Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTNSLKNDKIGEIFDYQIFKEGIVSYFEQFMQANQAYVALHGQLNLPLKPKTRVAIVTCMDPRLHVAQALGLALGDAHILRNAGGRVTEDMIRSLVISQQQMGTREIVVLHHTDCGAQTFENEPFQEYLKEELGVD------------------VSDQDFLPFQD----------------IEESVREDMQLLIESPLI----PDDVIISGAIYNVDTGSMTVVEL 3VQJ Chain:A ((32-206)) ----------------------------------------------PIQPSRRVAVVACMDARLDVEDLLGLQTGEAHIIRNAGGVINEDAIRCLIISHHLLNTHEIILVHHTRCGMLAFTDDLLRAGLEGDAAAEKLIGQATGRAFVSAGKASASPAAFQAFRGPPEPLDAPRSDASTERIAADVRRGLSIILNHPWLPTAGPDAITVRGFIYDVDTGRL-----

General information: TITO was launched using: RESULT: Template: 3VQJ.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 : 530 -41106 -77.56 -300.04 target 2D structure prediction score : 0.71 Monomeric hydrophicity matching model chain A : 0.72 3D Compatibility (PKB) : -77.56 2D Compatibility (Sec. Struct. Predict.) : 0.71 1D Compatibility (Hydrophobicity) : 0.72 QMean score : 0.564

(partial model without unconserved sides chains): PDB file : Tito_3VQJ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3VQJ-query.scw PDB file : Tito_Scwrl_3VQJ.pdb: