Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTPTKQHKKETFTHFIFRVFMILVGAASAAVSIELFLIPNDFIDGGIIGVSLILDHLFMSNPFLNFAFFVVILNIPFMIFGYKYIGKTFLVSTFIGIVGLAVIESSLHHVEAITTQPILATVFGGLLLGFGVGLVIRNGGSMDGTEILGILLTKKLPFSVGEFVMFINVFIFIWAVFVFGPEQAMYSFMTYYIAMKTIDAVIQGLDETKAVIIVSEQ--YDEISDAILHRLGRGTTKLKGKGGYTDEEKDVIYAVVT-RLEVTKLKSIVF-EVD--QNAFITIMNTHETRGGKFKNAIH 3DFE Chain:A ((7-102)) ----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------NKLVIVTEKVLLKKVAKIIEEAGATGYTVVDTGG-----SNVKFEVLTENREMAEKIADQVAIKFFTDYAGIIYICEAEVLYG--------

General information: TITO was launched using: RESULT: Template: 3DFE.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 : 305 7905 25.92 109.79 target 2D structure prediction score : 0.64 Monomeric hydrophicity matching model chain A : 0.44 3D Compatibility (PKB) : 25.92 2D Compatibility (Sec. Struct. Predict.) : 0.64 1D Compatibility (Hydrophobicity) : 0.44 QMean score : 0.571

(partial model without unconserved sides chains): PDB file : Tito_3DFE.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3DFE-query.scw PDB file : Tito_Scwrl_3DFE.pdb: