Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MDETKMSYQSIFRPDAFANKVIIVTGGGSGIGRCTAHELAALAAQVVITGRKIEKLEKVSQEIIEDGGLVHFIVCDNREEEQVKNMIAEVIEKFGKLDGLVNNAGGQFPSALEN-ISANGFDAVVRNNLHATFYLMR-EAYNQWMAKHGGSIVNMTADMWG--GMPGMGHSGAARSGVDNLTKTASVEWGKSGVRVNAVAPGWIVSSGMDNYSGDFAKVIIPSLAGNVPLKRMGTESEVSSAICYLLSDAAAFVSGVTLRIDGAASQGTRMYPLAEATNSQSYNGFHRAFIPEIFKKDKTEKVEQSNNSGSE 5H5X Chain:C ((17-259)) ----------------FAGRTALVTGAASGIGLATARRLGAGGARVVVADFNAEGAEKAAAELRAGGVEAAAVELDVTRPESVEAAVGFAVDTFGSLDLAVNNAGIGGPSAPTGEYDVAAYQRVVRTNLDGVFYSMRYELPAIEAAGKGGSIVNV-ASILGSVGFAGSPAYVAAKHGVVGLTKAAAAEYAARGIRINAVGPGFIDTPLLKTME----EAAYKGLVALHPAGRLGRSDEVAELIVFLLSDRASFVAGSYHLVDGA------------------------------------------------

General information: TITO was launched using: RESULT: Template: 5H5X.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 : 1356 -110689 -81.63 -463.13 target 2D structure prediction score : 0.62 Monomeric hydrophicity matching model chain C : 0.73 3D Compatibility (PKB) : -81.63 2D Compatibility (Sec. Struct. Predict.) : 0.62 1D Compatibility (Hydrophobicity) : 0.73 QMean score : 0.466

(partial model without unconserved sides chains): PDB file : Tito_5H5X.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5H5X-query.scw PDB file : Tito_Scwrl_5H5X.pdb: