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 6CGG Chain:A ((27-255)) -----------KVDSIEIIGSGYD----SVAYLVNNE-YIFKTKFSTN-KGYAKEKAIYNFLNTNLETNVKIPNIEYSYISDELSILGYKEIKGTFLTPEIYSTMSEEE-QNLLKRDIASFLRQMHGLDYTDI-SECTIDNKQNVLEEYILLRETIYNDLTD-IEKDYIESFMERLN-----ATTVFEGKKCLCHNDFSCNHLLLDGNNRLTGIIDFGDSGIIDEYCDFIYLLEDSEEEIGTNFGEDILRMY---------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 6CGG.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 : 848 1906 2.25 8.87 target 2D structure prediction score : 0.50 Monomeric hydrophicity matching model chain A : 0.69 3D Compatibility (PKB) : 2.25 2D Compatibility (Sec. Struct. Predict.) : 0.50 1D Compatibility (Hydrophobicity) : 0.69 QMean score : 0.310

(partial model without unconserved sides chains): PDB file : Tito_6CGG.pdb: (Unconserved sides chains are recalculated) : Sequence: align-6cgg-query.scw PDB file : Tito_Scwrl_6CGG.pdb: