data_nef_c17764_2lfm 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_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 ALA middle . . 3 A 3 GLU middle . . 4 A 4 PHE middle . . 5 A 5 ARG middle . . 6 A 6 HIS middle . . 7 A 7 ASP middle . . 8 A 8 SER middle . . 9 A 9 GLY middle . false 10 A 10 TYR middle . . 11 A 11 GLU middle . . 12 A 12 VAL middle . . 13 A 13 HIS middle . . 14 A 14 HIS middle . . 15 A 15 GLN middle . . 16 A 16 LYS middle . . 17 A 17 LEU middle . . 18 A 18 VAL middle . . 19 A 19 PHE middle . . 20 A 20 PHE middle . . 21 A 21 ALA middle . . 22 A 22 GLU middle . . 23 A 23 ASP middle . . 24 A 24 VAL middle . . 25 A 25 GLY middle . false 26 A 26 SER middle . . 27 A 27 ASN middle . . 28 A 28 LYS middle . . 29 A 29 GLY middle . false 30 A 30 ALA middle . . 31 A 31 ILE middle . . 32 A 32 ILE middle . . 33 A 33 GLY middle . false 34 A 34 LEU middle . . 35 A 35 MET middle . . 36 A 36 VAL middle . . 37 A 37 GLY middle . false 38 A 38 GLY middle . false 39 A 39 VAL middle . . 40 A 40 VAL 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 ASP HA H 1 4.035 0.002 A 1 ASP HBx H 1 2.540 0.002 A 1 ASP HBy H 1 2.668 0.000 A 2 ALA H H 1 7.931 0.000 A 2 ALA HA H 1 4.140 0.003 A 2 ALA HB% H 1 1.203 0.003 A 3 GLU H H 1 8.354 0.002 A 3 GLU HA H 1 4.019 0.003 A 3 GLU HBy H 1 1.769 0.000 A 3 GLU HBx H 1 1.719 0.000 A 3 GLU HGy H 1 2.058 0.000 A 3 GLU HGx H 1 1.965 0.002 A 4 PHE H H 1 8.209 0.002 A 4 PHE HA H 1 4.403 0.003 A 4 PHE HBx H 1 2.851 0.002 A 4 PHE HBy H 1 2.851 0.002 A 4 PHE HDx H 1 7.099 0.002 A 4 PHE HDy H 1 7.099 0.002 A 4 PHE HEx H 1 7.012 0.002 A 4 PHE HEy H 1 7.012 0.002 A 5 ARG H H 1 8.067 0.002 A 5 ARG HA H 1 4.095 0.003 A 5 ARG HBx H 1 1.328 0.005 A 5 ARG HBy H 1 1.328 0.005 A 5 ARG HDx H 1 2.965 0.004 A 5 ARG HDy H 1 2.965 0.004 A 5 ARG HGy H 1 1.576 0.002 A 5 ARG HGx H 1 1.469 0.002 A 6 HIS HA H 1 4.396 0.004 A 6 HIS HBy H 1 2.973 0.003 A 6 HIS HBx H 1 2.903 0.003 A 6 HIS HD1 H 1 6.645 0.000 A 6 HIS HD2 H 1 6.923 0.001 A 7 ASP H H 1 8.281 0.002 A 7 ASP HA H 1 4.463 0.004 A 7 ASP HBx H 1 2.516 0.001 A 7 ASP HBy H 1 2.516 0.001 A 8 SER H H 1 8.333 0.003 A 8 SER HA H 1 4.223 0.004 A 8 SER HBy H 1 3.754 0.003 A 8 SER HBx H 1 3.713 0.003 A 9 GLY H H 1 8.445 0.001 A 9 GLY HAy H 1 3.782 0.005 A 9 GLY HAx H 1 3.721 0.003 A 10 TYR H H 1 7.860 0.002 A 10 TYR HA H 1 4.344 0.004 A 10 TYR HBy H 1 2.862 0.002 A 10 TYR HBx H 1 2.791 0.002 A 10 TYR HDx H 1 6.893 0.001 A 10 TYR HDy H 1 6.893 0.001 A 10 TYR HEx H 1 6.612 0.001 A 10 TYR HEy H 1 6.612 0.001 A 11 GLU H H 1 8.283 0.001 A 11 GLU HA H 1 4.037 0.004 A 11 GLU HBx H 1 1.697 0.005 A 11 GLU HBy H 1 1.773 0.002 A 11 GLU HGy H 1 2.046 0.002 A 11 GLU HGx H 1 1.995 0.001 A 12 VAL H H 1 7.970 0.001 A 12 VAL HA H 1 3.775 0.002 A 12 VAL HB H 1 1.774 0.002 A 12 VAL HGx% H 1 0.707 0.002 A 12 VAL HGy% H 1 0.611 0.002 A 13 HIS H H 1 7.760 0.002 A 13 HIS HA H 1 4.457 0.002 A 13 HIS HBy H 1 2.920 0.002 A 13 HIS HBx H 1 2.866 0.003 A 13 HIS HD1 H 1 6.610 0.000 A 13 HIS HD2 H 1 6.849 0.001 A 14 HIS H H 1 6.860 0.003 A 14 HIS HA H 1 4.396 0.003 A 14 HIS HBy H 1 2.964 0.002 A 14 HIS HBx H 1 2.861 0.002 A 15 GLN H H 1 8.336 0.002 A 15 GLN HA H 1 4.110 0.003 A 15 GLN HBy H 1 1.905 0.002 A 15 GLN HBx H 1 1.819 0.002 A 15 GLN HE2y H 1 7.475 0.000 A 15 GLN HE2x H 1 6.795 0.001 A 15 GLN HGx H 1 2.173 0.002 A 15 GLN HGy H 1 2.173 0.002 A 16 LYS H H 1 8.317 0.002 A 16 LYS HA H 1 4.116 0.003 A 16 LYS HBy H 1 1.644 0.005 A 16 LYS HBx H 1 1.584 0.002 A 16 LYS HDx H 1 1.514 0.004 A 16 LYS HDy H 1 1.514 0.004 A 16 LYS HEx H 1 2.813 0.002 A 16 LYS HEy H 1 2.813 0.002 A 16 LYS HGy H 1 1.284 0.003 A 16 LYS HGx H 1 1.214 0.005 A 17 LEU H H 1 8.169 0.003 A 17 LEU HA H 1 4.169 0.003 A 17 LEU HBy H 1 1.443 0.002 A 17 LEU HBx H 1 1.398 0.002 A 17 LEU HDx% H 1 0.682 0.003 A 17 LEU HDy% H 1 0.749 0.003 A 17 LEU HG H 1 1.281 0.004 A 18 VAL H H 1 7.902 0.002 A 18 VAL HA H 1 3.871 0.002 A 18 VAL HB H 1 1.742 0.003 A 18 VAL HGx% H 1 0.673 0.003 A 18 VAL HGy% H 1 0.587 0.002 A 19 PHE H H 1 8.160 0.001 A 19 PHE HA H 1 4.418 0.001 A 19 PHE HBy H 1 2.821 0.006 A 19 PHE HBx H 1 2.749 0.002 A 19 PHE HDx H 1 7.005 0.002 A 19 PHE HDy H 1 7.005 0.002 A 19 PHE HEx H 1 7.144 0.001 A 19 PHE HEy H 1 7.144 0.001 A 19 PHE HZ H 1 7.114 0.002 A 20 PHE H H 1 8.132 0.002 A 20 PHE HA H 1 4.422 0.003 A 20 PHE HBy H 1 2.926 0.001 A 20 PHE HBx H 1 2.773 0.001 A 20 PHE HDx H 1 7.076 0.002 A 20 PHE HDy H 1 7.076 0.002 A 20 PHE HEx H 1 7.161 0.003 A 20 PHE HEy H 1 7.161 0.003 A 21 ALA H H 1 8.154 0.001 A 21 ALA HA H 1 4.061 0.003 A 21 ALA HB% H 1 1.206 0.002 A 22 GLU H H 1 8.269 0.003 A 22 GLU HA H 1 4.048 0.003 A 22 GLU HBx H 1 1.762 0.004 A 22 GLU HBy H 1 1.880 0.002 A 22 GLU HGx H 1 2.108 0.010 A 22 GLU HGy H 1 2.108 0.010 A 23 ASP H H 1 8.325 0.001 A 23 ASP HA H 1 4.487 0.002 A 23 ASP HBy H 1 2.584 0.003 A 23 ASP HBx H 1 2.480 0.004 A 24 VAL H H 1 8.053 0.001 A 24 VAL HA H 1 3.972 0.002 A 24 VAL HB H 1 2.025 0.003 A 24 VAL HGx% H 1 0.795 0.003 A 24 VAL HGy% H 1 0.795 0.003 A 25 GLY H H 1 8.451 0.001 A 25 GLY HAx H 1 3.817 0.003 A 25 GLY HAy H 1 3.817 0.003 A 26 SER H H 1 8.065 0.003 A 26 SER HA H 1 4.271 0.008 A 26 SER HBy H 1 3.752 0.006 A 26 SER HBx H 1 3.706 0.005 A 27 ASN H H 1 8.391 0.001 A 27 ASN HA H 1 4.575 0.003 A 27 ASN HBy H 1 2.712 0.002 A 27 ASN HBx H 1 2.645 0.003 A 27 ASN HD2x H 1 6.834 0.001 A 27 ASN HD2y H 1 7.545 0.001 A 28 LYS H H 1 8.252 0.002 A 28 LYS HA H 1 4.110 0.004 A 28 LYS HBy H 1 1.724 0.005 A 28 LYS HBx H 1 1.613 0.002 A 28 LYS HGx H 1 1.316 0.008 A 28 LYS HGy H 1 1.316 0.008 A 29 GLY H H 1 8.326 0.001 A 29 GLY HAx H 1 3.763 0.002 A 29 GLY HAy H 1 3.763 0.002 A 30 ALA H H 1 7.939 0.003 A 30 ALA HA H 1 4.155 0.003 A 30 ALA HB% H 1 1.209 0.002 A 31 ILE H H 1 8.076 0.002 A 31 ILE HA H 1 3.995 0.002 A 31 ILE HB H 1 1.703 0.001 A 31 ILE HD1% H 1 0.709 0.000 A 31 ILE HG1y H 1 1.339 0.003 A 31 ILE HG1x H 1 1.039 0.003 A 32 ILE H H 1 8.177 0.005 A 32 ILE HA H 1 3.999 0.002 A 32 ILE HB H 1 1.705 0.002 A 32 ILE HD1% H 1 0.703 0.003 A 32 ILE HG2% H 1 1.047 0.004 A 33 GLY H H 1 8.369 0.001 A 33 GLY HAx H 1 3.765 0.002 A 33 GLY HAy H 1 3.765 0.002 A 34 LEU H H 1 7.953 0.002 A 34 LEU HA H 1 4.183 0.003 A 34 LEU HBx H 1 1.438 0.001 A 34 LEU HBy H 1 1.438 0.001 A 34 LEU HDx% H 1 0.765 0.004 A 34 LEU HDy% H 1 0.713 0.003 A 35 MET H H 1 8.350 0.003 A 35 MET HA H 1 4.367 0.001 A 35 MET HBy H 1 1.918 0.003 A 35 MET HBx H 1 1.859 0.003 A 35 MET HGy H 1 2.431 0.002 A 35 MET HGx H 1 2.354 0.002 A 36 VAL H H 1 8.135 0.002 A 36 VAL HA H 1 3.969 0.002 A 36 VAL HB H 1 1.924 0.003 A 36 VAL HGx% H 1 0.786 0.002 A 36 VAL HGy% H 1 0.786 0.002 A 37 GLY H H 1 8.496 0.001 A 37 GLY HAx H 1 3.826 0.004 A 37 GLY HAy H 1 3.826 0.004 A 38 GLY H H 1 8.166 0.002 A 38 GLY HAy H 1 3.855 0.002 A 38 GLY HAx H 1 3.789 0.003 A 39 VAL H H 1 7.981 0.004 A 39 VAL HA H 1 4.015 0.001 A 39 VAL HB H 1 1.927 0.003 A 39 VAL HGx% H 1 0.776 0.003 A 39 VAL HGy% H 1 0.776 0.003 A 40 VAL H H 1 7.718 0.001 A 40 VAL HA H 1 3.890 0.000 A 40 VAL HB H 1 1.898 0.003 A 40 VAL HGx% H 1 0.738 0.006 A 40 VAL HGy% H 1 0.738 0.006 stop_ save_ save_DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-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 VAL H A 18 VAL HB 1.0 . 3.38 2 2 A 40 VAL H A 40 VAL HGx% 1.0 . 3.71 3 2 A 40 VAL H A 40 VAL HGy% 1.0 . 3.71 4 3 A 38 GLY H A 37 GLY HAx 1.0 . 3.30 5 3 A 37 GLY HAy A 38 GLY H 1.0 . 3.30 6 4 A 30 ALA H A 29 GLY HAx 1.0 . 3.24 7 4 A 29 GLY HAy A 30 ALA H 1.0 . 3.24 8 5 A 34 LEU H A 33 GLY HAx 1.0 . 3.39 9 5 A 33 GLY HAy A 34 LEU H 1.0 . 3.39 10 6 A 2 ALA H A 2 ALA HB% 1.0 . 3.02 11 7 A 30 ALA H A 30 ALA HB% 1.0 . 3.26 12 8 A 30 ALA HA A 31 ILE H 1.0 . 3.07 13 9 A 31 ILE H A 31 ILE HD1% 1.0 . 3.79 14 10 A 31 ILE H A 31 ILE HG21 1.0 . 3.67 15 11 A 31 ILE H A 31 ILE HG1y 1.0 . 3.58 16 11 A 31 ILE H A 31 ILE HG1x 1.0 . 3.58 17 12 A 31 ILE H A 31 ILE HB 1.0 . 3.76 18 13 A 30 ALA HB% A 31 ILE H 1.0 . 3.75 19 14 A 12 VAL HA A 13 HIS H 1.0 . 3.55 20 15 A 35 MET HA A 36 VAL H 1.0 . 3.13 21 16 A 38 GLY H A 38 GLY HAy 1.0 . 2.94 22 17 A 19 PHE H A 16 LYS HEx 1.0 . 4.15 23 17 A 16 LYS HEy A 19 PHE H 1.0 . 4.15 24 18 A 19 PHE H A 19 PHE HBx 1.0 . 3.70 25 19 A 20 PHE H A 20 PHE HBx 1.0 . 3.98 26 20 A 18 VAL H A 18 VAL HGx% 1.0 . 3.05 27 21 A 5 ARG H A 5 ARG HGx 1.0 . 4.24 28 22 A 5 ARG H A 5 ARG HGy 1.0 . 4.24 29 23 A 5 ARG H A 4 PHE HBx 1.0 . 3.95 30 23 A 5 ARG H A 4 PHE HBy 1.0 . 3.95 31 24 A 4 PHE H A 4 PHE HBx 1.0 . 3.08 32 24 A 4 PHE HBy A 4 PHE H 1.0 . 3.08 33 25 A 4 PHE H A 3 GLU HA 1.0 . 2.95 34 26 A 3 GLU H A 3 GLU HGy 1.0 . 4.76 35 27 A 3 GLU H A 3 GLU HGx 1.0 . 4.76 36 28 A 3 GLU H A 3 GLU HBy 1.0 . 3.80 37 29 A 3 GLU H A 3 GLU HBx 1.0 . 3.80 38 30 A 32 ILE HB A 33 GLY H 1.0 . 4.02 39 31 A 4 PHE H A 3 GLU HGx 1.0 . 5.44 40 32 A 4 PHE H A 3 GLU HGy 1.0 . 5.44 41 33 A 23 ASP HA A 24 VAL H 1.0 . 3.05 42 34 A 23 ASP H A 23 ASP HBy 1.0 . 3.84 43 35 A 8 SER H A 7 ASP HBx 1.0 . 3.49 44 35 A 7 ASP HBy A 8 SER H 1.0 . 3.49 45 36 A 23 ASP H A 23 ASP HBx 1.0 . 3.84 46 37 A 24 VAL H A 23 ASP HBx 1.0 . 4.58 47 38 A 24 VAL H A 23 ASP HBy 1.0 . 4.58 48 39 A 24 VAL H A 24 VAL HB 1.0 . 3.66 49 40 A 24 VAL H A 24 VAL HGx% 1.0 . 2.76 50 40 A 24 VAL H A 24 VAL HGy% 1.0 . 2.76 51 41 A 31 ILE H A 29 GLY HAx 1.0 . 4.75 52 41 A 29 GLY HAy A 31 ILE H 1.0 . 4.75 53 42 A 26 SER HA A 25 GLY HAx 1.0 . 4.59 54 42 A 25 GLY HAy A 26 SER HA 1.0 . 4.59 55 43 A 18 VAL HA A 19 PHE HA 1.0 . 4.94 56 44 A 23 ASP HA A 22 GLU HA 1.0 . 4.75 57 45 A 18 VAL HA A 17 LEU HA 1.0 . 4.97 58 46 A 28 LYS HA A 29 GLY HAx 1.0 . 4.26 59 46 A 29 GLY HAy A 28 LYS HA 1.0 . 4.26 60 47 A 32 ILE HA A 33 GLY HAx 1.0 . 4.42 61 47 A 33 GLY HAy A 32 ILE HA 1.0 . 4.42 62 48 A 12 VAL HA A 13 HIS HA 1.0 . 4.87 63 49 A 24 VAL HA A 25 GLY HAx 1.0 . 4.63 64 49 A 25 GLY HAy A 24 VAL HA 1.0 . 4.63 65 50 A 36 VAL HA A 37 GLY HAx 1.0 . 4.85 66 50 A 37 GLY HAy A 36 VAL HA 1.0 . 4.85 67 51 A 30 ALA HA A 29 GLY HAx 1.0 . 4.63 68 51 A 29 GLY HAy A 30 ALA HA 1.0 . 4.63 69 52 A 34 LEU HA A 33 GLY HAx 1.0 . 4.96 70 52 A 33 GLY HAy A 34 LEU HA 1.0 . 4.96 71 53 A 4 PHE HA A 5 ARG HA 1.0 . 5.15 72 54 A 14 HIS HA A 15 GLN HA 1.0 . 5.50 73 55 A 30 ALA H A 31 ILE H 1.0 . 4.04 74 56 A 40 VAL H A 39 VAL H 1.0 . 3.88 75 57 A 38 GLY H A 39 VAL H 1.0 . 4.55 76 58 A 11 GLU H A 12 VAL H 1.0 . 4.10 77 59 A 24 VAL H A 23 ASP H 1.0 . 3.88 78 60 A 23 ASP H A 22 GLU H 1.0 . 4.21 79 61 A 28 LYS H A 29 GLY H 1.0 . 4.23 80 62 A 24 VAL H A 25 GLY H 1.0 . 3.94 81 63 A 22 GLU H A 21 ALA H 1.0 . 4.11 82 64 A 31 ILE H A 32 ILE H 1.0 . 4.22 83 65 A 18 VAL H A 20 PHE H 1.0 . 4.61 84 66 A 38 GLY H A 37 GLY H 1.0 . 4.85 85 67 A 36 VAL HA A 37 GLY H 1.0 . 3.44 86 68 A 24 VAL HA A 25 GLY H 1.0 . 3.53 87 69 A 8 SER HA A 10 TYR H 1.0 . 5.50 88 70 A 26 SER H A 25 GLY HAx 1.0 . 3.55 89 70 A 25 GLY HAy A 26 SER H 1.0 . 3.55 90 71 A 11 GLU H A 10 TYR HA 1.0 . 3.21 91 72 A 23 ASP HA A 25 GLY H 1.0 . 4.59 92 73 A 28 LYS H A 28 LYS HGx 1.0 . 4.42 93 73 A 28 LYS H A 28 LYS HGy 1.0 . 4.42 94 74 A 28 LYS H A 27 ASN HBx 1.0 . 4.98 95 75 A 28 LYS H A 27 ASN HBy 1.0 . 4.98 96 76 A 22 GLU H A 22 GLU HGx 1.0 . 4.07 97 76 A 22 GLU H A 22 GLU HGy 1.0 . 4.07 98 77 A 22 GLU H A 22 GLU HBy 1.0 . 3.38 99 78 A 11 GLU H A 11 GLU HBy 1.0 . 3.65 100 79 A 22 GLU H A 22 GLU HBx 1.0 . 3.76 101 80 A 23 ASP H A 22 GLU HGx 1.0 . 4.79 102 80 A 23 ASP H A 22 GLU HGy 1.0 . 4.79 103 81 A 15 GLN H A 15 GLN HBy 1.0 . 3.82 104 82 A 23 ASP H A 22 GLU HBy 1.0 . 4.26 105 83 A 23 ASP H A 22 GLU HBx 1.0 . 4.47 106 84 A 25 GLY H A 24 VAL HGx% 1.0 . 3.49 107 84 A 24 VAL HGy% A 25 GLY H 1.0 . 3.49 108 85 A 37 GLY H A 36 VAL HGx% 1.0 . 3.80 109 85 A 37 GLY H A 36 VAL HGy% 1.0 . 3.80 110 86 A 36 VAL H A 36 VAL HGx% 1.0 . 3.08 111 86 A 36 VAL H A 36 VAL HGy% 1.0 . 3.08 112 87 A 36 VAL H A 35 MET HBy 1.0 . 4.48 113 88 A 37 GLY H A 36 VAL HB 1.0 . 4.22 114 89 A 33 GLY H A 32 ILE H 1.0 . 4.26 115 90 A 36 VAL H A 35 MET H 1.0 . 4.44 116 91 A 16 LYS H A 17 LEU H 1.0 . 4.64 117 92 A 34 LEU H A 35 MET H 1.0 . 4.31 118 93 A 10 TYR H A 9 GLY H 1.0 . 4.71 119 94 A 23 ASP H A 21 ALA H 1.0 . 5.17 120 95 A 19 PHE H A 19 PHE HBy 1.0 . 3.87 121 96 A 20 PHE H A 20 PHE HBy 1.0 . 3.73 122 97 A 13 HIS H A 13 HIS HBy 1.0 . 3.80 123 98 A 7 ASP H A 6 HIS HBx 1.0 . 4.72 124 99 A 11 GLU H A 10 TYR HBy 1.0 . 3.89 125 100 A 11 GLU H A 10 TYR HBx 1.0 . 4.04 126 101 A 10 TYR H A 10 TYR HBy 1.0 . 3.48 127 102 A 10 TYR H A 10 TYR HBx 1.0 . 3.43 128 103 A 15 GLN H A 15 GLN HBx 1.0 . 3.82 129 104 A 35 MET H A 35 MET HGx 1.0 . 4.22 130 105 A 35 MET H A 35 MET HGy 1.0 . 4.22 131 106 A 36 VAL H A 35 MET HGy 1.0 . 5.10 132 107 A 36 VAL H A 35 MET HGx 1.0 . 5.10 133 108 A 39 VAL H A 36 VAL HB 1.0 . 4.35 134 109 A 39 VAL H A 39 VAL HGx% 1.0 . 3.37 135 109 A 39 VAL H A 39 VAL HGy% 1.0 . 3.37 136 110 A 40 VAL H A 39 VAL HB 1.0 . 4.35 137 111 A 12 VAL H A 11 GLU HBx 1.0 . 4.19 138 112 A 12 VAL H A 11 GLU HGx 1.0 . 4.37 139 113 A 12 VAL H A 11 GLU HGy 1.0 . 4.37 140 114 A 11 GLU H A 11 GLU HGx 1.0 . 4.03 141 115 A 11 GLU H A 11 GLU HGy 1.0 . 4.03 142 116 A 11 GLU H A 11 GLU HBx 1.0 . 3.60 143 117 A 12 VAL H A 12 VAL HB 1.0 . 3.15 144 118 A 12 VAL H A 12 VAL HGx% 1.0 . 3.12 145 119 A 11 GLU H A 12 VAL HGx% 1.0 . 4.58 146 120 A 38 GLY HAx A 39 VAL HA 1.0 . 5.41 147 121 A 19 PHE H A 18 VAL HGx% 1.0 . 3.43 148 122 A 17 LEU H A 17 LEU HBx 1.0 . 3.77 149 123 A 17 LEU H A 17 LEU HBy 1.0 . 3.77 150 124 A 18 VAL H A 17 LEU HBy 1.0 . 4.54 151 125 A 18 VAL H A 17 LEU HBx 1.0 . 4.54 152 126 A 18 VAL H A 17 LEU HG 1.0 . 4.48 153 127 A 24 VAL HB A 25 GLY H 1.0 . 4.10 154 128 A 34 LEU H A 34 LEU HBx 1.0 . 2.99 155 128 A 34 LEU H A 34 LEU HBy 1.0 . 2.99 156 129 A 15 GLN H A 12 VAL HGx% 1.0 . 4.12 157 130 A 35 MET H A 34 LEU HBx 1.0 . 3.69 158 130 A 35 MET H A 34 LEU HBy 1.0 . 3.69 159 131 A 21 ALA H A 21 ALA HB% 1.0 . 2.87 160 132 A 22 GLU H A 21 ALA HB% 1.0 . 3.08 161 133 A 2 ALA HB% A 3 GLU H 1.0 . 3.62 162 134 A 15 GLN HA A 17 LEU H 1.0 . 3.94 163 135 A 30 ALA HA A 32 ILE H 1.0 . 4.40 164 136 A 18 VAL H A 15 GLN HA 1.0 . 4.93 165 137 A 18 VAL H A 16 LYS HA 1.0 . 5.16 166 138 A 3 GLU H A 2 ALA HA 1.0 . 3.27 167 139 A 7 ASP H A 7 ASP HBx 1.0 . 3.98 168 139 A 7 ASP HBy A 7 ASP H 1.0 . 3.98 169 140 A 7 ASP H A 6 HIS HBy 1.0 . 4.72 170 141 A 27 ASN HD2y A 27 ASN HBx 1.0 . 4.01 171 142 A 27 ASN HD2y A 27 ASN HBy 1.0 . 4.01 172 143 A 27 ASN HD2x A 27 ASN HBx 1.0 . 4.01 173 144 A 27 ASN HD2x A 27 ASN HBy 1.0 . 4.01 174 145 A 40 VAL H A 39 VAL HGx% 1.0 . 3.58 175 145 A 40 VAL H A 39 VAL HGy% 1.0 . 3.58 176 146 A 27 ASN HD2y A 36 VAL HGx% 1.0 . 4.86 177 146 A 36 VAL HGy% A 27 ASN HD2y 1.0 . 4.86 178 147 A 30 ALA HB% A 27 ASN HD2y 1.0 . 4.60 179 148 A 21 ALA HB% A 4 PHE HD% 1.0 . 3.91 180 149 A 21 ALA HB% A 20 PHE HD% 1.0 . 4.31 181 150 A 6 HIS HA A 6 HIS HD2 1.0 . 4.41 182 151 A 6 HIS HD2 A 7 ASP HBx 1.0 . 4.69 183 151 A 7 ASP HBy A 6 HIS HD2 1.0 . 4.69 184 152 A 10 TYR HA A 10 TYR HD% 1.0 . 3.45 185 153 A 10 TYR HA A 10 TYR HE% 1.0 . 4.38 186 154 A 12 VAL HA A 10 TYR HD% 1.0 . 4.67 187 155 A 12 VAL HA A 10 TYR HE% 1.0 . 4.79 188 156 A 11 GLU HBx A 10 TYR HD% 1.0 . 5.42 189 157 A 12 VAL HB A 10 TYR HD% 1.0 . 4.57 190 158 A 10 TYR HD% A 11 GLU HGx 1.0 . 4.84 191 159 A 10 TYR HD% A 11 GLU HGy 1.0 . 4.84 192 160 A 12 VAL HGx% A 10 TYR HD% 1.0 . 4.13 193 161 A 10 TYR HD% A 12 VAL HGy% 1.0 . 4.62 194 162 A 10 TYR HE% A 12 VAL HGy% 1.0 . 5.24 195 163 A 12 VAL HGx% A 10 TYR HE% 1.0 . 4.76 196 164 A 4 PHE HA A 4 PHE HD% 1.0 . 4.10 197 165 A 20 PHE HD% A 20 PHE HA 1.0 . 4.50 198 166 A 20 PHE HD% A 21 ALA HA 1.0 . 4.31 199 167 A 19 PHE HA A 19 PHE HD% 1.0 . 3.98 200 168 A 20 PHE HA A 19 PHE HD% 1.0 . 4.32 201 169 A 38 GLY HAy A 19 PHE HD% 1.0 . 4.07 202 170 A 21 ALA HB% A 4 PHE HE% 1.0 . 3.70 203 171 A 18 VAL HGx% A 4 PHE HE% 1.0 . 4.74 204 172 A 18 VAL HGx% A 19 PHE HD% 1.0 . 4.94 205 173 A 4 PHE HE% A 18 VAL HGy% 1.0 . 4.00 206 174 A 4 PHE HE% A 24 VAL HGx% 1.0 . 4.03 207 174 A 24 VAL HGy% A 4 PHE HE% 1.0 . 4.03 208 175 A 16 LYS H A 16 LYS HGx 1.0 . 5.00 209 176 A 23 ASP H A 21 ALA HB% 1.0 . 5.50 210 177 A 30 ALA HB% A 29 GLY H 1.0 . 5.50 211 178 A 16 LYS H A 16 LYS HBy 1.0 . 4.18 212 179 A 17 LEU H A 16 LYS HBy 1.0 . 4.28 213 180 A 32 ILE HB A 32 ILE H 1.0 . 3.13 214 181 A 32 ILE H A 31 ILE HG1y 1.0 . 3.63 215 181 A 31 ILE HG1x A 32 ILE H 1.0 . 3.63 216 182 A 18 VAL H A 17 LEU H 1.0 . 3.81 217 183 A 18 VAL H A 19 PHE H 1.0 . 4.12 218 184 A 11 GLU H A 10 TYR H 1.0 . 4.72 219 185 A 30 ALA H A 29 GLY H 1.0 . 4.62 220 186 A 26 SER H A 27 ASN H 1.0 . 5.34 221 187 A 31 ILE H A 33 GLY H 1.0 . 5.50 222 188 A 4 PHE H A 3 GLU H 1.0 . 4.74 223 189 A 15 GLN H A 15 GLN HGx 1.0 . 4.37 224 189 A 15 GLN H A 15 GLN HGy 1.0 . 4.37 225 190 A 16 LYS H A 15 GLN HGx 1.0 . 4.84 226 190 A 16 LYS H A 15 GLN HGy 1.0 . 4.84 227 191 A 32 ILE H A 32 ILE HG1x 1.0 . 3.66 228 191 A 32 ILE H A 32 ILE HG1y 1.0 . 3.66 229 192 A 33 GLY H A 31 ILE HG1y 1.0 . 4.58 230 192 A 31 ILE HG1x A 33 GLY H 1.0 . 4.58 231 193 A 33 GLY H A 32 ILE HG1x 1.0 . 4.99 232 193 A 33 GLY H A 32 ILE HG1y 1.0 . 4.99 233 194 A 4 PHE H A 24 VAL HGx% 1.0 . 5.30 234 194 A 4 PHE H A 24 VAL HGy% 1.0 . 5.30 235 195 A 13 HIS H A 12 VAL HGx% 1.0 . 4.38 236 196 A 13 HIS H A 12 VAL HGy% 1.0 . 4.27 237 197 A 19 PHE H A 18 VAL HGy% 1.0 . 4.75 238 198 A 21 ALA H A 18 VAL HGy% 1.0 . 5.00 239 199 A 18 VAL H A 17 LEU HDy% 1.0 . 4.03 240 200 A 17 LEU H A 15 GLN HGx 1.0 . 4.62 241 200 A 17 LEU H A 15 GLN HGy 1.0 . 4.62 242 201 A 36 VAL H A 35 MET HBx 1.0 . 4.48 243 202 A 2 ALA HB% A 4 PHE H 1.0 . 5.50 244 203 A 4 PHE H A 21 ALA HB% 1.0 . 5.50 245 204 A 23 ASP H A 24 VAL HGx% 1.0 . 3.99 246 204 A 23 ASP H A 24 VAL HGy% 1.0 . 3.99 247 205 A 23 ASP H A 24 VAL HA 1.0 . 4.91 248 206 A 31 ILE HA A 31 ILE HG1y 1.0 . 4.05 249 206 A 31 ILE HG1x A 31 ILE HA 1.0 . 4.05 250 207 A 32 ILE HA A 31 ILE HG1y 1.0 . 4.39 251 207 A 31 ILE HG1x A 32 ILE HA 1.0 . 4.39 252 208 A 15 GLN HA A 17 LEU HBy 1.0 . 5.50 253 209 A 22 GLU HA A 22 GLU HGx 1.0 . 3.94 254 209 A 22 GLU HA A 22 GLU HGy 1.0 . 3.94 255 210 A 2 ALA HB% A 3 GLU HA 1.0 . 4.70 256 211 A 30 ALA HB% A 31 ILE HA 1.0 . 5.06 257 212 A 31 ILE HG21 A 31 ILE HA 1.0 . 3.85 258 213 A 32 ILE HA A 32 ILE HD1% 1.0 . 3.98 259 214 A 12 VAL HA A 12 VAL HGy% 1.0 . 3.21 260 215 A 12 VAL HA A 12 VAL HGx% 1.0 . 3.28 261 216 A 38 GLY HAx A 36 VAL HGx% 1.0 . 3.79 262 216 A 36 VAL HGy% A 38 GLY HAx 1.0 . 3.79 263 217 A 29 GLY HAy A 28 LYS HBy 1.0 . 4.58 264 217 A 28 LYS HBy A 29 GLY HAx 1.0 . 4.58 265 218 A 32 ILE HB A 33 GLY HAx 1.0 . 4.75 266 218 A 33 GLY HAy A 32 ILE HB 1.0 . 4.75 267 219 A 28 LYS HGy A 29 GLY HAx 1.0 . 5.22 268 219 A 28 LYS HGx A 29 GLY HAx 1.0 . 5.22 269 219 A 29 GLY HAy A 28 LYS HGx 1.0 . 5.22 270 219 A 29 GLY HAy A 28 LYS HGy 1.0 . 5.22 271 220 A 29 GLY HAy A 31 ILE HG1y 1.0 . 5.39 272 220 A 29 GLY HAx A 31 ILE HG1y 1.0 . 5.39 273 220 A 31 ILE HG1x A 29 GLY HAx 1.0 . 5.39 274 220 A 29 GLY HAy A 31 ILE HG1x 1.0 . 5.39 275 221 A 29 GLY HAy A 28 LYS HBx 1.0 . 4.58 276 221 A 28 LYS HBx A 29 GLY HAx 1.0 . 4.58 277 222 A 18 VAL HGx% A 18 VAL HA 1.0 . 3.26 278 223 A 18 VAL HA A 17 LEU HG 1.0 . 5.00 279 224 A 12 VAL HA A 10 TYR HBx 1.0 . 5.22 280 225 A 19 PHE HBy A 38 GLY HAx 1.0 . 5.50 281 226 A 31 ILE HG21 A 29 GLY HAx 1.0 . 4.55 282 226 A 29 GLY HAy A 31 ILE HG21 1.0 . 4.55 283 227 A 13 HIS HBy A 12 VAL HGy% 1.0 . 4.81 284 228 A 20 PHE HBy A 17 LEU HG 1.0 . 4.87 285 229 A 22 GLU HBy A 21 ALA HB% 1.0 . 5.50 286 230 A 33 GLY HAy A 34 LEU HBx 1.0 . 4.00 287 230 A 34 LEU HBy A 33 GLY HAx 1.0 . 4.00 288 230 A 33 GLY HAy A 34 LEU HBy 1.0 . 4.00 289 230 A 33 GLY HAx A 34 LEU HBx 1.0 . 4.00 290 231 A 15 GLN HE2y A 15 GLN HGx 1.0 . 3.61 291 231 A 15 GLN HGy A 15 GLN HE2y 1.0 . 3.61 292 232 A 15 GLN HE2x A 15 GLN HGx 1.0 . 3.61 293 232 A 15 GLN HGy A 15 GLN HE2x 1.0 . 3.61 294 233 A 39 VAL HA A 39 VAL HGx% 1.0 . 3.29 295 233 A 39 VAL HGy% A 39 VAL HA 1.0 . 3.29 296 234 A 40 VAL HA A 40 VAL HGx% 1.0 . 3.75 297 234 A 40 VAL HGy% A 40 VAL HA 1.0 . 3.75 298 235 A 24 VAL HGx% A 25 GLY HAx 1.0 . 3.76 299 235 A 24 VAL HGy% A 25 GLY HAx 1.0 . 3.76 300 235 A 25 GLY HAy A 24 VAL HGx% 1.0 . 3.76 301 235 A 24 VAL HGy% A 25 GLY HAy 1.0 . 3.76 302 236 A 36 VAL HGy% A 37 GLY HAx 1.0 . 4.97 303 236 A 36 VAL HGx% A 37 GLY HAx 1.0 . 4.97 304 236 A 37 GLY HAy A 36 VAL HGx% 1.0 . 4.97 305 236 A 37 GLY HAy A 36 VAL HGy% 1.0 . 4.97 306 237 A 5 ARG HBy A 5 ARG HDx 1.0 . 3.23 307 237 A 5 ARG HBx A 5 ARG HDx 1.0 . 3.23 308 237 A 5 ARG HDy A 5 ARG HBx 1.0 . 3.23 309 237 A 5 ARG HBy A 5 ARG HDy 1.0 . 3.23 310 238 A 30 ALA HB% A 29 GLY HAx 1.0 . 4.15 311 238 A 29 GLY HAy A 30 ALA HB% 1.0 . 4.15 312 239 A 14 HIS HA A 12 VAL HGy% 1.0 . 4.39 313 240 A 19 PHE HA A 18 VAL HGy% 1.0 . 4.69 314 241 A 18 VAL HGx% A 19 PHE HA 1.0 . 4.30 315 242 A 35 MET HA A 36 VAL HGx% 1.0 . 4.01 316 242 A 35 MET HA A 36 VAL HGy% 1.0 . 4.01 317 243 A 19 PHE HBx A 18 VAL HGy% 1.0 . 5.27 318 244 A 10 TYR HBx A 12 VAL HGy% 1.0 . 4.44 319 245 A 10 TYR HBx A 12 VAL HGx% 1.0 . 4.23 320 246 A 18 VAL HGy% A 20 PHE HE% 1.0 . 4.00 321 247 A 20 PHE HD% A 18 VAL HGy% 1.0 . 4.52 322 248 A 18 VAL HB A 20 PHE HE% 1.0 . 4.57 323 249 A 38 GLY HAy A 19 PHE HBy 1.0 . 4.50 324 250 A 20 PHE HBx A 18 VAL HA 1.0 . 4.97 325 251 A 38 GLY HAy A 19 PHE HBx 1.0 . 5.46 326 252 A 18 VAL HA A 18 VAL HGy% 1.0 . 3.17 327 253 A 13 HIS H A 13 HIS HD1 1.0 . 5.49 328 254 A 10 TYR HD% A 11 GLU HA 1.0 . 4.98 329 255 A 23 ASP HA A 24 VAL HGx% 1.0 . 4.36 330 255 A 23 ASP HA A 24 VAL HGy% 1.0 . 4.36 331 256 A 24 VAL HA A 24 VAL HGx% 1.0 . 2.88 332 256 A 24 VAL HGy% A 24 VAL HA 1.0 . 2.88 333 257 A 36 VAL HA A 36 VAL HGx% 1.0 . 3.05 334 257 A 36 VAL HA A 36 VAL HGy% 1.0 . 3.05 335 258 A 24 VAL HB A 25 GLY HAx 1.0 . 4.68 336 258 A 24 VAL HB A 25 GLY HAy 1.0 . 4.68 337 259 A 7 ASP H A 6 HIS HD2 1.0 . 4.48 338 260 A 11 GLU H A 10 TYR HD% 1.0 . 4.83 339 261 A 17 LEU HDx% A 19 PHE HE% 1.0 . 4.13 340 262 A 21 ALA HB% A 20 PHE HE% 1.0 . 3.80 341 263 A 17 LEU HG A 19 PHE HE% 1.0 . 4.46 342 264 A 18 VAL HA A 20 PHE HE% 1.0 . 4.70 343 265 A 20 PHE HA A 19 PHE HE% 1.0 . 4.50 344 266 A 20 PHE HBx A 19 PHE HE% 1.0 . 3.97 345 267 A 38 GLY H A 36 VAL HGx% 1.0 . 3.39 346 267 A 38 GLY H A 36 VAL HGy% 1.0 . 3.39 347 268 A 13 HIS HBy A 14 HIS H 1.0 . 4.61 348 269 A 14 HIS H A 14 HIS HBx 1.0 . 3.88 349 270 A 13 HIS HA A 13 HIS HD2 1.0 . 4.45 350 271 A 10 TYR H A 10 TYR HD% 1.0 . 4.50 351 272 A 19 PHE H A 19 PHE HD% 1.0 . 3.96 352 273 A 4 PHE H A 4 PHE HE% 1.0 . 4.22 353 274 A 5 ARG H A 4 PHE HE% 1.0 . 5.50 354 275 A 24 VAL H A 4 PHE HE% 1.0 . 5.50 355 276 A 5 ARG H A 4 PHE HD% 1.0 . 4.94 356 277 A 20 PHE H A 20 PHE HD% 1.0 . 4.27 357 278 A 21 ALA H A 20 PHE HD% 1.0 . 4.49 358 279 A 20 PHE H A 19 PHE HE% 1.0 . 5.28 359 280 A 21 ALA H A 20 PHE HE% 1.0 . 4.79 360 281 A 22 GLU H A 20 PHE HD% 1.0 . 4.89 361 282 A 24 VAL H A 22 GLU HA 1.0 . 4.83 362 283 A 13 HIS H A 11 GLU HBx 1.0 . 5.50 363 284 A 24 VAL H A 22 GLU HBy 1.0 . 5.50 364 285 A 30 ALA H A 31 ILE HG1y 1.0 . 4.56 365 285 A 30 ALA H A 31 ILE HG1x 1.0 . 4.56 366 286 A 30 ALA H A 31 ILE HG21 1.0 . 4.76 367 287 A 12 VAL HGy% A 14 HIS H 1.0 . 4.05 368 288 A 12 VAL HGx% A 14 HIS H 1.0 . 4.13 369 289 A 30 ALA HB% A 27 ASN HD2x 1.0 . 4.60 370 290 A 20 PHE HD% A 17 LEU HDy% 1.0 . 4.04 371 291 A 3 GLU HA A 4 PHE HD% 1.0 . 4.60 372 292 A 22 GLU HA A 4 PHE HD% 1.0 . 5.20 373 293 A 27 ASN HD2x A 36 VAL HGx% 1.0 . 4.86 374 293 A 36 VAL HGy% A 27 ASN HD2x 1.0 . 4.86 375 294 A 17 LEU HG A 20 PHE HD% 1.0 . 4.65 376 295 A 20 PHE HD% A 17 LEU HDx% 1.0 . 4.96 377 296 A 18 VAL HGx% A 20 PHE HD% 1.0 . 5.28 378 297 A 19 PHE HD% A 17 LEU HDy% 1.0 . 4.89 379 298 A 19 PHE HD% A 39 VAL HGx% 1.0 . 5.32 380 298 A 39 VAL HGy% A 19 PHE HD% 1.0 . 5.32 381 299 A 17 LEU HDy% A 20 PHE HE% 1.0 . 3.84 382 300 A 12 VAL HB A 14 HIS H 1.0 . 4.85 383 301 A 14 HIS H A 15 GLN HGx 1.0 . 4.91 384 301 A 15 GLN HGy A 14 HIS H 1.0 . 4.91 385 302 A 15 GLN HA A 17 LEU HDy% 1.0 . 4.76 386 303 A 3 GLU HA A 4 PHE HBx 1.0 . 4.78 387 303 A 4 PHE HBy A 3 GLU HA 1.0 . 4.78 388 304 A 10 TYR HBy A 9 GLY HAy 1.0 . 5.50 389 305 A 10 TYR HBy A 9 GLY HAx 1.0 . 5.50 390 306 A 10 TYR HBy A 12 VAL HB 1.0 . 5.50 391 307 A 10 TYR HBy A 12 VAL HGx% 1.0 . 4.37 392 308 A 24 VAL HGy% A 23 ASP HBy 1.0 . 4.99 393 308 A 23 ASP HBy A 24 VAL HGx% 1.0 . 4.99 394 309 A 24 VAL HGy% A 23 ASP HBx 1.0 . 4.99 395 309 A 23 ASP HBx A 24 VAL HGx% 1.0 . 4.99 396 310 A 22 GLU HGx A 24 VAL HGx% 1.0 . 4.71 397 310 A 22 GLU HGy A 24 VAL HGx% 1.0 . 4.71 398 310 A 24 VAL HGy% A 22 GLU HGx 1.0 . 4.71 399 310 A 24 VAL HGy% A 22 GLU HGy 1.0 . 4.71 400 311 A 12 VAL HGx% A 15 GLN HGx 1.0 . 4.41 401 311 A 12 VAL HGx% A 15 GLN HGy 1.0 . 4.41 402 312 A 18 VAL HGx% A 15 GLN HGx 1.0 . 4.73 403 312 A 18 VAL HGx% A 15 GLN HGy 1.0 . 4.73 404 313 A 17 LEU HDy% A 15 GLN HGx 1.0 . 5.50 405 313 A 15 GLN HGy A 17 LEU HDy% 1.0 . 5.50 406 314 A 12 VAL HGy% A 15 GLN HGx 1.0 . 4.87 407 314 A 12 VAL HGy% A 15 GLN HGy 1.0 . 4.87 408 315 A 16 LYS HEx A 16 LYS HGx 1.0 . 3.71 409 315 A 16 LYS HEy A 16 LYS HGx 1.0 . 3.71 410 316 A 16 LYS HEy A 16 LYS HGy 1.0 . 3.71 411 316 A 16 LYS HGy A 16 LYS HEx 1.0 . 3.71 412 317 A 5 ARG HA A 5 ARG HDx 1.0 . 3.97 413 317 A 5 ARG HA A 5 ARG HDy 1.0 . 3.97 414 318 A 5 ARG HA A 4 PHE HBx 1.0 . 4.83 415 318 A 4 PHE HBy A 5 ARG HA 1.0 . 4.83 416 319 A 19 PHE H A 17 LEU HA 1.0 . 4.85 417 320 A 20 PHE H A 17 LEU HA 1.0 . 5.49 418 321 A 20 PHE H A 18 VAL HA 1.0 . 5.45 419 322 A 18 VAL HA A 21 ALA H 1.0 . 5.50 420 323 A 7 ASP HA A 7 ASP HBx 1.0 . 3.00 421 323 A 7 ASP HBy A 7 ASP HA 1.0 . 3.00 422 324 A 15 GLN HA A 15 GLN HGx 1.0 . 3.70 423 324 A 15 GLN HA A 15 GLN HGy 1.0 . 3.70 424 325 A 16 LYS HA A 15 GLN HGx 1.0 . 3.95 425 325 A 16 LYS HA A 15 GLN HGy 1.0 . 3.95 426 326 A 3 GLU HA A 3 GLU HGy 1.0 . 4.06 427 327 A 36 VAL HB A 38 GLY HAx 1.0 . 4.42 428 328 A 36 VAL HB A 37 GLY HAx 1.0 . 4.77 429 328 A 37 GLY HAy A 36 VAL HB 1.0 . 4.77 430 329 A 39 VAL HB A 40 VAL HA 1.0 . 4.87 431 330 A 18 VAL HA A 21 ALA HB% 1.0 . 4.50 432 331 A 19 PHE HBx A 18 VAL HGx% 1.0 . 4.43 433 332 A 20 PHE HBx A 17 LEU HDx% 1.0 . 5.09 434 333 A 18 VAL HGx% A 16 LYS HEx 1.0 . 4.06 435 333 A 16 LYS HEy A 18 VAL HGx% 1.0 . 4.06 436 334 A 21 ALA HB% A 18 VAL HGy% 1.0 . 3.88 437 335 A 21 ALA HB% A 24 VAL HGx% 1.0 . 3.79 438 335 A 24 VAL HGy% A 21 ALA HB% 1.0 . 3.79 439 336 A 30 ALA HB% A 36 VAL HGx% 1.0 . 4.26 440 336 A 30 ALA HB% A 36 VAL HGy% 1.0 . 4.26 441 337 A 3 GLU HA A 3 GLU HGx 1.0 . 4.06 442 338 A 30 ALA HA A 32 ILE HB 1.0 . 5.46 443 339 A 21 ALA HA A 20 PHE HE% 1.0 . 4.69 444 340 A 17 LEU HG A 19 PHE HD% 1.0 . 4.39 445 341 A 12 VAL HA A 13 HIS HBy 1.0 . 4.65 446 342 A 22 GLU HBx A 24 VAL HGx% 1.0 . 5.26 447 342 A 24 VAL HGy% A 22 GLU HBx 1.0 . 5.26 448 343 A 38 GLY HAx A 19 PHE HD% 1.0 . 4.96 449 344 A 38 GLY H A 36 VAL HB 1.0 . 4.57 450 345 A 17 LEU HA A 19 PHE HE% 1.0 . 4.58 451 346 A 17 LEU HA A 19 PHE HD% 1.0 . 4.85 452 347 A 30 ALA HB% A 27 ASN HBy 1.0 . 4.87 453 348 A 20 PHE HBx A 21 ALA HB% 1.0 . 5.50 454 349 A 21 ALA HB% A 22 GLU HGx 1.0 . 5.11 455 349 A 22 GLU HGy A 21 ALA HB% 1.0 . 5.11 456 350 A 30 ALA HB% A 27 ASN HBx 1.0 . 4.87 457 351 A 22 GLU HBx A 21 ALA HB% 1.0 . 4.14 458 352 A 31 ILE HG21 A 31 ILE HG1y 1.0 . 2.76 459 352 A 31 ILE HG21 A 31 ILE HG1x 1.0 . 2.76 460 353 A 31 ILE HG1x A 32 ILE HG1x 1.0 . 3.03 461 353 A 32 ILE HG1y A 31 ILE HG1y 1.0 . 3.03 462 353 A 31 ILE HG1x A 32 ILE HG1y 1.0 . 3.03 463 353 A 31 ILE HG1y A 32 ILE HG1x 1.0 . 3.03 464 354 A 18 VAL HGy% A 4 PHE HBx 1.0 . 4.91 465 354 A 4 PHE HBy A 18 VAL HGy% 1.0 . 4.91 466 355 A 21 ALA HA A 18 VAL HGy% 1.0 . 5.50 467 356 A 22 GLU HA A 18 VAL HGy% 1.0 . 5.50 468 357 A 18 VAL HGx% A 16 LYS HA 1.0 . 3.96 469 358 A 15 GLN HA A 12 VAL HGx% 1.0 . 4.29 470 359 A 34 LEU HA A 34 LEU HDy% 1.0 . 4.26 471 360 A 34 LEU HBx A 34 LEU HDy% 1.0 . 3.14 472 360 A 34 LEU HBy A 34 LEU HDy% 1.0 . 3.14 473 361 A 17 LEU HDy% A 17 LEU HBy 1.0 . 3.51 474 362 A 34 LEU HDx% A 34 LEU HBx 1.0 . 3.14 475 362 A 34 LEU HBy A 34 LEU HDx% 1.0 . 3.14 476 363 A 17 LEU HA A 17 LEU HDy% 1.0 . 4.05 477 364 A 34 LEU HA A 34 LEU HDx% 1.0 . 4.26 478 365 A 12 VAL HGx% A 11 GLU HA 1.0 . 4.55 479 366 A 17 LEU HA A 17 LEU HG 1.0 . 3.43 480 367 A 17 LEU HDy% A 17 LEU HBx 1.0 . 3.51 481 368 A 15 GLN HA A 17 LEU HBx 1.0 . 5.50 482 369 A 16 LYS H A 16 LYS HGy 1.0 . 5.00 483 370 A 29 GLY H A 28 LYS HGx 1.0 . 5.05 484 370 A 29 GLY H A 28 LYS HGy 1.0 . 5.05 485 371 A 16 LYS H A 16 LYS HDx 1.0 . 4.60 486 371 A 16 LYS H A 16 LYS HDy 1.0 . 4.60 487 372 A 16 LYS H A 16 LYS HBx 1.0 . 4.18 488 373 A 17 LEU H A 16 LYS HBx 1.0 . 4.28 489 374 A 17 LEU H A 16 LYS HDx 1.0 . 5.50 490 374 A 17 LEU H A 16 LYS HDy 1.0 . 5.50 491 375 A 19 PHE H A 16 LYS HDx 1.0 . 5.50 492 375 A 19 PHE H A 16 LYS HDy 1.0 . 5.50 493 376 A 16 LYS HA A 16 LYS HDx 1.0 . 4.12 494 376 A 16 LYS HA A 16 LYS HDy 1.0 . 4.12 495 377 A 18 VAL H A 16 LYS HDx 1.0 . 5.43 496 377 A 18 VAL H A 16 LYS HDy 1.0 . 5.43 497 378 A 18 VAL H A 16 LYS HEx 1.0 . 5.50 498 378 A 18 VAL H A 16 LYS HEy 1.0 . 5.50 499 379 A 13 HIS HA A 15 GLN H 1.0 . 4.99 500 380 A 10 TYR H A 11 GLU HA 1.0 . 5.50 501 381 A 13 HIS H A 11 GLU HA 1.0 . 5.50 502 382 A 4 PHE HD% A 24 VAL HGx% 1.0 . 4.17 503 382 A 24 VAL HGy% A 4 PHE HD% 1.0 . 4.17 504 383 A 4 PHE HD% A 18 VAL HGy% 1.0 . 4.11 505 384 A 22 GLU HBx A 4 PHE HD% 1.0 . 5.50 506 385 A 22 GLU HBx A 4 PHE HE% 1.0 . 4.33 507 386 A 17 LEU HG A 19 PHE HZ 1.0 . 5.50 508 387 A 14 HIS H A 14 HIS HBy 1.0 . 3.88 509 388 A 6 HIS HD2 A 7 ASP HA 1.0 . 4.78 510 389 A 15 GLN HA A 14 HIS H 1.0 . 5.27 511 390 A 11 GLU HA A 13 HIS HD2 1.0 . 4.80 512 391 A 11 GLU HBx A 13 HIS HD2 1.0 . 4.71 513 392 A 4 PHE HE% A 5 ARG HDx 1.0 . 5.50 514 392 A 4 PHE HE% A 5 ARG HDy 1.0 . 5.50 515 393 A 22 GLU HA A 4 PHE HE% 1.0 . 4.62 516 394 A 16 LYS HA A 19 PHE HD% 1.0 . 5.21 517 395 A 21 ALA HA A 4 PHE HE% 1.0 . 5.50 518 396 A 16 LYS HEy A 16 LYS HBx 1.0 . 4.63 519 396 A 16 LYS HBx A 16 LYS HEx 1.0 . 4.63 520 397 A 16 LYS HEy A 16 LYS HBy 1.0 . 4.63 521 397 A 16 LYS HBy A 16 LYS HEx 1.0 . 4.63 522 398 A 2 ALA HA A 3 GLU HBy 1.0 . 4.50 523 398 A 2 ALA HA A 3 GLU HBx 1.0 . 4.50 524 399 A 2 ALA HB% A 3 GLU HBy 1.0 . 4.62 525 399 A 2 ALA HB% A 3 GLU HBx 1.0 . 4.62 526 400 A 3 GLU H A 3 GLU HBy 1.0 . 3.31 527 400 A 3 GLU H A 3 GLU HBx 1.0 . 3.31 528 401 A 3 GLU H A 3 GLU HGy 1.0 . 4.14 529 401 A 3 GLU H A 3 GLU HGx 1.0 . 4.14 530 402 A 3 GLU HA A 3 GLU HGy 1.0 . 3.46 531 402 A 3 GLU HA A 3 GLU HGx 1.0 . 3.46 532 403 A 4 PHE H A 3 GLU HBy 1.0 . 3.68 533 403 A 4 PHE H A 3 GLU HBx 1.0 . 3.68 534 404 A 3 GLU HBy A 4 PHE HBx 1.0 . 5.34 535 404 A 3 GLU HBx A 4 PHE HBx 1.0 . 5.34 536 404 A 4 PHE HBy A 3 GLU HBy 1.0 . 5.34 537 404 A 4 PHE HBy A 3 GLU HBx 1.0 . 5.34 538 405 A 4 PHE HD% A 3 GLU HBy 1.0 . 5.34 539 405 A 4 PHE HD% A 3 GLU HBx 1.0 . 5.34 540 406 A 4 PHE H A 3 GLU HGy 1.0 . 4.68 541 406 A 4 PHE H A 3 GLU HGx 1.0 . 4.68 542 407 A 5 ARG H A 5 ARG HGy 1.0 . 3.53 543 407 A 5 ARG H A 5 ARG HGx 1.0 . 3.53 544 408 A 6 HIS HD2 A 6 HIS HBx 1.0 . 3.37 545 408 A 6 HIS HD2 A 6 HIS HBy 1.0 . 3.37 546 409 A 7 ASP H A 6 HIS HBx 1.0 . 4.12 547 409 A 7 ASP H A 6 HIS HBy 1.0 . 4.12 548 410 A 9 GLY H A 8 SER HBy 1.0 . 3.97 549 410 A 9 GLY H A 8 SER HBx 1.0 . 3.97 550 411 A 10 TYR HA A 9 GLY HAx 1.0 . 4.46 551 411 A 10 TYR HA A 9 GLY HAy 1.0 . 4.46 552 412 A 10 TYR HBy A 9 GLY HAx 1.0 . 4.76 553 412 A 10 TYR HBy A 9 GLY HAy 1.0 . 4.76 554 413 A 10 TYR HD% A 11 GLU HGy 1.0 . 4.26 555 413 A 10 TYR HD% A 11 GLU HGx 1.0 . 4.26 556 414 A 11 GLU HA A 11 GLU HGy 1.0 . 3.67 557 414 A 11 GLU HA A 11 GLU HGx 1.0 . 3.67 558 415 A 12 VAL HGx% A 11 GLU HGy 1.0 . 4.78 559 415 A 12 VAL HGx% A 11 GLU HGx 1.0 . 4.78 560 416 A 13 HIS H A 11 GLU HGy 1.0 . 5.34 561 416 A 13 HIS H A 11 GLU HGx 1.0 . 5.34 562 417 A 12 VAL HA A 14 HIS HBx 1.0 . 5.34 563 417 A 12 VAL HA A 14 HIS HBy 1.0 . 5.34 564 418 A 12 VAL HGx% A 15 GLN HE2y 1.0 . 4.71 565 418 A 12 VAL HGx% A 15 GLN HE2x 1.0 . 4.71 566 419 A 12 VAL HGy% A 14 HIS HBx 1.0 . 4.33 567 419 A 12 VAL HGy% A 14 HIS HBy 1.0 . 4.33 568 420 A 14 HIS H A 14 HIS HBx 1.0 . 3.37 569 420 A 14 HIS H A 14 HIS HBy 1.0 . 3.37 570 421 A 15 GLN HA A 14 HIS HBx 1.0 . 5.03 571 421 A 15 GLN HA A 14 HIS HBy 1.0 . 5.03 572 422 A 15 GLN HA A 17 LEU HBy 1.0 . 4.63 573 422 A 15 GLN HA A 17 LEU HBx 1.0 . 4.63 574 423 A 15 GLN HE2y A 15 GLN HBx 1.0 . 4.52 575 423 A 15 GLN HE2y A 15 GLN HBy 1.0 . 4.52 576 423 A 15 GLN HE2x A 15 GLN HBy 1.0 . 4.52 577 423 A 15 GLN HE2x A 15 GLN HBx 1.0 . 4.52 578 424 A 15 GLN HE2x A 15 GLN HGx 1.0 . 3.10 579 424 A 15 GLN HGy A 15 GLN HE2y 1.0 . 3.10 580 424 A 15 GLN HGy A 15 GLN HE2x 1.0 . 3.10 581 424 A 15 GLN HE2y A 15 GLN HGx 1.0 . 3.10 582 425 A 15 GLN HGy A 16 LYS HBx 1.0 . 4.56 583 425 A 15 GLN HGx A 16 LYS HBx 1.0 . 4.56 584 425 A 16 LYS HBy A 15 GLN HGx 1.0 . 4.56 585 425 A 15 GLN HGy A 16 LYS HBy 1.0 . 4.56 586 426 A 16 LYS H A 16 LYS HBx 1.0 . 3.58 587 426 A 16 LYS H A 16 LYS HBy 1.0 . 3.58 588 427 A 16 LYS H A 16 LYS HGx 1.0 . 4.31 589 427 A 16 LYS H A 16 LYS HGy 1.0 . 4.31 590 428 A 16 LYS HA A 16 LYS HGx 1.0 . 3.43 591 428 A 16 LYS HA A 16 LYS HGy 1.0 . 3.43 592 429 A 16 LYS HBx A 16 LYS HEx 1.0 . 4.02 593 429 A 16 LYS HBy A 16 LYS HEx 1.0 . 4.02 594 429 A 16 LYS HEy A 16 LYS HBx 1.0 . 4.02 595 429 A 16 LYS HEy A 16 LYS HBy 1.0 . 4.02 596 430 A 17 LEU H A 16 LYS HBx 1.0 . 3.62 597 430 A 17 LEU H A 16 LYS HBy 1.0 . 3.62 598 431 A 18 VAL H A 16 LYS HBx 1.0 . 5.00 599 431 A 18 VAL H A 16 LYS HBy 1.0 . 5.00 600 432 A 19 PHE HBx A 16 LYS HGx 1.0 . 5.34 601 432 A 19 PHE HBx A 16 LYS HGy 1.0 . 5.34 602 433 A 19 PHE HD% A 16 LYS HGx 1.0 . 5.14 603 433 A 19 PHE HD% A 16 LYS HGy 1.0 . 5.14 604 434 A 17 LEU H A 17 LEU HBy 1.0 . 3.20 605 434 A 17 LEU H A 17 LEU HBx 1.0 . 3.20 606 435 A 17 LEU HDx% A 17 LEU HBy 1.0 . 3.24 607 435 A 17 LEU HDx% A 17 LEU HBx 1.0 . 3.24 608 436 A 17 LEU HDy% A 17 LEU HBy 1.0 . 2.80 609 436 A 17 LEU HDy% A 17 LEU HBx 1.0 . 2.80 610 437 A 18 VAL H A 17 LEU HBy 1.0 . 3.78 611 437 A 18 VAL H A 17 LEU HBx 1.0 . 3.78 612 438 A 19 PHE H A 17 LEU HBy 1.0 . 5.26 613 438 A 19 PHE H A 17 LEU HBx 1.0 . 5.26 614 439 A 19 PHE HD% A 17 LEU HBy 1.0 . 4.61 615 439 A 19 PHE HD% A 17 LEU HBx 1.0 . 4.61 616 440 A 19 PHE HE% A 17 LEU HBy 1.0 . 5.11 617 440 A 19 PHE HE% A 17 LEU HBx 1.0 . 5.11 618 441 A 23 ASP H A 23 ASP HBx 1.0 . 3.20 619 441 A 23 ASP H A 23 ASP HBy 1.0 . 3.20 620 442 A 24 VAL H A 23 ASP HBx 1.0 . 3.92 621 442 A 24 VAL H A 23 ASP HBy 1.0 . 3.92 622 443 A 23 ASP HBx A 24 VAL HGx% 1.0 . 4.24 623 443 A 23 ASP HBy A 24 VAL HGx% 1.0 . 4.24 624 443 A 24 VAL HGy% A 23 ASP HBx 1.0 . 4.24 625 443 A 24 VAL HGy% A 23 ASP HBy 1.0 . 4.24 626 444 A 25 GLY H A 23 ASP HBx 1.0 . 5.34 627 444 A 25 GLY H A 23 ASP HBy 1.0 . 5.34 628 445 A 27 ASN HD2x A 27 ASN HA 1.0 . 4.72 629 445 A 27 ASN HD2y A 27 ASN HA 1.0 . 4.72 630 446 A 27 ASN HD2x A 27 ASN HBy 1.0 . 3.02 631 446 A 27 ASN HD2y A 27 ASN HBx 1.0 . 3.02 632 446 A 27 ASN HD2y A 27 ASN HBy 1.0 . 3.02 633 446 A 27 ASN HD2x A 27 ASN HBx 1.0 . 3.02 634 447 A 28 LYS H A 27 ASN HBx 1.0 . 4.37 635 447 A 28 LYS H A 27 ASN HBy 1.0 . 4.37 636 448 A 30 ALA HB% A 27 ASN HBx 1.0 . 4.04 637 448 A 30 ALA HB% A 27 ASN HBy 1.0 . 4.04 638 449 A 30 ALA HB% A 27 ASN HD2x 1.0 . 3.98 639 449 A 30 ALA HB% A 27 ASN HD2y 1.0 . 3.98 640 450 A 27 ASN HD2y A 36 VAL HGx% 1.0 . 4.26 641 450 A 36 VAL HGy% A 27 ASN HD2x 1.0 . 4.26 642 450 A 36 VAL HGy% A 27 ASN HD2y 1.0 . 4.26 643 450 A 27 ASN HD2x A 36 VAL HGx% 1.0 . 4.26 644 451 A 28 LYS H A 28 LYS HBx 1.0 . 3.60 645 451 A 28 LYS H A 28 LYS HBy 1.0 . 3.60 646 452 A 34 LEU HA A 34 LEU HDy% 1.0 . 3.10 647 452 A 34 LEU HA A 34 LEU HDx% 1.0 . 3.10 648 453 A 34 LEU HBx A 34 LEU HDy% 1.0 . 2.64 649 453 A 34 LEU HBy A 34 LEU HDy% 1.0 . 2.64 650 453 A 34 LEU HDx% A 34 LEU HBx 1.0 . 2.64 651 453 A 34 LEU HBy A 34 LEU HDx% 1.0 . 2.64 652 454 A 34 LEU HBy A 35 MET HBy 1.0 . 3.77 653 454 A 34 LEU HBx A 35 MET HBy 1.0 . 3.77 654 454 A 35 MET HBx A 34 LEU HBx 1.0 . 3.77 655 454 A 34 LEU HBy A 35 MET HBx 1.0 . 3.77 656 455 A 35 MET H A 34 LEU HDy% 1.0 . 4.30 657 455 A 35 MET H A 34 LEU HDx% 1.0 . 4.30 658 456 A 34 LEU HDx% A 35 MET HGx 1.0 . 4.30 659 456 A 34 LEU HDy% A 35 MET HGx 1.0 . 4.30 660 456 A 35 MET HGy A 34 LEU HDy% 1.0 . 4.30 661 456 A 34 LEU HDx% A 35 MET HGy 1.0 . 4.30 662 457 A 36 VAL H A 35 MET HBy 1.0 . 3.82 663 457 A 36 VAL H A 35 MET HBx 1.0 . 3.82 664 458 A 36 VAL H A 35 MET HGx 1.0 . 4.29 665 458 A 36 VAL H A 35 MET HGy 1.0 . 4.29 666 459 A 35 MET HGx A 36 VAL HGx% 1.0 . 5.34 667 459 A 36 VAL HGy% A 35 MET HGx 1.0 . 5.34 668 459 A 36 VAL HGy% A 35 MET HGy 1.0 . 5.34 669 459 A 35 MET HGy A 36 VAL HGx% 1.0 . 5.34 stop_ save_