Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MWRNASMNHSKRNDANDFDSMDEWLRQFFEDPFAWYDETLPIDLYETSQQYIIEADLTFLQPTQVTVTLSG-CEFILTVKSSGQ------------TFEKQMMLPFYF-NDKNIQVECENQILTVAVNKETEDGSSFSLQFPLS 4YLB Chain:A ((16-117)) -------------------KLDELSREFYESVIP------PIDMYEEGGELVVVADLAGFNKDKISVRLSAQNELIINAEREIQYIGTKYATQRPLKIHKVIRLPVKVKRDSQVTDKYENGVLTIRI-----------------

General information: TITO was launched using: RESULT: Template: 4YLB.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 : 259 -17257 -66.63 -196.10 target 2D structure prediction score : 0.58 Monomeric hydrophicity matching model chain A : 0.73 3D Compatibility (PKB) : -66.63 2D Compatibility (Sec. Struct. Predict.) : 0.58 1D Compatibility (Hydrophobicity) : 0.73 QMean score : 0.526

(partial model without unconserved sides chains): PDB file : Tito_4YLB.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4YLB-query.scw PDB file : Tito_Scwrl_4YLB.pdb: