Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKKILAICGIELSLIFKKPQNYLIMFAAPLLLTFVFGSMLSGNDDKVRLAIVDQDDTILSQHYIRQLKAHDDMYVFENMSESKASEKLKQKK------IAGIIVISRSFQTQLEKGKHPELIFRHGPELSEAPMVKQYAESALATLNIQVTAAKTASQTAGENWKAAYKTVFAKKHEDIVPAVTRQTLSDKKEGAEASDTASRAAGFSILFVMLTMMGAAGTILEARKNGVWSRLLTASVSRAEIGAGYVLSFFVIGWIQFGILLLSTHWLFGINWGNPAAVIVLVSLFLLTVVGIGLMIAANVRTPEQQLAFGNLFVIATCMVSGMYWPIDIEPKFMQSIAEFLPQKWAMSGLTEIIANGARVTDILGICGILLAFAAITFAAGLKALRA 4G87 Chain:A ((154-232)) ---------------------------------FGYGRILRTQDHEV-MAIVEQTDATPSQREIREVNA--GVYAFDIAALRSALSRLSSNNAQQELYLTDVIAILRS-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4G87.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 : 186 -16624 -89.37 -251.87 target 2D structure prediction score : 0.41 Monomeric hydrophicity matching model chain A : 0.49 3D Compatibility (PKB) : -89.37 2D Compatibility (Sec. Struct. Predict.) : 0.41 1D Compatibility (Hydrophobicity) : 0.49 QMean score : 0.278

(partial model without unconserved sides chains): PDB file : Tito_4G87.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4G87-query.scw PDB file : Tito_Scwrl_4G87.pdb: