Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MREDTKVYDITIIGGGPVGLFTAFYGGMRQASVKIIESLPQLGGQLSALYPEKYIYDVAGFPKIRAQELINNLKEQMAKFDQTICLEQAVESVEKQADGVFKLVTN-EETHYSKTVIITAGNGAFKPRKLELENAEQYEGKNLH-YFVDDLQKFAGRRVAILGGGDSAVDWALMLEPIAKEVSIIHRRDKFRAHEHS-VENLHASKVNVLTPFVPAELIGE-DKIEQLVLEEVKGDRKEILEIDDLIVNYGFVSSLGPIKNWGLDIEKNSIVVKSTMETNIEGFFAAGDICTYEGKVNLIASGFGEAPTAVNNAKAYMDPKARVQPLHSTSLFENK 4GCM Chain:A ((4-308)) ----EIDFDIAIIGAGPAGMTAAVYASRANLKTVMIERGI-PGGQMANTEE---VENFPGFEMITGPDLSTKMFEHAKKFGAVYQYG-DIKSVEDK--GEYKVINFGNKELTAKAVIIATGAE---YKKIGVPGEQELGGRGVSYCAVCDGAFFKNKRLFVIGGGDSAVEEGTFLTKFADKVTIVHRRDELRAQRILQDRAFKNDKIDFIWSHTLKSINEKDGKVGSVTLTSTKDGSEETHEADGVFIYIGMKPLTAPFKDLGITNDVGYIVTKDDMTTSVPGIFAAGDVRDK-G-LRQIVTATGDGSIAAQSAAEYIEHL---------------

General information: TITO was launched using: RESULT: Template: 4GCM.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 : 1804 -41288 -22.89 -137.17 target 2D structure prediction score : 0.46 Monomeric hydrophicity matching model chain A : 0.75 3D Compatibility (PKB) : -22.89 2D Compatibility (Sec. Struct. Predict.) : 0.46 1D Compatibility (Hydrophobicity) : 0.75 QMean score : 0.490

(partial model without unconserved sides chains): PDB file : Tito_4GCM.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4GCM-query.scw PDB file : Tito_Scwrl_4GCM.pdb: