Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNTSTAKHNYAPDILGAGYEQLTLNFPDDYEGKVVATLVRKKATQPTQKAVLYIHGFLDYF---FQTEMAEQFNAHGYDFYALDLRKYGRSKLPHQIFYNVLDLIEYDAEITQALEIIGQE-KHTQVLLAGHSTGGLTATLYAAHHPDHPLIKALWANSPFYDFNLSLVEKKFGIPMLSRVGKYLPKVKFPSQLNKWYTTSLHKQLKGEWDFNLDWKPTSAPTVQLSFVHAIHTAQKEIHRGVKLNIPALIMHSHQTKNPRKWGPDATQSDVILDVKDIAKFGKKMKGDVSVVSIHNGLHDLVLSAQPVREQVYQQLFQWLDQKVT 3QM1 Chain:A ((21-265)) -------------------GMATITLERDGL-QLVGTREEPFG--EIYDMAIIFHGFTANRNTSLLREIANSLRDENIASVRFDFNGHGDSDGK-F---ENMTVLNEIEDANAILNYVKTDPHVRNIYLVGHAQGGVVASMLAGLYP--DLIKKVVLLAPAATLKGDALEGN-----TQGVT-YNPD-HIP----DRLP--F-----KDLTLG-------------GFYLRIAQQLPIYEVSAQFTKPVCLIHGTDD--------------TVVSPNASKKYDQIY-QNSTLHLIEGADHCFSDSYQK---NAVNLTTDFLQ----

General information: TITO was launched using: RESULT: Template: 3QM1.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 : 1446 -14757 -10.21 -61.23 target 2D structure prediction score : 0.49 Monomeric hydrophicity matching model chain A : 0.67 3D Compatibility (PKB) : -10.21 2D Compatibility (Sec. Struct. Predict.) : 0.49 1D Compatibility (Hydrophobicity) : 0.67 QMean score : 0.461

(partial model without unconserved sides chains): PDB file : Tito_3QM1.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3QM1-query.scw PDB file : Tito_Scwrl_3QM1.pdb: