Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence --------------------------------------------------MEQIRPFPPTDFIDQADDEEATRLTPAPDLMDWVVKNYLTVDGELYNPDHDHIAELIHENEGFLAFAWASQACTVK--KQMVSGQCEKVMFNVGGWRKARQEQQMRDWFGYVPVYLITIDASYCEQATDRDFCALIEHELYH-IGVER--DEDGEPLYSEMTGLPKHYLAGHDVEEFVGVVKRWGADENVKRLIEVAKQAPFVSDVNISKCCGTCLIN------------------------------------------------------------------------------------------------------------------------------- 4QA5 Chain:A ((14-377)) LVPVYIYSPEYVSMCDSLAKIPKRASMVHSLIEAYALHKQMRIVKPKVASMEEMATFHTDAYLQHLQKVSQEGDDDHPDSIE-------------YGLGYDCPA-----TEGIFDYAAAIGGATITAAQCLIDGMCKVAINWSGGWHHAKKDEA--SGFCYLNDAVLGILRL--RRKFERILYVDLD--LHHGDGVEDTFSFTSKVMTVSLHKFSPGFFPGT------GDVSDVGLGKGRYYSVNVPIQ-DGIQDEKYYQICESVLKEVYQAFNPKAVVLQLGADTIAGDPMCSFNMTPVGIGKCLKYILQWQLATLILGGGGFNLANTARCWTYLTGVILGKTLSSEIPDHEFFTAYGPDYVLEITPSCRPDRNEPHRIQQILNYIKGNLKHVV

General information: TITO was launched using: RESULT: Template: 4QA5.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 : 880 28282 32.14 155.40 target 2D structure prediction score : 0.38 Monomeric hydrophicity matching model chain A : 0.57 3D Compatibility (PKB) : 32.14 2D Compatibility (Sec. Struct. Predict.) : 0.38 1D Compatibility (Hydrophobicity) : 0.57 QMean score : 0.264

(partial model without unconserved sides chains): PDB file : Tito_4QA5.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4QA5-query.scw PDB file : Tito_Scwrl_4QA5.pdb: