Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTYEYKSHIYLAETALNVKDLASQTAFYQQVIGLEILSQTETESILGLGGKVLVQLIQA-QESGEVREHYGLYHLAILLPTRKALADVLKHLTDLQIPLVGGA----DHGYSEAIYLEDLEGNGIELYRDKPVSTWDIREDGRIIGVTEALAAQDIYELGERVEPFILAEGTRMGHIHLSVKDSRKSSQFYQKVLGLEDKFSVP-SASWIAAGDYHHHLAVNEWRGKGLASRKQGLPGLAYYVIEVAHKKELLTIAQRAQEVDAPIKWM-------TSSKLEITDSDGIVTRIRLAR 3B59 Chain:C ((3-253)) ----LSRVTEIRYVGYGVKDFDAEKAFYADVWGLEPVGEDANNAWFKAQG-ADEHHVVQLRR----ADENRIDVIALAADSRSDVDALRASVEAAGCKVASEPAVLATPGGGYGFRFFSPDGLLFEVSSDVAKGAK-R--D--L------------------A--RWEGVPVKISHIVLHSPNHQDMVKFFTDVLGFKVSDWLGDFMCFLRCNSAHHRIAILPG-----------PPCLNHVAYDMLSVDDMMRGAHRLKVKGIDIGWGPGRHTAGNNTFSYFVTPGGFVTEYTSE-

General information: TITO was launched using: RESULT: Template: 3B59.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain C - contact count / total energy / energy per contact / energy per residue : 1279 6936 5.42 29.14 target 2D structure prediction score : 0.58 Monomeric hydrophicity matching model chain C : 0.66 3D Compatibility (PKB) : 5.42 2D Compatibility (Sec. Struct. Predict.) : 0.58 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.379

(partial model without unconserved sides chains): PDB file : Tito_3B59.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3B59-query.scw PDB file : Tito_Scwrl_3B59.pdb: