Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MDQKDFRENLELKPVTQEHIDQFNELLSYVFQVTEADIEESGFENKRAFIRSKKPILEVSKVFGWFHENKLISQIAIYPCEVNIHGARYKMGGVTGVGTYPEYANHGLMQDLIIVALDNMRKNKQWISYLYPYSIPYYRRKGWEIMSDKLSFKIRDTQLPKQIPVSGMVERLP-VDHPDVFS-VYDKFAQQNHGALFRSDFHWEEYWRFENEDERTAAVYYDSNHEPRGVLFYWVAEEIFHVKEMFYLDQEARNGLWNFISAHFSMI---YWVHGDIYKNEPLAFLIEDSQIKEQIEPYFMARIVDVKEFLQRFPF-VGTADAFHFIIEDPVAPWNNGVFALTWDEQGQVRVLNEPIGK--SVRLDIQTLTCLMMNYRRASYLARIERLETDEETLKSLERIIPNMEAYFSDYF 2HV2 Chain:A ((43-400)) -------------------------------------------------------LLSHTQSYGFLIDEQLTSQVMATPFQVNFHGVRYPMAGIGYVASYPEYRGEGGISAIMKEMLADLAKQKVALSYLAPFSYPFYRQYGYEQTFEQAEYTIKTEDWPRVKRVPGTIKRVSWADGKEVIKDVYLENQRAHSGGVIRETW-WLDYTLNRASKPNNQAIYYSSEGKAEGYVIYRIAAGTFEIVEWNYLTNTAFKALAGFIGSHSGSVQSFHWING--FAGKDLNDLMPTPAASVKILPYMMARIVELQTFLEKYPFQSGEKETYSLEIEDSYGPWNEGIWTITIDEQGKATVTKGAA--TAALKADIQTWTQLFLGYRSAETLSFYERLQGDATIAQRLGQRLVKGMPILEDYF

General information: TITO was launched using: RESULT: Template: 2HV2.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 : 1733 -75643 -43.65 -218.62 target 2D structure prediction score : 0.59 Monomeric hydrophicity matching model chain A : 0.76 3D Compatibility (PKB) : -43.65 2D Compatibility (Sec. Struct. Predict.) : 0.59 1D Compatibility (Hydrophobicity) : 0.76 QMean score : 0.458

(partial model without unconserved sides chains): PDB file : Tito_2HV2.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2HV2-query.scw PDB file : Tito_Scwrl_2HV2.pdb: