data_AVS_bmrb_pdb_report_15958 save_AVS_chem_shift_analysis _AVS_report.Sf_category AVS_report _AVS_report.Sf_framecode AVS_chem_shift_analysis _AVS_report.Entry_ID 15958 _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 62 ARG Anomalous Consistent Consistent Consistent Consistent Anomalous . . 15958 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 62 ARG CA 56.698 . 56.95 2.41 9.1672e-01 15958 1 1 1 1 62 ARG CB 31.230 . 30.66 1.77 7.4743e-01 15958 1 1 1 1 62 ARG CG 26.638 . 27.31 1.65 6.8381e-01 15958 1 1 1 1 62 ARG CD 43.462 . 43.1 1.1 7.4209e-01 15958 1 1 1 1 62 ARG H 8.557 . 8.24 0.6 5.9727e-01 15958 1 1 1 1 62 ARG HA 4.201 . 4.27 0.44 8.7539e-01 15958 1 1 1 1 62 ARG HB2 2.075 . 1.79 0.28 3.0875e-01 15958 1 1 1 1 62 ARG HB3 2.296 . 1.78 0.28 6.5350e-02 15958 1 1 1 1 62 ARG HG2 1.617 . 1.58 0.27 8.9100e-01 15958 1 1 1 1 62 ARG HG3 1.894 . 1.58 0.27 2.4484e-01 15958 1 1 1 1 62 ARG HD2 3.122 . 3.13 0.23 9.7225e-01 15958 1 1 1 1 62 ARG HD3 3.307 . 3.13 0.22 4.2108e-01 15958 1 1 1 1 62 ARG HH11 7.119 . 6.74 0.31 2.2149e-01 15958 1 1 1 1 62 ARG HH12 6.985 . 6.75 0.32 4.6272e-01 15958 1 1 1 1 62 ARG HH21 7.512 . 6.72 0.32 1.3324e-02 15958 1 1 1 1 62 ARG HH22 7.600 . 6.72 0.33 7.6608e-03 15958 1 1 1 1 62 ARG N 119.448 . 120.61 3.9 7.6574e-01 15958 1 1 1 1 62 ARG NH2 128.470 A 75.84 11.44 4.2143e-06 15958 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 62 ARG ARG 0.42 15958 1 1 1 1 62 ARG CYS 0.38 15958 1 1 1 1 62 ARG LYS 0.1 15958 1 1 1 1 62 ARG GLY 0.08 15958 1 stop_ save_ save_AVS _Software.Sf_category software _Software.Sf_framecode AVS _Software.Entry_ID 15958 _Software.ID 1 _Software.Name "AutoPeak - validate_assignments" _Software.Version 1.4 _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 15958 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID "validate protein chemical shift assignments" 15958 1 stop_ loop_ _Software_citation.Citation_ID _Software_citation.Citation_label _Software_citation.Entry_ID _Software_citation.Software_ID 2 $AVS_citation 15958 1 stop_ save_ save_AVS_citation _Citation.Sf_category citation _Citation.Sf_framecode AVS_citation _Citation.Entry_ID 15958 _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_