data_AVS_bmrb_pdb_report_30478 save_AVS_chem_shift_analysis _AVS_report.Sf_category AVS_report _AVS_report.Sf_framecode AVS_chem_shift_analysis _AVS_report.Entry_ID 30478 _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 1 130 ARG Anomalous Consistent Consistent Suspicious Consistent Anomalous . . 30478 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 1 130 ARG CA 54.948 . 56.77 2.31 4.3026e-01 30478 1 1 1 1 130 ARG CB 34.883 . 30.7 1.83 2.2266e-02 30478 1 1 1 1 130 ARG CG 28.565 . 27.21 1.2 2.5883e-01 30478 1 1 1 1 130 ARG CD 43.796 . 43.16 0.88 4.6985e-01 30478 1 1 1 1 130 ARG H 8.554 . 8.24 0.61 6.0672e-01 30478 1 1 1 1 130 ARG HA 4.676 . 4.3 0.46 4.1371e-01 30478 1 1 1 1 130 ARG HB2 1.032 . 1.79 0.27 4.9942e-03 30478 1 1 1 1 130 ARG HB3 1.63 . 1.76 0.28 6.4244e-01 30478 1 1 1 1 130 ARG HG2 1.102 . 1.57 0.27 8.3037e-02 30478 1 1 1 1 130 ARG HG3 1.483 . 1.54 0.29 8.4418e-01 30478 1 1 1 1 130 ARG HD2 2.023 S 3.12 0.24 4.8579e-06 30478 1 1 1 1 130 ARG HD3 3.213 . 3.1 0.26 6.6384e-01 30478 1 1 1 1 130 ARG HE 8.742 . 7.4 0.63 3.3159e-02 30478 1 1 1 1 130 ARG HH11 6.818 . 6.91 0.46 8.4148e-01 30478 1 1 1 1 130 ARG HH21 6.879 . 6.81 0.48 8.8570e-01 30478 1 1 1 1 130 ARG N 121.194 . 120.8 3.68 9.1474e-01 30478 1 1 1 1 130 ARG NE 82.82 . 84.63 1.68 2.8131e-01 30478 1 1 1 1 130 ARG NH1 66.697 A 73.82 4.62 1.2313e-01 30478 1 1 1 1 130 ARG NH2 66.84 A 73.26 3.32 5.3146e-02 30478 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 1 130 ARG CYS 0.55 30478 1 1 1 1 130 ARG GLY 0.24 30478 1 1 1 1 130 ARG ARG 0.1 30478 1 1 1 1 130 ARG LYS 0.1 30478 1 stop_ save_ save_AVS _Software.Sf_category software _Software.Sf_framecode AVS _Software.Entry_ID 30478 _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 30478 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID "validate protein chemical shift assignments" 30478 1 stop_ loop_ _Software_citation.Citation_ID _Software_citation.Citation_label _Software_citation.Entry_ID _Software_citation.Software_ID 2 $AVS_citation 30478 1 stop_ save_ save_AVS_citation _Citation.Sf_category citation _Citation.Sf_framecode AVS_citation _Citation.Entry_ID 30478 _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_