Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MENLKKMAGIKAAEFVSDGMVVGLGTGSTAYYFVEEIGRRIKEEGLQITAVTTSSVTTKQAEGLNIPLKSIDQVDFVDVTVDGADEVDSQFNGIKGGGGALLMEKVVATPSKEYIWVVDESKLVEKLGAFKLPVEVVQYGAEQVFRHFERAG------YKPSFREKDGQRFVTDMQNFIIDLALDVIENPIAFGQELDHVVGVVEHGLFNQMVDKVIVAGRDGVQISTSKKGK 3HHE Chain:B ((24-244)) VQQLKKMAALKALEFVEDDMRLGIGSGSTVNEFIPLLGERVAN-GLRVTCVATSQYSEQLCHKFGVPISTLEKIPELDLDIDGADEIGPEMTLIKGGGGALLHEKIVASASRAMFVIADETKMVKTLGAFALPIEVNPFGIHATRIAIEKAADNLGLSGEITLRMNGDDPFKTDGGHFIFDAFWGRILQPKLLSEALLAIPGVVEHGLFLGLASRAIVAMAD-----------

General information: TITO was launched using: RESULT: Template: 3HHE.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 : 1209 -106088 -87.75 -493.43 target 2D structure prediction score : 0.47 Monomeric hydrophicity matching model chain B : 0.80 3D Compatibility (PKB) : -87.75 2D Compatibility (Sec. Struct. Predict.) : 0.47 1D Compatibility (Hydrophobicity) : 0.80 QMean score : 0.415

(partial model without unconserved sides chains): PDB file : Tito_3HHE.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3HHE-query.scw PDB file : Tito_Scwrl_3HHE.pdb: