Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MYEFKDYYQNTVQLSFDDQPFSDSPKHVWVICRFGGKWLLTEHEDRGYEFPGGKVEPMECAEEAALREVKEETGARVKSLKYLGQYKVLGKEKVIVKNIYFADIEKLEKQADYFETKGPVLFHELPENLSRNKKFSFIMKDSVLPISLKKLKESGWIE 3GRN Chain:B ((38-90)) -----------------------------------------------WDLPGGKVNPDESLKEGVAREVWEETGITMVPGDIAGQVNFELTEKKVIAIVF----------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 3GRN.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 132 -8734 -66.17 -164.79 target 2D structure prediction score : 0.57 Monomeric hydrophicity matching model chain B : 0.61 3D Compatibility (PKB) : -66.17 2D Compatibility (Sec. Struct. Predict.) : 0.57 1D Compatibility (Hydrophobicity) : 0.61 QMean score : 0.527

(partial model without unconserved sides chains): PDB file : Tito_3GRN.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3GRN-query.scw PDB file : Tito_Scwrl_3GRN.pdb: