Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence DVEPPGASVKPTEAARRRVFKIDGEEFT-PLETDCLIRIFK---NKKTVHALFVPPGTELDWRLDHNHYAVGIKHNCDIIIGWKPSS---WRIEGDKVSSLADGFSVVTTKSTD----------------- 2KIE Chain:A ((1-124)) --GPLGSMEPPLPVGAQPLATVEGMEMKGPLREPCALTLAQRNGQYELIIQLHEKEQHVQDIIPINSHFRCVQEAEETLLIDIASNSGCKIRVQGDWIRE-----RRFEIPDEEHCLKFLSAVLAAQKAQS

General information: TITO was launched using: RESULT: Template: 2KIE.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 : 342 24306 71.07 243.06 target 2D structure prediction score : 0.58 Monomeric hydrophicity matching model chain A : 0.63 3D Compatibility (PKB) : 71.07 2D Compatibility (Sec. Struct. Predict.) : 0.58 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.347

(partial model without unconserved sides chains): PDB file : Tito_2KIE.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2KIE-query.scw PDB file : Tito_Scwrl_2KIE.pdb: