data_AVS_bmrb_pdb_report_30160 save_AVS_chem_shift_analysis _AVS_report.Sf_category AVS_report _AVS_report.Sf_framecode AVS_chem_shift_analysis _AVS_report.Entry_ID 30160 _AVS_report.ID 1 _AVS_report.Software_ID 1 _AVS_report.Software_label $AVS loop_ _AVS_analysis.Assembly_ID _AVS_analysis.Entity_assembly_ID _AVS_analysis.Entity_ID _AVS_analysis.Comp_index_ID _AVS_analysis.Comp_ID _AVS_analysis.Comp_overall_assignment_score _AVS_analysis.Comp_typing_score _AVS_analysis.Comp_SRO_score _AVS_analysis.Comp_1H_shifts_analysis_status _AVS_analysis.Comp_13C_shifts_analysis_status _AVS_analysis.Comp_15N_shifts_analysis_status _AVS_analysis.SRO_rule_break _AVS_analysis.SRO_rule_break_probability _AVS_analysis.Entry_ID _AVS_analysis.AVS_report_ID 1 1 1 26 ARG Anomalous Consistent Consistent Consistent Consistent Anomalous . . 30160 1 1 1 1 29 ARG Anomalous Consistent Consistent Consistent Consistent Anomalous . . 30160 1 stop_ loop_ _AVS_analysis.Assembly_ID _AVS_analysis.Entity_assembly_ID _AVS_analysis.Entity_ID _AVS_analysis.Comp_index_ID _AVS_analysis.Comp_ID _AVS_analysis.Atom_ID _AVS_analysis.Observed_chem_shift _AVS_analysis.Observed_chem_shift_typing _AVS_analysis.Stat_chem_shift_expected _AVS_analysis.Stat_chem_shift_std _AVS_analysis.Stat_chem_shift_chi_sqr _AVS_analysis.Entry_ID _AVS_analysis.AVS_report_ID 1 1 1 26 ARG C 176.787 . 176.41 2.03 8.5267e-01 30160 1 1 1 1 26 ARG CA 58.871 . 56.77 2.31 3.6307e-01 30160 1 1 1 1 26 ARG CB 30.001 . 30.7 1.83 7.0249e-01 30160 1 1 1 1 26 ARG CG 28.538 . 27.21 1.2 2.6844e-01 30160 1 1 1 1 26 ARG CD 43.308 . 43.16 0.88 8.6644e-01 30160 1 1 1 1 26 ARG H 8.965 . 8.24 0.61 2.3463e-01 30160 1 1 1 1 26 ARG HA 3.853 . 4.3 0.46 3.3118e-01 30160 1 1 1 1 26 ARG HB2 1.868 . 1.79 0.27 7.7267e-01 30160 1 1 1 1 26 ARG HB3 1.771 . 1.76 0.28 9.6866e-01 30160 1 1 1 1 26 ARG HG2 1.618 . 1.57 0.27 8.5890e-01 30160 1 1 1 1 26 ARG HG3 1.740 . 1.54 0.29 4.9041e-01 30160 1 1 1 1 26 ARG HD2 3.199 . 3.12 0.24 7.4203e-01 30160 1 1 1 1 26 ARG HD3 3.199 . 3.1 0.26 7.0337e-01 30160 1 1 1 1 26 ARG HE 7.295 . 7.4 0.63 8.6763e-01 30160 1 1 1 1 26 ARG N 128.676 . 120.8 3.68 3.2337e-02 30160 1 1 1 1 26 ARG NE 116.438 A 84.63 1.68 6.0603e-80 30160 1 1 1 1 29 ARG C 175.712 . 176.41 2.03 7.3096e-01 30160 1 1 1 1 29 ARG CA 57.546 . 56.77 2.31 7.3692e-01 30160 1 1 1 1 29 ARG CB 26.440 . 30.7 1.83 1.9919e-02 30160 1 1 1 1 29 ARG CG 28.311 . 27.21 1.2 3.5888e-01 30160 1 1 1 1 29 ARG CD 43.660 . 43.16 0.88 5.6991e-01 30160 1 1 1 1 29 ARG H 8.006 . 8.24 0.61 7.0127e-01 30160 1 1 1 1 29 ARG HA 3.748 . 4.3 0.46 2.3014e-01 30160 1 1 1 1 29 ARG HB2 2.029 . 1.79 0.27 3.7606e-01 30160 1 1 1 1 29 ARG HB3 2.338 . 1.76 0.28 3.8991e-02 30160 1 1 1 1 29 ARG HG2 1.261 . 1.57 0.27 2.5244e-01 30160 1 1 1 1 29 ARG HG3 1.420 . 1.54 0.29 6.7903e-01 30160 1 1 1 1 29 ARG HD2 3.234 . 3.12 0.24 6.3479e-01 30160 1 1 1 1 29 ARG HD3 3.188 . 3.1 0.26 7.3502e-01 30160 1 1 1 1 29 ARG HE 7.302 . 7.4 0.63 8.7638e-01 30160 1 1 1 1 29 ARG N 115.697 . 120.8 3.68 1.6554e-01 30160 1 1 1 1 29 ARG NE 116.940 A 84.63 1.68 1.9922e-82 30160 1 stop_ loop_ _AVS_analysis.Assembly_ID _AVS_analysis.Entity_assembly_ID _AVS_analysis.Entity_ID _AVS_analysis.Comp_index_ID _AVS_analysis.Comp_ID _AVS_analysis.PRTL_comp_type _AVS_analysis.PRTL_probability_score _AVS_analysis.Entry_ID _AVS_analysis.AVS_report_ID 1 1 1 26 ARG CYS 0.47 30160 1 1 1 1 26 ARG ARG 0.36 30160 1 1 1 1 26 ARG LYS 0.09 30160 1 1 1 1 26 ARG GLY 0.06 30160 1 1 1 1 29 ARG CYS 0.47 30160 1 1 1 1 29 ARG LEU 0.21 30160 1 1 1 1 29 ARG GLY 0.12 30160 1 1 1 1 29 ARG ARG 0.09 30160 1 1 1 1 29 ARG LYS 0.08 30160 1 stop_ save_ save_AVS _Software.Sf_category software _Software.Sf_framecode AVS _Software.Entry_ID 30160 _Software.ID 1 _Software.Name "AutoPeak - validate_assignments" _Software.Version 2011-12-10 _Software.Details ; Original version modified by BMRB to export results in a BMRB STAR format. Changed status "Misassigned" to "Anomalous" ; loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID "Hunter Moseley" ; Center for Advanced Biotechnology and Medicine Rutgers University 679 Hoes Lane, Piscataway NJ 08854-5638 ; hunter@cabm.rutgers.edu 30160 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID "validate protein chemical shift assignments" 30160 1 stop_ loop_ _Software_citation.Citation_ID _Software_citation.Citation_label _Software_citation.Entry_ID _Software_citation.Software_ID 2 $AVS_citation 30160 1 stop_ save_ save_AVS_citation _Citation.Sf_category citation _Citation.Sf_framecode AVS_citation _Citation.Entry_ID 30160 _Citation.ID 2 _Citation.Class citation _Citation.PubMed_ID 14872126 _Citation.Full_citation ; Moseley HN, Sahota G, Montelione GT., Assignment validation software suite for the evaluation and presentation of protein resonance assignment data. J Biomol NMR. 28, 341-55 (2004) ; _Citation.Status published _Citation.Type journal save_