Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MGFRKDFLWGGATAANQCEGGYDEGGRGLANVDVVPIGKDRFPVITGKKKMFEFDEDHFYPAKIAIDMYHRYKEDIALFAEMGFKTYRMSIAWSRIFPMGDEKEPNEAGLKFYEDVFKECQKHGIEPLVTITHFDCPMHLIKEYGAWRSRELVGFYENLCRVIFNRYKGLVKYWLTFNEINMILHAPFMGAGLYFEEGENEEQIKYQAAHHELVASAIATKIAHEVDPENKVGCMLAAGAYYPYTCNPEDVWASRKSDR-ENYFFIDVQSRGEYPAYALKEMERNGIQIEMEPGDAALLKEHTVDFISFSYYSSR--------------VSTTDNELLEQTAG--NIFASVKNPYLQASEWGWQIDPLGLRITMNDIYDRYQKPLFIVENGLGAVDTPDENGYVEDDYRIDYLAAHIQAMKDAVELDGVDLLGYTTWGCIDLVSAGTGEMKKRYGFIYVDRDNQGNGTLARSKKKSFNWYKKVIDSNGENLSND 4ZEH Chain:A ((16-485)) --FPPEFLWGAASAAYQVEGAWNEDGKGLSVWDVFAKQPGR--TFKGTN------------GDVAVDHYHRYQEDVALMAEMGLKAYRFSVSWSRVFPDGN-GAVNEKGLDFYDRLIEELRNHGIEPIVTLYHWDVPQALMDAYGAWESRRIIDDFDRYAVTLFQRFGDRVKYWVTLNEQNIFISFGYR-LGLH-PPGVKDMKRMYEANHIANLANAKVIQSFRHYVPDGKIGPSFAYSPMYPYDSRPENVLAFENAEEFQNHWWMDVYAWGMYPQAAWNYLESQGLEPTVAPGDWELLQAAKPDFMGVNYYQTTTVEHNPPDGVGEGVMNTTGKKGTSTSSGIPGLFKTVRNPHVDTTNWDWAIDPVGLRIGLRRIANRYQLPILITENGLGEFDTLEPGDIVNDDYRIDYLRRHVQEIQRAIT-DGVDVLGYCAWSFTDLLSWLNG-YQKRYGFVYVNRDDESEKDLRRIKKKSFYWYQRVIETNGAEL---

General information: TITO was launched using: RESULT: Template: 4ZEH.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 : 2672 -86352 -32.32 -190.62 target 2D structure prediction score : 0.63 Monomeric hydrophicity matching model chain A : 0.82 3D Compatibility (PKB) : -32.32 2D Compatibility (Sec. Struct. Predict.) : 0.63 1D Compatibility (Hydrophobicity) : 0.82 QMean score : 0.527

(partial model without unconserved sides chains): PDB file : Tito_4ZEH.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4ZEH-query.scw PDB file : Tito_Scwrl_4ZEH.pdb: