Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSKFSDEYWMQLAYEQAELAAEQGEIPVGAVIVSQNKLIGAGFNAPIGLSDPTAHAEIQAIRAACESLK------NYRLPEDATLYVTLEPCTMCVGALVHARIKHVVFGTTEPKAGSLVSARQLLENGY--YNHKFTFEHGCLHEKCAQQLSLFFKQRREQKKQEKQQKNVLK 3DH1 Chain:A ((23-177)) --MEETEKWMEEAMHMAKEALENTEVPVGCLMVYNNEVVGKGRNEVNQTKNATRHAEMVAIDQVLDWCRQSGKSPSEVFEH-TVLYVTVEPCIMCAAALRLMKIPLVVYGCQNERFGGCGSVLNIASADLPNTGRPFQCIPGYRAEEAVEMLKTFYKQ----------------

General information: TITO was launched using: RESULT: Template: 3DH1.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 : 795 -59766 -75.18 -406.57 target 2D structure prediction score : 0.70 Monomeric hydrophicity matching model chain A : 0.74 3D Compatibility (PKB) : -75.18 2D Compatibility (Sec. Struct. Predict.) : 0.70 1D Compatibility (Hydrophobicity) : 0.74 QMean score : 0.550

(partial model without unconserved sides chains): PDB file : Tito_3DH1.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3DH1-query.scw PDB file : Tito_Scwrl_3DH1.pdb: