Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MGYLHDAFSLKGKTALVTGPGTGIGQGIAKALAGAGADIIGTS-HTSSLSETQQLVEQEGRIFTSFTLDMSKPEAIKDSAAEL-FENRQIDILVNNAGIIHREKAEDFPEENWQHVLNVNLNSLFILTQLAGRHMLKRGHG-KIINIASLLSFQGGILVPAYTASKHAVAGLTKSFANEWAASGIQVNAIAPGYISTANTKPIRDDEKRNEDILKRIPAGRWGQADDIGGTAVFLASRASDYVNGHILAVDGGWLSR 4G81 Chain:C ((5-253)) -------FDLTGKTALVTGSARGLGFAYAEGLAAAGARVILNDIRATLLAESVDTLTRKGYDAHGVAFDVTDELAIEAAFSKLDAEGIHVDILINNAGIQYRKPMVELELENWQKVIDTNLTSAFLVSRSAAKRMIARNSGGKIINIGSLTSQAARPTVAPYTAAKGGIKMLTCSMAAEWAQFNIQTNAIGPGYILTDMNTALIEDKQFDSWVKSSTPSQRWGRPEELIGTAIFLSSKASDYINGQIIYVDGGWLA-

General information: TITO was launched using: RESULT: Template: 4G81.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 : 1312 -31022 -23.64 -126.10 target 2D structure prediction score : 0.70 Monomeric hydrophicity matching model chain C : 0.82 3D Compatibility (PKB) : -23.64 2D Compatibility (Sec. Struct. Predict.) : 0.70 1D Compatibility (Hydrophobicity) : 0.82 QMean score : 0.608

(partial model without unconserved sides chains): PDB file : Tito_4G81.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4G81-query.scw PDB file : Tito_Scwrl_4G81.pdb: