Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MLVYIGNGHYCYSNSTAMFLSSIGENVSPQLVEILTGVGLGAMIEYEKNLYFSMRDPDDGINYALNILGFTAEEHQQASDLDDPFPLLKQQIKQNPVILGPLDMGELTYHPNHKNLNGSDHYVLGYQMDN--ENIYVQDPAGFPFVPLSLDQFKKAWMAERIPYRKGINKYWSTAKKVVTLDNNEIYERAIDYFKRTYRKFEKVDIGLIGREAICFYADQLLNAPITADTIRHTTFFLFQLSARRANDYAMYFKDRHSHLSVLKTEQAKVFGICHSMSVNKDWKGISEKLMKLADLEDNFRLELLKVGY 3ZUA Chain:A ((3-119)) ----SCHKIDYGLYALEILAQYHNVSVNPEEI-K---HRFDT------D---GTGLGLTSWLLAAKSLELKVKQVKK--T-------IDRLNFISLPALVWRE--------------DGRHF-ILTKVSKEANRYLIFDLEQRNPRVLEQSEFEALYQ-------------------------------------------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 3ZUA.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 : 501 -44275 -88.37 -385.00 target 2D structure prediction score : 0.54 Monomeric hydrophicity matching model chain A : 0.54 3D Compatibility (PKB) : -88.37 2D Compatibility (Sec. Struct. Predict.) : 0.54 1D Compatibility (Hydrophobicity) : 0.54 QMean score : 0.464

(partial model without unconserved sides chains): PDB file : Tito_3ZUA.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3ZUA-query.scw PDB file : Tito_Scwrl_3ZUA.pdb: