Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MIREILLADTHNYYGILDERFIDLAHQFSRLQDA-RTGQGGAALAVYF-RGQKVVDIYTGLKSQ-------TEAWQPDTLAVCYSTGKGVLATLAHILVSEGFLEYDKPIATYWPEFAQN----------------GKEQMTLRHVLSHQSGMFDVRNIIESARE-----MLDW-SHM-LVVVAATKPRFLAGEGNAYQALTFGWLVGGVLEKATGQSLDQLMQNYLVEPLQLDGAYFGTPANEL--DRV-ARLIIQPKPEKPASTQVEKPKKPQTRKSSLSEKVITWTGQDPQDFQDAMIPKGMKNFSFFSDEGLQAVIPAANGTFTANSLAKIYAMLANQGEWDGQQLIRPEVFKELSTIQSYARDR-------------------VMPIPMNWRLGYHRIITMGKRAKNGFGHIG-----YNGSGAWCDPERDLSFAYTHNLQIGSIT-GDYRLWGLTQEALRCTDQILKGRKGWF 3HLF Chain:A ((21-430)) --------GSIIDAAAAAGPVVLMETAFRKAVESRQ--IPGAVIMARDASGNLNYTRCFGARTVRRDENNQLPPLQVDTPCRLAAATKLLTTIMVLQCMERGLVDLDETVDRLLPDLSAMPVLEGFDDAGNARLRERRGKITLRHLLTHTSGLSYVF-LHPLLREYMAQGYLQSAEKFGIQSRLAPPAVNDPGAEWIYGT-NL-DWAGKLVERATGLDLEQYLQENICAPLGITDMTFKLQQRPDMLARRADQTHRN--SADGR-------------------------------------LRY-DDSVYFR-ADGEECFGGQGVFSSPGSYMKVLHSLLKRDG----LLLQPQTVDLMFQPALEPRLEEQMNQHMDASPHINYGGPMPMVLRRSFGLGGIIALEDL-DGENWRRKGSLTFGGGPNIVWQIDPKAGLCTLAFFQLEPWNDPVCRDLTRTFEHAIYAQYQ----------

General information: TITO was launched using: RESULT: Template: 3HLF.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 : 1617 -14748 -9.12 -42.14 target 2D structure prediction score : 0.60 Monomeric hydrophicity matching model chain A : 0.64 3D Compatibility (PKB) : -9.12 2D Compatibility (Sec. Struct. Predict.) : 0.60 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.436

(partial model without unconserved sides chains): PDB file : Tito_3HLF.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3HLF-query.scw PDB file : Tito_Scwrl_3HLF.pdb: