Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MFTAKLIKGKTYNVMGITF-RAGVSQTVPKKLYE-----YLNENPYFILTQELNNQKDDPINYTESELKGMNKAEHESIISNL-------------GRNPSDFKNADERIAYILKQIDNKGE 1REG Chain:X ((1-122)) MIEITLKKPEDFLKVKETLTRMGIANNKDKVLYQSCHILQKKGLYYIVHFKEMLRMDGRQVEMTEEDEVRRDSIAWLLEDWGLIEIVPGQRTFMKDLTNNFRVISFKQKHEWKLVPKYTIGN

General information: TITO was launched using: RESULT: Template: 1REG.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain X - contact count / total energy / energy per contact / energy per residue : 392 10485 26.75 101.79 target 2D structure prediction score : 0.47 Monomeric hydrophicity matching model chain X : 0.58 3D Compatibility (PKB) : 26.75 2D Compatibility (Sec. Struct. Predict.) : 0.47 1D Compatibility (Hydrophobicity) : 0.58 QMean score : 0.182

(partial model without unconserved sides chains): PDB file : Tito_1REG.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1REG-query.scw PDB file : Tito_Scwrl_1REG.pdb: