data_AVS_bmrb_pdb_report_16239 save_AVS_chem_shift_analysis _AVS_report.Sf_category AVS_report _AVS_report.Sf_framecode AVS_chem_shift_analysis _AVS_report.Entry_ID 16239 _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 25 ARG Anomalous Consistent Consistent Consistent Consistent Anomalous . . 16239 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 25 ARG CA 55.519 . 56.95 2.41 5.5266e-01 16239 1 1 1 1 25 ARG CB 30.672 . 30.66 1.77 9.9459e-01 16239 1 1 1 1 25 ARG CG 27.317 . 27.31 1.65 9.9662e-01 16239 1 1 1 1 25 ARG CD 43.45 . 43.1 1.1 7.5035e-01 16239 1 1 1 1 25 ARG H 8.142 . 8.24 0.6 8.7026e-01 16239 1 1 1 1 25 ARG HA 4.276 . 4.27 0.44 9.8912e-01 16239 1 1 1 1 25 ARG HB2 1.796 . 1.79 0.28 9.8290e-01 16239 1 1 1 1 25 ARG HB3 1.912 . 1.78 0.28 6.3733e-01 16239 1 1 1 1 25 ARG HG2 1.663 . 1.58 0.27 7.5853e-01 16239 1 1 1 1 25 ARG HG3 1.663 . 1.58 0.27 7.5853e-01 16239 1 1 1 1 25 ARG HD2 3.186 . 3.13 0.23 8.0763e-01 16239 1 1 1 1 25 ARG HD3 3.186 . 3.13 0.22 7.9907e-01 16239 1 1 1 1 25 ARG HE 7.427 . 7.32 0.52 8.3697e-01 16239 1 1 1 1 25 ARG N 64.792 A 120.61 3.9 1.8333e-46 16239 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 25 ARG ARG 0.69 16239 1 1 1 1 25 ARG LYS 0.16 16239 1 1 1 1 25 ARG GLY 0.13 16239 1 1 1 1 25 ARG LEU 0.01 16239 1 stop_ save_ save_AVS _Software.Sf_category software _Software.Sf_framecode AVS _Software.Entry_ID 16239 _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 16239 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID "validate protein chemical shift assignments" 16239 1 stop_ loop_ _Software_citation.Citation_ID _Software_citation.Citation_label _Software_citation.Entry_ID _Software_citation.Software_ID 2 $AVS_citation 16239 1 stop_ save_ save_AVS_citation _Citation.Sf_category citation _Citation.Sf_framecode AVS_citation _Citation.Entry_ID 16239 _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_