Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTKRVLITGVSSGIGLAQARLFLEKGYQVYGVDQGE----KPLLEGDFRFLQRDLTLD--LEPIFDWCPQVDVLCNTAGVLDDYKPLLEQTAQDIQEIFEINYIIPVELTRYYLTQMLENKKGIIINMCSIASSLAGGGGHAYTSSKHALAGFTKQLALDYAEAG--IQVFGIAPGAVKTAMTAADFEPGGLADWVASETPIKRWIEPEEIAELSLFLASGKASAMQGQILTIDGGWSLK 4NBT Chain:D ((7-240)) --KVAVITGGAKGLGQAIALAYAEEGAKVIAGDLGDLTYSHPNVEGMYLNVTDVTGVEKFYQSVIDKYGKIDILVNNAGITKDAMTRKMTEAQ-WDAVIDVNLKGVFNLTRLVGPQMQTNGYGSIINISSVVGVFGNIGQANYAATKAGVIGLTMTWAKEFALKGANVRVNAIAPGYIMTDILKT--VPQDLLDKFAALTMLNRLGQPEEIAKVALFLASDDASYVTGQTINVNGGMRL-

General information: TITO was launched using: RESULT: Template: 4NBT.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain D - contact count / total energy / energy per contact / energy per residue : 1244 -20854 -16.76 -92.27 target 2D structure prediction score : 0.61 Monomeric hydrophicity matching model chain D : 0.76 3D Compatibility (PKB) : -16.76 2D Compatibility (Sec. Struct. Predict.) : 0.61 1D Compatibility (Hydrophobicity) : 0.76 QMean score : 0.553

(partial model without unconserved sides chains): PDB file : Tito_4NBT.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4NBT-query.scw PDB file : Tito_Scwrl_4NBT.pdb: