data_AVS_bmrb_pdb_report_19957 save_AVS_chem_shift_analysis _AVS_report.Sf_category AVS_report _AVS_report.Sf_framecode AVS_chem_shift_analysis _AVS_report.Entry_ID 19957 _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 Indeterminable Consistent Anomalous Indeterminable Consistent . . 19957 1 1 1 2 1 DA UNSUPPORTED . . . . . . . 19957 1 1 1 2 2 DA UNSUPPORTED . . . . . . . 19957 1 1 1 2 3 DA UNSUPPORTED . . . . . . . 19957 1 1 1 2 4 DA UNSUPPORTED . . . . . . . 19957 1 1 1 2 5 DA UNSUPPORTED . . . . . . . 19957 1 1 1 2 6 DC UNSUPPORTED . . . . . . . 19957 1 1 1 2 7 DA UNSUPPORTED . . . . . . . 19957 1 1 1 2 8 DC UNSUPPORTED . . . . . . . 19957 1 1 1 2 9 DA UNSUPPORTED . . . . . . . 19957 1 1 1 2 10 DC UNSUPPORTED . . . . . . . 19957 1 1 1 2 11 DA UNSUPPORTED . . . . . . . 19957 1 1 1 2 12 DC UNSUPPORTED . . . . . . . 19957 1 1 1 2 13 DC UNSUPPORTED . . . . . . . 19957 1 1 1 2 14 DC UNSUPPORTED . . . . . . . 19957 1 1 1 2 15 DA UNSUPPORTED . . . . . . . 19957 1 1 1 3 1 DT UNSUPPORTED . . . . . . . 19957 1 1 1 3 2 DG UNSUPPORTED . . . . . . . 19957 1 1 1 3 3 DG UNSUPPORTED . . . . . . . 19957 1 1 1 3 4 DG UNSUPPORTED . . . . . . . 19957 1 1 1 3 5 DT UNSUPPORTED . . . . . . . 19957 1 1 1 3 6 DG UNSUPPORTED . . . . . . . 19957 1 1 1 3 7 DT UNSUPPORTED . . . . . . . 19957 1 1 1 3 8 DG UNSUPPORTED . . . . . . . 19957 1 1 1 3 9 DT UNSUPPORTED . . . . . . . 19957 1 1 1 3 10 DG UNSUPPORTED . . . . . . . 19957 1 1 1 3 11 DT UNSUPPORTED . . . . . . . 19957 1 1 1 3 12 DT UNSUPPORTED . . . . . . . 19957 1 1 1 3 13 DT UNSUPPORTED . . . . . . . 19957 1 1 1 3 14 DT UNSUPPORTED . . . . . . . 19957 1 1 1 3 15 DT UNSUPPORTED . . . . . . . 19957 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 H 8.357 . 8.24 0.61 8.4790e-01 19957 1 1 1 1 25 ARG HA 3.413 . 4.3 0.46 5.3823e-02 19957 1 1 1 1 25 ARG HE 7.322 . 7.4 0.63 9.0147e-01 19957 1 1 1 1 25 ARG HH11 10.070 A 6.91 0.46 6.4398e-12 19957 1 1 1 1 25 ARG HH12 10.070 A 6.8 0.33 3.8009e-23 19957 1 1 1 1 25 ARG HH21 10.099 S 6.81 0.48 7.2782e-12 19957 1 1 1 1 25 ARG HH22 10.099 S 6.76 0.36 1.7762e-20 19957 1 1 1 1 25 ARG N 117.937 . 120.8 3.68 4.3658e-01 19957 1 1 1 1 25 ARG NE 85.88 . 84.63 1.68 4.5685e-01 19957 1 stop_ save_ save_AVS _Software.Sf_category software _Software.Sf_framecode AVS _Software.Entry_ID 19957 _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 19957 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID "validate protein chemical shift assignments" 19957 1 stop_ loop_ _Software_citation.Citation_ID _Software_citation.Citation_label _Software_citation.Entry_ID _Software_citation.Software_ID 2 $AVS_citation 19957 1 stop_ save_ save_AVS_citation _Citation.Sf_category citation _Citation.Sf_framecode AVS_citation _Citation.Entry_ID 19957 _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_