Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MIIMKEAIIATHNPGKVKEFKEILEPRGYDVKSLAEIGFTEEIEETGHTFEENAIMKAEAVAKAVNKMVIADDSGLSIDNLGGRPGVYSARYAGEQKDDQANIEKVLSELKGIEKEQRTARFRCALAVSIPGEETKTVEGHVEGYIAEEPRGE-YGFGYDPIFIVKDKDKTMAELTSDEKNKISHRADALKKLSKLLEA 2MJP Chain:A ((10-189)) ----K-IYFATGNPNKIKEANIILK----DLKDVEIEQIKISYPEIQGTLEEVAEFGAKWVYNILKKPVIVEDSGFFVEALNGFPGTYS-KFVQETIGN----EGILKLLEG--KDNRNAYFKTVIGYC-DENGVRLFKGIVKGRVSEEIRSKGYGFAYDSIFIPEEEERTFAEMTTEEKSQISHRKKAFEEFKKFL--

General information: TITO was launched using: RESULT: Template: 2MJP.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 : 909 -40951 -45.05 -228.78 target 2D structure prediction score : 0.55 Monomeric hydrophicity matching model chain A : 0.78 3D Compatibility (PKB) : -45.05 2D Compatibility (Sec. Struct. Predict.) : 0.55 1D Compatibility (Hydrophobicity) : 0.78 QMean score : 0.462

(partial model without unconserved sides chains): PDB file : Tito_2MJP.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2MJP-query.scw PDB file : Tito_Scwrl_2MJP.pdb: