Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MQQQVIIVGGGMVGLSLSLMLAKANIAVKLLEAVKYPNYDDQNVAPYHSSFDARNTALSRRSVQIYQKLGLWDALQQHATPILQVHITEQGSFGKARLIAEQEKVESFGQVIENAWLGRVLLTQVRQQPLIELIDGVQVTALTQDAEQVHIEAQRGDEVLKLESKLLIAADGRDSFCRQAIGVGVDVHDYDQVAIVTTVQTS--KPHEHVGFERF--SALGPLALLPLPGEYRRSVVWPVKKGTEGEWLGEENDQHFLDALQKTYGDRAGKFEKTGKRFSYPLSQVLAHKQAVGRIILMGNAAHTIHPVAGQGFNLCLRDADVLLRYLVNQLSASDDIGNPDNLLAYEEARLSDQQRVIKFCDTVVRGFSNQNPLLKLIRNTGLIAFDVIPGVKPLVANYAMGLKA 4K2X Chain:B ((22-386)) -RYDVVIAGAGPTGLMLACELRLAGARTLVLERLAEP------------VDFSKALGVHARTVELLDMRGLGEGFQAEAPKLRGGNFASLG-VP-LDFSSFD-TRHPYALFVPQVRTEELLTGRALEL-GAELRRGHAVTALEQDADGVTVSVTGPEGPYEVECAYLVGCDGGGSTVRKLLGIDFPGQDPHMFAVIADARFREELPHG--PYGVMRHDLRAWFAAFPLEP-DVYRATVAFFDR-----RAPVTEEDVRAALTEVAGSDF-GMHDVRWLSRLTDTSRQAERYRDGRVLLAGDACHIHLPAGGQGLNLGFQDAVNLGWKLGATIA-GT--APPELLDTYEAERRPIAAGVLRNTRAQAVLIDPD-PRYEGLRELM-----------------------

General information: TITO was launched using: RESULT: Template: 4K2X.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 1997 -131997 -66.10 -378.21 target 2D structure prediction score : 0.58 Monomeric hydrophicity matching model chain B : 0.68 3D Compatibility (PKB) : -66.10 2D Compatibility (Sec. Struct. Predict.) : 0.58 1D Compatibility (Hydrophobicity) : 0.68 QMean score : 0.449

(partial model without unconserved sides chains): PDB file : Tito_4K2X.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4K2X-query.scw PDB file : Tito_Scwrl_4K2X.pdb: