############################## # Heteronuclear NOE values # ############################## save_heteronuclear_noe_list_1 _Heteronucl_NOE_list.Sf_category heteronucl_NOEs _Heteronucl_NOE_list.Sf_framecode heteronuclear_noe_list_1 _Heteronucl_NOE_list.Entry_ID 17926 _Heteronucl_NOE_list.ID 1 _Heteronucl_NOE_list.Sample_condition_list_ID 1 _Heteronucl_NOE_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_NOE_list.Spectrometer_frequency_1H 800 _Heteronucl_NOE_list.Heteronuclear_NOE_val_type 'relative intensities' _Heteronucl_NOE_list.NOE_ref_val 2.00E+07 _Heteronucl_NOE_list.NOE_ref_description 'I do not understand what NOE ref val refer to, then I put the value given as an example' _Heteronucl_NOE_list.Details . _Heteronucl_NOE_list.Text_data_format . _Heteronucl_NOE_list.Text_data . loop_ _Heteronucl_NOE_experiment.Experiment_ID _Heteronucl_NOE_experiment.Experiment_name _Heteronucl_NOE_experiment.Sample_ID _Heteronucl_NOE_experiment.Sample_label _Heteronucl_NOE_experiment.Sample_state _Heteronucl_NOE_experiment.Entry_ID _Heteronucl_NOE_experiment.Heteronucl_NOE_list_ID 17 'HETERONUCLEAR NOE 15N' . . . 17926 1 stop_ loop_ _Heteronucl_NOE.ID _Heteronucl_NOE.Assembly_atom_ID_1 _Heteronucl_NOE.Entity_assembly_ID_1 _Heteronucl_NOE.Entity_ID_1 _Heteronucl_NOE.Comp_index_ID_1 _Heteronucl_NOE.Seq_ID_1 _Heteronucl_NOE.Comp_ID_1 _Heteronucl_NOE.Atom_ID_1 _Heteronucl_NOE.Atom_type_1 _Heteronucl_NOE.Atom_isotope_number_1 _Heteronucl_NOE.Assembly_atom_ID_2 _Heteronucl_NOE.Entity_assembly_ID_2 _Heteronucl_NOE.Entity_ID_2 _Heteronucl_NOE.Comp_index_ID_2 _Heteronucl_NOE.Seq_ID_2 _Heteronucl_NOE.Comp_ID_2 _Heteronucl_NOE.Atom_ID_2 _Heteronucl_NOE.Atom_type_2 _Heteronucl_NOE.Atom_isotope_number_2 _Heteronucl_NOE.Val _Heteronucl_NOE.Val_err _Heteronucl_NOE.Resonance_ID_1 _Heteronucl_NOE.Resonance_ID_2 _Heteronucl_NOE.Auth_entity_assembly_ID_1 _Heteronucl_NOE.Auth_seq_ID_1 _Heteronucl_NOE.Auth_comp_ID_1 _Heteronucl_NOE.Auth_atom_ID_1 _Heteronucl_NOE.Auth_entity_assembly_ID_2 _Heteronucl_NOE.Auth_seq_ID_2 _Heteronucl_NOE.Auth_comp_ID_2 _Heteronucl_NOE.Auth_atom_ID_2 _Heteronucl_NOE.Entry_ID _Heteronucl_NOE.Heteronucl_NOE_list_ID 1 . 1 1 79 79 ASP N N 15 . 1 1 79 79 ASP H H 1 0.431 0.003 . . . 58 ASP N . 58 ASP H 17926 1 2 . 1 1 81 81 LEU N N 15 . 1 1 81 81 LEU H H 1 0.670 0.002 . . . 60 LEU N . 60 LEU H 17926 1 3 . 1 1 82 82 GLU N N 15 . 1 1 82 82 GLU H H 1 0.661 0.002 . . . 61 GLU N . 61 GLU H 17926 1 4 . 1 1 83 83 GLU N N 15 . 1 1 83 83 GLU H H 1 0.929 0.004 . . . 62 GLU N . 62 GLU H 17926 1 5 . 1 1 84 84 TYR N N 15 . 1 1 84 84 TYR H H 1 0.821 0.004 . . . 63 TYR N . 63 TYR H 17926 1 6 . 1 1 85 85 CYS N N 15 . 1 1 85 85 CYS H H 1 0.705 0.002 . . . 64 CYS N . 64 CYS H 17926 1 7 . 1 1 86 86 LYS N N 15 . 1 1 86 86 LYS H H 1 0.744 0.002 . . . 65 LYS N . 65 LYS H 17926 1 8 . 1 1 87 87 ASP N N 15 . 1 1 87 87 ASP H H 1 0.594 0.004 . . . 66 ASP N . 66 ASP H 17926 1 9 . 1 1 88 88 ASN N N 15 . 1 1 88 88 ASN H H 1 0.603 0.002 . . . 67 ASN N . 67 ASN H 17926 1 10 . 1 1 90 90 GLU N N 15 . 1 1 90 90 GLU H H 1 0.633 0.002 . . . 69 GLU N . 69 GLU H 17926 1 11 . 1 1 91 91 THR N N 15 . 1 1 91 91 THR H H 1 0.585 0.002 . . . 70 THR N . 70 THR H 17926 1 12 . 1 1 92 92 ASN N N 15 . 1 1 92 92 ASN H H 1 0.737 0.006 . . . 71 ASN N . 71 ASN H 17926 1 13 . 1 1 93 93 GLU N N 15 . 1 1 93 93 GLU H H 1 0.739 0.005 . . . 72 GLU N . 72 GLU H 17926 1 14 . 1 1 94 94 CYS N N 15 . 1 1 94 94 CYS H H 1 0.675 0.003 . . . 73 CYS N . 73 CYS H 17926 1 15 . 1 1 95 95 ARG N N 15 . 1 1 95 95 ARG H H 1 0.494 0.002 . . . 74 ARG N . 74 ARG H 17926 1 16 . 1 1 96 96 THR N N 15 . 1 1 96 96 THR H H 1 0.437 0.002 . . . 75 THR N . 75 THR H 17926 1 17 . 1 1 97 97 TYR N N 15 . 1 1 97 97 TYR H H 1 0.304 0.002 . . . 76 TYR N . 76 TYR H 17926 1 18 . 1 1 98 98 ASP N N 15 . 1 1 98 98 ASP H H 1 0.086 0.001 . . . 77 ASP N . 77 ASP H 17926 1 19 . 1 1 99 99 ASN N N 15 . 1 1 99 99 ASN H H 1 -0.072 0.001 . . . 78 ASN N . 78 ASN H 17926 1 stop_ save_