Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MLLMIDNYDSFTYNIVQYFGELNQEVKVVRNDQVTLEDIERWQPKYLVIGPGPCSPSEVGISIPAI-NHFA-GKIPLFGVCLGHQSIGQAFGGKIVRAKTVMHGRLSDMYHS-NKGIFSNLPSPFSATRYHSLVIDQETLPDCLEVTCWTNEADGSMEEIMGVKHKTLPVEGVQFHPESILSQHGHQIFKNFLDIYA 2VXO Chain:B ((31-223)) AVVILDAGAQYGKVIDRRVRELFVQSEIFPLETPAF-AIKEQGFRAIIISGGPNSVYAED--APWFDPAIFTIGKPVLGICYGMQMMNKVFGGTVHKKS---DGVF-NISVDNTCSLFRGLQKEEVVLLTHGDSVD--KVADGFKVVARSGN-----I-VAGIANESKKLYGAQFHPEVGLTENGKVILKNFLYD--

General information: TITO was launched using: RESULT: Template: 2VXO.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 1007 -67957 -67.48 -383.94 target 2D structure prediction score : 0.64 Monomeric hydrophicity matching model chain B : 0.69 3D Compatibility (PKB) : -67.48 2D Compatibility (Sec. Struct. Predict.) : 0.64 1D Compatibility (Hydrophobicity) : 0.69 QMean score : 0.388

(partial model without unconserved sides chains): PDB file : Tito_2VXO.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2VXO-query.scw PDB file : Tito_Scwrl_2VXO.pdb: