Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKMLLVLFDKQGQILLCRNPSGYSVPTNGAEVDEGFGFGSPQEENRWFWENCGLLVYRRYICFYKDYCAAVFELYGEGNVGKEFIWMDSGSLDKFIVGNSLTVLLKAVMKNYNCSKTVSWVNKDGFQPYLNWALKAAGSDTQLTYGKIEQIKNTYVSTIFRFQAGEEIFYLKIPGKTYL---NDAVHIEKFLVN--STYGLPEITAVYPDGN--AFLAKAMGGHDLSVETD-MVFLEQVVEQWADMQQRFTEKQDAFSSKIPLLHNYTAEGIMKRIDNFPSEVSDIFAFLNEQSNAVDAAKTGQMIREVKRLLSLLAKCKVPD--TLCHGDLRPGNIRVVNGF-CFLYDWGMGMYGHPFYDVVHFLHVTRRQLS-QEMQEKIKNTYLKQWEMYGTGKDILRNYETVERLKDFFMVLADADWLMETIEAVGGKVPEGSMDSWLLMRRVYYFRRVLGRFLAGDNN 1J7L Chain:A ((2-264)) ------------------------------------------------------------------------------------------------AKMRISPELKKLIEKYR------------------CVKDTEGMSPA---------------KVYKLVGENENLYLKMTDSRYKGTTYDVEREKDMMLWLEGKLPVPKVLHFERHDGWSNLLMSEADGVLCSEEYEDEQSPEKIIELYAECIRLFHS------------IDISDCPYTNSLDSRLAELDYLLNNDLADVDCENWEED-TPFKDPRELYDFLKTEKPEEELVFSHGDLGDSNIFVKDGKVSGFIDLGRSGRADKWYDIAFCVRSIREDIGEEQYVELFFDLL-----GIKPDWEKIKYYILLDELF-----------------------------------------------------

General information: TITO was launched using: RESULT: Template: 1J7L.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 : 1137 -6439 -5.66 -25.65 target 2D structure prediction score : 0.67 Monomeric hydrophicity matching model chain A : 0.59 3D Compatibility (PKB) : -5.66 2D Compatibility (Sec. Struct. Predict.) : 0.67 1D Compatibility (Hydrophobicity) : 0.59 QMean score : 0.199

(partial model without unconserved sides chains): PDB file : Tito_1J7L.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1j7l-query.scw PDB file : Tito_Scwrl_1J7L.pdb: