Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MAAEPVQRRIQFVFDQYQVF-PNDNLTLCYFGMANEVYIVPTEKGRYVLKKCFKSN--TKALI-SNEVALIEQLNSYGCKTPEIVPDKEGNAYVDFDGEIYLLTKYCQDMTYNWSSEIPDKA-HCETIRAMAHFHCATDTFVPPFSDTRTTFLGLAGHSEKLAELRHHDSDTERGS-F---QQMSLFLPQLESQLNRLKAEVTQADLSQAKQCFIHGDLHCYNLFFDQD-GRYTHVIDFDFSRLDYRLADIFWTSRIIAFKLLRRRYSREQLEAWDHVLPEPQMLEILTHVWQMIIDQYRQ--VAALDDRELALVPLFAHAVPLYICHFFEYSNSEQECIEHLKWFEWELSQVERSARLNRLAIEKVLKDVA 4OCV Chain:A ((24-321)) -----TNEALFDVASHFALEGTVDSIEPYGDGHINTTYLVTTDGPRYILQRMNTGIFPDTVNLMRNVELVTSTLKAQGKETLDIVRTTSGDTWAEIDGGAWRVYKFIEHTMSYNL--VPNPDVFREAGRAFGDFQNFLSGFDANQLT--ETIAHFHDTPHRFEDFK----KALAADELGRAAGCGPEIEFYLSHADQYAVVMDGLRDGSIPLRVTHNDTKLNNILMDATTGKARAIIDLDTIMPGSMLFDFGDSIRFGASTAL-EDER------------DLDKVHFSTELFRAYTEGFVGELRDSITAREAELLPFSGNLLTM------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4OCV.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 : 1257 -5723 -4.55 -20.01 target 2D structure prediction score : 0.53 Monomeric hydrophicity matching model chain A : 0.66 3D Compatibility (PKB) : -4.55 2D Compatibility (Sec. Struct. Predict.) : 0.53 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.416

(partial model without unconserved sides chains): PDB file : Tito_4OCV.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4ocv-query.scw PDB file : Tito_Scwrl_4OCV.pdb: