Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence -----------------MTKQVYIIHGYRASSTNHWFPWLKKRLLADGVQADILNMP-------NPLQPRLEDWLDTLSLYQHTLH---ENTYLVAHSLGCPAILRFLEHLQLRKQLGGIILV------SGFAKSLPTLQMLDEFTQG----------------------SFDHQKIIESAKHRA--------VIASKDDQIVPFSFSKDLAQQI---DAALYEVQHGGHFLEDEGFTSLPIVYDVLTSYFSKETR 4KEA Chain:A ((22-269)) SEQYPVLSGAEPFYAENGPVGVLLVHGF--TGTPHSMRPLAEAYAKAGYTVCLPRLKGHGTHYEDMERTTFHDWVASVEEGYGWLKQRCQTIFVTGLSMGGTLTLYLAEH---HPDICGIVPINAAVDIPAIAAGMTGGGELPRYLDSIGSDLKNPDVKELAYEKTPTASLLQLARLMAQTKAKLDRIVCPALIFVSDENHVVPPGNADIIFQGISSTEKEIVRLRNSYHVATLD--YDQPMIIERSLEFFAKHA-

General information: TITO was launched using: RESULT: Template: 4KEA.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 : 892 -147494 -165.35 -810.41 target 2D structure prediction score : 0.66 Monomeric hydrophicity matching model chain A : 0.71 3D Compatibility (PKB) : -165.35 2D Compatibility (Sec. Struct. Predict.) : 0.66 1D Compatibility (Hydrophobicity) : 0.71 QMean score : 0.464

(partial model without unconserved sides chains): PDB file : Tito_4KEA.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4KEA-query.scw PDB file : Tito_Scwrl_4KEA.pdb: