Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MHPAKWRETIDPFELDYHHFRLTEILGYPHAGNDVFHAKGIYQQQE--TEVYIKVARQQGA-DIKREIDTILKLNLELAPEIIDY-DQ--NREQFVVTIARQGERL-SMLLNQNKDEKSIDYLFEYGQTLAILHQTQGNFENVKDR---RFFHIPLE--EHFR-------EL---RLEEVYHYLVKHKPERETRCFCHGDFHYANILWKEKHISAILDFELSGMGNREFDIAWALIVRPGQRFLLTEEEIREFLRGYASEGTFQEDLVRYYMVLIYSFFYKMGETEYQDFVRSFLQQNIR 4GKI Chain:C ((38-269)) -------------------------------GATIYRLY----GKPNAPELFLKHGKGSVANDVTDEMVRLNWLTA-FMPLPTIKHFIRTPDDAWLLTTAIPGKTAFQVLEE--YPDSGENIVDALAVFLRRLHSIPVCNCPFNSDRVFRLAQAQSRMNNGLVDASDFDDERNGWPVEQVWKEMHKLLPFSPDSVVTHGDFSLDNLIFDEGKLIGCIDVGRVGIADRYQDLAILWNCLG----EFSPSLQKRLFQKYGIDN-PDMNKLQFHLMLD-------------------------

General information: TITO was launched using: RESULT: Template: 4GKI.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 : 853 8333 9.77 39.68 target 2D structure prediction score : 0.58 Monomeric hydrophicity matching model chain C : 0.64 3D Compatibility (PKB) : 9.77 2D Compatibility (Sec. Struct. Predict.) : 0.58 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.342

(partial model without unconserved sides chains): PDB file : Tito_4GKI.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4gki-query.scw PDB file : Tito_Scwrl_4GKI.pdb: