGAGRSGLMAKSFAMRLMHMGFNAHIVGEIL-----TPPLAEGDLVIIGSGSGETKSLIHTAAKAKSLHGIVAALTINPESSIGKQADLIIRMPGSPKDQSNGSYKTIQPMGSLFEQTLLLFYDAVILKLMEKKGLDSETMFTHHANLE 2XHZ Chain:A ((17-182)) ---KEVLAIERECLAELDQYIN-QNFTLACEKMFWCKGKVVVMGMGASGHIGRKMAATFASTGTPSFFVHPGEAAHGDLGMVTPQDVVIAISNSGESSEITALIPVLKRLHVPLICITGRPESSMARAADVHLCVKVAKEACP---L-GLAPTSST--TATLVMGDALAVALLKAR---------------

General information: TITO was launched using: RESULT: Template: 2XHZ.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 : 840 -115069 -136.99 -719.18 target 2D structure prediction score : 0.78 Monomeric hydrophicity matching model chain A : 0.73 3D Compatibility (PKB) : -136.99 2D Compatibility (Sec. Struct. Predict.) : 0.78 1D Compatibility (Hydrophobicity) : 0.73 QMean score : 0.459

(partial model without unconserved sides chains): PDB file : Tito_2XHZ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2XHZ-query.scw PDB file : Tito_Scwrl_2XHZ.pdb: