Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MYEGLEDLKVDTVNRKTLAKQVIERIVHLLSSGQLRAGDKLPTEMELMDILHVSRPVLREALSSLETLGVITRKTRGGTYFNDKIGMQPFSVMLALATDNLPAIIEARMALELGLVTIAAEKI-NEEELQRLQKTIDDIANST---D-NHYGEADKEFHRIIALSANNPVVEGMIQSL-L-ITHAKIDSQIPYRERDVTVEYHKKIYDALAKRDPYKAHYHMYEHLKFVRDKILKGMDEK 3IHU Chain:A ((16-220)) ----------------SASDTVFFGIMSGLELGTFVPGQRL-VETDLVAHFGVGRNSVREALQRLAAEGIVDLQRHRGAVIRRLS------------LQETLDVLDVAERMTGLLARAATRGSGNQPQVQALRASVQALVAAEKAQDGETFSNARRHFYRTLLEMGDNRELRRLFPTIHMPIVHAQH-R--LASLRQMRLDDYRRIATAVLAGEPDAAEAAGAAHVKNVRGAILDRQ---

General information: TITO was launched using: RESULT: Template: 3IHU.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 : 863 -108946 -126.24 -550.23 target 2D structure prediction score : 0.68 Monomeric hydrophicity matching model chain A : 0.70 3D Compatibility (PKB) : -126.24 2D Compatibility (Sec. Struct. Predict.) : 0.68 1D Compatibility (Hydrophobicity) : 0.70 QMean score : 0.615

(partial model without unconserved sides chains): PDB file : Tito_3IHU.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3IHU-query.scw PDB file : Tito_Scwrl_3IHU.pdb: