data_nef_c30409_6cfb 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 _nef_nmr_meta_data.program_name . _nef_nmr_meta_data.program_version . _nef_nmr_meta_data.creation_date . _nef_nmr_meta_data.uuid . _nef_nmr_meta_data.coordinate_file_name . loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 6CFB 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 5 CYS SG 1 23 CYS SG 1 7 CYS SG 1 18 CYS SG 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 ASP start . . 2 A 2 VAL middle . . 3 A 3 SER middle . . 4 A 4 PRO middle . false 5 A 5 CYS middle -HG . 6 A 6 PHE middle . . 7 A 7 CYS middle -HG . 8 A 8 VAL middle . . 9 A 9 GLU middle . . 10 A 10 ASP middle . . 11 A 11 GLU middle . . 12 A 12 THR middle . . 13 A 13 SER middle . . 14 A 14 GLY middle . false 15 A 15 ALA middle . . 16 A 16 LYS middle . . 17 A 17 THR middle . . 18 A 18 CYS middle -HG . 19 A 19 VAL middle . . 20 A 20 PRO middle . true 21 A 21 ASP middle . . 22 A 22 ASN middle . . 23 A 23 CYS middle -HG . 24 A 24 ASP middle . . 25 A 25 ALA middle . . 26 A 26 SER middle . . 27 A 27 ARG middle . . 28 A 28 GLY middle . false 29 A 29 THR middle . . 30 A 30 ASN middle . . 31 A 31 PRO end . false stop_ save_ save_assigned_chemical_shifts_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chemical_shifts_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 ASP HA H 1 4.243 0.000 A 1 ASP HBy H 1 2.767 0.000 A 1 ASP HBx H 1 2.613 0.000 A 1 ASP CA C 13 53.393 0.000 A 1 ASP CB C 13 39.977 0.000 A 2 VAL HA H 1 4.140 0.000 A 2 VAL HB H 1 2.010 0.002 A 2 VAL CA C 13 62.179 0.000 A 2 VAL CB C 13 32.977 0.000 A 2 VAL N N 15 119.591 0.000 A 3 SER HA H 1 4.712 0.000 A 3 SER HBy H 1 3.824 0.002 A 3 SER HBx H 1 3.767 0.002 A 3 SER CA C 13 56.449 0.000 A 3 SER CB C 13 63.495 0.000 A 3 SER N N 15 121.461 0.000 A 4 PRO HA H 1 4.344 0.000 A 4 PRO HBy H 1 2.210 0.002 A 4 PRO HBx H 1 1.858 0.000 A 4 PRO HDy H 1 3.781 0.002 A 4 PRO HDx H 1 3.716 0.002 A 4 PRO HGx H 1 1.977 0.002 A 4 PRO HGy H 1 1.977 0.002 A 4 PRO CA C 13 63.402 0.000 A 4 PRO CB C 13 32.266 0.000 A 4 PRO CG C 13 27.405 0.000 A 5 CYS HA H 1 5.075 0.002 A 5 CYS HBy H 1 3.093 0.002 A 5 CYS HBx H 1 2.575 0.003 A 5 CYS CA C 13 54.800 0.000 A 5 CYS CB C 13 37.266 0.000 A 5 CYS N N 15 118.203 0.000 A 6 PHE HA H 1 4.925 0.000 A 6 PHE HBx H 1 3.039 0.002 A 6 PHE HBy H 1 3.039 0.002 A 6 PHE HDx H 1 7.205 0.000 A 6 PHE HDy H 1 7.205 0.000 A 6 PHE HEx H 1 7.255 0.001 A 6 PHE HEy H 1 7.255 0.001 A 6 PHE CA C 13 56.832 0.000 A 6 PHE CB C 13 41.481 0.000 A 6 PHE N N 15 129.223 0.000 A 7 CYS HA H 1 5.459 0.004 A 7 CYS HBy H 1 2.927 0.005 A 7 CYS HBx H 1 2.439 0.004 A 7 CYS CA C 13 55.421 0.000 A 7 CYS CB C 13 48.822 0.000 A 7 CYS N N 15 124.124 0.000 A 8 VAL HA H 1 4.243 0.000 A 8 VAL HB H 1 1.937 0.002 A 8 VAL CA C 13 60.504 0.000 A 8 VAL CB C 13 34.977 0.000 A 8 VAL N N 15 119.761 0.000 A 9 GLU HA H 1 4.712 0.000 A 9 GLU HBy H 1 1.804 0.003 A 9 GLU HBx H 1 1.751 0.003 A 9 GLU HGx H 1 1.993 0.003 A 9 GLU HGy H 1 1.993 0.003 A 9 GLU CA C 13 54.921 0.000 A 9 GLU CB C 13 31.362 0.000 A 9 GLU CG C 13 35.646 0.000 A 9 GLU N N 15 124.266 0.000 A 10 ASP HA H 1 4.596 0.000 A 10 ASP HBy H 1 2.906 0.003 A 10 ASP HBx H 1 2.569 0.002 A 10 ASP CA C 13 54.004 0.000 A 10 ASP CB C 13 42.553 0.000 A 10 ASP N N 15 125.512 0.000 A 11 GLU HA H 1 4.052 0.001 A 11 GLU HBy H 1 2.069 0.002 A 11 GLU HBx H 1 2.017 0.005 A 11 GLU HGx H 1 2.327 0.002 A 11 GLU HGy H 1 2.327 0.002 A 11 GLU CA C 13 58.818 0.000 A 11 GLU CB C 13 29.573 0.000 A 11 GLU CG C 13 35.959 0.000 A 11 GLU N N 15 126.192 0.000 A 12 THR HA H 1 4.154 0.000 A 12 THR HB H 1 4.197 0.000 A 12 THR HG2% H 1 1.170 0.002 A 12 THR CA C 13 64.882 0.000 A 12 THR CB C 13 68.842 0.000 A 12 THR N N 15 113.444 0.000 A 13 SER HA H 1 4.479 0.000 A 13 SER HBy H 1 3.968 0.000 A 13 SER HBx H 1 3.753 0.000 A 13 SER CA C 13 58.627 0.000 A 13 SER CB C 13 65.448 0.000 A 13 SER N N 15 115.285 0.000 A 14 GLY HAx H 1 3.752 0.002 A 14 GLY CA C 13 45.616 0.000 A 14 GLY N N 15 112.339 0.000 A 15 ALA HA H 1 4.253 0.000 A 15 ALA HB% H 1 1.273 0.002 A 15 ALA CA C 13 52.400 0.000 A 15 ALA CB C 13 19.702 0.000 A 15 ALA N N 15 122.849 0.000 A 16 LYS HA H 1 4.959 0.000 A 16 LYS HBx H 1 1.641 0.003 A 16 LYS HBy H 1 1.641 0.003 A 16 LYS HGy H 1 1.279 0.002 A 16 LYS HGx H 1 1.169 0.002 A 16 LYS CA C 13 55.647 0.000 A 16 LYS CB C 13 31.995 2.643 A 16 LYS CG C 13 25.275 0.000 A 16 LYS N N 15 123.189 0.000 A 17 THR HA H 1 4.494 0.000 A 17 THR HB H 1 3.929 0.002 A 17 THR HG2% H 1 1.126 0.002 A 17 THR CA C 13 61.759 0.000 A 17 THR CB C 13 70.812 0.000 A 17 THR N N 15 121.064 0.000 A 18 CYS HA H 1 5.546 0.008 A 18 CYS HBy H 1 3.291 0.005 A 18 CYS HBx H 1 3.038 0.007 A 18 CYS CA C 13 55.732 0.000 A 18 CYS CB C 13 48.400 0.020 A 18 CYS N N 15 125.512 0.000 A 19 VAL HA H 1 4.102 0.001 A 19 VAL HB H 1 1.952 0.002 A 19 VAL CA C 13 59.391 0.000 A 19 VAL CB C 13 35.621 0.000 A 19 VAL N N 15 121.121 0.000 A 20 PRO HA H 1 4.661 0.000 A 20 PRO HBx H 1 2.448 0.000 A 20 PRO HBy H 1 2.453 0.002 A 20 PRO HDx H 1 3.652 0.002 A 20 PRO HDy H 1 3.652 0.002 A 20 PRO HGy H 1 1.892 0.002 A 20 PRO HGx H 1 1.844 0.002 A 20 PRO CA C 13 63.249 0.000 A 20 PRO CB C 13 34.804 0.000 A 20 PRO CG C 13 26.047 0.000 A 21 ASP HA H 1 4.250 0.000 A 21 ASP HBy H 1 2.591 0.002 A 21 ASP HBx H 1 2.494 0.002 A 21 ASP CA C 13 55.953 0.000 A 21 ASP CB C 13 41.196 0.000 A 21 ASP N N 15 119.195 0.000 A 22 ASN HA H 1 4.442 0.000 A 22 ASN HBy H 1 2.994 0.002 A 22 ASN HBx H 1 2.667 0.002 A 22 ASN HD2y H 1 7.544 0.002 A 22 ASN HD2x H 1 6.805 0.002 A 22 ASN CA C 13 54.272 0.000 A 22 ASN CB C 13 38.096 0.017 A 22 ASN N N 15 114.379 2.163 A 23 CYS HA H 1 4.342 0.002 A 23 CYS HBy H 1 3.306 0.004 A 23 CYS HBx H 1 2.873 0.002 A 23 CYS CA C 13 48.362 9.233 A 23 CYS CB C 13 39.095 0.000 A 23 CYS N N 15 115.484 0.000 A 24 ASP HA H 1 4.402 0.000 A 24 ASP HBx H 1 2.656 0.002 A 24 ASP HBy H 1 2.656 0.002 A 24 ASP CA C 13 54.234 0.000 A 24 ASP N N 15 123.331 1.246 A 25 ALA HA H 1 4.161 0.000 A 25 ALA HB% H 1 1.342 0.002 A 25 ALA CA C 13 53.049 0.000 A 25 ALA CB C 13 18.859 0.000 A 26 SER HA H 1 4.327 0.002 A 26 SER HBx H 1 3.834 0.002 A 26 SER HBy H 1 3.834 0.002 A 26 SER CA C 13 58.932 0.000 A 26 SER N N 15 114.067 0.000 A 27 ARG HA H 1 4.310 0.000 A 27 ARG HBy H 1 1.847 0.002 A 27 ARG HBx H 1 1.723 0.003 A 27 ARG HDx H 1 3.139 0.002 A 27 ARG HDy H 1 3.139 0.002 A 27 ARG HE H 1 7.153 0.000 A 27 ARG HGx H 1 1.601 0.003 A 27 ARG HGy H 1 1.601 0.003 A 27 ARG CA C 13 56.335 0.000 A 27 ARG CB C 13 30.716 0.000 A 27 ARG CG C 13 27.059 0.000 A 27 ARG N N 15 121.093 1.388 A 28 GLY HAx H 1 3.949 0.000 A 28 GLY HAy H 1 3.949 0.000 A 28 GLY CA C 13 45.219 0.000 A 28 GLY N N 15 109.336 0.000 A 29 THR HA H 1 4.267 0.000 A 29 THR HB H 1 4.151 0.002 A 29 THR HG2% H 1 1.115 0.002 A 29 THR CA C 13 61.759 0.000 A 29 THR CB C 13 69.899 0.000 A 29 THR N N 15 112.991 0.000 A 30 ASN HA H 1 4.940 0.004 A 30 ASN HBy H 1 2.759 0.002 A 30 ASN HBx H 1 2.603 0.002 A 30 ASN HD2y H 1 7.561 0.002 A 30 ASN HD2x H 1 6.853 0.002 A 30 ASN CA C 13 51.674 0.000 A 30 ASN CB C 13 38.858 0.000 A 30 ASN N N 15 116.079 3.566 A 31 PRO HA H 1 4.173 0.000 A 31 PRO HBx H 1 2.159 0.002 A 31 PRO HBy H 1 2.159 0.002 A 31 PRO HDy H 1 3.680 0.002 A 31 PRO HDx H 1 3.610 0.002 A 31 PRO HGx H 1 1.925 0.000 A 31 PRO HGy H 1 1.925 0.000 A 31 PRO CA C 13 64.891 0.000 A 31 PRO CB C 13 32.164 0.000 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 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 18 CYS H A 18 CYS HBx 1.0 1.8 3.89 2 2 A 18 CYS H A 18 CYS HBy 1.0 1.8 2.96 3 3 A 17 THR H A 17 THR HB 1.0 1.8 3.21 4 4 A 7 CYS H A 7 CYS HBy 1.0 1.8 3.33 5 5 A 7 CYS H A 7 CYS HBx 1.0 1.8 3.98 6 6 A 9 GLU HA A 16 LYS H 1.0 1.8 3.89 7 7 A 2 VAL H A 2 VAL HB 1.0 1.8 4.17 8 8 A 3 SER H A 3 SER HBy 1.0 1.8 3.95 9 9 A 3 SER H A 3 SER HBx 1.0 1.8 3.95 10 10 A 14 GLY H A 14 GLY HAx 1.0 1.8 2.59 11 11 A 5 CYS H A 5 CYS HBy 1.0 1.8 3.33 12 12 A 5 CYS H A 5 CYS HBx 1.0 1.8 3.21 13 13 A 26 SER HA A 27 ARG H 1.0 1.8 3.05 14 14 A 29 THR H A 29 THR HB 1.0 1.8 3.98 15 15 A 11 GLU H A 11 GLU HBx 1.0 1.8 3.70 16 16 A 8 VAL H A 8 VAL HB 1.0 1.8 3.39 17 17 A 5 CYS H A 4 PRO HBx 1.0 1.8 3.55 18 18 A 10 ASP H A 10 ASP HBx 1.0 1.8 2.90 19 19 A 10 ASP H A 10 ASP HBy 1.0 1.8 3.05 20 20 A 7 CYS H A 6 PHE HA 1.0 1.8 2.93 21 21 A 5 CYS HBx A 6 PHE H 1.0 1.8 4.57 22 22 A 5 CYS HBy A 6 PHE H 1.0 1.8 4.48 23 23 A 6 PHE H A 5 CYS HA 1.0 1.8 2.59 24 24 A 5 CYS H A 4 PRO HA 1.0 1.8 2.83 25 25 A 8 VAL H A 7 CYS HA 1.0 1.8 2.52 26 26 A 7 CYS HBy A 8 VAL H 1.0 1.8 3.76 27 27 A 7 CYS HBx A 8 VAL H 1.0 1.8 3.21 28 28 A 16 LYS H A 16 LYS HBx 1.0 1.8 3.78 29 28 A 16 LYS H A 16 LYS HBy 1.0 1.8 3.78 30 29 A 9 GLU H A 9 GLU HBx 1.0 1.8 3.67 31 30 A 21 ASP H A 21 ASP HBx 1.0 1.8 3.45 32 31 A 25 ALA HA A 26 SER H 1.0 1.8 3.27 33 32 A 16 LYS H A 15 ALA HA 1.0 1.8 2.59 34 33 A 27 ARG HA A 28 GLY H 1.0 1.8 3.36 35 34 A 17 THR H A 16 LYS HA 1.0 1.8 2.56 36 35 A 18 CYS H A 17 THR HA 1.0 1.8 2.52 37 36 A 19 VAL H A 19 VAL HB 1.0 1.8 3.27 38 37 A 19 VAL H A 18 CYS HA 1.0 1.8 2.68 39 38 A 18 CYS H A 17 THR HB 1.0 1.8 4.01 40 39 A 18 CYS HBy A 19 VAL H 1.0 1.8 3.36 41 40 A 18 CYS HBx A 19 VAL H 1.0 1.8 3.27 42 41 A 3 SER H A 2 VAL HA 1.0 1.8 2.90 43 42 A 2 VAL HB A 3 SER H 1.0 1.8 4.72 44 43 A 9 GLU H A 8 VAL HA 1.0 1.8 2.40 45 44 A 8 VAL HB A 9 GLU H 1.0 1.8 3.61 46 45 A 9 GLU H A 9 GLU HBy 1.0 1.8 3.67 47 46 A 10 ASP H A 9 GLU HBy 1.0 1.8 4.51 48 47 A 10 ASP H A 9 GLU HBx 1.0 1.8 4.51 49 48 A 9 GLU HA A 10 ASP H 1.0 1.8 2.96 50 49 A 11 GLU H A 10 ASP HA 1.0 1.8 2.65 51 50 A 11 GLU H A 10 ASP HBx 1.0 1.8 4.88 52 51 A 11 GLU H A 10 ASP HBy 1.0 1.8 4.38 53 52 A 11 GLU H A 11 GLU HBy 1.0 1.8 3.70 54 53 A 12 THR H A 11 GLU HBy 1.0 1.8 4.11 55 54 A 12 THR H A 11 GLU HBx 1.0 1.8 4.11 56 55 A 12 THR H A 12 THR HB 1.0 1.8 3.55 57 56 A 12 THR HB A 13 SER H 1.0 1.8 3.42 58 57 A 13 SER HA A 15 ALA H 1.0 1.8 4.66 59 58 A 17 THR H A 16 LYS HBx 1.0 1.8 4.89 60 58 A 17 THR H A 16 LYS HBy 1.0 1.8 4.89 61 59 A 22 ASN H A 22 ASN HBy 1.0 1.8 3.89 62 60 A 22 ASN H A 22 ASN HA 1.0 1.8 2.71 63 61 A 25 ALA H A 24 ASP HBx 1.0 1.8 5.79 64 61 A 24 ASP HBy A 25 ALA H 1.0 1.8 5.79 65 62 A 23 CYS HA A 24 ASP H 1.0 1.8 3.30 66 63 A 24 ASP H A 23 CYS H 1.0 1.8 3.61 67 64 A 23 CYS H A 23 CYS HBx 1.0 1.8 2.96 68 65 A 24 ASP H A 23 CYS HBx 1.0 1.8 4.54 69 66 A 23 CYS H A 22 ASN HBy 1.0 1.8 4.72 70 67 A 22 ASN H A 22 ASN HBx 1.0 1.8 3.89 71 68 A 22 ASN HA A 23 CYS H 1.0 1.8 3.45 72 69 A 22 ASN H A 21 ASP HA 1.0 1.8 2.62 73 70 A 22 ASN H A 21 ASP HBy 1.0 1.8 4.38 74 71 A 21 ASP HBx A 22 ASN H 1.0 1.8 4.14 75 72 A 21 ASP H A 21 ASP HBy 1.0 1.8 2.93 76 73 A 21 ASP H A 20 PRO HBx 1.0 1.8 3.45 77 74 A 21 ASP H A 20 PRO HA 1.0 1.8 3.33 78 75 A 21 ASP H A 19 VAL HA 1.0 1.8 3.52 79 76 A 21 ASP H A 20 PRO HBy 1.0 1.8 3.45 80 77 A 27 ARG H A 26 SER HBx 1.0 1.8 5.76 81 77 A 27 ARG H A 26 SER HBy 1.0 1.8 5.76 82 78 A 8 VAL H A 18 CYS HA 1.0 1.8 3.92 83 79 A 17 THR H A 7 CYS HA 1.0 1.8 5.16 84 80 A 7 CYS HA A 19 VAL H 1.0 1.8 3.92 85 81 A 10 ASP H A 16 LYS HA 1.0 1.8 3.70 86 82 A 12 THR H A 13 SER H 1.0 1.8 3.21 87 83 A 5 CYS H A 4 PRO HBy 1.0 1.8 4.14 88 84 A 10 ASP HBx A 13 SER H 1.0 1.8 3.27 89 85 A 10 ASP HBy A 13 SER H 1.0 1.8 4.42 90 86 A 10 ASP HBy A 12 THR H 1.0 1.8 5.50 91 87 A 26 SER H A 24 ASP HA 1.0 1.8 5.04 92 88 A 17 THR H A 9 GLU HA 1.0 1.8 4.66 93 89 A 10 ASP HA A 12 THR H 1.0 1.8 3.58 94 90 A 26 SER H A 25 ALA H 1.0 1.8 3.70 95 91 A 11 GLU H A 10 ASP H 1.0 1.8 4.26 96 92 A 11 GLU H A 12 THR H 1.0 1.8 3.17 97 93 A 18 CYS H A 17 THR H 1.0 1.8 4.94 98 94 A 18 CYS H A 19 VAL H 1.0 1.8 5.41 99 95 A 6 PHE H A 19 VAL H 1.0 1.8 3.73 100 96 A 21 ASP H A 22 ASN H 1.0 1.8 4.72 101 97 A 11 GLU H A 13 SER H 1.0 1.8 5.22 102 98 A 14 GLY H A 10 ASP H 1.0 1.8 5.34 103 99 A 5 CYS H A 6 PHE H 1.0 1.8 4.94 104 100 A 22 ASN H A 23 CYS H 1.0 1.8 3.33 105 101 A 10 ASP H A 15 ALA H 1.0 1.8 3.86 106 102 A 14 GLY H A 15 ALA H 1.0 1.8 3.02 107 103 A 29 THR H A 30 ASN H 1.0 1.8 5.16 108 104 A 29 THR H A 28 GLY H 1.0 1.8 5.50 109 105 A 25 ALA H A 24 ASP H 1.0 1.8 3.55 110 106 A 23 CYS H A 22 ASN HBx 1.0 1.8 4.72 111 107 A 23 CYS H A 21 ASP HA 1.0 1.8 4.14 112 108 A 18 CYS H A 21 ASP HA 1.0 1.8 4.17 113 109 A 22 ASN HA A 24 ASP H 1.0 1.8 4.23 114 110 A 2 VAL H A 1 ASP HA 1.0 1.8 3.02 115 111 A 27 ARG H A 28 GLY H 1.0 1.8 4.23 116 112 A 11 GLU H A 11 GLU HGx 1.0 1.8 6.01 117 112 A 11 GLU H A 11 GLU HGy 1.0 1.8 6.01 118 113 A 9 GLU H A 9 GLU HGx 1.0 1.8 6.38 119 113 A 9 GLU H A 9 GLU HGy 1.0 1.8 6.38 120 114 A 27 ARG H A 27 ARG HGx 1.0 1.8 6.38 121 114 A 27 ARG H A 27 ARG HGy 1.0 1.8 6.38 122 115 A 27 ARG HE A 27 ARG HBy 1.0 1.8 5.50 123 116 A 27 ARG HE A 27 ARG HBx 1.0 1.8 5.50 124 117 A 6 PHE HA A 6 PHE HD% 1.0 1.8 7.57 125 118 A 16 LYS H A 16 LYS HDx 1.0 1.8 6.38 126 118 A 16 LYS H A 16 LYS HDy 1.0 1.8 6.38 127 119 A 10 ASP H A 9 GLU HGx 1.0 1.8 6.04 128 119 A 10 ASP H A 9 GLU HGy 1.0 1.8 6.04 129 120 A 12 THR H A 11 GLU HGx 1.0 1.8 6.38 130 120 A 12 THR H A 11 GLU HGy 1.0 1.8 6.38 131 121 A 17 THR H A 16 LYS HDx 1.0 1.8 6.38 132 121 A 17 THR H A 16 LYS HDy 1.0 1.8 6.38 133 122 A 17 THR H A 16 LYS HGy 1.0 1.8 5.25 134 123 A 17 THR H A 16 LYS HGx 1.0 1.8 5.25 135 124 A 28 GLY H A 27 ARG HGx 1.0 1.8 6.38 136 124 A 28 GLY H A 27 ARG HGy 1.0 1.8 6.38 137 125 A 18 CYS HBx A 24 ASP H 1.0 1.8 5.04 138 126 A 18 CYS HBx A 23 CYS H 1.0 1.8 3.83 139 127 A 21 ASP H A 20 PRO HGx 1.0 1.8 5.50 140 128 A 4 PRO HBx A 6 PHE HE% 1.0 1.8 7.63 141 129 A 4 PRO HBx A 6 PHE HD% 1.0 1.8 7.63 142 130 A 4 PRO HBy A 6 PHE HD% 1.0 1.8 7.63 143 131 A 4 PRO HBy A 6 PHE HE% 1.0 1.8 7.63 144 132 A 8 VAL HB A 6 PHE HE% 1.0 1.8 7.63 145 133 A 8 VAL HB A 6 PHE HD% 1.0 1.8 7.63 146 134 A 6 PHE HD% A 4 PRO HGx 1.0 1.8 8.52 147 134 A 6 PHE HD% A 4 PRO HGy 1.0 1.8 8.52 148 135 A 6 PHE HE% A 4 PRO HGx 1.0 1.8 8.52 149 135 A 6 PHE HE% A 4 PRO HGy 1.0 1.8 8.52 150 136 A 8 VAL H A 16 LYS HGy 1.0 1.8 5.50 151 137 A 8 VAL H A 16 LYS HGx 1.0 1.8 5.50 152 138 A 17 THR H A 8 VAL HB 1.0 1.8 5.50 153 139 A 17 THR H A 9 GLU HGx 1.0 1.8 6.38 154 139 A 17 THR H A 9 GLU HGy 1.0 1.8 6.38 155 140 A 17 THR H A 7 CYS HBx 1.0 1.8 5.50 156 141 A 6 PHE H A 19 VAL HB 1.0 1.8 5.50 157 142 A 18 CYS HBy A 24 ASP H 1.0 1.8 5.50 158 143 A 18 CYS HBx A 6 PHE H 1.0 1.8 5.50 159 144 A 6 PHE H A 20 PRO HDx 1.0 1.8 6.39 160 144 A 6 PHE H A 20 PRO HDy 1.0 1.8 6.39 161 145 A 6 PHE H A 6 PHE HD% 1.0 1.8 7.63 162 146 A 6 PHE H A 6 PHE HE% 1.0 1.8 7.63 163 147 A 7 CYS HA A 6 PHE HD% 1.0 1.8 7.63 164 148 A 5 CYS HBx A 6 PHE HE% 1.0 1.8 7.63 165 149 A 5 CYS HBx A 6 PHE HD% 1.0 1.8 7.63 166 150 A 15 ALA H A 9 GLU HGx 1.0 1.8 6.38 167 150 A 15 ALA H A 9 GLU HGy 1.0 1.8 6.38 168 151 A 10 ASP HBy A 15 ALA H 1.0 1.8 5.50 169 152 A 23 CYS H A 20 PRO HGx 1.0 1.8 5.50 170 153 A 10 ASP HBx A 15 ALA H 1.0 1.8 3.55 171 154 A 18 CYS HBy A 23 CYS H 1.0 1.8 4.82 172 155 A 23 CYS H A 20 PRO HDx 1.0 1.8 6.39 173 155 A 23 CYS H A 20 PRO HDy 1.0 1.8 6.39 174 156 A 10 ASP H A 16 LYS HGy 1.0 1.8 5.50 175 157 A 10 ASP H A 16 LYS HGx 1.0 1.8 5.50 176 158 A 14 GLY H A 9 GLU HGx 1.0 1.8 6.38 177 158 A 14 GLY H A 9 GLU HGy 1.0 1.8 6.38 178 159 A 8 VAL H A 8 VAL HG11 1.0 1.8 6.33 179 159 A 8 VAL H A 8 VAL HG21 1.0 1.8 6.33 180 160 A 29 THR H A 29 THR HG2% 1.0 1.8 6.52 181 161 A 15 ALA H A 15 ALA HB% 1.0 1.8 3.98 182 162 A 17 THR H A 17 THR HG2% 1.0 1.8 5.62 183 163 A 26 SER H A 25 ALA HB% 1.0 1.8 5.71 184 164 A 12 THR H A 12 THR HG2% 1.0 1.8 5.43 185 165 A 19 VAL H A 19 VAL HG11 1.0 1.8 6.61 186 165 A 19 VAL H A 19 VAL HG21 1.0 1.8 6.61 187 166 A 18 CYS H A 17 THR HG2% 1.0 1.8 5.15 188 167 A 18 CYS H A 19 VAL HG11 1.0 1.8 7.60 189 167 A 18 CYS H A 19 VAL HG21 1.0 1.8 7.60 190 168 A 3 SER H A 2 VAL HG11 1.0 1.8 7.60 191 168 A 3 SER H A 2 VAL HG21 1.0 1.8 7.60 192 169 A 2 VAL H A 2 VAL HG11 1.0 1.8 7.60 193 169 A 2 VAL H A 2 VAL HG21 1.0 1.8 7.60 194 170 A 9 GLU H A 8 VAL HG11 1.0 1.8 6.76 195 170 A 9 GLU H A 8 VAL HG21 1.0 1.8 6.76 196 171 A 13 SER H A 12 THR HG2% 1.0 1.8 6.52 197 172 A 16 LYS H A 15 ALA HB% 1.0 1.8 4.88 198 173 A 21 ASP H A 19 VAL HG11 1.0 1.8 7.60 199 173 A 21 ASP H A 19 VAL HG21 1.0 1.8 7.60 200 174 A 30 ASN H A 29 THR HG2% 1.0 1.8 6.52 201 175 A 6 PHE HE% A 8 VAL HG11 1.0 1.8 9.73 202 175 A 6 PHE HE% A 8 VAL HG21 1.0 1.8 9.73 203 176 A 6 PHE HD% A 8 VAL HG11 1.0 1.8 9.73 204 176 A 6 PHE HD% A 8 VAL HG21 1.0 1.8 9.73 205 177 A 6 PHE HE% A 19 VAL HG11 1.0 1.8 9.73 206 177 A 6 PHE HE% A 19 VAL HG21 1.0 1.8 9.73 207 178 A 6 PHE HD% A 19 VAL HG11 1.0 1.8 9.73 208 178 A 6 PHE HD% A 19 VAL HG21 1.0 1.8 9.73 209 179 A 6 PHE HD% A 17 THR HG2% 1.0 1.8 8.65 210 180 A 6 PHE HE% A 17 THR HG2% 1.0 1.8 8.65 211 181 A 11 GLU H A 12 THR HG2% 1.0 1.8 6.52 212 182 A 19 VAL H A 8 VAL HG11 1.0 1.8 7.60 213 182 A 19 VAL H A 8 VAL HG21 1.0 1.8 7.60 214 183 A 19 VAL H A 17 THR HG2% 1.0 1.8 6.52 215 184 A 17 THR H A 8 VAL HG11 1.0 1.8 7.60 216 184 A 17 THR H A 8 VAL HG21 1.0 1.8 7.60 217 185 A 6 PHE H A 19 VAL HG11 1.0 1.8 7.60 218 185 A 6 PHE H A 19 VAL HG21 1.0 1.8 7.60 219 186 A 7 CYS H A 8 VAL HG11 1.0 1.8 7.60 220 186 A 7 CYS H A 8 VAL HG21 1.0 1.8 7.60 221 187 A 8 VAL H A 17 THR HG2% 1.0 1.8 6.52 222 188 A 16 LYS H A 17 THR HG2% 1.0 1.8 6.52 223 189 A 10 ASP H A 17 THR HG2% 1.0 1.8 6.52 224 190 A 24 ASP H A 25 ALA HB% 1.0 1.8 6.52 225 191 A 25 ALA HB% A 22 ASN HD2y 1.0 1.8 6.52 226 192 A 25 ALA HB% A 22 ASN HD2x 1.0 1.8 6.52 227 193 A 14 GLY H A 15 ALA HB% 1.0 1.8 6.52 228 194 A 10 ASP HBy A 10 ASP HA 1.0 1.8 2.99 229 195 A 13 SER HA A 13 SER HBy 1.0 1.8 2.93 230 196 A 20 PRO HA A 19 VAL HA 1.0 1.8 2.40 231 197 A 19 VAL HA A 20 PRO HBy 1.0 1.8 5.24 232 197 A 19 VAL HA A 20 PRO HBx 1.0 1.8 5.24 233 198 A 19 VAL HB A 18 CYS HA 1.0 1.8 5.16 234 199 A 7 CYS HBx A 7 CYS HA 1.0 1.8 2.74 235 200 A 8 VAL HB A 7 CYS HA 1.0 1.8 5.25 236 201 A 7 CYS HBy A 7 CYS HA 1.0 1.8 3.02 237 202 A 7 CYS HA A 6 PHE HBx 1.0 1.8 4.92 238 202 A 7 CYS HA A 6 PHE HBy 1.0 1.8 4.92 239 203 A 18 CYS HBx A 18 CYS HA 1.0 1.8 2.87 240 204 A 7 CYS HA A 8 VAL HA 1.0 1.8 5.22 241 205 A 7 CYS HA A 18 CYS HA 1.0 1.8 2.43 242 206 A 23 CYS HA A 23 CYS HBy 1.0 1.8 2.90 243 207 A 23 CYS HA A 23 CYS HBx 1.0 1.8 2.87 244 208 A 5 CYS HBy A 5 CYS HA 1.0 1.8 2.99 245 209 A 5 CYS HBy A 4 PRO HA 1.0 1.8 4.63 246 210 A 5 CYS HBx A 4 PRO HA 1.0 1.8 4.88 247 211 A 22 ASN HA A 22 ASN HBy 1.0 1.8 3.02 248 212 A 22 ASN HA A 22 ASN HBx 1.0 1.8 3.02 249 213 A 13 SER HA A 13 SER HBx 1.0 1.8 2.93 250 214 A 18 CYS HBy A 21 ASP HA 1.0 1.8 4.26 251 215 A 9 GLU HA A 16 LYS HA 1.0 1.8 3.21 252 216 A 3 SER HA A 4 PRO HDy 1.0 1.8 3.39 253 217 A 3 SER HA A 4 PRO HDx 1.0 1.8 3.39 254 218 A 3 SER HA A 4 PRO HGx 1.0 1.8 5.89 255 218 A 4 PRO HGy A 3 SER HA 1.0 1.8 5.89 256 219 A 16 LYS HA A 16 LYS HDx 1.0 1.8 6.38 257 219 A 16 LYS HA A 16 LYS HDy 1.0 1.8 6.38 258 220 A 16 LYS HA A 16 LYS HEx 1.0 1.8 6.38 259 220 A 16 LYS HA A 16 LYS HEy 1.0 1.8 6.38 260 221 A 16 LYS HBy A 16 LYS HEx 1.0 1.8 7.26 261 221 A 16 LYS HBx A 16 LYS HEx 1.0 1.8 7.26 262 221 A 16 LYS HEy A 16 LYS HBx 1.0 1.8 7.26 263 221 A 16 LYS HBy A 16 LYS HEy 1.0 1.8 7.26 264 222 A 27 ARG HA A 27 ARG HDx 1.0 1.8 6.38 265 222 A 27 ARG HA A 27 ARG HDy 1.0 1.8 6.38 266 223 A 26 SER HA A 27 ARG HGx 1.0 1.8 6.07 267 223 A 26 SER HA A 27 ARG HGy 1.0 1.8 6.07 268 224 A 7 CYS HBx A 18 CYS HA 1.0 1.8 4.63 269 225 A 18 CYS HBx A 7 CYS HA 1.0 1.8 4.66 270 226 A 5 CYS HA A 23 CYS HBy 1.0 1.8 5.10 271 227 A 5 CYS HA A 23 CYS HBx 1.0 1.8 5.50 272 228 A 7 CYS HBy A 18 CYS HA 1.0 1.8 5.50 273 229 A 5 CYS HA A 20 PRO HDx 1.0 1.8 5.05 274 229 A 5 CYS HA A 20 PRO HDy 1.0 1.8 5.05 275 230 A 23 CYS HBx A 20 PRO HDx 1.0 1.8 4.87 276 230 A 23 CYS HBx A 20 PRO HDy 1.0 1.8 4.87 277 231 A 23 CYS HBy A 20 PRO HDx 1.0 1.8 6.39 278 231 A 20 PRO HDy A 23 CYS HBy 1.0 1.8 6.39 279 232 A 5 CYS HBx A 20 PRO HDx 1.0 1.8 6.39 280 232 A 5 CYS HBx A 20 PRO HDy 1.0 1.8 6.39 281 233 A 16 LYS HA A 9 GLU HGx 1.0 1.8 6.38 282 233 A 16 LYS HA A 9 GLU HGy 1.0 1.8 6.38 283 234 A 9 GLU HA A 16 LYS HBx 1.0 1.8 6.38 284 234 A 9 GLU HA A 16 LYS HBy 1.0 1.8 6.38 285 235 A 19 VAL HB A 6 PHE HBx 1.0 1.8 5.76 286 235 A 19 VAL HB A 6 PHE HBy 1.0 1.8 5.76 287 236 A 18 CYS HBx A 19 VAL HB 1.0 1.8 5.44 288 237 A 23 CYS HBy A 20 PRO HGy 1.0 1.8 5.50 289 238 A 20 PRO HGx A 23 CYS HBy 1.0 1.8 5.22 290 239 A 7 CYS HBx A 16 LYS HBx 1.0 1.8 6.38 291 239 A 7 CYS HBx A 16 LYS HBy 1.0 1.8 6.38 292 240 A 7 CYS HBx A 16 LYS HDx 1.0 1.8 6.38 293 240 A 7 CYS HBx A 16 LYS HDy 1.0 1.8 6.38 294 241 A 23 CYS HBx A 20 PRO HGx 1.0 1.8 4.04 295 242 A 23 CYS HBx A 20 PRO HGy 1.0 1.8 4.45 296 243 A 9 GLU HGy A 16 LYS HEx 1.0 1.8 7.26 297 243 A 9 GLU HGx A 16 LYS HEx 1.0 1.8 7.26 298 243 A 16 LYS HEy A 9 GLU HGx 1.0 1.8 7.26 299 243 A 9 GLU HGy A 16 LYS HEy 1.0 1.8 7.26 300 244 A 16 LYS HA A 9 GLU HBy 1.0 1.8 5.50 301 245 A 9 GLU HBx A 16 LYS HA 1.0 1.8 5.50 302 246 A 18 CYS HA A 17 THR HG2% 1.0 1.8 6.52 303 247 A 7 CYS HA A 17 THR HG2% 1.0 1.8 6.52 304 248 A 7 CYS HA A 19 VAL HG11 1.0 1.8 7.60 305 248 A 7 CYS HA A 19 VAL HG21 1.0 1.8 7.60 306 249 A 7 CYS HA A 8 VAL HG11 1.0 1.8 7.60 307 249 A 7 CYS HA A 8 VAL HG21 1.0 1.8 7.60 308 250 A 18 CYS HA A 8 VAL HG11 1.0 1.8 7.60 309 250 A 18 CYS HA A 8 VAL HG21 1.0 1.8 7.60 310 251 A 18 CYS HA A 19 VAL HG11 1.0 1.8 7.60 311 251 A 18 CYS HA A 19 VAL HG21 1.0 1.8 7.60 312 252 A 20 PRO HA A 19 VAL HG11 1.0 1.8 5.77 313 252 A 20 PRO HA A 19 VAL HG21 1.0 1.8 5.77 314 253 A 19 VAL HG21 A 20 PRO HDx 1.0 1.8 8.49 315 253 A 19 VAL HG11 A 20 PRO HDx 1.0 1.8 8.49 316 253 A 20 PRO HDy A 19 VAL HG11 1.0 1.8 8.49 317 253 A 20 PRO HDy A 19 VAL HG21 1.0 1.8 8.49 318 254 A 6 PHE HBx A 19 VAL HG11 1.0 1.8 8.23 319 254 A 6 PHE HBy A 19 VAL HG11 1.0 1.8 8.23 320 254 A 19 VAL HG21 A 6 PHE HBx 1.0 1.8 8.23 321 254 A 19 VAL HG21 A 6 PHE HBy 1.0 1.8 8.23 322 255 A 17 THR HB A 8 VAL HG11 1.0 1.8 6.95 323 255 A 17 THR HB A 8 VAL HG21 1.0 1.8 6.95 324 256 A 3 SER H A 3 SER HBx 1.0 1.8 3.40 325 256 A 3 SER H A 3 SER HBy 1.0 1.8 3.40 326 257 A 3 SER HA A 4 PRO HDx 1.0 1.8 2.82 327 257 A 3 SER HA A 4 PRO HDy 1.0 1.8 2.82 328 258 A 10 ASP H A 13 SER HBx 1.0 1.8 5.11 329 258 A 10 ASP H A 13 SER HBy 1.0 1.8 5.11 330 259 A 11 GLU H A 11 GLU HBx 1.0 1.8 3.10 331 259 A 11 GLU H A 11 GLU HBy 1.0 1.8 3.10 332 260 A 13 SER H A 13 SER HBx 1.0 1.8 2.79 333 260 A 13 SER H A 13 SER HBy 1.0 1.8 2.79 334 261 A 13 SER HA A 13 SER HBx 1.0 1.8 2.50 335 261 A 13 SER HA A 13 SER HBy 1.0 1.8 2.50 336 262 A 15 ALA H A 13 SER HBx 1.0 1.8 3.85 337 262 A 15 ALA H A 13 SER HBy 1.0 1.8 3.85 338 263 A 16 LYS H A 16 LYS HGx 1.0 1.8 5.34 339 263 A 16 LYS H A 16 LYS HGy 1.0 1.8 5.34 340 264 A 16 LYS HA A 16 LYS HGx 1.0 1.8 3.66 341 264 A 16 LYS HA A 16 LYS HGy 1.0 1.8 3.66 342 265 A 17 THR H A 16 LYS HGx 1.0 1.8 4.42 343 265 A 17 THR H A 16 LYS HGy 1.0 1.8 4.42 344 266 A 23 CYS H A 20 PRO HBy 1.0 1.8 4.53 345 266 A 23 CYS H A 20 PRO HBx 1.0 1.8 4.53 346 267 A 23 CYS HBx A 20 PRO HBy 1.0 1.8 4.41 347 267 A 23 CYS HBx A 20 PRO HBx 1.0 1.8 4.41 348 268 A 22 ASN H A 22 ASN HBx 1.0 1.8 3.34 349 268 A 22 ASN H A 22 ASN HBy 1.0 1.8 3.34 350 269 A 23 CYS H A 22 ASN HBx 1.0 1.8 3.93 351 269 A 23 CYS H A 22 ASN HBy 1.0 1.8 3.93 352 270 A 27 ARG H A 27 ARG HBy 1.0 1.8 3.35 353 270 A 27 ARG H A 27 ARG HBx 1.0 1.8 3.35 stop_ save_ save_CNS/XPLOR_distance_constraints_5 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_5 _nef_distance_restraint_list.restraint_origin hbond _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 6 PHE H A 19 VAL O 1.0 0.0 2.3 2 2 A 19 VAL O A 6 PHE N 1.0 0.0 3.3 3 3 A 8 VAL H A 17 THR O 1.0 0.0 2.3 4 4 A 17 THR O A 8 VAL N 1.0 0.0 3.3 5 5 A 12 THR H A 10 ASP OD2 1.0 0.0 2.3 6 5 A 12 THR H A 10 ASP OD1 1.0 0.0 2.3 7 6 A 10 ASP OD2 A 12 THR N 1.0 0.0 3.3 8 6 A 10 ASP OD1 A 12 THR N 1.0 0.0 3.3 9 7 A 14 GLY H A 10 ASP O 1.0 0.0 2.3 10 8 A 10 ASP O A 14 GLY N 1.0 0.0 3.3 11 9 A 15 ALA H A 10 ASP O 1.0 0.0 2.3 12 10 A 10 ASP O A 15 ALA N 1.0 0.0 3.3 13 11 A 17 THR H A 8 VAL O 1.0 0.0 2.3 14 12 A 8 VAL O A 17 THR N 1.0 0.0 3.3 15 13 A 19 VAL H A 6 PHE O 1.0 0.0 2.3 16 14 A 6 PHE O A 19 VAL N 1.0 0.0 3.3 17 15 A 23 CYS H A 20 PRO O 1.0 0.0 2.3 18 16 A 20 PRO O A 23 CYS N 1.0 0.0 3.3 stop_ save_ save_CNS/XPLOR_dihedral_4 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_4 _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 4 PRO C A 5 CYS N A 5 CYS CA A 5 CYS C 1.0 -103.9 -59.1 PHI 2 2 A 5 CYS N A 5 CYS CA A 5 CYS C A 6 PHE N 1.0 103.8 143.8 PSI 3 3 A 5 CYS C A 6 PHE N A 6 PHE CA A 6 PHE C 1.0 -135.0 -85.8 PHI 4 4 A 6 PHE N A 6 PHE CA A 6 PHE C A 7 CYS N 1.0 113.7 153.7 PSI 5 5 A 6 PHE C A 7 CYS N A 7 CYS CA A 7 CYS C 1.0 -152.6 -112.6 PHI 6 6 A 7 CYS N A 7 CYS CA A 7 CYS C A 8 VAL N 1.0 129.7 169.7 PSI 7 7 A 7 CYS C A 8 VAL N A 8 VAL CA A 8 VAL C 1.0 -146.8 -101.2 PHI 8 8 A 8 VAL N A 8 VAL CA A 8 VAL C A 9 GLU N 1.0 113.0 156.4 PSI 9 9 A 8 VAL C A 9 GLU N A 9 GLU CA A 9 GLU C 1.0 -145.2 -57.0 PHI 10 10 A 9 GLU N A 9 GLU CA A 9 GLU C A 10 ASP N 1.0 106.4 159.0 PSI 11 11 A 9 GLU C A 10 ASP N A 10 ASP CA A 10 ASP C 1.0 -104.4 -51.0 PHI 12 12 A 10 ASP N A 10 ASP CA A 10 ASP C A 11 GLU N 1.0 101.6 141.6 PSI 13 13 A 10 ASP C A 11 GLU N A 11 GLU CA A 11 GLU C 1.0 -89.3 -49.3 PHI 14 14 A 11 GLU N A 11 GLU CA A 11 GLU C A 12 THR N 1.0 -48.9 -2.3 PSI 15 15 A 11 GLU C A 12 THR N A 12 THR CA A 12 THR C 1.0 -97.1 -57.1 PHI 16 16 A 12 THR N A 12 THR CA A 12 THR C A 13 SER N 1.0 -55.6 -14.6 PSI 17 17 A 12 THR C A 13 SER N A 13 SER CA A 13 SER C 1.0 -137.1 -80.3 PHI 18 18 A 13 SER N A 13 SER CA A 13 SER C A 14 GLY N 1.0 -42.7 -2.7 PSI 19 19 A 15 ALA C A 16 LYS N A 16 LYS CA A 16 LYS C 1.0 -102.8 -62.8 PHI 20 20 A 16 LYS N A 16 LYS CA A 16 LYS C A 17 THR N 1.0 103.4 143.4 PSI 21 21 A 16 LYS C A 17 THR N A 17 THR CA A 17 THR C 1.0 -140.1 -94.3 PHI 22 22 A 17 THR N A 17 THR CA A 17 THR C A 18 CYS N 1.0 111.1 151.1 PSI 23 23 A 17 THR C A 18 CYS N A 18 CYS CA A 18 CYS C 1.0 -151.7 -111.7 PHI 24 24 A 18 CYS N A 18 CYS CA A 18 CYS C A 19 VAL N 1.0 122.3 174.5 PSI 25 25 A 18 CYS C A 19 VAL N A 19 VAL CA A 19 VAL C 1.0 -158.6 -95.2 PHI 26 26 A 19 VAL N A 19 VAL CA A 19 VAL C A 20 PRO N 1.0 88.2 180.8 PSI 27 27 A 19 VAL C A 20 PRO N A 20 PRO CA A 20 PRO C 1.0 -87.8 -47.8 PHI 28 28 A 20 PRO N A 20 PRO CA A 20 PRO C A 21 ASP N 1.0 126.9 170.3 PSI 29 29 A 20 PRO C A 21 ASP N A 21 ASP CA A 21 ASP C 1.0 -116.9 -37.7 PHI 30 30 A 21 ASP C A 22 ASN N A 22 ASN CA A 22 ASN C 1.0 -5.1 94.9 PHI 31 31 A 22 ASN N A 22 ASN CA A 22 ASN C A 23 CYS N 1.0 -35.4 98.6 PSI 32 32 A 23 CYS C A 24 ASP N A 24 ASP CA A 24 ASP C 1.0 -100.8 -51.0 PHI 33 33 A 24 ASP N A 24 ASP CA A 24 ASP C A 25 ALA N 1.0 78.9 171.3 PSI 34 34 A 5 CYS N A 5 CYS CA A 5 CYS CB A 5 CYS SG 1.0 150.0 210.0 CHI1 35 35 A 7 CYS N A 7 CYS CA A 7 CYS CB A 7 CYS SG 1.0 -90.0 -30.0 CHI1 36 36 A 18 CYS N A 18 CYS CA A 18 CYS CB A 18 CYS SG 1.0 -90.0 -30.0 CHI1 37 37 A 23 CYS N A 23 CYS CA A 23 CYS CB A 23 CYS SG 1.0 30.0 90.0 CHI1 38 38 A 10 ASP N A 10 ASP CA A 10 ASP CB A 10 ASP CG 1.0 150.0 210.0 CHI1 39 39 A 21 ASP N A 21 ASP CA A 21 ASP CB A 21 ASP CG 1.0 150.0 210.0 CHI1 40 40 A 22 ASN N A 22 ASN CA A 22 ASN CB A 22 ASN CG 1.0 -90.0 -30.0 CHI1 41 41 A 1 ASP C A 2 VAL N A 2 VAL CA A 2 VAL C 1.0 -180.0 -20.0 PHI 42 42 A 2 VAL C A 3 SER N A 3 SER CA A 3 SER C 1.0 -180.0 -20.0 PHI 43 43 A 2 VAL C A 3 SER N A 3 SER CA A 3 SER C 1.0 -180.0 -20.0 PHI 44 44 A 25 ALA C A 26 SER N A 26 SER CA A 26 SER C 1.0 -180.0 -20.0 PHI 45 45 A 28 GLY C A 29 THR N A 29 THR CA A 29 THR C 1.0 -180.0 -20.0 PHI 46 46 A 29 THR C A 30 ASN N A 30 ASN CA A 30 ASN C 1.0 -180.0 -20.0 PHI stop_ save_ save_spectral_peak_list_1 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_1 _nef_nmr_spectrum.experiment_classification . _nef_nmr_spectrum.experiment_type . _nef_nmr_spectrum.num_dimensions 2 _nef_nmr_spectrum.chemical_shift_list . loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_unit _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectrometer_frequency _nef_spectrum_dimension.spectral_width _nef_spectrum_dimension.value_first_point _nef_spectrum_dimension.folding _nef_spectrum_dimension.absolute_peak_positions _nef_spectrum_dimension.is_acquisition 1 ppm . . 12 . . . . 2 ppm . . 12 . . . . stop_ save_