Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNVQEALNLLKENGYKYTNKREDMLQLFADSDRYLTAKNVLSALNDDYPGLSFDTIYRNLSLYEELGILETTELS-GEKLFRFKCSFTHHHHHFICLACGKTKEIESCPMDKLC-DD--LDGYQVSGHKFEIYGTCPDCTAENQENTTA 2FE3 Chain:A ((6-144)) --LKEALETLKETGVRITPQRHAILEYLVNSMAHPTADDIYKALEGKFPNMSVATVYNNLRVFRESGLVKELTYGDASSRFDFVTS---DHYHAICENCGKIVDFHYPGLDEVEQLAAHVTGFKVSHHRLEIYGVCQECSKKEN-----

General information: TITO was launched using: RESULT: Template: 2FE3.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 : 448 -48619 -108.52 -360.14 target 2D structure prediction score : 0.74 Monomeric hydrophicity matching model chain A : 0.82 3D Compatibility (PKB) : -108.52 2D Compatibility (Sec. Struct. Predict.) : 0.74 1D Compatibility (Hydrophobicity) : 0.82 QMean score : 0.706

(partial model without unconserved sides chains): PDB file : Tito_2FE3.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2FE3-query.scw PDB file : Tito_Scwrl_2FE3.pdb: