data_AVS_bmrb_pdb_report_10255 save_AVS_chem_shift_analysis _AVS_report.Sf_category AVS_report _AVS_report.Sf_framecode AVS_chem_shift_analysis _AVS_report.Entry_ID 10255 _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 10 LYS Anomalous Consistent Consistent Anomalous Consistent Consistent . . 10255 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 10 LYS C 172.963 . 176.46 2.05 8.8035e-02 10255 1 1 1 1 10 LYS CA 56.096 . 56.84 2.25 7.4090e-01 10255 1 1 1 1 10 LYS CB 36.131 . 32.83 1.88 7.9114e-02 10255 1 1 1 1 10 LYS CG 24.787 . 24.91 1.31 9.2519e-01 10255 1 1 1 1 10 LYS CD 28.256 . 28.78 1.39 7.0619e-01 10255 1 1 1 1 10 LYS CE 41.190 . 41.78 0.98 5.4715e-01 10255 1 1 1 1 10 LYS H 8.236 . 8.22 0.64 9.8006e-01 10255 1 1 1 1 10 LYS HA 4.345 . 4.28 0.45 8.8515e-01 10255 1 1 1 1 10 LYS HB2 1.347 . 1.79 0.25 7.6395e-02 10255 1 1 1 1 10 LYS HB3 0.885 S 1.78 0.26 5.7677e-04 10255 1 1 1 1 10 LYS HG2 -0.134 S 1.38 0.27 2.0538e-08 10255 1 1 1 1 10 LYS HG3 0.532 . 1.37 0.29 3.8566e-03 10255 1 1 1 1 10 LYS HD2 -0.187 A 1.61 0.25 6.5747e-13 10255 1 1 1 1 10 LYS HD3 0.904 . 1.61 0.25 4.7428e-03 10255 1 1 1 1 10 LYS HE2 1.725 S 2.93 0.2 1.6911e-09 10255 1 1 1 1 10 LYS HE3 1.675 S 2.93 0.2 3.4963e-10 10255 1 1 1 1 10 LYS N 122.938 . 121.16 4.11 6.6530e-01 10255 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 10 LYS LYS 0.81 10255 1 1 1 1 10 LYS ARG 0.16 10255 1 1 1 1 10 LYS MET 0.01 10255 1 stop_ save_ save_AVS _Software.Sf_category software _Software.Sf_framecode AVS _Software.Entry_ID 10255 _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 10255 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID "validate protein chemical shift assignments" 10255 1 stop_ loop_ _Software_citation.Citation_ID _Software_citation.Citation_label _Software_citation.Entry_ID _Software_citation.Software_ID 2 $AVS_citation 10255 1 stop_ save_ save_AVS_citation _Citation.Sf_category citation _Citation.Sf_framecode AVS_citation _Citation.Entry_ID 10255 _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_