Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence ----MERYDELKKGESGALVSIAAYL-----VLSAIKLIIGYLFHSEALTADGLNNTTDIIASV-AVLIGLRISQKPPDEDHPYGHFRAETIASLIASFIMMVVGLQVLFSAGESIF---SAKQET--------PDMIAAWTAAGGAVLMLIVYRYNKRLAKKVKSQAL--------LAAAADNKSDAFVSIGTFIGI---VAAQFHLAWIDTVTAFVIGLLICKTAW------DIFKESSHSLTDGFDIKDI--SAYKQTIEKISGVSRLKDIK------ARYLGS------TVHVDVVVEVSADLNITE---SHDIANEIERRMKE-----------------EHAIDYSHVHMEPLEQK----------- 4L8T Chain:A ((1359-1742)) EYLGMLQYK--REDEAKLIQNLILDLKPRGVVVNMIPGLPAHILFMCVRYADSLNDANMLKSLMNSTINGIKQVVKEHLED-------FEMLSFWLSNTCHFLNCLKQ-YSGEEEFMKHNSPQQNKNCLNNFDLSEYRQILSDVAIRIYHQFIIIMEKNIQPIIVPGMLEYESLQGYTMTSVLQQLSYFYTTMCQNGLDPELVRQAVKQLFFLIGAVTLNSLFLRKDMCSCRKGMQIRCNISYLEEWLKDKNLQNSLAKETLEPLSQAAWLLQVKKTTDSDAKEIYERCTSLSAVQIIKILNSYTPIDDFEKRVTPSFVRKVQALLNSREDSSQLMLDTKYLFQVTFPFTPSPHALEMIQIPSSFKLGFLNRL

General information: TITO was launched using: RESULT: Template: 4L8T.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 : 1034 -183688 -177.65 -656.03 target 2D structure prediction score : 0.53 Monomeric hydrophicity matching model chain A : 0.67 3D Compatibility (PKB) : -177.65 2D Compatibility (Sec. Struct. Predict.) : 0.53 1D Compatibility (Hydrophobicity) : 0.67 QMean score : 0.349

(partial model without unconserved sides chains): PDB file : Tito_4L8T.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4L8T-query.scw PDB file : Tito_Scwrl_4L8T.pdb: