Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence -----------------------------------------RRVFKIDGEEFTPLETDCLIRIFKNKKTVHALFVPPGTELDWRLDHNHYAVGIKHNCDIIIGWKPSSWRIEGD------------------------------------------ 3IBM Chain:A ((8-161)) HEASRVLRERDYRWEGTEEESGARRQTLVGRPAGQEAPAFETRYFEVEPGGYTTLE---------RHEHTHVVMVVRG-HAEVVLDDRVEPLT-PLDCVYIAPHAWHQIHATGANEPLGFLCIVDSDRDRPQRPDADDLARMCADPAVARRIRTEG

General information: TITO was launched using: RESULT: Template: 3IBM.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 : 105 3505 33.38 56.53 target 2D structure prediction score : 0.73 Monomeric hydrophicity matching model chain A : 0.66 3D Compatibility (PKB) : 33.38 2D Compatibility (Sec. Struct. Predict.) : 0.73 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.240

(partial model without unconserved sides chains): PDB file : Tito_3IBM.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3ibm-query.scw PDB file : Tito_Scwrl_3IBM.pdb: