Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTNQTARSSKKERYANLIPMEELHSEKDRLFPFPIYDKLRRESPVRYDPLRDCWDVFKYDDVQFVLKNPKLFSSKRGIQTE---SILTMDPPKHTKLRALVSRAFTPKAVKQLETRIKDVTAFLLQEARQKSTIDIIEDFAGPLPVIIIAEMLGAPIEDRHLIKTYSDVLVAGAKDSSDKAVADMVHNRRDGHAFLSDYFRDILSKRRAEPKEDLMTMLLQAEIDGEYLTEEQLIGFCILLLVAGNETTTNLIANAVRYLTEDSVVQQQVRQNTDNVANVIEETLRYYSPVQAI-GRVATEDTELGGVFIKKGSSVISWIASANRDEDKFCKPDCFKIDRPSYPHLSFGFGIHFCLGAPLARLEANIALSSLLSMSACIEKAAHDEKLEAIPSPFVFGVKRLPVRITFK 2RFB Chain:B ((1-314)) --------------------------------------MRLNDPVHYDG---AWHVYKYSDVKHVLMNDKIFSSN------GGISFITMDNPEHKEFRDISAPYFLPSKINDYKDFIEETSNDLIKNIDNK---DIISEYAVRLPVNIISKILGIPDSDMPLFKLWSDYIIGNKRDENFNYVNNRMVSR------LLEIFK--------SDSHGIINVLAGSSLKNRKLTMDEKIKYIMLLIIGGNETTTNLIGNMIRVIDENPDIIDDALKNR---SGFVEETLRYYSPIQFLPHRFAAEDSYINNKKIKKGDQVIVYLGSANRDETFFDEPDLFKIGRREM-HLAFGIGIHMCLGAPLARLEASIALNDILN-----------------------------------

General information: TITO was launched using: RESULT: Template: 2RFB.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 : 1358 -175738 -129.41 -581.91 target 2D structure prediction score : 0.66 Monomeric hydrophicity matching model chain B : 0.75 3D Compatibility (PKB) : -129.41 2D Compatibility (Sec. Struct. Predict.) : 0.66 1D Compatibility (Hydrophobicity) : 0.75 QMean score : 0.510

(partial model without unconserved sides chains): PDB file : Tito_2RFB.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2RFB-query.scw PDB file : Tito_Scwrl_2RFB.pdb: