################################ # Residual dipolar couplings # ################################ save_RDC_list_1 _RDC_list.Sf_category RDCs _RDC_list.Sf_framecode RDC_list_1 _RDC_list.Entry_ID 15774 _RDC_list.ID 1 _RDC_list.Sample_condition_list_ID 1 _RDC_list.Sample_condition_list_label $sample_conditions_1 _RDC_list.Spectrometer_frequency_1H 600 _RDC_list.Bond_length_usage_flag . _RDC_list.Dipolar_constraint_calib_method . _RDC_list.Mol_align_tensor_axial_sym_mol . _RDC_list.Mol_align_tensor_rhombic_mol . _RDC_list.General_order_param_int_motions . _RDC_list.Assumed_H_N_bond_length . _RDC_list.Assumed_H_C_bond_length . _RDC_list.Assumed_C_N_bond_length . _RDC_list.Details . _RDC_list.Text_data_format . _RDC_list.Text_data . loop_ _RDC_experiment.Experiment_ID _RDC_experiment.Experiment_name _RDC_experiment.Sample_ID _RDC_experiment.Sample_label _RDC_experiment.Sample_state _RDC_experiment.Entry_ID _RDC_experiment.RDC_list_ID 13 '2D 1H-15N HSQC-IPAP' . . . 15774 1 stop_ loop_ _RDC_software.Software_ID _RDC_software.Software_label _RDC_software.Method_ID _RDC_software.Method_label _RDC_software.Entry_ID _RDC_software.RDC_list_ID 1 $NMRPipe . . 15774 1 2 $SPARKY . . 15774 1 5 $xwinnmr . . 15774 1 stop_ loop_ _RDC.ID _RDC.RDC_code _RDC.Assembly_atom_ID_1 _RDC.Entity_assembly_ID_1 _RDC.Entity_ID_1 _RDC.Comp_index_ID_1 _RDC.Seq_ID_1 _RDC.Comp_ID_1 _RDC.Atom_ID_1 _RDC.Atom_type_1 _RDC.Atom_isotope_number_1 _RDC.Ambiguity_code_1 _RDC.Assembly_atom_ID_2 _RDC.Entity_assembly_ID_2 _RDC.Entity_ID_2 _RDC.Comp_index_ID_2 _RDC.Seq_ID_2 _RDC.Comp_ID_2 _RDC.Atom_ID_2 _RDC.Atom_type_2 _RDC.Atom_isotope_number_2 _RDC.Ambiguity_code_2 _RDC.Val _RDC.Val_min _RDC.Val_max _RDC.Val_err _RDC.Val_bond_length _RDC.Resonance_ID_1 _RDC.Resonance_ID_2 _RDC.Auth_entity_assembly_ID_1 _RDC.Auth_seq_ID_1 _RDC.Auth_comp_ID_1 _RDC.Auth_atom_ID_1 _RDC.Auth_entity_assembly_ID_2 _RDC.Auth_seq_ID_2 _RDC.Auth_comp_ID_2 _RDC.Auth_atom_ID_2 _RDC.Entry_ID _RDC.RDC_list_ID 1 1DHNN . 1 1 25 25 MET N N 15 . . 1 1 25 25 MET H H 1 . 0.12 . . 0.2 . . . . 1 MET N . 1 MET H 15774 1 2 1DHNN . 1 1 26 26 SER N N 15 . . 1 1 26 26 SER H H 1 . 0.61 . . 0.2 . . . . 2 SER N . 2 SER H 15774 1 3 1DHNN . 1 1 27 27 ASP N N 15 . . 1 1 27 27 ASP H H 1 . 0.54 . . 0.2 . . . . 3 ASP N . 3 ASP H 15774 1 4 1DHNN . 1 1 28 28 PHE N N 15 . . 1 1 28 28 PHE H H 1 . -0.14 . . 0.2 . . . . 4 PHE N . 4 PHE H 15774 1 5 1DHNN . 1 1 29 29 ASP N N 15 . . 1 1 29 29 ASP H H 1 . -1.53 . . 0.2 . . . . 5 ASP N . 5 ASP H 15774 1 6 1DHNN . 1 1 30 30 THR N N 15 . . 1 1 30 30 THR H H 1 . -2.78 . . 0.2 . . . . 6 THR N . 6 THR H 15774 1 7 1DHNN . 1 1 31 31 GLU N N 15 . . 1 1 31 31 GLU H H 1 . -1.19 . . 0.2 . . . . 7 GLU N . 7 GLU H 15774 1 8 1DHNN . 1 1 32 32 ARG N N 15 . . 1 1 32 32 ARG H H 1 . -0.44 . . 0.2 . . . . 8 ARG N . 8 ARG H 15774 1 9 1DHNN . 1 1 33 33 VAL N N 15 . . 1 1 33 33 VAL H H 1 . -3.32 . . 0.2 . . . . 9 VAL N . 9 VAL H 15774 1 10 1DHNN . 1 1 34 34 SER N N 15 . . 1 1 34 34 SER H H 1 . -3.7 . . 0.2 . . . . 10 SER N . 10 SER H 15774 1 11 1DHNN . 1 1 35 35 ARG N N 15 . . 1 1 35 35 ARG H H 1 . -0.69 . . 0.2 . . . . 11 ARG N . 11 ARG H 15774 1 12 1DHNN . 1 1 36 36 ALA N N 15 . . 1 1 36 36 ALA H H 1 . -1.57 . . 0.2 . . . . 12 ALA N . 12 ALA H 15774 1 13 1DHNN . 1 1 37 37 VAL N N 15 . . 1 1 37 37 VAL H H 1 . -3.14 . . 0.2 . . . . 13 VAL N . 13 VAL H 15774 1 14 1DHNN . 1 1 38 38 ALA N N 15 . . 1 1 38 38 ALA H H 1 . -1.85 . . 0.2 . . . . 14 ALA N . 14 ALA H 15774 1 15 1DHNN . 1 1 39 39 ALA N N 15 . . 1 1 39 39 ALA H H 1 . 0.97 . . 0.2 . . . . 15 ALA N . 15 ALA H 15774 1 16 1DHNN . 1 1 40 40 ALA N N 15 . . 1 1 40 40 ALA H H 1 . -3.79 . . 0.2 . . . . 16 ALA N . 16 ALA H 15774 1 17 1DHNN . 1 1 41 41 LEU N N 15 . . 1 1 41 41 LEU H H 1 . -3.44 . . 0.2 . . . . 17 LEU N . 17 LEU H 15774 1 18 1DHNN . 1 1 42 42 VAL N N 15 . . 1 1 42 42 VAL H H 1 . 0.65 . . 0.2 . . . . 18 VAL N . 18 VAL H 15774 1 19 1DHNN . 1 1 43 43 GLY N N 15 . . 1 1 43 43 GLY H H 1 . 0.74 . . 0.2 . . . . 19 GLY N . 19 GLY H 15774 1 20 1DHNN . 1 1 45 45 GLY N N 15 . . 1 1 45 45 GLY H H 1 . 3.76 . . 0.2 . . . . 21 GLY N . 21 GLY H 15774 1 21 1DHNN . 1 1 46 46 GLY N N 15 . . 1 1 46 46 GLY H H 1 . 4.6 . . 0.2 . . . . 22 GLY N . 22 GLY H 15774 1 22 1DHNN . 1 1 47 47 VAL N N 15 . . 1 1 47 47 VAL H H 1 . 2.72 . . 0.2 . . . . 23 VAL N . 23 VAL H 15774 1 23 1DHNN . 1 1 48 48 ALA N N 15 . . 1 1 48 48 ALA H H 1 . 8.01 . . 0.2 . . . . 24 ALA N . 24 ALA H 15774 1 24 1DHNN . 1 1 49 49 LEU N N 15 . . 1 1 49 49 LEU H H 1 . 5.78 . . 0.2 . . . . 25 LEU N . 25 LEU H 15774 1 25 1DHNN . 1 1 50 50 VAL N N 15 . . 1 1 50 50 VAL H H 1 . 5.76 . . 0.2 . . . . 26 VAL N . 26 VAL H 15774 1 26 1DHNN . 1 1 51 51 VAL N N 15 . . 1 1 51 51 VAL H H 1 . 2.17 . . 0.2 . . . . 27 VAL N . 27 VAL H 15774 1 27 1DHNN . 1 1 52 52 LYS N N 15 . . 1 1 52 52 LYS H H 1 . 7.84 . . 0.2 . . . . 28 LYS N . 28 LYS H 15774 1 28 1DHNN . 1 1 53 53 VAL N N 15 . . 1 1 53 53 VAL H H 1 . 7.17 . . 0.2 . . . . 29 VAL N . 29 VAL H 15774 1 29 1DHNN . 1 1 54 54 PHE N N 15 . . 1 1 54 54 PHE H H 1 . 5.14 . . 0.2 . . . . 30 CYS N . 30 CYS H 15774 1 30 1DHNN . 1 1 55 55 ALA N N 15 . . 1 1 55 55 ALA H H 1 . 5.03 . . 0.2 . . . . 31 ALA N . 31 ALA H 15774 1 31 1DHNN . 1 1 56 56 GLY N N 15 . . 1 1 56 56 GLY H H 1 . 6.21 . . 0.2 . . . . 32 GLY N . 32 GLY H 15774 1 32 1DHNN . 1 1 57 57 LEU N N 15 . . 1 1 57 57 LEU H H 1 . 8.17 . . 0.2 . . . . 33 LEU N . 33 LEU H 15774 1 33 1DHNN . 1 1 59 59 GLY N N 15 . . 1 1 59 59 GLY H H 1 . 4.15 . . 0.2 . . . . 35 GLY N . 35 GLY H 15774 1 34 1DHNN . 1 1 60 60 VAL N N 15 . . 1 1 60 60 VAL H H 1 . 5.84 . . 0.2 . . . . 36 VAL N . 36 VAL H 15774 1 35 1DHNN . 1 1 61 61 ILE N N 15 . . 1 1 61 61 ILE H H 1 . 5.48 . . 0.2 . . . . 37 ILE N . 37 ILE H 15774 1 36 1DHNN . 1 1 62 62 HIS N N 15 . . 1 1 62 62 HIS H H 1 . -1.91 . . 0.2 . . . . 38 HIS N . 38 HIS H 15774 1 37 1DHNN . 1 1 63 63 THR N N 15 . . 1 1 63 63 THR H H 1 . -3.67 . . 0.2 . . . . 39 THR N . 39 THR H 15774 1 38 1DHNN . 1 1 65 65 ALA N N 15 . . 1 1 65 65 ALA H H 1 . -2.54 . . 0.2 . . . . 41 ALA N . 41 ALA H 15774 1 39 1DHNN . 1 1 66 66 ARG N N 15 . . 1 1 66 66 ARG H H 1 . -3.95 . . 0.2 . . . . 42 ARG N . 42 ARG H 15774 1 40 1DHNN . 1 1 67 67 ARG N N 15 . . 1 1 67 67 ARG H H 1 . -5.31 . . 0.2 . . . . 43 ARG N . 43 ARG H 15774 1 41 1DHNN . 1 1 68 68 GLY N N 15 . . 1 1 68 68 GLY H H 1 . -2.7 . . 0.2 . . . . 44 GLY N . 44 GLY H 15774 1 42 1DHNN . 1 1 69 69 PHE N N 15 . . 1 1 69 69 PHE H H 1 . -4.87 . . 0.2 . . . . 45 PHE N . 45 PHE H 15774 1 43 1DHNN . 1 1 70 70 PHE N N 15 . . 1 1 70 70 PHE H H 1 . -10.61 . . 0.2 . . . . 46 PHE N . 46 PHE H 15774 1 44 1DHNN . 1 1 71 71 ARG N N 15 . . 1 1 71 71 ARG H H 1 . -8.48 . . 0.2 . . . . 47 ARG N . 47 ARG H 15774 1 45 1DHNN . 1 1 72 72 SER N N 15 . . 1 1 72 72 SER H H 1 . -5.8 . . 0.2 . . . . 48 CYS N . 48 CYS H 15774 1 46 1DHNN . 1 1 73 73 ASN N N 15 . . 1 1 73 73 ASN H H 1 . -7.28 . . 0.2 . . . . 49 ASN N . 49 ASN H 15774 1 47 1DHNN . 1 1 75 75 GLU N N 15 . . 1 1 75 75 GLU H H 1 . -5.67 . . 0.2 . . . . 51 GLU N . 51 GLU H 15774 1 48 1DHNN . 1 1 77 77 ILE N N 15 . . 1 1 77 77 ILE H H 1 . -7.71 . . 0.2 . . . . 53 ILE N . 53 ILE H 15774 1 49 1DHNN . 1 1 78 78 GLN N N 15 . . 1 1 78 78 GLN H H 1 . -8.58 . . 0.2 . . . . 54 GLN N . 54 GLN H 15774 1 50 1DHNN . 1 1 79 79 ILE N N 15 . . 1 1 79 79 ILE H H 1 . -3.99 . . 0.2 . . . . 55 ILE N . 55 ILE H 15774 1 51 1DHNN . 1 1 80 80 GLY N N 15 . . 1 1 80 80 GLY H H 1 . 1.29 . . 0.2 . . . . 56 GLY N . 56 GLY H 15774 1 52 1DHNN . 1 1 81 81 ASP N N 15 . . 1 1 81 81 ASP H H 1 . -4.01 . . 0.2 . . . . 57 ASP N . 57 ASP H 15774 1 53 1DHNN . 1 1 82 82 TRP N N 15 . . 1 1 82 82 TRP H H 1 . -3.43 . . 0.2 . . . . 58 TRP N . 58 TRP H 15774 1 54 1DHNN . 1 1 83 83 ARG N N 15 . . 1 1 83 83 ARG H H 1 . 10.84 . . 0.2 . . . . 59 ARG N . 59 ARG H 15774 1 55 1DHNN . 1 1 85 85 GLU N N 15 . . 1 1 85 85 GLU H H 1 . 0.71 . . 0.2 . . . . 61 GLU N . 61 GLU H 15774 1 56 1DHNN . 1 1 86 86 VAL N N 15 . . 1 1 86 86 VAL H H 1 . 2.17 . . 0.2 . . . . 62 VAL N . 62 VAL H 15774 1 57 1DHNN . 1 1 88 88 HIS N N 15 . . 1 1 88 88 HIS H H 1 . 5.85 . . 0.2 . . . . 64 HIS N . 64 HIS H 15774 1 58 1DHNN . 1 1 89 89 ASP N N 15 . . 1 1 89 89 ASP H H 1 . 1.7 . . 0.2 . . . . 65 ASP N . 65 ASP H 15774 1 59 1DHNN . 1 1 90 90 GLY N N 15 . . 1 1 90 90 GLY H H 1 . 5.56 . . 0.2 . . . . 66 GLY N . 66 GLY H 15774 1 60 1DHNN . 1 1 92 92 LEU N N 15 . . 1 1 92 92 LEU H H 1 . 4.7 . . 0.2 . . . . 68 LEU N . 68 LEU H 15774 1 61 1DHNN . 1 1 93 93 LEU N N 15 . . 1 1 93 93 LEU H H 1 . 5.76 . . 0.2 . . . . 69 LEU N . 69 LEU H 15774 1 62 1DHNN . 1 1 94 94 ALA N N 15 . . 1 1 94 94 ALA H H 1 . -1.31 . . 0.2 . . . . 70 ALA N . 70 ALA H 15774 1 63 1DHNN . 1 1 95 95 ALA N N 15 . . 1 1 95 95 ALA H H 1 . 2.65 . . 0.2 . . . . 71 ALA N . 71 ALA H 15774 1 64 1DHNN . 1 1 96 96 HIS N N 15 . . 1 1 96 96 HIS H H 1 . -1.79 . . 0.2 . . . . 72 HIS N . 72 HIS H 15774 1 65 1DHNN . 1 1 98 98 VAL N N 15 . . 1 1 98 98 VAL H H 1 . 5.33 . . 0.2 . . . . 74 VAL N . 74 VAL H 15774 1 66 1DHNN . 1 1 99 99 ASN N N 15 . . 1 1 99 99 ASN H H 1 . -1.93 . . 0.2 . . . . 75 ASN N . 75 ASN H 15774 1 67 1DHNN . 1 1 100 100 GLY N N 15 . . 1 1 100 100 GLY H H 1 . 6.39 . . 0.2 . . . . 76 GLY N . 76 GLY H 15774 1 68 1DHNN . 1 1 101 101 ILE N N 15 . . 1 1 101 101 ILE H H 1 . 1.51 . . 0.2 . . . . 77 ILE N . 77 ILE H 15774 1 69 1DHNN . 1 1 102 102 VAL N N 15 . . 1 1 102 102 VAL H H 1 . 2.88 . . 0.2 . . . . 78 VAL N . 78 VAL H 15774 1 70 1DHNN . 1 1 103 103 ILE N N 15 . . 1 1 103 103 ILE H H 1 . 6.17 . . 0.2 . . . . 79 ILE N . 79 ILE H 15774 1 71 1DHNN . 1 1 104 104 ALA N N 15 . . 1 1 104 104 ALA H H 1 . 1.88 . . 0.2 . . . . 80 ALA N . 80 ALA H 15774 1 72 1DHNN . 1 1 105 105 GLU N N 15 . . 1 1 105 105 GLU H H 1 . 0.57 . . 0.2 . . . . 81 GLU N . 81 GLU H 15774 1 73 1DHNN . 1 1 106 106 ASP N N 15 . . 1 1 106 106 ASP H H 1 . 4.08 . . 0.2 . . . . 82 ASP N . 82 ASP H 15774 1 74 1DHNN . 1 1 107 107 ALA N N 15 . . 1 1 107 107 ALA H H 1 . 6.69 . . 0.2 . . . . 83 ALA N . 83 ALA H 15774 1 75 1DHNN . 1 1 108 108 LEU N N 15 . . 1 1 108 108 LEU H H 1 . 5.59 . . 0.2 . . . . 84 LEU N . 84 LEU H 15774 1 76 1DHNN . 1 1 109 109 ILE N N 15 . . 1 1 109 109 ILE H H 1 . -3.08 . . 0.2 . . . . 85 ILE N . 85 ILE H 15774 1 77 1DHNN . 1 1 110 110 ALA N N 15 . . 1 1 110 110 ALA H H 1 . 2.51 . . 0.2 . . . . 86 ALA N . 86 ALA H 15774 1 78 1DHNN . 1 1 111 111 GLU N N 15 . . 1 1 111 111 GLU H H 1 . 1.81 . . 0.2 . . . . 87 GLU N . 87 GLU H 15774 1 79 1DHNN . 1 1 113 113 VAL N N 15 . . 1 1 113 113 VAL H H 1 . -1.96 . . 0.2 . . . . 89 VAL N . 89 VAL H 15774 1 80 1DHNN . 1 1 114 114 GLY N N 15 . . 1 1 114 114 GLY H H 1 . 2.13 . . 0.2 . . . . 90 GLY N . 90 GLY H 15774 1 81 1DHNN . 1 1 117 117 LEU N N 15 . . 1 1 117 117 LEU H H 1 . -3.93 . . 0.2 . . . . 93 LEU N . 93 LEU H 15774 1 82 1DHNN . 1 1 118 118 ALA N N 15 . . 1 1 118 118 ALA H H 1 . 0.96 . . 0.2 . . . . 94 ALA N . 94 ALA H 15774 1 83 1DHNN . 1 1 119 119 ARG N N 15 . . 1 1 119 119 ARG H H 1 . 2.45 . . 0.2 . . . . 95 ARG N . 95 ARG H 15774 1 84 1DHNN . 1 1 120 120 ALA N N 15 . . 1 1 120 120 ALA H H 1 . -2.42 . . 0.2 . . . . 96 ALA N . 96 ALA H 15774 1 85 1DHNN . 1 1 121 121 LEU N N 15 . . 1 1 121 121 LEU H H 1 . -1.14 . . 0.2 . . . . 97 LEU N . 97 LEU H 15774 1 86 1DHNN . 1 1 122 122 GLY N N 15 . . 1 1 122 122 GLY H H 1 . 2.44 . . 0.2 . . . . 98 GLY N . 98 GLY H 15774 1 87 1DHNN . 1 1 124 124 ILE N N 15 . . 1 1 124 124 ILE H H 1 . -1.54 . . 0.2 . . . . 100 ILE N . 100 ILE H 15774 1 88 1DHNN . 1 1 125 125 VAL N N 15 . . 1 1 125 125 VAL H H 1 . 1.15 . . 0.2 . . . . 101 VAL N . 101 VAL H 15774 1 89 1DHNN . 1 1 126 126 SER N N 15 . . 1 1 126 126 SER H H 1 . 3.13 . . 0.2 . . . . 102 CYS N . 102 CYS H 15774 1 90 1DHNN . 1 1 127 127 ARG N N 15 . . 1 1 127 127 ARG H H 1 . 0.2 . . 0.2 . . . . 103 ARG N . 103 ARG H 15774 1 91 1DHNN . 1 1 128 128 TYR N N 15 . . 1 1 128 128 TYR H H 1 . -1.56 . . 0.2 . . . . 104 TYR N . 104 TYR H 15774 1 92 1DHNN . 1 1 129 129 GLY N N 15 . . 1 1 129 129 GLY H H 1 . 3.48 . . 0.2 . . . . 105 GLY N . 105 GLY H 15774 1 93 1DHNN . 1 1 130 130 ALA N N 15 . . 1 1 130 130 ALA H H 1 . 1.24 . . 0.2 . . . . 106 ALA N . 106 ALA H 15774 1 94 1DHNN . 1 1 131 131 THR N N 15 . . 1 1 131 131 THR H H 1 . 2.9 . . 0.2 . . . . 107 THR N . 107 THR H 15774 1 95 1DHNN . 1 1 132 132 VAL N N 15 . . 1 1 132 132 VAL H H 1 . 2.79 . . 0.2 . . . . 108 VAL N . 108 VAL H 15774 1 96 1DHNN . 1 1 133 133 ILE N N 15 . . 1 1 133 133 ILE H H 1 . -0.12 . . 0.2 . . . . 109 ILE N . 109 ILE H 15774 1 97 1DHNN . 1 1 135 135 ASN N N 15 . . 1 1 135 135 ASN H H 1 . 2.77 . . 0.2 . . . . 111 ASN N . 111 ASN H 15774 1 98 1DHNN . 1 1 136 136 ILE N N 15 . . 1 1 136 136 ILE H H 1 . 1.27 . . 0.2 . . . . 112 ILE N . 112 ILE H 15774 1 99 1DHNN . 1 1 137 137 ASN N N 15 . . 1 1 137 137 ASN H H 1 . -2.33 . . 0.2 . . . . 113 ASN N . 113 ASN H 15774 1 100 1DHNN . 1 1 138 138 ALA N N 15 . . 1 1 138 138 ALA H H 1 . 0.12 . . 0.2 . . . . 114 ALA N . 114 ALA H 15774 1 101 1DHNN . 1 1 139 139 ALA N N 15 . . 1 1 139 139 ALA H H 1 . 2.01 . . 0.2 . . . . 115 ALA N . 115 ALA H 15774 1 102 1DHNN . 1 1 140 140 ILE N N 15 . . 1 1 140 140 ILE H H 1 . -1.32 . . 0.2 . . . . 116 ILE N . 116 ILE H 15774 1 103 1DHNN . 1 1 141 141 GLU N N 15 . . 1 1 141 141 GLU H H 1 . -2.95 . . 0.2 . . . . 117 GLU N . 117 GLU H 15774 1 104 1DHNN . 1 1 142 142 VAL N N 15 . . 1 1 142 142 VAL H H 1 . 1.49 . . 0.2 . . . . 118 VAL N . 118 VAL H 15774 1 105 1DHNN . 1 1 143 143 LEU N N 15 . . 1 1 143 143 LEU H H 1 . 0.59 . . 0.2 . . . . 119 LEU N . 119 LEU H 15774 1 106 1DHNN . 1 1 144 144 GLY N N 15 . . 1 1 144 144 GLY H H 1 . -3.27 . . 0.2 . . . . 120 GLY N . 120 GLY H 15774 1 107 1DHNN . 1 1 145 145 THR N N 15 . . 1 1 145 145 THR H H 1 . -0.27 . . 0.2 . . . . 121 THR N . 121 THR H 15774 1 108 1DHNN . 1 1 146 146 GLY N N 15 . . 1 1 146 146 GLY H H 1 . 0.16 . . 0.2 . . . . 122 GLY N . 122 GLY H 15774 1 109 1DHNN . 1 1 147 147 THR N N 15 . . 1 1 147 147 THR H H 1 . -1 . . 0.2 . . . . 123 THR N . 123 THR H 15774 1 110 1DHNN . 1 1 148 148 ASP N N 15 . . 1 1 148 148 ASP H H 1 . 0.58 . . 0.2 . . . . 124 ASP N . 124 ASP H 15774 1 111 1DHNN . 1 1 149 149 TYR N N 15 . . 1 1 149 149 TYR H H 1 . -0.38 . . 0.2 . . . . 125 TYR N . 125 TYR H 15774 1 112 1DHNN . 1 1 150 150 ARG N N 15 . . 1 1 150 150 ARG H H 1 . -0.11 . . 0.2 . . . . 126 ARG N . 126 ARG H 15774 1 113 1DHNN . 1 1 151 151 PHE N N 15 . . 1 1 151 151 PHE H H 1 . -0.19 . . 0.2 . . . . 127 PHE N . 127 PHE H 15774 1 stop_ save_ ################################ # Residual dipolar couplings # ################################ save_RDC_list_2 _RDC_list.Sf_category RDCs _RDC_list.Sf_framecode RDC_list_2 _RDC_list.Entry_ID 15774 _RDC_list.ID 2 _RDC_list.Sample_condition_list_ID 1 _RDC_list.Sample_condition_list_label $sample_conditions_1 _RDC_list.Spectrometer_frequency_1H 600 _RDC_list.Bond_length_usage_flag . _RDC_list.Dipolar_constraint_calib_method . _RDC_list.Mol_align_tensor_axial_sym_mol . _RDC_list.Mol_align_tensor_rhombic_mol . _RDC_list.General_order_param_int_motions . _RDC_list.Assumed_H_N_bond_length . _RDC_list.Assumed_H_C_bond_length . _RDC_list.Assumed_C_N_bond_length . _RDC_list.Details . _RDC_list.Text_data_format . _RDC_list.Text_data . loop_ _RDC_experiment.Experiment_ID _RDC_experiment.Experiment_name _RDC_experiment.Sample_ID _RDC_experiment.Sample_label _RDC_experiment.Sample_state _RDC_experiment.Entry_ID _RDC_experiment.RDC_list_ID 14 '2D 1H-15N HSQC-IPAP' . . . 15774 2 stop_ loop_ _RDC_software.Software_ID _RDC_software.Software_label _RDC_software.Method_ID _RDC_software.Method_label _RDC_software.Entry_ID _RDC_software.RDC_list_ID 1 $NMRPipe . . 15774 2 2 $SPARKY . . 15774 2 5 $xwinnmr . . 15774 2 stop_ loop_ _RDC.ID _RDC.RDC_code _RDC.Assembly_atom_ID_1 _RDC.Entity_assembly_ID_1 _RDC.Entity_ID_1 _RDC.Comp_index_ID_1 _RDC.Seq_ID_1 _RDC.Comp_ID_1 _RDC.Atom_ID_1 _RDC.Atom_type_1 _RDC.Atom_isotope_number_1 _RDC.Ambiguity_code_1 _RDC.Assembly_atom_ID_2 _RDC.Entity_assembly_ID_2 _RDC.Entity_ID_2 _RDC.Comp_index_ID_2 _RDC.Seq_ID_2 _RDC.Comp_ID_2 _RDC.Atom_ID_2 _RDC.Atom_type_2 _RDC.Atom_isotope_number_2 _RDC.Ambiguity_code_2 _RDC.Val _RDC.Val_min _RDC.Val_max _RDC.Val_err _RDC.Val_bond_length _RDC.Resonance_ID_1 _RDC.Resonance_ID_2 _RDC.Auth_entity_assembly_ID_1 _RDC.Auth_seq_ID_1 _RDC.Auth_comp_ID_1 _RDC.Auth_atom_ID_1 _RDC.Auth_entity_assembly_ID_2 _RDC.Auth_seq_ID_2 _RDC.Auth_comp_ID_2 _RDC.Auth_atom_ID_2 _RDC.Entry_ID _RDC.RDC_list_ID 1 1DHNN . 1 1 25 25 MET N N 15 . . 1 1 25 25 MET H H 1 . 0.36 . . 0.2 . . . . 1 MET N . 1 MET H 15774 2 2 1DHNN . 1 1 26 26 SER N N 15 . . 1 1 26 26 SER H H 1 . 0.74 . . 0.2 . . . . 2 SER N . 2 SER H 15774 2 3 1DHNN . 1 1 27 27 ASP N N 15 . . 1 1 27 27 ASP H H 1 . 0.57 . . 0.2 . . . . 3 ASP N . 3 ASP H 15774 2 4 1DHNN . 1 1 28 28 PHE N N 15 . . 1 1 28 28 PHE H H 1 . 0.39 . . 0.2 . . . . 4 PHE N . 4 PHE H 15774 2 5 1DHNN . 1 1 29 29 ASP N N 15 . . 1 1 29 29 ASP H H 1 . 0.1 . . 0.2 . . . . 5 ASP N . 5 ASP H 15774 2 6 1DHNN . 1 1 30 30 THR N N 15 . . 1 1 30 30 THR H H 1 . 0.82 . . 0.2 . . . . 6 THR N . 6 THR H 15774 2 7 1DHNN . 1 1 31 31 GLU N N 15 . . 1 1 31 31 GLU H H 1 . -0.22 . . 0.2 . . . . 7 GLU N . 7 GLU H 15774 2 8 1DHNN . 1 1 33 33 VAL N N 15 . . 1 1 33 33 VAL H H 1 . 0.74 . . 0.2 . . . . 9 VAL N . 9 VAL H 15774 2 9 1DHNN . 1 1 34 34 SER N N 15 . . 1 1 34 34 SER H H 1 . -0.38 . . 0.2 . . . . 10 SER N . 10 SER H 15774 2 10 1DHNN . 1 1 36 36 ALA N N 15 . . 1 1 36 36 ALA H H 1 . 3.25 . . 0.2 . . . . 12 ALA N . 12 ALA H 15774 2 11 1DHNN . 1 1 38 38 ALA N N 15 . . 1 1 38 38 ALA H H 1 . -0.67 . . 0.2 . . . . 14 ALA N . 14 ALA H 15774 2 12 1DHNN . 1 1 39 39 ALA N N 15 . . 1 1 39 39 ALA H H 1 . 1.5 . . 0.2 . . . . 15 ALA N . 15 ALA H 15774 2 13 1DHNN . 1 1 40 40 ALA N N 15 . . 1 1 40 40 ALA H H 1 . 2.64 . . 0.2 . . . . 16 ALA N . 16 ALA H 15774 2 14 1DHNN . 1 1 41 41 LEU N N 15 . . 1 1 41 41 LEU H H 1 . -0.66 . . 0.2 . . . . 17 LEU N . 17 LEU H 15774 2 15 1DHNN . 1 1 42 42 VAL N N 15 . . 1 1 42 42 VAL H H 1 . -0.71 . . 0.2 . . . . 18 VAL N . 18 VAL H 15774 2 16 1DHNN . 1 1 43 43 GLY N N 15 . . 1 1 43 43 GLY H H 1 . 1.64 . . 0.2 . . . . 19 GLY N . 19 GLY H 15774 2 17 1DHNN . 1 1 45 45 GLY N N 15 . . 1 1 45 45 GLY H H 1 . -2.27 . . 0.2 . . . . 21 GLY N . 21 GLY H 15774 2 18 1DHNN . 1 1 46 46 GLY N N 15 . . 1 1 46 46 GLY H H 1 . -1.33 . . 0.2 . . . . 22 GLY N . 22 GLY H 15774 2 19 1DHNN . 1 1 49 49 LEU N N 15 . . 1 1 49 49 LEU H H 1 . -3.32 . . 0.2 . . . . 25 LEU N . 25 LEU H 15774 2 20 1DHNN . 1 1 50 50 VAL N N 15 . . 1 1 50 50 VAL H H 1 . -0.94 . . 0.2 . . . . 26 VAL N . 26 VAL H 15774 2 21 1DHNN . 1 1 51 51 VAL N N 15 . . 1 1 51 51 VAL H H 1 . -0.45 . . 0.2 . . . . 27 VAL N . 27 VAL H 15774 2 22 1DHNN . 1 1 52 52 LYS N N 15 . . 1 1 52 52 LYS H H 1 . -4.44 . . 0.2 . . . . 28 LYS N . 28 LYS H 15774 2 23 1DHNN . 1 1 53 53 VAL N N 15 . . 1 1 53 53 VAL H H 1 . -3.18 . . 0.2 . . . . 29 VAL N . 29 VAL H 15774 2 24 1DHNN . 1 1 54 54 PHE N N 15 . . 1 1 54 54 PHE H H 1 . -1.53 . . 0.2 . . . . 30 CYS N . 30 CYS H 15774 2 25 1DHNN . 1 1 55 55 ALA N N 15 . . 1 1 55 55 ALA H H 1 . -1.18 . . 0.2 . . . . 31 ALA N . 31 ALA H 15774 2 26 1DHNN . 1 1 56 56 GLY N N 15 . . 1 1 56 56 GLY H H 1 . -4.74 . . 0.2 . . . . 32 GLY N . 32 GLY H 15774 2 27 1DHNN . 1 1 57 57 LEU N N 15 . . 1 1 57 57 LEU H H 1 . -0.57 . . 0.2 . . . . 33 LEU N . 33 LEU H 15774 2 28 1DHNN . 1 1 59 59 GLY N N 15 . . 1 1 59 59 GLY H H 1 . -0.55 . . 0.2 . . . . 35 GLY N . 35 GLY H 15774 2 29 1DHNN . 1 1 60 60 VAL N N 15 . . 1 1 60 60 VAL H H 1 . 0.37 . . 0.2 . . . . 36 VAL N . 36 VAL H 15774 2 30 1DHNN . 1 1 61 61 ILE N N 15 . . 1 1 61 61 ILE H H 1 . 2.17 . . 0.2 . . . . 37 ILE N . 37 ILE H 15774 2 31 1DHNN . 1 1 62 62 HIS N N 15 . . 1 1 62 62 HIS H H 1 . 3.52 . . 0.2 . . . . 38 HIS N . 38 HIS H 15774 2 32 1DHNN . 1 1 63 63 THR N N 15 . . 1 1 63 63 THR H H 1 . 0.12 . . 0.2 . . . . 39 THR N . 39 THR H 15774 2 33 1DHNN . 1 1 65 65 ALA N N 15 . . 1 1 65 65 ALA H H 1 . 2.9 . . 0.2 . . . . 41 ALA N . 41 ALA H 15774 2 34 1DHNN . 1 1 66 66 ARG N N 15 . . 1 1 66 66 ARG H H 1 . 1.08 . . 0.2 . . . . 42 ARG N . 42 ARG H 15774 2 35 1DHNN . 1 1 67 67 ARG N N 15 . . 1 1 67 67 ARG H H 1 . 0.38 . . 0.2 . . . . 43 ARG N . 43 ARG H 15774 2 36 1DHNN . 1 1 68 68 GLY N N 15 . . 1 1 68 68 GLY H H 1 . 1.36 . . 0.2 . . . . 44 GLY N . 44 GLY H 15774 2 37 1DHNN . 1 1 69 69 PHE N N 15 . . 1 1 69 69 PHE H H 1 . 2.64 . . 0.2 . . . . 45 PHE N . 45 PHE H 15774 2 38 1DHNN . 1 1 70 70 PHE N N 15 . . 1 1 70 70 PHE H H 1 . 1.68 . . 0.2 . . . . 46 PHE N . 46 PHE H 15774 2 39 1DHNN . 1 1 71 71 ARG N N 15 . . 1 1 71 71 ARG H H 1 . 1.54 . . 0.2 . . . . 47 ARG N . 47 ARG H 15774 2 40 1DHNN . 1 1 72 72 SER N N 15 . . 1 1 72 72 SER H H 1 . 0.34 . . 0.2 . . . . 48 CYS N . 48 CYS H 15774 2 41 1DHNN . 1 1 73 73 ASN N N 15 . . 1 1 73 73 ASN H H 1 . -0.29 . . 0.2 . . . . 49 ASN N . 49 ASN H 15774 2 42 1DHNN . 1 1 75 75 GLU N N 15 . . 1 1 75 75 GLU H H 1 . -0.05 . . 0.2 . . . . 51 GLU N . 51 GLU H 15774 2 43 1DHNN . 1 1 77 77 ILE N N 15 . . 1 1 77 77 ILE H H 1 . 0.93 . . 0.2 . . . . 53 ILE N . 53 ILE H 15774 2 44 1DHNN . 1 1 78 78 GLN N N 15 . . 1 1 78 78 GLN H H 1 . 1.58 . . 0.2 . . . . 54 GLN N . 54 GLN H 15774 2 45 1DHNN . 1 1 79 79 ILE N N 15 . . 1 1 79 79 ILE H H 1 . 2.22 . . 0.2 . . . . 55 ILE N . 55 ILE H 15774 2 46 1DHNN . 1 1 80 80 GLY N N 15 . . 1 1 80 80 GLY H H 1 . 1.14 . . 0.2 . . . . 56 GLY N . 56 GLY H 15774 2 47 1DHNN . 1 1 81 81 ASP N N 15 . . 1 1 81 81 ASP H H 1 . 0.86 . . 0.2 . . . . 57 ASP N . 57 ASP H 15774 2 48 1DHNN . 1 1 82 82 TRP N N 15 . . 1 1 82 82 TRP H H 1 . 3.95 . . 0.2 . . . . 58 TRP N . 58 TRP H 15774 2 49 1DHNN . 1 1 83 83 ARG N N 15 . . 1 1 83 83 ARG H H 1 . 2.48 . . 0.2 . . . . 59 ARG N . 59 ARG H 15774 2 50 1DHNN . 1 1 84 84 TYR N N 15 . . 1 1 84 84 TYR H H 1 . -0.52 . . 0.2 . . . . 60 TYR N . 60 TYR H 15774 2 51 1DHNN . 1 1 85 85 GLU N N 15 . . 1 1 85 85 GLU H H 1 . 4.57 . . 0.2 . . . . 61 GLU N . 61 GLU H 15774 2 52 1DHNN . 1 1 86 86 VAL N N 15 . . 1 1 86 86 VAL H H 1 . 5.64 . . 0.2 . . . . 62 VAL N . 62 VAL H 15774 2 53 1DHNN . 1 1 87 87 ALA N N 15 . . 1 1 87 87 ALA H H 1 . 4.61 . . 0.2 . . . . 63 ALA N . 63 ALA H 15774 2 54 1DHNN . 1 1 88 88 HIS N N 15 . . 1 1 88 88 HIS H H 1 . 4.19 . . 0.2 . . . . 64 HIS N . 64 HIS H 15774 2 55 1DHNN . 1 1 89 89 ASP N N 15 . . 1 1 89 89 ASP H H 1 . 5.7 . . 0.2 . . . . 65 ASP N . 65 ASP H 15774 2 56 1DHNN . 1 1 90 90 GLY N N 15 . . 1 1 90 90 GLY H H 1 . 2.31 . . 0.2 . . . . 66 GLY N . 66 GLY H 15774 2 57 1DHNN . 1 1 92 92 LEU N N 15 . . 1 1 92 92 LEU H H 1 . 5.37 . . 0.2 . . . . 68 LEU N . 68 LEU H 15774 2 58 1DHNN . 1 1 93 93 LEU N N 15 . . 1 1 93 93 LEU H H 1 . 6.85 . . 0.2 . . . . 69 LEU N . 69 LEU H 15774 2 59 1DHNN . 1 1 94 94 ALA N N 15 . . 1 1 94 94 ALA H H 1 . -5.94 . . 0.2 . . . . 70 ALA N . 70 ALA H 15774 2 60 1DHNN . 1 1 95 95 ALA N N 15 . . 1 1 95 95 ALA H H 1 . -0.24 . . 0.2 . . . . 71 ALA N . 71 ALA H 15774 2 61 1DHNN . 1 1 99 99 ASN N N 15 . . 1 1 99 99 ASN H H 1 . -5.31 . . 0.2 . . . . 75 ASN N . 75 ASN H 15774 2 62 1DHNN . 1 1 100 100 GLY N N 15 . . 1 1 100 100 GLY H H 1 . 0.68 . . 0.2 . . . . 76 GLY N . 76 GLY H 15774 2 63 1DHNN . 1 1 102 102 VAL N N 15 . . 1 1 102 102 VAL H H 1 . -2.4 . . 0.2 . . . . 78 VAL N . 78 VAL H 15774 2 64 1DHNN . 1 1 104 104 ALA N N 15 . . 1 1 104 104 ALA H H 1 . -1.73 . . 0.2 . . . . 80 ALA N . 80 ALA H 15774 2 65 1DHNN . 1 1 105 105 GLU N N 15 . . 1 1 105 105 GLU H H 1 . 3.98 . . 0.2 . . . . 81 GLU N . 81 GLU H 15774 2 66 1DHNN . 1 1 106 106 ASP N N 15 . . 1 1 106 106 ASP H H 1 . 1.48 . . 0.2 . . . . 82 ASP N . 82 ASP H 15774 2 67 1DHNN . 1 1 107 107 ALA N N 15 . . 1 1 107 107 ALA H H 1 . 0.02 . . 0.2 . . . . 83 ALA N . 83 ALA H 15774 2 68 1DHNN . 1 1 108 108 LEU N N 15 . . 1 1 108 108 LEU H H 1 . 2.66 . . 0.2 . . . . 84 LEU N . 84 LEU H 15774 2 69 1DHNN . 1 1 110 110 ALA N N 15 . . 1 1 110 110 ALA H H 1 . 1.09 . . 0.2 . . . . 86 ALA N . 86 ALA H 15774 2 70 1DHNN . 1 1 111 111 GLU N N 15 . . 1 1 111 111 GLU H H 1 . -0.55 . . 0.2 . . . . 87 GLU N . 87 GLU H 15774 2 71 1DHNN . 1 1 112 112 ALA N N 15 . . 1 1 112 112 ALA H H 1 . -2.04 . . 0.2 . . . . 88 ALA N . 88 ALA H 15774 2 72 1DHNN . 1 1 113 113 VAL N N 15 . . 1 1 113 113 VAL H H 1 . -4.6 . . 0.2 . . . . 89 VAL N . 89 VAL H 15774 2 73 1DHNN . 1 1 114 114 GLY N N 15 . . 1 1 114 114 GLY H H 1 . 5.08 . . 0.2 . . . . 90 GLY N . 90 GLY H 15774 2 74 1DHNN . 1 1 117 117 LEU N N 15 . . 1 1 117 117 LEU H H 1 . 2.96 . . 0.2 . . . . 93 LEU N . 93 LEU H 15774 2 75 1DHNN . 1 1 118 118 ALA N N 15 . . 1 1 118 118 ALA H H 1 . 5.83 . . 0.2 . . . . 94 ALA N . 94 ALA H 15774 2 76 1DHNN . 1 1 119 119 ARG N N 15 . . 1 1 119 119 ARG H H 1 . 6.2 . . 0.2 . . . . 95 ARG N . 95 ARG H 15774 2 77 1DHNN . 1 1 120 120 ALA N N 15 . . 1 1 120 120 ALA H H 1 . 4.52 . . 0.2 . . . . 96 ALA N . 96 ALA H 15774 2 78 1DHNN . 1 1 121 121 LEU N N 15 . . 1 1 121 121 LEU H H 1 . 6.95 . . 0.2 . . . . 97 LEU N . 97 LEU H 15774 2 79 1DHNN . 1 1 122 122 GLY N N 15 . . 1 1 122 122 GLY H H 1 . 5.39 . . 0.2 . . . . 98 GLY N . 98 GLY H 15774 2 80 1DHNN . 1 1 125 125 VAL N N 15 . . 1 1 125 125 VAL H H 1 . 4.01 . . 0.2 . . . . 101 VAL N . 101 VAL H 15774 2 81 1DHNN . 1 1 126 126 SER N N 15 . . 1 1 126 126 SER H H 1 . 5.76 . . 0.2 . . . . 102 CYS N . 102 CYS H 15774 2 82 1DHNN . 1 1 127 127 ARG N N 15 . . 1 1 127 127 ARG H H 1 . 6.15 . . 0.2 . . . . 103 ARG N . 103 ARG H 15774 2 83 1DHNN . 1 1 128 128 TYR N N 15 . . 1 1 128 128 TYR H H 1 . 5.94 . . 0.2 . . . . 104 TYR N . 104 TYR H 15774 2 84 1DHNN . 1 1 129 129 GLY N N 15 . . 1 1 129 129 GLY H H 1 . -0.54 . . 0.2 . . . . 105 GLY N . 105 GLY H 15774 2 85 1DHNN . 1 1 130 130 ALA N N 15 . . 1 1 130 130 ALA H H 1 . -1.65 . . 0.2 . . . . 106 ALA N . 106 ALA H 15774 2 86 1DHNN . 1 1 131 131 THR N N 15 . . 1 1 131 131 THR H H 1 . 2.65 . . 0.2 . . . . 107 THR N . 107 THR H 15774 2 87 1DHNN . 1 1 132 132 VAL N N 15 . . 1 1 132 132 VAL H H 1 . -0.8 . . 0.2 . . . . 108 VAL N . 108 VAL H 15774 2 88 1DHNN . 1 1 133 133 ILE N N 15 . . 1 1 133 133 ILE H H 1 . -4.81 . . 0.2 . . . . 109 ILE N . 109 ILE H 15774 2 89 1DHNN . 1 1 135 135 ASN N N 15 . . 1 1 135 135 ASN H H 1 . -0.94 . . 0.2 . . . . 111 ASN N . 111 ASN H 15774 2 90 1DHNN . 1 1 136 136 ILE N N 15 . . 1 1 136 136 ILE H H 1 . -6.31 . . 0.2 . . . . 112 ILE N . 112 ILE H 15774 2 91 1DHNN . 1 1 137 137 ASN N N 15 . . 1 1 137 137 ASN H H 1 . -5.33 . . 0.2 . . . . 113 ASN N . 113 ASN H 15774 2 92 1DHNN . 1 1 138 138 ALA N N 15 . . 1 1 138 138 ALA H H 1 . -2.96 . . 0.2 . . . . 114 ALA N . 114 ALA H 15774 2 93 1DHNN . 1 1 139 139 ALA N N 15 . . 1 1 139 139 ALA H H 1 . -1.92 . . 0.2 . . . . 115 ALA N . 115 ALA H 15774 2 94 1DHNN . 1 1 140 140 ILE N N 15 . . 1 1 140 140 ILE H H 1 . -4.13 . . 0.2 . . . . 116 ILE N . 116 ILE H 15774 2 95 1DHNN . 1 1 141 141 GLU N N 15 . . 1 1 141 141 GLU H H 1 . -3.27 . . 0.2 . . . . 117 GLU N . 117 GLU H 15774 2 96 1DHNN . 1 1 142 142 VAL N N 15 . . 1 1 142 142 VAL H H 1 . -1.64 . . 0.2 . . . . 118 VAL N . 118 VAL H 15774 2 97 1DHNN . 1 1 144 144 GLY N N 15 . . 1 1 144 144 GLY H H 1 . -3 . . 0.2 . . . . 120 GLY N . 120 GLY H 15774 2 98 1DHNN . 1 1 145 145 THR N N 15 . . 1 1 145 145 THR H H 1 . -0.84 . . 0.2 . . . . 121 THR N . 121 THR H 15774 2 99 1DHNN . 1 1 146 146 GLY N N 15 . . 1 1 146 146 GLY H H 1 . -0.37 . . 0.2 . . . . 122 GLY N . 122 GLY H 15774 2 100 1DHNN . 1 1 147 147 THR N N 15 . . 1 1 147 147 THR H H 1 . -0.6 . . 0.2 . . . . 123 THR N . 123 THR H 15774 2 101 1DHNN . 1 1 148 148 ASP N N 15 . . 1 1 148 148 ASP H H 1 . -0.53 . . 0.2 . . . . 124 ASP N . 124 ASP H 15774 2 102 1DHNN . 1 1 149 149 TYR N N 15 . . 1 1 149 149 TYR H H 1 . -0.65 . . 0.2 . . . . 125 TYR N . 125 TYR H 15774 2 103 1DHNN . 1 1 150 150 ARG N N 15 . . 1 1 150 150 ARG H H 1 . 0.11 . . 0.2 . . . . 126 ARG N . 126 ARG H 15774 2 104 1DHNN . 1 1 151 151 PHE N N 15 . . 1 1 151 151 PHE H H 1 . 0.24 . . 0.2 . . . . 127 PHE N . 127 PHE H 15774 2 stop_ save_