data_nef_c18014_2lkw 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 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 1 ACE C 1 2 GLY N 1 21 ILE C 1 22 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 0 ACE start . . 2 A 1 GLY middle . false 3 A 2 GLN middle . . 4 A 3 ARG middle . . 5 A 4 HIS middle . . 6 A 5 SER middle . . 7 A 6 ILE middle . . 8 A 7 VAL middle . . 9 A 8 GLN middle . . 10 A 9 PRO middle . false 11 A 10 PRO middle . false 12 A 11 ALA middle . . 13 A 12 PRO middle . false 14 A 13 PRO middle . false 15 A 14 PRO middle . false 16 A 15 ASN middle . . 17 A 16 ALA middle . . 18 A 17 PHE middle . . 19 A 18 VAL middle . . 20 A 19 GLU middle . . 21 A 20 ILE middle . . 22 A 21 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 0 GLY H1 H 1 8.388 0.003 A 1 GLY HAx H 1 3.861 0.002 A 1 GLY HAy H 1 3.861 0.002 A 2 GLN H H 1 8.473 0.003 A 2 GLN HA H 1 4.248 0.005 A 2 GLN HBx H 1 1.888 0.007 A 2 GLN HBy H 1 2.004 0.007 A 2 GLN HGx H 1 2.299 0.003 A 2 GLN HGy H 1 2.299 0.003 A 3 ARG H H 1 8.504 0.003 A 3 ARG HA H 1 4.220 0.003 A 3 ARG HBx H 1 1.683 0.004 A 3 ARG HBy H 1 1.742 0.005 A 3 ARG HDx H 1 3.128 0.003 A 3 ARG HDy H 1 3.128 0.003 A 3 ARG HE H 1 7.172 0.003 A 3 ARG HGx H 1 1.553 0.023 A 3 ARG HGy H 1 1.553 0.023 A 3 ARG HH1x H 1 6.446 0.002 A 3 ARG HH2x H 1 6.853 0.008 A 4 HIS H H 1 8.674 0.003 A 4 HIS HA H 1 4.700 0.003 A 4 HIS HBx H 1 3.120 0.004 A 4 HIS HBy H 1 3.215 0.005 A 4 HIS HD2 H 1 7.253 0.003 A 4 HIS HE1 H 1 8.563 0.001 A 5 SER H H 1 8.495 0.004 A 5 SER HA H 1 4.411 0.003 A 5 SER HBx H 1 3.777 0.004 A 5 SER HBy H 1 3.777 0.004 A 6 ILE H H 1 8.424 0.002 A 6 ILE HA H 1 4.165 0.004 A 6 ILE HB H 1 1.811 0.003 A 6 ILE HD1% H 1 0.813 0.004 A 6 ILE HG1x H 1 1.135 0.004 A 6 ILE HG1y H 1 1.410 0.004 A 6 ILE HG2% H 1 0.838 0.006 A 7 VAL H H 1 8.366 0.003 A 7 VAL HA H 1 4.015 0.003 A 7 VAL HB H 1 1.936 0.003 A 7 VAL HGx% H 1 0.835 0.003 A 7 VAL HGy% H 1 0.875 0.003 A 8 GLN H H 1 8.653 0.003 A 8 GLN HA H 1 4.545 0.003 A 8 GLN HBx H 1 1.868 0.005 A 8 GLN HBy H 1 2.018 0.006 A 8 GLN HE2x H 1 6.940 0.000 A 8 GLN HE2y H 1 7.612 0.003 A 8 GLN HGx H 1 2.348 0.004 A 8 GLN HGy H 1 2.348 0.004 A 9 PRO HA H 1 4.657 0.003 A 9 PRO HBx H 1 1.861 0.005 A 9 PRO HBy H 1 2.314 0.005 A 9 PRO HDx H 1 3.611 0.006 A 9 PRO HDy H 1 3.799 0.004 A 9 PRO HGx H 1 1.989 0.005 A 9 PRO HGy H 1 1.989 0.005 A 10 PRO HA H 1 4.354 0.003 A 10 PRO HBx H 1 1.848 0.006 A 10 PRO HBy H 1 2.240 0.005 A 10 PRO HDx H 1 3.569 0.003 A 10 PRO HDy H 1 3.755 0.005 A 10 PRO HGx H 1 1.970 0.005 A 10 PRO HGy H 1 1.970 0.005 A 11 ALA H H 1 8.466 0.004 A 11 ALA HA H 1 4.521 0.006 A 11 ALA HB% H 1 1.289 0.002 A 12 PRO HA H 1 4.667 0.007 A 12 PRO HBx H 1 1.843 0.008 A 12 PRO HBy H 1 2.300 0.004 A 12 PRO HDx H 1 3.569 0.004 A 12 PRO HDy H 1 3.777 0.004 A 12 PRO HGx H 1 1.987 0.004 A 12 PRO HGy H 1 1.987 0.004 A 13 PRO HA H 1 4.657 0.005 A 13 PRO HBx H 1 1.831 0.004 A 13 PRO HBy H 1 2.288 0.007 A 13 PRO HDx H 1 3.561 0.005 A 13 PRO HDy H 1 3.793 0.005 A 13 PRO HGx H 1 1.975 0.007 A 13 PRO HGy H 1 1.975 0.007 A 14 PRO HA H 1 4.339 0.003 A 14 PRO HBx H 1 1.849 0.004 A 14 PRO HBy H 1 2.221 0.006 A 14 PRO HDx H 1 3.593 0.005 A 14 PRO HDy H 1 3.758 0.005 A 14 PRO HGx H 1 1.969 0.005 A 14 PRO HGy H 1 1.969 0.005 A 15 ASN H H 1 8.482 0.002 A 15 ASN HA H 1 4.538 0.003 A 15 ASN HBx H 1 2.703 0.002 A 15 ASN HBy H 1 2.703 0.002 A 15 ASN HD2x H 1 6.964 0.003 A 15 ASN HD2y H 1 7.668 0.001 A 16 ALA H H 1 8.281 0.002 A 16 ALA HA H 1 4.181 0.004 A 16 ALA HB% H 1 1.223 0.003 A 17 PHE H H 1 8.266 0.003 A 17 PHE HA H 1 4.527 0.004 A 17 PHE HBx H 1 3.004 0.006 A 17 PHE HBy H 1 3.030 0.004 A 17 PHE HDx H 1 7.179 0.003 A 17 PHE HDy H 1 7.179 0.003 A 17 PHE HEx H 1 7.287 0.004 A 17 PHE HEy H 1 7.287 0.004 A 17 PHE HZ H 1 7.249 0.002 A 18 VAL H H 1 7.923 0.004 A 18 VAL HA H 1 3.950 0.004 A 18 VAL HB H 1 1.885 0.003 A 18 VAL HGx% H 1 0.819 0.003 A 18 VAL HGy% H 1 0.849 0.002 A 19 GLU H H 1 8.433 0.002 A 19 GLU HA H 1 4.280 0.003 A 19 GLU HBx H 1 1.922 0.006 A 19 GLU HBy H 1 2.022 0.008 A 19 GLU HGx H 1 2.411 0.004 A 19 GLU HGy H 1 2.411 0.004 A 20 ILE H H 1 8.324 0.002 A 20 ILE HA H 1 4.054 0.005 A 20 ILE HB H 1 1.792 0.005 A 20 ILE HD1% H 1 0.826 0.007 A 20 ILE HG1x H 1 1.157 0.004 A 20 ILE HG1y H 1 1.440 0.005 A 20 ILE HG2% H 1 0.883 0.004 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _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 1 GLY H A 1 GLY HAx 1.0 2.20 3.50 2 1 A 1 GLY H A 1 GLY HAy 1.0 2.20 3.50 3 2 A 2 GLN H A 2 GLN HA 1.0 2.90 4.50 4 3 A 2 GLN H A 2 GLN HBy 1.0 2.90 4.50 5 4 A 2 GLN HA A 2 GLN HBy 1.0 2.40 3.75 6 5 A 2 GLN HA A 2 GLN HBx 1.0 2.90 4.50 7 6 A 2 GLN HBy A 2 GLN HBx 1.0 1.85 2.85 8 7 A 2 GLN HBy A 2 GLN HGx 1.0 2.70 3.45 9 7 A 2 GLN HBy A 2 GLN HGy 1.0 2.70 3.45 10 8 A 2 GLN HBx A 2 GLN HGx 1.0 1.85 3.00 11 8 A 2 GLN HBx A 2 GLN HGy 1.0 1.85 3.00 12 9 A 3 ARG H A 3 ARG HA 1.0 2.00 3.25 13 10 A 3 ARG H A 3 ARG HBy 1.0 3.25 5.00 14 11 A 3 ARG H A 3 ARG HBx 1.0 4.25 6.00 15 12 A 3 ARG H A 3 ARG HGx 1.0 4.25 6.50 16 12 A 3 ARG H A 3 ARG HGy 1.0 4.25 6.50 17 13 A 3 ARG HA A 3 ARG HBy 1.0 2.00 3.25 18 14 A 3 ARG HA A 3 ARG HBx 1.0 4.25 6.50 19 15 A 3 ARG HBy A 3 ARG HBx 1.0 1.70 2.60 20 16 A 3 ARG HBy A 3 ARG HGx 1.0 2.90 4.50 21 16 A 3 ARG HBy A 3 ARG HGy 1.0 2.90 4.50 22 17 A 3 ARG HBx A 3 ARG HGx 1.0 2.40 3.75 23 17 A 3 ARG HBx A 3 ARG HGy 1.0 2.40 3.75 24 18 A 3 ARG HDy A 3 ARG HGx 1.0 2.40 3.75 25 18 A 3 ARG HDx A 3 ARG HGx 1.0 2.40 3.75 26 18 A 3 ARG HGy A 3 ARG HDx 1.0 2.40 3.75 27 18 A 3 ARG HGy A 3 ARG HDy 1.0 2.40 3.75 28 19 A 3 ARG HE A 3 ARG HDx 1.0 2.00 3.25 29 19 A 3 ARG HDy A 3 ARG HE 1.0 2.00 3.25 30 20 A 4 HIS H A 4 HIS HA 1.0 2.40 3.75 31 21 A 4 HIS H A 4 HIS HBy 1.0 2.90 4.50 32 22 A 4 HIS H A 4 HIS HBx 1.0 2.90 4.50 33 23 A 4 HIS HA A 4 HIS HBy 1.0 2.20 3.25 34 24 A 4 HIS HBy A 4 HIS HBx 1.0 1.70 2.60 35 25 A 4 HIS HBy A 4 HIS HD1 1.0 4.25 6.50 36 26 A 4 HIS HBx A 4 HIS HD1 1.0 3.25 5.00 37 27 A 5 SER H A 5 SER HA 1.0 2.65 4.13 38 28 A 5 SER H A 5 SER HBy 1.0 1.70 2.60 39 29 A 5 SER HA A 5 SER HBy 1.0 1.70 2.60 40 30 A 6 ILE HA A 6 ILE H 1.0 2.20 3.25 41 31 A 6 ILE H A 6 ILE HB 1.0 1.70 2.75 42 32 A 6 ILE H A 6 ILE HG1x 1.0 2.90 4.50 43 33 A 6 ILE H A 6 ILE HG2% 1.0 2.20 3.50 44 34 A 6 ILE H A 6 ILE HD1% 1.0 4.25 6.00 45 35 A 6 ILE HA A 6 ILE HB 1.0 1.70 2.75 46 36 A 6 ILE HA A 6 ILE HG1x 1.0 4.25 6.25 47 37 A 6 ILE HA A 6 ILE HG2% 1.0 1.85 3.00 48 38 A 6 ILE HA A 6 ILE HD1% 1.0 4.25 6.25 49 39 A 6 ILE HB A 6 ILE HG1x 1.0 2.90 4.50 50 40 A 6 ILE HB A 6 ILE HG2% 1.0 1.70 2.75 51 41 A 6 ILE HB A 6 ILE HD1% 1.0 2.40 3.75 52 42 A 6 ILE HG1x A 6 ILE HG2% 1.0 1.70 2.75 53 43 A 6 ILE HG1x A 6 ILE HD1% 1.0 1.70 2.60 54 44 A 7 VAL H A 7 VAL HA 1.0 2.40 3.75 55 45 A 7 VAL H A 7 VAL HB 1.0 2.00 3.25 56 46 A 7 VAL H A 7 VAL HGx% 1.0 2.20 3.50 57 47 A 7 VAL H A 7 VAL HGy% 1.0 2.00 3.25 58 48 A 7 VAL HA A 7 VAL HB 1.0 2.00 3.25 59 49 A 7 VAL HA A 7 VAL HGx% 1.0 2.00 3.25 60 50 A 7 VAL HA A 7 VAL HGy% 1.0 2.90 4.50 61 51 A 7 VAL HB A 7 VAL HGx% 1.0 1.70 2.45 62 52 A 7 VAL HB A 7 VAL HGy% 1.0 1.70 2.60 63 53 A 8 GLN H A 8 GLN HA 1.0 3.07 4.75 64 54 A 8 GLN H A 8 GLN HBy 1.0 2.65 4.13 65 55 A 8 GLN H A 8 GLN HBx 1.0 2.40 3.75 66 56 A 8 GLN H A 8 GLN HGx 1.0 3.07 4.75 67 56 A 8 GLN H A 8 GLN HGy 1.0 3.07 4.75 68 57 A 8 GLN HA A 8 GLN HBy 1.0 2.20 3.50 69 58 A 8 GLN HA A 8 GLN HBx 1.0 3.07 4.75 70 59 A 8 GLN HA A 8 GLN HGx 1.0 2.90 4.50 71 59 A 8 GLN HA A 8 GLN HGy 1.0 2.90 4.50 72 60 A 8 GLN HBy A 8 GLN HBx 1.0 2.20 3.50 73 61 A 8 GLN HBy A 8 GLN HGx 1.0 1.70 2.75 74 61 A 8 GLN HBy A 8 GLN HGy 1.0 1.70 2.75 75 62 A 8 GLN HBx A 8 GLN HGx 1.0 1.70 2.75 76 62 A 8 GLN HBx A 8 GLN HGy 1.0 1.70 2.75 77 63 A 8 GLN HE2x A 8 GLN HE2y 1.0 1.70 2.45 78 64 A 9 PRO HA A 9 PRO HBy 1.0 2.00 3.25 79 65 A 9 PRO HA A 9 PRO HBx 1.0 1.85 2.85 80 66 A 9 PRO HA A 9 PRO HGx 1.0 2.00 3.25 81 66 A 9 PRO HA A 9 PRO HGy 1.0 2.00 3.25 82 67 A 9 PRO HBy A 9 PRO HBx 1.0 1.70 2.45 83 68 A 9 PRO HBy A 9 PRO HGx 1.0 1.70 2.45 84 68 A 9 PRO HBy A 9 PRO HGy 1.0 1.70 2.45 85 69 A 9 PRO HBy A 9 PRO HDx 1.0 2.00 3.25 86 70 A 9 PRO HBy A 9 PRO HDy 1.0 2.90 4.50 87 71 A 9 PRO HBx A 9 PRO HGx 1.0 2.00 3.25 88 71 A 9 PRO HBx A 9 PRO HGy 1.0 2.00 3.25 89 72 A 9 PRO HBx A 9 PRO HDx 1.0 2.65 4.13 90 73 A 9 PRO HBx A 9 PRO HDy 1.0 3.25 5.00 91 74 A 9 PRO HDx A 9 PRO HGx 1.0 1.70 2.45 92 74 A 9 PRO HGy A 9 PRO HDx 1.0 1.70 2.45 93 75 A 9 PRO HDy A 9 PRO HGx 1.0 1.70 2.75 94 75 A 9 PRO HGy A 9 PRO HDy 1.0 1.70 2.75 95 76 A 9 PRO HDx A 9 PRO HDy 1.0 1.70 2.45 96 77 A 10 PRO HA A 10 PRO HBy 1.0 1.85 2.85 97 78 A 10 PRO HA A 10 PRO HBx 1.0 1.85 2.85 98 79 A 10 PRO HA A 10 PRO HGx 1.0 2.90 4.50 99 79 A 10 PRO HA A 10 PRO HGy 1.0 2.90 4.50 100 80 A 10 PRO HA A 10 PRO HDx 1.0 3.25 5.00 101 81 A 10 PRO HA A 10 PRO HDy 1.0 3.25 5.00 102 82 A 10 PRO HBy A 10 PRO HBx 1.0 1.70 2.45 103 83 A 10 PRO HBy A 10 PRO HGx 1.0 1.70 2.45 104 83 A 10 PRO HBy A 10 PRO HGy 1.0 1.70 2.45 105 84 A 10 PRO HBy A 10 PRO HDy 1.0 2.90 4.50 106 85 A 10 PRO HBx A 10 PRO HGx 1.0 1.70 2.60 107 85 A 10 PRO HBx A 10 PRO HGy 1.0 1.70 2.60 108 86 A 10 PRO HBx A 10 PRO HDx 1.0 2.90 4.50 109 87 A 10 PRO HDx A 10 PRO HGx 1.0 2.70 3.45 110 87 A 10 PRO HGy A 10 PRO HDx 1.0 2.70 3.45 111 88 A 10 PRO HDy A 10 PRO HGx 1.0 1.70 2.60 112 88 A 10 PRO HGy A 10 PRO HDy 1.0 1.70 2.60 113 89 A 10 PRO HDx A 10 PRO HDy 1.0 1.70 2.45 114 90 A 11 ALA H A 11 ALA HA 1.0 2.00 3.25 115 91 A 11 ALA H A 11 ALA HB% 1.0 1.70 2.45 116 92 A 11 ALA HA A 11 ALA HB% 1.0 1.70 2.45 117 93 A 12 PRO HBy A 12 PRO HA 1.0 2.40 3.75 118 94 A 12 PRO HA A 12 PRO HBx 1.0 2.00 3.25 119 95 A 12 PRO HA A 12 PRO HGx 1.0 3.25 5.00 120 95 A 12 PRO HA A 12 PRO HGy 1.0 3.25 5.00 121 96 A 12 PRO HBy A 12 PRO HBx 1.0 1.70 2.45 122 97 A 12 PRO HBy A 12 PRO HGx 1.0 2.00 3.25 123 97 A 12 PRO HBy A 12 PRO HGy 1.0 2.00 3.25 124 98 A 12 PRO HBy A 12 PRO HDx 1.0 1.70 2.45 125 99 A 12 PRO HBy A 12 PRO HDy 1.0 2.90 4.50 126 100 A 12 PRO HBx A 12 PRO HGx 1.0 1.70 2.75 127 100 A 12 PRO HBx A 12 PRO HGy 1.0 1.70 2.75 128 101 A 12 PRO HBx A 12 PRO HDx 1.0 2.20 3.50 129 102 A 12 PRO HBx A 12 PRO HDy 1.0 2.65 4.13 130 103 A 12 PRO HDx A 12 PRO HGx 1.0 1.70 2.45 131 103 A 12 PRO HGy A 12 PRO HDx 1.0 1.70 2.45 132 104 A 12 PRO HDy A 12 PRO HGx 1.0 1.70 2.60 133 104 A 12 PRO HGy A 12 PRO HDy 1.0 1.70 2.60 134 105 A 12 PRO HDx A 12 PRO HDy 1.0 1.70 2.45 135 106 A 13 PRO HA A 13 PRO HBy 1.0 1.85 3.00 136 107 A 13 PRO HA A 13 PRO HBx 1.0 1.85 2.85 137 108 A 13 PRO HA A 13 PRO HGx 1.0 1.70 2.60 138 108 A 13 PRO HA A 13 PRO HGy 1.0 1.70 2.60 139 109 A 13 PRO HBy A 13 PRO HBx 1.0 1.70 2.45 140 110 A 13 PRO HBy A 13 PRO HGx 1.0 1.70 2.45 141 110 A 13 PRO HBy A 13 PRO HGy 1.0 1.70 2.45 142 111 A 13 PRO HBy A 13 PRO HDx 1.0 4.25 6.50 143 112 A 13 PRO HBy A 13 PRO HDy 1.0 2.40 3.75 144 113 A 13 PRO HBx A 13 PRO HGx 1.0 1.70 2.60 145 113 A 13 PRO HBx A 13 PRO HGy 1.0 1.70 2.60 146 114 A 13 PRO HBx A 13 PRO HDx 1.0 2.90 4.50 147 115 A 13 PRO HBx A 13 PRO HDy 1.0 2.40 3.75 148 116 A 13 PRO HDx A 13 PRO HGx 1.0 4.25 6.00 149 116 A 13 PRO HGy A 13 PRO HDx 1.0 4.25 6.00 150 117 A 13 PRO HDy A 13 PRO HGx 1.0 1.70 2.45 151 117 A 13 PRO HGy A 13 PRO HDy 1.0 1.70 2.45 152 118 A 14 PRO HBy A 14 PRO HA 1.0 1.70 2.75 153 119 A 14 PRO HA A 14 PRO HBx 1.0 1.70 2.45 154 120 A 14 PRO HA A 14 PRO HGx 1.0 2.40 3.75 155 120 A 14 PRO HA A 14 PRO HGy 1.0 2.40 3.75 156 121 A 14 PRO HA A 14 PRO HDy 1.0 2.90 4.50 157 122 A 14 PRO HBy A 14 PRO HBx 1.0 1.70 2.60 158 123 A 14 PRO HBy A 14 PRO HGx 1.0 1.70 2.45 159 123 A 14 PRO HBy A 14 PRO HGy 1.0 1.70 2.45 160 124 A 14 PRO HBy A 14 PRO HDx 1.0 1.70 2.45 161 125 A 14 PRO HBy A 14 PRO HDy 1.0 2.40 3.75 162 126 A 14 PRO HBx A 14 PRO HGx 1.0 2.25 4.00 163 126 A 14 PRO HBx A 14 PRO HGy 1.0 2.25 4.00 164 127 A 14 PRO HBx A 14 PRO HDx 1.0 2.90 4.50 165 128 A 14 PRO HDx A 14 PRO HGx 1.0 2.25 4.00 166 128 A 14 PRO HGy A 14 PRO HDx 1.0 2.25 4.00 167 129 A 14 PRO HDy A 14 PRO HGx 1.0 1.70 2.45 168 129 A 14 PRO HGy A 14 PRO HDy 1.0 1.70 2.45 169 130 A 14 PRO HDy A 14 PRO HDx 1.0 1.70 2.45 170 131 A 15 ASN H A 15 ASN HA 1.0 1.70 2.60 171 132 A 15 ASN H A 15 ASN HBx 1.0 1.70 2.60 172 132 A 15 ASN H A 15 ASN HBy 1.0 1.70 2.60 173 133 A 15 ASN HA A 15 ASN HBx 1.0 1.70 2.45 174 133 A 15 ASN HA A 15 ASN HBy 1.0 1.70 2.45 175 134 A 15 ASN HD2x A 15 ASN HBx 1.0 2.40 3.75 176 134 A 15 ASN HBy A 15 ASN HD2x 1.0 2.40 3.75 177 135 A 15 ASN HD2y A 15 ASN HBx 1.0 2.40 3.75 178 135 A 15 ASN HBy A 15 ASN HD2y 1.0 2.40 3.75 179 136 A 15 ASN HD2x A 15 ASN HD2y 1.0 1.70 2.45 180 137 A 16 ALA HA A 16 ALA H 1.0 1.90 3.25 181 138 A 16 ALA H A 16 ALA HB% 1.0 1.70 2.75 182 139 A 16 ALA HA A 16 ALA HB% 1.0 1.70 2.45 183 140 A 17 PHE H A 17 PHE HA 1.0 1.70 2.75 184 141 A 17 PHE H A 17 PHE HBy 1.0 2.90 4.50 185 142 A 17 PHE H A 17 PHE HBx 1.0 2.20 3.50 186 143 A 17 PHE HA A 17 PHE HBy 1.0 1.85 3.00 187 144 A 17 PHE HA A 17 PHE HBx 1.0 4.25 6.50 188 145 A 17 PHE HA A 17 PHE HD% 1.0 2.40 3.75 189 146 A 17 PHE HBy A 17 PHE HBx 1.0 1.70 2.45 190 147 A 17 PHE HBy A 17 PHE HD% 1.0 2.20 3.50 191 148 A 17 PHE HBx A 17 PHE HD% 1.0 2.00 3.25 192 149 A 17 PHE HD% A 17 PHE HE% 1.0 1.70 2.45 193 150 A 17 PHE HE% A 17 PHE HZ 1.0 2.90 4.50 194 151 A 18 VAL H A 18 VAL HA 1.0 2.00 3.25 195 152 A 18 VAL H A 18 VAL HB 1.0 2.90 4.50 196 153 A 18 VAL H A 18 VAL HGx% 1.0 4.25 6.00 197 154 A 18 VAL H A 18 VAL HGy% 1.0 3.25 5.00 198 155 A 18 VAL HA A 18 VAL HB 1.0 1.85 3.00 199 156 A 18 VAL HA A 18 VAL HGx% 1.0 2.20 3.50 200 157 A 18 VAL HA A 18 VAL HGy% 1.0 2.65 4.13 201 158 A 18 VAL HB A 18 VAL HGx% 1.0 1.70 2.75 202 159 A 18 VAL HB A 18 VAL HGy% 1.0 2.00 3.25 203 160 A 19 GLU H A 19 GLU HA 1.0 2.00 3.25 204 161 A 19 GLU H A 19 GLU HBy 1.0 2.40 3.75 205 162 A 19 GLU H A 19 GLU HBx 1.0 3.25 5.00 206 163 A 19 GLU HA A 19 GLU HBy 1.0 2.00 3.25 207 164 A 19 GLU HA A 19 GLU HGx 1.0 3.25 5.00 208 164 A 19 GLU HA A 19 GLU HGy 1.0 3.25 5.00 209 165 A 19 GLU HBy A 19 GLU HBx 1.0 2.00 3.25 210 166 A 19 GLU HBy A 19 GLU HGx 1.0 2.00 3.25 211 166 A 19 GLU HBy A 19 GLU HGy 1.0 2.00 3.25 212 167 A 19 GLU HBx A 19 GLU HGx 1.0 2.90 4.50 213 167 A 19 GLU HBx A 19 GLU HGy 1.0 2.90 4.50 214 168 A 20 ILE H A 20 ILE HA 1.0 1.85 3.00 215 169 A 20 ILE H A 20 ILE HB 1.0 3.07 4.75 216 170 A 20 ILE HA A 20 ILE HB 1.0 2.40 4.00 217 171 A 20 ILE HB A 20 ILE HG1x 1.0 2.90 4.50 218 172 A 20 ILE HB A 20 ILE HG2% 1.0 2.00 3.25 219 173 A 20 ILE HB A 20 ILE HD1% 1.0 2.90 4.50 220 174 A 20 ILE HG1x A 20 ILE HD1% 1.0 3.25 5.00 221 175 A 2 GLN H A 1 GLY HAx 1.0 3.07 4.55 222 175 A 1 GLY HAy A 2 GLN H 1.0 3.07 4.55 223 176 A 2 GLN HA A 3 ARG H 1.0 2.90 4.25 224 177 A 3 ARG HA A 4 HIS H 1.0 2.20 3.50 225 178 A 4 HIS H A 5 SER H 1.0 3.25 4.85 226 179 A 4 HIS HA A 5 SER H 1.0 2.40 3.75 227 180 A 5 SER HA A 6 ILE H 1.0 2.00 3.25 228 181 A 5 SER HBy A 6 ILE H 1.0 2.90 4.25 229 182 A 6 ILE HA A 7 VAL H 1.0 2.00 3.25 230 183 A 6 ILE HB A 7 VAL H 1.0 4.00 5.60 231 184 A 7 VAL HA A 8 GLN H 1.0 1.85 2.87 232 185 A 7 VAL HB A 8 GLN H 1.0 4.00 5.60 233 186 A 7 VAL HGx% A 8 GLN H 1.0 3.25 4.85 234 187 A 7 VAL HGy% A 8 GLN H 1.0 4.00 5.60 235 188 A 8 GLN HA A 9 PRO HGx 1.0 4.00 5.60 236 188 A 8 GLN HA A 9 PRO HGy 1.0 4.00 5.60 237 189 A 8 GLN HA A 9 PRO HDx 1.0 2.40 3.75 238 190 A 8 GLN HA A 9 PRO HDy 1.0 2.40 3.75 239 191 A 8 GLN HBy A 9 PRO HDy 1.0 4.00 5.60 240 192 A 9 PRO HA A 10 PRO HDx 1.0 2.00 3.05 241 193 A 9 PRO HA A 10 PRO HDy 1.0 2.00 3.05 242 194 A 9 PRO HBx A 10 PRO HDx 1.0 4.00 5.60 243 195 A 10 PRO HA A 11 ALA H 1.0 2.00 3.25 244 196 A 10 PRO HA A 11 ALA HB% 1.0 3.25 4.85 245 197 A 10 PRO HBy A 11 ALA H 1.0 3.25 4.85 246 198 A 10 PRO HBx A 11 ALA H 1.0 3.63 5.23 247 199 A 11 ALA H A 10 PRO HGx 1.0 3.25 4.85 248 199 A 10 PRO HGy A 11 ALA H 1.0 3.25 4.85 249 200 A 11 ALA HA A 10 PRO HGx 1.0 3.07 4.55 250 200 A 10 PRO HGy A 11 ALA HA 1.0 3.07 4.55 251 201 A 11 ALA HA A 12 PRO HDx 1.0 1.90 3.05 252 202 A 11 ALA HA A 12 PRO HDy 1.0 1.90 3.05 253 203 A 11 ALA HB% A 12 PRO HDx 1.0 3.63 5.23 254 204 A 11 ALA HB% A 12 PRO HDy 1.0 3.07 4.55 255 205 A 12 PRO HA A 13 PRO HDx 1.0 1.90 3.05 256 206 A 12 PRO HA A 13 PRO HDy 1.0 1.90 3.05 257 207 A 13 PRO HA A 14 PRO HDx 1.0 2.00 3.05 258 208 A 13 PRO HA A 14 PRO HDy 1.0 1.90 3.05 259 209 A 14 PRO HA A 15 ASN H 1.0 2.00 3.25 260 210 A 14 PRO HA A 15 ASN HBx 1.0 4.00 5.60 261 210 A 14 PRO HA A 15 ASN HBy 1.0 4.00 5.60 262 211 A 15 ASN H A 14 PRO HGx 1.0 3.25 4.85 263 211 A 14 PRO HGy A 15 ASN H 1.0 3.25 4.85 264 212 A 15 ASN H A 16 ALA H 1.0 3.25 4.85 265 213 A 15 ASN HA A 16 ALA H 1.0 2.40 3.75 266 214 A 16 ALA H A 15 ASN HBx 1.0 3.07 4.55 267 214 A 15 ASN HBy A 16 ALA H 1.0 3.07 4.55 268 215 A 16 ALA H A 18 VAL H 1.0 4.00 5.60 269 216 A 16 ALA HA A 17 PHE H 1.0 2.40 3.75 270 217 A 16 ALA HB% A 17 PHE H 1.0 3.25 4.85 271 218 A 17 PHE H A 18 VAL H 1.0 3.63 5.23 272 219 A 17 PHE HA A 18 VAL H 1.0 2.20 3.50 273 220 A 17 PHE HA A 18 VAL HGy% 1.0 4.00 5.60 274 221 A 17 PHE HBy A 18 VAL H 1.0 4.00 5.60 275 222 A 17 PHE HBx A 18 VAL H 1.0 4.00 5.60 276 223 A 18 VAL H A 19 GLU H 1.0 3.25 4.85 277 224 A 18 VAL HA A 19 GLU H 1.0 2.20 3.50 278 225 A 18 VAL HB A 19 GLU H 1.0 3.25 4.85 279 226 A 18 VAL HGx% A 19 GLU H 1.0 4.00 5.60 280 227 A 19 GLU HA A 20 ILE H 1.0 2.40 3.75 stop_ save_