Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MFKDIENRFGAKIQDIKVLKSGWAGEIISLEFKDNTQKYVIKTYNSS-KNGLENIKQEWTGLNLLYNANYPVPRPIISDFVNEKPYIVMEKIEGENLWT-CYQTLSKEDRQQLLEKFVKVFLK-LHELDVSIIDKELRKDSTSSFIEKEI-------NEIKKLVEENKLEYFTQIIDWLQKEKANIIGEKLSIIHRDYHPWNVIVD-NNKAIYVIDLL-WGIGDYRFDLAWMYTLMERSGFEDFSQNALKKYKELKNQNINNFEYFKVFSTLRWLINVMISLKTGENLNETRNKEFENFVSPLIQNRIMSIKKITGIQITI 5BYL Chain:A ((27-255)) -----------KVDSIEIIGSGYD----SVAYLVNNE-YIFKTKFSTN-KGYAKEKAIYNFLNTNLETNVKIPNIEYSYISDELSILGYKEIKGTFLTPEIYSTMSEEE-QNLLKRDIASFLRQMHGLDYTDI-SECTIDNKQNVLEEYILLRETIYNDLTD-IEKDYIESFMERLN-----ATTVFEGKKCLCHNDFSCNHLLLDGNNRLTGIIDFGDSGIIDEYCDFIYLLEDSEEEIGTNFGEDILRMY---------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 5BYL.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 : 836 -1444 -1.73 -6.72 target 2D structure prediction score : 0.51 Monomeric hydrophicity matching model chain A : 0.69 3D Compatibility (PKB) : -1.73 2D Compatibility (Sec. Struct. Predict.) : 0.51 1D Compatibility (Hydrophobicity) : 0.69 QMean score : 0.314

(partial model without unconserved sides chains): PDB file : Tito_5BYL.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5byl-query.scw PDB file : Tito_Scwrl_5BYL.pdb: