Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSIHIAAQQGEIADKILLPGDPLRAKFIAENFLGDAV-CFNEVRNMFGYTGTYKGHRVSVMGTGMGMPSISIYARELIVDYGVKKLIRVGTAGSLNEEVHVRELVLAQAAATNSNIVRNDWPQYDFPQIASFDLLDKAYHIAKELGMTTHVGNVLSSDVFYSNYFEKNIELGKWGVKAVEMEAAALYYLAAQYHVDALAIMTISDSLVNPDEDTTA-EERQNTFTDMMKVGLETLIAE 4TYM Chain:A ((24-258)) -SIHIEAKQGEIADKILLPGDPLRAKFIAENF-LEDAVCFNTVRNMFGYTGTYKGHRVSVMGTGMGMPSISIYARELIVDYGVKTLIRVGTAGAINPDIHVRELVLAQAAATNSNIIRNDWPEFDFPQIADFKLLDKAYHIAKEMDITTHVGSVLSSDVFYSNQPDRNMALGKLGVHAIEMEAAALYYLAAQHNVNALAMMTISDNLNNPE-EDTSAEERQTTFTDMMKVGLETLISE

General information: TITO was launched using: RESULT: Template: 4TYM.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 : 1350 -70823 -52.46 -303.96 target 2D structure prediction score : 0.54 Monomeric hydrophicity matching model chain A : 0.94 3D Compatibility (PKB) : -52.46 2D Compatibility (Sec. Struct. Predict.) : 0.54 1D Compatibility (Hydrophobicity) : 0.94 QMean score : 0.536

(partial model without unconserved sides chains): PDB file : Tito_4TYM.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4TYM-query.scw PDB file : Tito_Scwrl_4TYM.pdb: