Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSKLLDKILSRENMLEAYNQVKSNKGSAGIDGMTIEEMDNYLRQNWRLTKELIKQRKYKPQPVLRVEIPKPD---------GGIRQLGIPTVMDRMIQQAIV 3CDU Chain:A ((123-190)) ------------------------------LGIKKRDILSKKTKDLTKLKECMDKYGLN-LPM--VTYVKDELRSIEKVAKGKSRLIEASSLNDSVAMRQT-

General information: TITO was launched using: RESULT: Template: 3CDU.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 : 104 -4471 -42.99 -75.77 target 2D structure prediction score : 0.56 Monomeric hydrophicity matching model chain A : 0.60 3D Compatibility (PKB) : -42.99 2D Compatibility (Sec. Struct. Predict.) : 0.56 1D Compatibility (Hydrophobicity) : 0.60 QMean score : 0.571

(partial model without unconserved sides chains): PDB file : Tito_3CDU.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3CDU-query.scw PDB file : Tito_Scwrl_3CDU.pdb: