Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNKMERNINMKKWQTCVLGAGSLLCLTACSGKSVTSEHQTKDEMKTEQTASKTSAAKGKEVADFELMGVDGKTYRLSDYKGKKVYLKFWASWCSICLASLPDTDEIAKEAGDDYVVLTVVSPGHKGEQSEADFKNWYKGLDYKNLPVLVDPSGKLLETYGVRSYPTQAFIDKEGKLVKTHPGFMEKDAILQTLKELS 4HQZ Chain:B ((43-186)) ----------------------------------------------------QQIAVGKDAPDFTLQSMDGKEVKLSDFKGKKVYLKFWASWCGPCKKSMPELMELAAKPDRDFEILTVIAPGIQGEKTVEQFPQWFQEQGYKDIPVLYDTKATTFQAYQIRSIPTEYLIDSQGKIGKIQFGAISNADAEAAFKEM-

General information: TITO was launched using: RESULT: Template: 4HQZ.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 693 -70234 -101.35 -487.74 target 2D structure prediction score : 0.72 Monomeric hydrophicity matching model chain B : 0.76 3D Compatibility (PKB) : -101.35 2D Compatibility (Sec. Struct. Predict.) : 0.72 1D Compatibility (Hydrophobicity) : 0.76 QMean score : 0.769

(partial model without unconserved sides chains): PDB file : Tito_4HQZ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4HQZ-query.scw PDB file : Tito_Scwrl_4HQZ.pdb: