Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence -MNEGYIIAGLLLLTAGMIDFLWTTLWLESGAGPITRCLSAWLWKGCRKISGDHAKVLSMAGPLLLCLTLVIWISLFWSGWVLIYSSDPHSLMETQSKEPASWSDRIYFSGYVMFTLGNGDLAPNGGLWKLVTIIETAQGLLTITFSVTYLISVLSAVNQKRSFAQSVLSLGHDGTEIVHNAWNGKDFHDIDFLLVAASSELGKLTAQHNAFPILHFYHSTQHQESSIIAVAVLDEALTIFKYGIPEQYQPNQLHIKEARSSIKNYLDTVHTAYIHPAEQAPPEPDISKLQQSGIPALSKQTFQIAVNSIKERRQLLLGIIQAGARKWPVQEQAIGNAYSPK 1B0P Chain:A ((1-257)) GKKMMTTDGNTATAHVAYAMSEVAAIYPITPSSTMGEEADDWAAQGRKNIFGQTLTIRE--------------------------MQSEAGAAGAVHGALAA--------GALTTTFTAS-----QGLLLMIPNMYKISGE-LLPGVFHVTARAIAAHALSIFGDHQDIYAARQTGFAMLASSSVQEAHDMALVAHLAAIESN--------VPFMHFFDG----------------------FRTSHEIQKIEVL---DYADMASLVNQKALAEFRAKSMNPEHP---------HVRGTAQNPDIYFQGREAANPYYLKVPGIVAEYMQKVASLTGRSY---

General information: TITO was launched using: RESULT: Template: 1B0P.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 : 1478 -140185 -94.85 -547.60 target 2D structure prediction score : 0.49 Monomeric hydrophicity matching model chain A : 0.61 3D Compatibility (PKB) : -94.85 2D Compatibility (Sec. Struct. Predict.) : 0.49 1D Compatibility (Hydrophobicity) : 0.61 QMean score : 0.327

(partial model without unconserved sides chains): PDB file : Tito_1B0P.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1B0P-query.scw PDB file : Tito_Scwrl_1B0P.pdb: