Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MGIINGKEFIDRLNKLENEIWYDGEKIKGNISEHPAFKGIIKTKSSLYELQTKDELIHEMTYCLPGDHNRIGLSYLQPKTKNDLKKRRTMIEHWARHTHGM-MGRSPDYMNTVMMSFASSAELLK-----DKENCFPEHILDMYEQAAKHDLSFTHTFITPQVNRSQSYFGLSEKPISAKVIDRTEKGLMIHGARLLATQGGLTDEILVFSAPKFFFET-DEAYAFSIPSNTKGVKFITRESFVLSDSSFNHPLSSRYEEMDSIVVFDHVLVPWNRVFFYDNVEAAKDFMTKSSFHAFTFHQVVIRQMIKIEFLLGVAQLLVDTINVSEYQHIQEKLSEIIVGLETIKALIDKSENDAQLDEFGYMRPCLIPLQVISTIIPKLYPRFTEIIQLIGASGMVTLPTENAFDSE-IREDLDQYLQATNTNAEERVKIFRLAWDLTMSSFGTRQTHYERYFFGDPIRISSRLYTSYPKQE---QLNMIKTFLHADTEH 4G5E Chain:A ((2-483)) --IRTGKQYLESLN-DGRNVWVGNEKID-NVATHPKTRDYAQRHADFYDLHHRPDLQDVMTFVDKD-GERRTMQWFGHYDKEQLRRKRKYHETIMREMAGASFPRTPDVNNYVLQTYIDDPSPWETQTIGAEGKVKAKNIVDFVNFAKKHDLNCAPQFVDPQM-------------PGLRVIEKNDKGIVVSGVKAIGTGVAFADWIHIGVFFR-PGIPGDQIIFAATPVNTPGVTIVCRESVVKE-DPIEHPLASQGDELDGMTVFDNVFIPWSHVFHLGNPEHAKLYPQ--RVFDWLHYHALIRQSVRAELMAGLAILITEHIGTNKIPAVQTRVAKLIGFHQAMLAHIVASEELGFHTPGGAYKPNILIYDFGRALYLENFSQMIYELVDLSGRSALIFASEDQWNDEALNGWFERMNNGPVGQPHDRVKIGRVIRDLFLTDWGNRLFVFENFNGTPLQAIRMLTMQRAEFSAAGPYGTLARKVCGIELT-

General information: TITO was launched using: RESULT: Template: 4G5E.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 : 2408 -67094 -27.86 -145.86 target 2D structure prediction score : 0.60 Monomeric hydrophicity matching model chain A : 0.74 3D Compatibility (PKB) : -27.86 2D Compatibility (Sec. Struct. Predict.) : 0.60 1D Compatibility (Hydrophobicity) : 0.74 QMean score : 0.483

(partial model without unconserved sides chains): PDB file : Tito_4G5E.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4G5E-query.scw PDB file : Tito_Scwrl_4G5E.pdb: