Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MVKVGLVDDYRVDLEKLEA--IVSRMQDVEIVFSTDSAKEAYRRVKNGDIDLLLADIEM--PHMSGYELADLIKSHSLDVDVIFVTGHGGY--AVHAFDLNVHDYIMKPYYADRLAASFDRYLKKKTETSLNGRILIKQKSEMHVLQKKDIIFAERTGRSTTIVTTAEEVQTYQTLNDIKGDLPEKDFLRSHRSFIINIHYIKHFSAYTKHSFTVSFEGTSKKAMITKQQLDYFQNYYF 4D6X Chain:A ((20-135)) -----LVVDDEVDIRDLVAGILSDEGHETRTAFDADSALAA---INDRAPRLVFLDIWLQGSRLDGLALLDEIKKQHPELPVVMISGHGNIETAVSAIRRGAYDFIEKPFKADRLILVAERALE-------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4D6X.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 : 522 -76937 -147.39 -699.42 target 2D structure prediction score : 0.62 Monomeric hydrophicity matching model chain A : 0.65 3D Compatibility (PKB) : -147.39 2D Compatibility (Sec. Struct. Predict.) : 0.62 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.499

(partial model without unconserved sides chains): PDB file : Tito_4D6X.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4D6X-query.scw PDB file : Tito_Scwrl_4D6X.pdb: