data_nef_c19578_2mfy save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 2MFY stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 1 3 CYS SG 1 16 CYS SG 1 1 GLY C 1 2 ABA N 1 2 ABA C 1 3 CYS N 1 7 ARG C 1 8 ABA N 1 8 ABA C 1 9 ASN N 1 16 CYS C 1 17 NH2 N stop_ loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 GLY start . false 2 A 2 ABA middle . . 3 A 3 CYS middle -HG . 4 A 4 SER middle . . 5 A 5 ASP middle . . 6 A 6 PRO middle . false 7 A 7 ARG middle . . 8 A 8 ABA middle . . 9 A 9 ASN middle . . 10 A 10 TYR middle . . 11 A 11 ASP middle . . 12 A 12 HIS middle . . 13 A 13 PRO middle . false 14 A 14 GLU middle . . 15 A 15 ILE middle . . 16 A 16 CYS middle -HG . 17 A 17 NH2 end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 GLY HAx H 1 3.92 . A 1 GLY HAy H 1 3.92 . A 1 GLY CA C 13 43.32 . A 2 ABA H H 1 8.52 . A 2 ABA HA H 1 4.53 . A 2 ABA CA C 13 55.83 . A 2 ABA CB C 13 36.68 . A 2 ABA N N 15 120.40 . A 3 CYS H H 1 8.57 . A 3 CYS HA H 1 4.68 . A 3 CYS CA C 13 56.81 . A 3 CYS CB C 13 39.89 . A 4 SER H H 1 8.45 . A 4 SER HA H 1 4.36 . A 4 SER CA C 13 59.10 . A 4 SER CB C 13 62.98 . A 4 SER N N 15 115.06 . A 5 ASP H H 1 7.62 . A 5 ASP HA H 1 4.88 . A 5 ASP CA C 13 51.89 . A 5 ASP CB C 13 42.74 . A 5 ASP N N 15 123.20 . A 6 PRO HA H 1 4.46 . A 6 PRO CA C 13 64.36 . A 6 PRO CB C 13 32.27 . A 7 ARG H H 1 8.63 . A 7 ARG HA H 1 4.19 . A 7 ARG CA C 13 56.97 . A 7 ARG CB C 13 30.01 . A 7 ARG N N 15 117.98 . A 8 ABA H H 1 7.66 . A 8 ABA HA H 1 4.16 . A 8 ABA CA C 13 56.94 . A 8 ABA CB C 13 36.71 . A 8 ABA N N 15 118.35 . A 9 ASN H H 1 7.95 . A 9 ASN HA H 1 4.52 . A 9 ASN CA C 13 53.18 . A 9 ASN CB C 13 38.86 . A 9 ASN N N 15 118.15 . A 10 TYR H H 1 8.03 . A 10 TYR HA H 1 4.54 . A 10 TYR CA C 13 57.67 . A 10 TYR CB C 13 38.43 . A 10 TYR N N 15 119.39 . A 11 ASP H H 1 8.36 . A 11 ASP HA H 1 4.46 . A 11 ASP CA C 13 54.62 . A 11 ASP CB C 13 40.34 . A 11 ASP N N 15 119.16 . A 12 HIS H H 1 7.77 . A 12 HIS HA H 1 5.11 . A 12 HIS CA C 13 53.49 . A 12 HIS CB C 13 28.81 . A 12 HIS N N 15 115.97 . A 13 PRO HA H 1 4.45 . A 13 PRO CA C 13 64.04 . A 13 PRO CB C 13 32.04 . A 14 GLU H H 1 9.06 . A 14 GLU HA H 1 4.37 . A 14 GLU CA C 13 56.52 . A 14 GLU CB C 13 29.76 . A 15 ILE H H 1 8.13 . A 15 ILE HA H 1 4.15 . A 15 ILE CA C 13 61.17 . A 15 ILE CB C 13 38.11 . A 15 ILE N N 15 122.65 . A 16 CYS H H 1 8.30 . A 16 CYS HA H 1 4.65 . A 16 CYS CA C 13 54.68 . A 16 CYS CB C 13 41.45 . A 16 CYS N N 15 122.81 . stop_ save_ save_CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type . save_ save_CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 7 ARG H A 7 ARG HBy 1.0 1.8 3.56 2 2 A 7 ARG HE A 7 ARG HBx 1.0 1.8 3.67 3 3 A 7 ARG HE A 7 ARG HBy 1.0 1.8 3.67 4 4 A 15 ILE H A 15 ILE HB 1.0 1.8 3.32 5 5 A 7 ARG H A 7 ARG HBx 1.0 1.8 3.56 6 6 A 15 ILE H A 15 ILE HG1x 1.0 1.8 4.23 7 7 A 15 ILE HG21 A 16 CYS H 1.0 1.8 3.94 8 8 A 15 ILE H A 15 ILE HG21 1.0 1.8 3.93 9 9 A 15 ILE H A 15 ILE HG1y 1.0 1.8 4.23 10 10 A 9 ASN H A 8 ABA HBx 1.0 1.8 4.13 11 11 A 7 ARG H A 6 PRO HDx 1.0 1.8 3.80 12 12 A 7 ARG H A 5 ASP HBy 1.0 1.8 4.51 13 13 A 11 ASP H A 11 ASP HBy 1.0 1.8 3.49 14 14 A 11 ASP H A 11 ASP HBx 1.0 1.8 3.49 15 15 A 11 ASP H A 10 TYR HBx 1.0 1.8 3.56 16 16 A 3 CYS HBx A 4 SER H 1.0 1.8 3.11 17 17 A 4 SER H A 3 CYS HBy 1.0 1.8 3.11 18 18 A 16 CYS H A 16 CYS HBy 1.0 1.8 3.48 19 19 A 16 CYS H A 16 CYS HBx 1.0 1.8 3.95 20 20 A 16 CYS H A 15 ILE HA 1.0 1.8 3.05 21 21 A 11 ASP H A 10 TYR HA 1.0 1.8 2.87 22 22 A 9 ASN HA A 10 TYR H 1.0 1.8 2.78 23 23 A 15 ILE H A 14 GLU HA 1.0 1.8 3.06 24 24 A 11 ASP HA A 12 HIS H 1.0 1.8 3.17 25 25 A 7 ARG HE A 7 ARG HA 1.0 1.8 3.66 26 26 A 4 SER HA A 5 ASP H 1.0 1.8 3.51 27 27 A 10 TYR HA A 10 TYR HD% 1.0 1.8 3.01 28 28 A 10 TYR HD% A 13 PRO HA 1.0 1.8 3.85 29 29 A 12 HIS H A 13 PRO HDy 1.0 1.8 4.06 30 30 A 10 TYR HBx A 12 HIS H 1.0 1.8 3.80 31 31 A 12 HIS H A 10 TYR HBy 1.0 1.8 4.07 32 32 A 12 HIS H A 11 ASP HBy 1.0 1.8 3.97 33 33 A 9 ASN H A 9 ASN HBx 1.0 1.8 3.79 34 34 A 9 ASN H A 9 ASN HBy 1.0 1.8 3.79 35 35 A 10 TYR HBx A 10 TYR H 1.0 1.8 3.35 36 36 A 10 TYR H A 10 TYR HBy 1.0 1.8 3.08 37 37 A 12 HIS HD2 A 12 HIS HBy 1.0 1.8 3.63 38 38 A 12 HIS HD2 A 12 HIS HBx 1.0 1.8 3.63 39 39 A 9 ASN HBy A 9 ASN HD2x 1.0 1.8 4.13 40 40 A 9 ASN HBx A 9 ASN HD2x 1.0 1.8 4.13 41 41 A 5 ASP H A 5 ASP HBx 1.0 1.8 3.33 42 42 A 5 ASP H A 5 ASP HBy 1.0 1.8 3.33 43 43 A 11 ASP H A 12 HIS H 1.0 1.8 3.03 44 44 A 4 SER H A 5 ASP H 1.0 1.8 3.22 45 45 A 11 ASP H A 10 TYR HD% 1.0 1.8 4.00 46 46 A 10 TYR H A 10 TYR HD% 1.0 1.8 3.52 47 47 A 15 ILE H A 16 CYS H 1.0 1.8 3.54 48 48 A 10 TYR HA A 10 TYR H 1.0 1.8 2.81 49 49 A 11 ASP H A 10 TYR HBy 1.0 1.8 3.82 50 50 A 12 HIS HD2 A 12 HIS HA 1.0 1.8 3.91 51 51 A 12 HIS H A 12 HIS HD2 1.0 1.8 3.79 52 52 A 12 HIS HD2 A 11 ASP HBy 1.0 1.8 4.40 53 53 A 12 HIS HD2 A 11 ASP HBx 1.0 1.8 4.40 54 54 A 12 HIS HA A 13 PRO HDx 1.0 1.8 3.18 55 55 A 12 HIS HA A 13 PRO HDy 1.0 1.8 3.18 56 56 A 5 ASP HA A 6 PRO HDy 1.0 1.8 3.05 57 57 A 5 ASP HA A 6 PRO HDx 1.0 1.8 3.05 58 58 A 16 CYS HBy A 16 CYS HA 1.0 1.8 2.81 59 59 A 15 ILE HG21 A 15 ILE HA 1.0 1.8 2.93 60 60 A 15 ILE HG21 A 15 ILE HG1x 1.0 1.8 3.69 61 61 A 15 ILE HG21 A 15 ILE HG1y 1.0 1.8 3.69 62 62 A 15 ILE HB A 15 ILE HD11 1.0 1.8 3.39 63 63 A 15 ILE HA A 15 ILE HD11 1.0 1.8 3.30 64 64 A 12 HIS H A 11 ASP HBx 1.0 1.8 3.97 65 65 A 7 ARG HBx A 7 ARG HDx 1.0 1.8 3.93 66 66 A 7 ARG HDx A 7 ARG HBy 1.0 1.8 3.93 67 67 A 15 ILE HA A 15 ILE HG1y 1.0 1.8 3.97 68 68 A 15 ILE HA A 15 ILE HG1x 1.0 1.8 3.97 69 69 A 7 ARG H A 6 PRO HDy 1.0 1.8 3.80 70 70 A 7 ARG HBx A 7 ARG HDy 1.0 1.8 3.93 71 71 A 7 ARG HBy A 7 ARG HDy 1.0 1.8 3.93 72 72 A 12 HIS HBx A 13 PRO HDx 1.0 1.8 6.02 73 73 A 12 HIS HBx A 13 PRO HDy 1.0 1.8 6.02 74 74 A 13 PRO HDx A 12 HIS HBy 1.0 1.8 6.02 75 75 A 5 ASP HBx A 6 PRO HDy 1.0 1.8 5.90 76 76 A 5 ASP HBx A 6 PRO HDx 1.0 1.8 5.90 77 77 A 6 PRO HDx A 5 ASP HBy 1.0 1.8 5.90 78 78 A 10 TYR H A 12 HIS H 1.0 1.8 3.96 79 79 A 12 HIS H A 13 PRO HDx 1.0 1.8 4.06 80 80 A 14 GLU HA A 14 GLU HGx 1.0 1.8 3.99 81 81 A 14 GLU HA A 14 GLU HGy 1.0 1.8 3.99 82 82 A 15 ILE H A 15 ILE HD11 1.0 1.8 4.60 83 83 A 15 ILE HB A 16 CYS H 1.0 1.8 4.33 84 84 A 7 ARG H A 5 ASP HBx 1.0 1.8 4.51 85 85 A 15 ILE H A 14 GLU H 1.0 1.8 4.26 86 86 A 13 PRO HA A 12 HIS HD2 1.0 1.8 3.88 87 87 A 12 HIS H A 10 TYR HD% 1.0 1.8 4.27 88 88 A 9 ASN HBy A 9 ASN HD2y 1.0 1.8 4.13 89 89 A 9 ASN HBx A 9 ASN HD2y 1.0 1.8 4.13 90 90 A 16 CYS HBy A 15 ILE HA 1.0 1.8 4.19 91 91 A 2 ABA HBx A 8 ABA HBy 1.0 1.8 3.71 92 91 A 2 ABA HBx A 8 ABA HBx 1.0 1.8 3.71 93 92 A 4 SER H A 4 SER HBx 1.0 1.8 3.73 94 92 A 4 SER H A 4 SER HBy 1.0 1.8 3.73 95 93 A 5 ASP H A 5 ASP HBy 1.0 1.8 3.14 96 93 A 5 ASP H A 5 ASP HBx 1.0 1.8 3.14 97 94 A 5 ASP HBx A 6 PRO HDy 1.0 1.8 4.49 98 94 A 5 ASP HBy A 6 PRO HDy 1.0 1.8 4.49 99 94 A 6 PRO HDx A 5 ASP HBy 1.0 1.8 4.49 100 94 A 5 ASP HBx A 6 PRO HDx 1.0 1.8 4.49 101 95 A 5 ASP HBy A 6 PRO HDy 1.0 1.8 5.90 102 96 A 7 ARG H A 5 ASP HBy 1.0 1.8 4.30 103 96 A 7 ARG H A 5 ASP HBx 1.0 1.8 4.30 104 97 A 5 ASP HBy A 8 ABA HBy 1.0 1.8 5.15 105 97 A 5 ASP HBx A 8 ABA HBy 1.0 1.8 5.15 106 97 A 8 ABA HBx A 5 ASP HBy 1.0 1.8 5.15 107 97 A 8 ABA HBx A 5 ASP HBx 1.0 1.8 5.15 108 98 A 8 ABA HBx A 5 ASP HBy 1.0 1.8 6.26 109 99 A 8 ABA HBx A 5 ASP HBx 1.0 1.8 6.26 110 100 A 7 ARG H A 6 PRO HBx 1.0 1.8 4.18 111 100 A 7 ARG H A 6 PRO HBy 1.0 1.8 4.18 112 101 A 7 ARG H A 6 PRO HDy 1.0 1.8 3.57 113 101 A 7 ARG H A 6 PRO HDx 1.0 1.8 3.57 114 102 A 7 ARG H A 7 ARG HBy 1.0 1.8 3.27 115 102 A 7 ARG H A 7 ARG HBx 1.0 1.8 3.27 116 103 A 7 ARG H A 7 ARG HGx 1.0 1.8 3.99 117 103 A 7 ARG H A 7 ARG HGy 1.0 1.8 3.99 118 104 A 7 ARG HA A 7 ARG HGx 1.0 1.8 3.72 119 104 A 7 ARG HA A 7 ARG HGy 1.0 1.8 3.72 120 105 A 7 ARG HBy A 7 ARG HGx 1.0 1.8 2.45 121 105 A 7 ARG HBx A 7 ARG HGx 1.0 1.8 2.45 122 105 A 7 ARG HGy A 7 ARG HBy 1.0 1.8 2.45 123 105 A 7 ARG HBx A 7 ARG HGy 1.0 1.8 2.45 124 106 A 7 ARG HBx A 7 ARG HDy 1.0 1.8 3.64 125 106 A 7 ARG HBy A 7 ARG HDy 1.0 1.8 3.64 126 106 A 7 ARG HDx A 7 ARG HBy 1.0 1.8 3.64 127 106 A 7 ARG HBx A 7 ARG HDx 1.0 1.8 3.64 128 107 A 7 ARG HE A 7 ARG HBy 1.0 1.8 3.33 129 107 A 7 ARG HE A 7 ARG HBx 1.0 1.8 3.33 130 108 A 7 ARG HE A 7 ARG HGx 1.0 1.8 3.72 131 108 A 7 ARG HE A 7 ARG HGy 1.0 1.8 3.72 132 109 A 9 ASN H A 8 ABA HBy 1.0 1.8 3.95 133 109 A 9 ASN H A 8 ABA HBx 1.0 1.8 3.95 134 110 A 12 HIS H A 9 ASN HD2x 1.0 1.8 5.09 135 110 A 12 HIS H A 9 ASN HD2y 1.0 1.8 5.09 136 111 A 10 TYR HE% A 13 PRO HBx 1.0 1.8 4.79 137 111 A 10 TYR HE% A 13 PRO HBy 1.0 1.8 4.79 138 112 A 11 ASP H A 11 ASP HBy 1.0 1.8 3.29 139 112 A 11 ASP H A 11 ASP HBx 1.0 1.8 3.29 140 113 A 11 ASP HA A 11 ASP HBy 1.0 1.8 2.70 141 113 A 11 ASP HA A 11 ASP HBx 1.0 1.8 2.70 142 114 A 12 HIS HD2 A 11 ASP HBy 1.0 1.8 4.04 143 114 A 12 HIS HD2 A 11 ASP HBx 1.0 1.8 4.04 144 115 A 12 HIS H A 12 HIS HBy 1.0 1.8 3.73 145 115 A 12 HIS H A 12 HIS HBx 1.0 1.8 3.73 146 116 A 12 HIS H A 13 PRO HDy 1.0 1.8 3.88 147 116 A 12 HIS H A 13 PRO HDx 1.0 1.8 3.88 148 117 A 12 HIS HA A 13 PRO HGx 1.0 1.8 5.08 149 117 A 12 HIS HA A 13 PRO HGy 1.0 1.8 5.08 150 118 A 12 HIS HA A 13 PRO HDy 1.0 1.8 3.00 151 118 A 12 HIS HA A 13 PRO HDx 1.0 1.8 3.00 152 119 A 12 HIS HD2 A 12 HIS HBy 1.0 1.8 3.37 153 119 A 12 HIS HD2 A 12 HIS HBx 1.0 1.8 3.37 154 120 A 12 HIS HBx A 13 PRO HDy 1.0 1.8 4.57 155 120 A 12 HIS HBy A 13 PRO HDy 1.0 1.8 4.57 156 120 A 13 PRO HDx A 12 HIS HBy 1.0 1.8 4.57 157 120 A 12 HIS HBx A 13 PRO HDx 1.0 1.8 4.57 158 121 A 12 HIS HBy A 13 PRO HDy 1.0 1.8 6.02 159 122 A 13 PRO HBx A 14 GLU HBx 1.0 1.8 4.34 160 122 A 13 PRO HBy A 14 GLU HBx 1.0 1.8 4.34 161 122 A 14 GLU HBy A 13 PRO HBx 1.0 1.8 4.34 162 122 A 13 PRO HBy A 14 GLU HBy 1.0 1.8 4.34 163 123 A 14 GLU HA A 14 GLU HGy 1.0 1.8 3.60 164 123 A 14 GLU HA A 14 GLU HGx 1.0 1.8 3.60 165 124 A 15 ILE H A 14 GLU HGy 1.0 1.8 5.67 166 124 A 15 ILE H A 14 GLU HGx 1.0 1.8 5.67 167 125 A 15 ILE H A 15 ILE HG1y 1.0 1.8 4.04 168 125 A 15 ILE H A 15 ILE HG1x 1.0 1.8 4.04 169 126 A 15 ILE HA A 15 ILE HG1y 1.0 1.8 3.71 170 126 A 15 ILE HA A 15 ILE HG1x 1.0 1.8 3.71 171 127 A 15 ILE HG21 A 15 ILE HG1y 1.0 1.8 3.41 172 127 A 15 ILE HG21 A 15 ILE HG1x 1.0 1.8 3.41 stop_ save_ save_CNS/XPLOR_dihedral_2 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_2 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 9 ASN C A 10 TYR N A 10 TYR CA A 10 TYR C 1.0 -90.0 -30.0 PHI 2 2 A 11 ASP C A 12 HIS N A 12 HIS CA A 12 HIS C 1.0 -160.0 -80.0 PHI 3 3 A 2 ABA C A 3 CYS N A 3 CYS CA A 3 CYS C 1.0 -96.4 -49.2 PHI 4 4 A 3 CYS N A 3 CYS CA A 3 CYS C A 4 SER N 1.0 -40.1 18.3 PSI 5 5 A 3 CYS C A 4 SER N A 4 SER CA A 4 SER C 1.0 -117.8 -55.4 PHI 6 6 A 4 SER N A 4 SER CA A 4 SER C A 5 ASP N 1.0 -42.4 32.6 PSI 7 7 A 4 SER C A 5 ASP N A 5 ASP CA A 5 ASP C 1.0 -160.0 -40.6 PHI 8 8 A 5 ASP N A 5 ASP CA A 5 ASP C A 6 PRO N 1.0 48.3 173.3 PSI 9 9 A 6 PRO N A 6 PRO CA A 6 PRO C A 7 ARG N 1.0 -48.2 -8.2 PSI 10 10 A 6 PRO C A 7 ARG N A 7 ARG CA A 7 ARG C 1.0 -98.3 -43.5 PHI 11 11 A 7 ARG N A 7 ARG CA A 7 ARG C A 8 ABA N 1.0 -63.0 12.0 PSI 12 12 A 8 ABA C A 9 ASN N A 9 ASN CA A 9 ASN C 1.0 -110.6 -47.4 PHI 13 13 A 10 TYR C A 11 ASP N A 11 ASP CA A 11 ASP C 1.0 -135.9 -51.3 PHI 14 14 A 11 ASP N A 11 ASP CA A 11 ASP C A 12 HIS N 1.0 -51.7 39.9 PSI 15 15 A 2 ABA N A 2 ABA CA A 2 ABA CB A 2 ABA CG 1.0 -120.0 0.0 CHI1 16 16 A 10 TYR N A 10 TYR CA A 10 TYR CB A 10 TYR CG 1.0 -120.0 0.0 CHI1 17 17 A 16 CYS N A 16 CYS CA A 16 CYS CB A 16 CYS SG 1.0 -120.0 0.0 CHI1 stop_ save_