Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MVIIKKKFTVLLTIIVTGIMSGFALVSINKQVLYR-TNEFFHQTDTYTPIRLPQHFIGQEEYEQLIMVFENVSSETELSYMKKTVNESNEVDTSWNFKIQPKLEMTLYYQGDVKSSHEKVPYSNTSFRVTSIEESIKIKDFEGEFFLMTREKEAYERFISLFTDRFN---------QAFHTDYATNIFEDFENSYSYSVISNTDVYNYRVYLTIGLILLFLLLSSFFLLMNKEISLLLNNDFSLHQVLWCLLGKKK-----------IIITFIIAGIIGGFIFMYYKEQFLYLFQMYVFLFSGIYGISLISLLLVEKIASLREAFNYIQYILFTFGLLFSLLLTVANVELATIVFSSSQLAVSHEPPKEIAGEDYHVFYPVTIGKNHVDFIYSNRFASAADQELYETLNKN----GSILVNVSDYLNEENEQFGRGIKINLNYLKKFPLIDVSGRLIQITEKETHPVILIPERYRHTDLKNDLAQITEYYQEISEK---EPKFLFIKNNQPIYTFIPSIPWIEHYPVVEIL--TLKNSMYLERNILSGEIYPPLKIKIGSLSKERLFELIEESQLRDNLQLSFPYTQTEEIAVKVLSRSFHYLIQIFLLTFFSFFLLSYVMLCIYFVYNCRKIAIFRSSGYSLFETYKDFFMMNLIKWGTTSVIFLFLIEREPKYLFNIFFFSFIDFILSVVFILSTEKKSQLLLMNGG 4R1D Chain:A ((45-561)) ------QTAPLPVIFIPGIMGTNLRNKADKSEVWRPPNGLWPMDD-------------LFASIGALWTWAWRGPKARQELLK---AEQVEVDD----------------QGTIDVGQ-----SGLS------EEAARLR---GWGKVM---RSAYNPVMGLMERRLDNIVSRRELQAWWNDEALSPPGDQGEEQGKVGPIDEEELLRASRY------QFDVWCAGYNWLQSNRQSALDVRDYIENTVLPFYQKECGLDPEQMRRMKVILVTHSMGGLVARALTQLHGYERVLGVVHGVQPATG-------SSTIYHHMRCGYEGIAQV-----VLG---------RNAGEVTAIVANSAGALELAPSAEYREGRPWLFLCDAQGQVLKD-IDGKPRAYPQNQDPYEEIYKNTTWYGLVPEQNSQYLDMSDKKEGLRVG------------------------------------PRDNFEDLIDSIANFHGELSAAGYHSETYAHYGADDSRHSW-RDLIWKGDPTPLETPGATLNDDENGTYNSWFRRGLP--TIVQGPLETGN--PLDASGSGGDE---TVPTDSGQAPALAGVKASFRHG-------------------------SKGKGQANTKRGYEHQESYND----ARAQWAALYGVIKITQLADW------------------------------------

General information: TITO was launched using: RESULT: Template: 4R1D.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 : 2792 56440 20.21 115.89 target 2D structure prediction score : 0.42 Monomeric hydrophicity matching model chain A : 0.58 3D Compatibility (PKB) : 20.21 2D Compatibility (Sec. Struct. Predict.) : 0.42 1D Compatibility (Hydrophobicity) : 0.58 QMean score : 0.201

(partial model without unconserved sides chains): PDB file : Tito_4R1D.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4R1D-query.scw PDB file : Tito_Scwrl_4R1D.pdb: