################################ # Residual dipolar couplings # ################################ save_GEL _RDC_list.Sf_category RDCs _RDC_list.Sf_framecode GEL _RDC_list.Entry_ID 15678 _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 12 '2D 1H-15N HSQC-TROSY' . . . 15678 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 3 $SPARKY . . 15678 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 DHN . 1 1 3 3 ILE N N 15 . . 1 1 3 3 ILE H H 1 . 1.728 . . 1.5 . . . . 3 I N . 3 I H 15678 1 2 DHN . 1 1 4 4 ILE N N 15 . . 1 1 4 4 ILE H H 1 . -5.168 . . 1.5 . . . . 4 I N . 4 I H 15678 1 3 DHN . 1 1 7 7 SER N N 15 . . 1 1 7 7 SER H H 1 . 5.61 . . 1.5 . . . . 7 S N . 7 S H 15678 1 4 DHN . 1 1 8 8 GLU N N 15 . . 1 1 8 8 GLU H H 1 . 5.18 . . 1.5 . . . . 8 E N . 8 E H 15678 1 5 DHN . 1 1 13 13 ASN N N 15 . . 1 1 13 13 ASN H H 1 . -14.152 . . 1.5 . . . . 13 N N . 13 N H 15678 1 6 DHN . 1 1 14 14 THR N N 15 . . 1 1 14 14 THR H H 1 . -6.102 . . 1.5 . . . . 14 T N . 14 T H 15678 1 7 DHN . 1 1 15 15 MET N N 15 . . 1 1 15 15 MET H H 1 . 2.618 . . 1.5 . . . . 15 M N . 15 M H 15678 1 8 DHN . 1 1 16 16 LYS N N 15 . . 1 1 16 16 LYS H H 1 . 3.684 . . 1.5 . . . . 16 K N . 16 K H 15678 1 9 DHN . 1 1 17 17 VAL N N 15 . . 1 1 17 17 VAL H H 1 . 3.512 . . 1.5 . . . . 17 V N . 17 V H 15678 1 10 DHN . 1 1 18 18 SER N N 15 . . 1 1 18 18 SER H H 1 . 4.83 . . 1.5 . . . . 18 S N . 18 S H 15678 1 11 DHN . 1 1 19 19 LEU N N 15 . . 1 1 19 19 LEU H H 1 . -6.612 . . 1.5 . . . . 19 L N . 19 L H 15678 1 12 DHN . 1 1 28 28 PHE N N 15 . . 1 1 28 28 PHE H H 1 . -0.382 . . 1.5 . . . . 28 F N . 28 F H 15678 1 13 DHN . 1 1 29 29 THR N N 15 . . 1 1 29 29 THR H H 1 . 2.016 . . 1.5 . . . . 29 T N . 29 T H 15678 1 14 DHN . 1 1 32 32 THR N N 15 . . 1 1 32 32 THR H H 1 . 3.18 . . 1.5 . . . . 32 T N . 32 T H 15678 1 15 DHN . 1 1 35 35 GLN N N 15 . . 1 1 35 35 GLN H H 1 . 8.212 . . 1.5 . . . . 35 Q N . 35 Q H 15678 1 16 DHN . 1 1 36 36 GLU N N 15 . . 1 1 36 36 GLU H H 1 . 9.242 . . 1.5 . . . . 36 E N . 36 E H 15678 1 17 DHN . 1 1 38 38 GLN N N 15 . . 1 1 38 38 GLN H H 1 . 9.322 . . 1.5 . . . . 38 Q N . 38 Q H 15678 1 18 DHN . 1 1 40 40 GLU N N 15 . . 1 1 40 40 GLU H H 1 . 4.466 . . 1.5 . . . . 40 E N . 40 E H 15678 1 19 DHN . 1 1 43 43 ASN N N 15 . . 1 1 43 43 ASN H H 1 . 5.604 . . 1.5 . . . . 43 N N . 43 N H 15678 1 20 DHN . 1 1 45 45 LEU N N 15 . . 1 1 45 45 LEU H H 1 . 11.474 . . 1.5 . . . . 45 L N . 45 L H 15678 1 21 DHN . 1 1 46 46 PHE N N 15 . . 1 1 46 46 PHE H H 1 . 4.928 . . 1.5 . . . . 46 F N . 46 F H 15678 1 22 DHN . 1 1 47 47 GLU N N 15 . . 1 1 47 47 GLU H H 1 . 9.004 . . 1.5 . . . . 47 E N . 47 E H 15678 1 23 DHN . 1 1 48 48 ILE N N 15 . . 1 1 48 48 ILE H H 1 . 8.252 . . 1.5 . . . . 48 I N . 48 I H 15678 1 24 DHN . 1 1 50 50 GLY N N 15 . . 1 1 50 50 GLY H H 1 . 4.604 . . 1.5 . . . . 50 G N . 50 G H 15678 1 25 DHN . 1 1 52 52 LYS N N 15 . . 1 1 52 52 LYS H H 1 . 4.558 . . 1.5 . . . . 52 K N . 52 K H 15678 1 26 DHN . 1 1 53 53 SER N N 15 . . 1 1 53 53 SER H H 1 . 4.92 . . 1.5 . . . . 53 S N . 53 S H 15678 1 27 DHN . 1 1 54 54 ILE N N 15 . . 1 1 54 54 ILE H H 1 . 4.918 . . 1.5 . . . . 54 I N . 54 I H 15678 1 28 DHN . 1 1 55 55 PHE N N 15 . . 1 1 55 55 PHE H H 1 . 4.682 . . 1.5 . . . . 55 F N . 55 F H 15678 1 29 DHN . 1 1 56 56 TYR N N 15 . . 1 1 56 56 TYR H H 1 . 2.946 . . 1.5 . . . . 56 Y N . 56 Y H 15678 1 30 DHN . 1 1 57 57 VAL N N 15 . . 1 1 57 57 VAL H H 1 . 3.204 . . 1.5 . . . . 57 V N . 57 V H 15678 1 31 DHN . 1 1 59 59 ASP N N 15 . . 1 1 59 59 ASP H H 1 . -9.698 . . 1.5 . . . . 59 D N . 59 D H 15678 1 32 DHN . 1 1 60 60 PHE N N 15 . . 1 1 60 60 PHE H H 1 . -0.432 . . 1.5 . . . . 60 F N . 60 F H 15678 1 33 DHN . 1 1 61 61 ILE N N 15 . . 1 1 61 61 ILE H H 1 . 3.216 . . 1.5 . . . . 61 I N . 61 I H 15678 1 34 DHN . 1 1 62 62 SER N N 15 . . 1 1 62 62 SER H H 1 . 5.362 . . 1.5 . . . . 62 S N . 62 S H 15678 1 35 DHN . 1 1 63 63 ILE N N 15 . . 1 1 63 63 ILE H H 1 . 5.872 . . 1.5 . . . . 63 I N . 63 I H 15678 1 36 DHN . 1 1 64 64 ASP N N 15 . . 1 1 64 64 ASP H H 1 . 1.518 . . 1.5 . . . . 64 D N . 64 D H 15678 1 37 DHN . 1 1 67 67 ASP N N 15 . . 1 1 67 67 ASP H H 1 . 0.594 . . 1.5 . . . . 67 D N . 67 D H 15678 1 38 DHN . 1 1 68 68 ASN N N 15 . . 1 1 68 68 ASN H H 1 . 4.15 . . 1.5 . . . . 68 N N . 68 N H 15678 1 39 DHN . 1 1 69 69 ALA N N 15 . . 1 1 69 69 ALA H H 1 . -0.114 . . 1.5 . . . . 69 A N . 69 A H 15678 1 40 DHN . 1 1 70 70 ASN N N 15 . . 1 1 70 70 ASN H H 1 . -10.742 . . 1.5 . . . . 70 N N . 70 N H 15678 1 41 DHN . 1 1 71 71 TRP N N 15 . . 1 1 71 71 TRP H H 1 . -15.004 . . 1.5 . . . . 71 W N . 71 W H 15678 1 42 DHN . 1 1 72 72 ASN N N 15 . . 1 1 72 72 ASN H H 1 . -9.62 . . 1.5 . . . . 72 N N . 72 N H 15678 1 43 DHN . 1 1 73 73 GLU N N 15 . . 1 1 73 73 GLU H H 1 . -15.85 . . 1.5 . . . . 73 E N . 73 E H 15678 1 44 DHN . 1 1 74 74 LEU N N 15 . . 1 1 74 74 LEU H H 1 . -16.52 . . 1.5 . . . . 74 L N . 74 L H 15678 1 45 DHN . 1 1 75 75 LEU N N 15 . . 1 1 75 75 LEU H H 1 . -5.644 . . 1.5 . . . . 75 L N . 75 L H 15678 1 46 DHN . 1 1 77 77 GLN N N 15 . . 1 1 77 77 GLN H H 1 . -14.012 . . 1.5 . . . . 77 Q N . 77 Q H 15678 1 47 DHN . 1 1 78 78 ILE N N 15 . . 1 1 78 78 ILE H H 1 . -5.986 . . 1.5 . . . . 78 I N . 78 I H 15678 1 48 DHN . 1 1 79 79 GLU N N 15 . . 1 1 79 79 GLU H H 1 . 1.518 . . 1.5 . . . . 79 E N . 79 E H 15678 1 49 DHN . 1 1 82 82 PHE N N 15 . . 1 1 82 82 PHE H H 1 . -2.354 . . 1.5 . . . . 82 F N . 82 F H 15678 1 50 DHN . 1 1 83 83 ALA N N 15 . . 1 1 83 83 ALA H H 1 . 2.836 . . 1.5 . . . . 83 A N . 83 A H 15678 1 51 DHN . 1 1 84 84 LYS N N 15 . . 1 1 84 84 LYS H H 1 . -3.432 . . 1.5 . . . . 84 K N . 84 K H 15678 1 52 DHN . 1 1 85 85 SER N N 15 . . 1 1 85 85 SER H H 1 . -4.67 . . 1.5 . . . . 85 S N . 85 S H 15678 1 53 DHN . 1 1 86 86 ASN N N 15 . . 1 1 86 86 ASN H H 1 . 1.998 . . 1.5 . . . . 86 N N . 86 N H 15678 1 stop_ save_ ################################ # Residual dipolar couplings # ################################ save_Bicelle _RDC_list.Sf_category RDCs _RDC_list.Sf_framecode Bicelle _RDC_list.Entry_ID 15678 _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 13 '2D 1H-15N HSQC-TROSY' . . . 15678 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 3 $SPARKY . . 15678 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 DHN . 1 1 2 2 GLU N N 15 . . 1 1 2 2 GLU H H 1 . 0.408 . . 1.5 . . . . 2 E N . 2 E H 15678 2 2 DHN . 1 1 3 3 ILE N N 15 . . 1 1 3 3 ILE H H 1 . 3 . . 1.5 . . . . 3 I N . 3 I H 15678 2 3 DHN . 1 1 7 7 SER N N 15 . . 1 1 7 7 SER H H 1 . 7.704 . . 1.5 . . . . 7 S N . 7 S H 15678 2 4 DHN . 1 1 8 8 GLU N N 15 . . 1 1 8 8 GLU H H 1 . 9.884 . . 1.5 . . . . 8 E N . 8 E H 15678 2 5 DHN . 1 1 9 9 THR N N 15 . . 1 1 9 9 THR H H 1 . 3.782 . . 1.5 . . . . 9 T N . 9 T H 15678 2 6 DHN . 1 1 11 11 ASN N N 15 . . 1 1 11 11 ASN H H 1 . -6.69 . . 1.5 . . . . 11 N N . 11 N H 15678 2 7 DHN . 1 1 13 13 ASN N N 15 . . 1 1 13 13 ASN H H 1 . -7.69 . . 1.5 . . . . 13 N N . 13 N H 15678 2 8 DHN . 1 1 14 14 THR N N 15 . . 1 1 14 14 THR H H 1 . -4.062 . . 1.5 . . . . 14 T N . 14 T H 15678 2 9 DHN . 1 1 15 15 MET N N 15 . . 1 1 15 15 MET H H 1 . 3.588 . . 1.5 . . . . 15 M N . 15 M H 15678 2 10 DHN . 1 1 16 16 LYS N N 15 . . 1 1 16 16 LYS H H 1 . 5.454 . . 1.5 . . . . 16 K N . 16 K H 15678 2 11 DHN . 1 1 17 17 VAL N N 15 . . 1 1 17 17 VAL H H 1 . 8.628 . . 1.5 . . . . 17 V N . 17 V H 15678 2 12 DHN . 1 1 18 18 SER N N 15 . . 1 1 18 18 SER H H 1 . 4.956 . . 1.5 . . . . 18 S N . 18 S H 15678 2 13 DHN . 1 1 19 19 LEU N N 15 . . 1 1 19 19 LEU H H 1 . -2.356 . . 1.5 . . . . 19 L N . 19 L H 15678 2 14 DHN . 1 1 20 20 SER N N 15 . . 1 1 20 20 SER H H 1 . -0.72 . . 1.5 . . . . 20 S N . 20 S H 15678 2 15 DHN . 1 1 25 25 ASP N N 15 . . 1 1 25 25 ASP H H 1 . 0.912 . . 1.5 . . . . 25 D N . 25 D H 15678 2 16 DHN . 1 1 26 26 ASN N N 15 . . 1 1 26 26 ASN H H 1 . 3.884 . . 1.5 . . . . 26 N N . 26 N H 15678 2 17 DHN . 1 1 29 29 THR N N 15 . . 1 1 29 29 THR H H 1 . 8.078 . . 1.5 . . . . 29 T N . 29 T H 15678 2 18 DHN . 1 1 34 34 ALA N N 15 . . 1 1 34 34 ALA H H 1 . 2.046 . . 1.5 . . . . 34 A N . 34 A H 15678 2 19 DHN . 1 1 35 35 GLN N N 15 . . 1 1 35 35 GLN H H 1 . 10.138 . . 1.5 . . . . 35 Q N . 35 Q H 15678 2 20 DHN . 1 1 36 36 GLU N N 15 . . 1 1 36 36 GLU H H 1 . 9.232 . . 1.5 . . . . 36 E N . 36 E H 15678 2 21 DHN . 1 1 38 38 GLN N N 15 . . 1 1 38 38 GLN H H 1 . 2.118 . . 1.5 . . . . 38 Q N . 38 Q H 15678 2 22 DHN . 1 1 40 40 GLU N N 15 . . 1 1 40 40 GLU H H 1 . -3.136 . . 1.5 . . . . 40 E N . 40 E H 15678 2 23 DHN . 1 1 43 43 ASN N N 15 . . 1 1 43 43 ASN H H 1 . -1.972 . . 1.5 . . . . 43 N N . 43 N H 15678 2 24 DHN . 1 1 45 45 LEU N N 15 . . 1 1 45 45 LEU H H 1 . 1.428 . . 1.5 . . . . 45 L N . 45 L H 15678 2 25 DHN . 1 1 46 46 PHE N N 15 . . 1 1 46 46 PHE H H 1 . -3.758 . . 1.5 . . . . 46 F N . 46 F H 15678 2 26 DHN . 1 1 47 47 GLU N N 15 . . 1 1 47 47 GLU H H 1 . 5.214 . . 1.5 . . . . 47 E N . 47 E H 15678 2 27 DHN . 1 1 48 48 ILE N N 15 . . 1 1 48 48 ILE H H 1 . 0.09 . . 1.5 . . . . 48 I N . 48 I H 15678 2 28 DHN . 1 1 50 50 GLY N N 15 . . 1 1 50 50 GLY H H 1 . 9.618 . . 1.5 . . . . 50 G N . 50 G H 15678 2 29 DHN . 1 1 52 52 LYS N N 15 . . 1 1 52 52 LYS H H 1 . 6.324 . . 1.5 . . . . 52 K N . 52 K H 15678 2 30 DHN . 1 1 53 53 SER N N 15 . . 1 1 53 53 SER H H 1 . 8.63 . . 1.5 . . . . 53 S N . 53 S H 15678 2 31 DHN . 1 1 54 54 ILE N N 15 . . 1 1 54 54 ILE H H 1 . 8.612 . . 1.5 . . . . 54 I N . 54 I H 15678 2 32 DHN . 1 1 55 55 PHE N N 15 . . 1 1 55 55 PHE H H 1 . 6.554 . . 1.5 . . . . 55 F N . 55 F H 15678 2 33 DHN . 1 1 56 56 TYR N N 15 . . 1 1 56 56 TYR H H 1 . 9.562 . . 1.5 . . . . 56 Y N . 56 Y H 15678 2 34 DHN . 1 1 57 57 VAL N N 15 . . 1 1 57 57 VAL H H 1 . 6.21 . . 1.5 . . . . 57 V N . 57 V H 15678 2 35 DHN . 1 1 59 59 ASP N N 15 . . 1 1 59 59 ASP H H 1 . -8.786 . . 1.5 . . . . 59 D N . 59 D H 15678 2 36 DHN . 1 1 60 60 PHE N N 15 . . 1 1 60 60 PHE H H 1 . 4.384 . . 1.5 . . . . 60 F N . 60 F H 15678 2 37 DHN . 1 1 61 61 ILE N N 15 . . 1 1 61 61 ILE H H 1 . 7.256 . . 1.5 . . . . 61 I N . 61 I H 15678 2 38 DHN . 1 1 62 62 SER N N 15 . . 1 1 62 62 SER H H 1 . 7.186 . . 1.5 . . . . 62 S N . 62 S H 15678 2 39 DHN . 1 1 63 63 ILE N N 15 . . 1 1 63 63 ILE H H 1 . 9.256 . . 1.5 . . . . 63 I N . 63 I H 15678 2 40 DHN . 1 1 64 64 ASP N N 15 . . 1 1 64 64 ASP H H 1 . 0.998 . . 1.5 . . . . 64 D N . 64 D H 15678 2 41 DHN . 1 1 66 66 GLU N N 15 . . 1 1 66 66 GLU H H 1 . -4.508 . . 1.5 . . . . 66 E N . 66 E H 15678 2 42 DHN . 1 1 67 67 ASP N N 15 . . 1 1 67 67 ASP H H 1 . 8.108 . . 1.5 . . . . 67 D N . 67 D H 15678 2 43 DHN . 1 1 68 68 ASN N N 15 . . 1 1 68 68 ASN H H 1 . 8.168 . . 1.5 . . . . 68 N N . 68 N H 15678 2 44 DHN . 1 1 72 72 ASN N N 15 . . 1 1 72 72 ASN H H 1 . -8.89 . . 1.5 . . . . 72 N N . 72 N H 15678 2 45 DHN . 1 1 73 73 GLU N N 15 . . 1 1 73 73 GLU H H 1 . -7.488 . . 1.5 . . . . 73 E N . 73 E H 15678 2 46 DHN . 1 1 74 74 LEU N N 15 . . 1 1 74 74 LEU H H 1 . -11.78 . . 1.5 . . . . 74 L N . 74 L H 15678 2 47 DHN . 1 1 75 75 LEU N N 15 . . 1 1 75 75 LEU H H 1 . -7.592 . . 1.5 . . . . 75 L N . 75 L H 15678 2 48 DHN . 1 1 77 77 GLN N N 15 . . 1 1 77 77 GLN H H 1 . -11.22 . . 1.5 . . . . 77 Q N . 77 Q H 15678 2 49 DHN . 1 1 78 78 ILE N N 15 . . 1 1 78 78 ILE H H 1 . -7.508 . . 1.5 . . . . 78 I N . 78 I H 15678 2 50 DHN . 1 1 79 79 GLU N N 15 . . 1 1 79 79 GLU H H 1 . -4.842 . . 1.5 . . . . 79 E N . 79 E H 15678 2 51 DHN . 1 1 82 82 PHE N N 15 . . 1 1 82 82 PHE H H 1 . -5.328 . . 1.5 . . . . 82 F N . 82 F H 15678 2 52 DHN . 1 1 83 83 ALA N N 15 . . 1 1 83 83 ALA H H 1 . -1.98 . . 1.5 . . . . 83 A N . 83 A H 15678 2 53 DHN . 1 1 85 85 SER N N 15 . . 1 1 85 85 SER H H 1 . -3.912 . . 1.5 . . . . 85 S N . 85 S H 15678 2 stop_ save_