Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MQQQVIIVGGGMVGLSLSLMLAKANIAVKLLEAVKYPNYDDQNVAPYHSSFDARNTALSRRSVQIYQKLGLWDALQQHATPILQVHITEQGSFGKARLIAEQEKVESFGQVIENAWLGRVLLTQVRQQPLIELIDGVQVTALTQDAEQVHIEAQRGDEVLKLESKLLIAADGRDSFCRQAIGVGVDVHDYDQVAIVTTVQTSKPHEHVGFERFSALGPLALLPLPGEYRRSVVWPVKKGTEGEWLGEENDQHFLDALQKTYGDRAGKFEKTGKRFSYPLSQVLAHKQAVGRIILMGNAAHTIHPVAGQGFNLCLRDADVLLRYLVNQLSASDDIGNPDNLLAYEEARLSDQQRVIKFCDTVVRGFSNQNPLLKLIRNTGLIAFDVIPGVKPLVANYAMGLKA 2QA1 Chain:A ((10-349)) SDAAVIVVGAGPAGMMLAGELRLAGVEVVVLERLVE-------------TGESRGLGFTARTMEVFDQRGILPRFGEVETSTQG-H-FGG--LP-IDFGVLE-GAWQAAKTVPQSVTETHLEQWATGL-GADIRRGHEVLSLTDDGAGVTVEVRGPEGKHTLRAAYLVGCDGGRSSVRKAAGFDFPGTAATMEMYLADIKGVEL-QPRMIGETLPGGMVMVGPLPG-GITRIIVCERGTP-P----PPSWHEVADAWKRLTGDDIA-HAEPVWVSAFGNATRQVTEYRRGRVILAGDSAHIHLPAGGQGMNTSIQDAVNLGWKLGAVVN-GT--ATEELLDSYHSERHAVGKRLLMNTQAQGLLF-------------------------------------

General information: TITO was launched using: RESULT: Template: 2QA1.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 : 1928 -201125 -104.32 -602.17 target 2D structure prediction score : 0.58 Monomeric hydrophicity matching model chain A : 0.66 3D Compatibility (PKB) : -104.32 2D Compatibility (Sec. Struct. Predict.) : 0.58 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.461

(partial model without unconserved sides chains): PDB file : Tito_2QA1.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2QA1-query.scw PDB file : Tito_Scwrl_2QA1.pdb: