data_nef_c25008_2mq1 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 2MQ1 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 80 HIS NE2 2 3 ZN ZN 1 85 HIS NE2 2 3 ZN ZN 1 22 HIS ND1 2 2 ZN ZN 1 25 CYS SG 2 1 ZN ZN 1 43 CYS SG 2 2 ZN ZN 1 7 CYS SG 2 1 ZN ZN 1 61 CYS SG 2 3 ZN ZN 1 67 CYS SG 2 3 ZN ZN 1 20 CYS SG 2 2 ZN ZN 1 28 CYS SG 2 1 ZN ZN 1 40 CYS SG 2 2 ZN ZN 1 4 CYS SG 2 1 ZN ZN 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 VAL start . . 2 A 2 HIS middle . . 3 A 3 PHE middle . . 4 A 4 CYS middle -HG . 5 A 5 ASP middle . . 6 A 6 LYS middle . . 7 A 7 CYS middle -HG . 8 A 8 GLY middle . false 9 A 9 LEU middle . . 10 A 10 PRO middle . false 11 A 11 ILE middle . . 12 A 12 LYS middle . . 13 A 13 VAL middle . . 14 A 14 TYR middle . . 15 A 15 GLY middle . false 16 A 16 ARG middle . . 17 A 17 MET middle . . 18 A 18 ILE middle . . 19 A 19 PRO middle . true 20 A 20 CYS middle -HG . 21 A 21 LYS middle . . 22 A 22 HIS middle -HD1 . 23 A 23 VAL middle . . 24 A 24 PHE middle . . 25 A 25 CYS middle -HG . 26 A 26 TYR middle . . 27 A 27 ASP middle . . 28 A 28 CYS middle -HG . 29 A 29 ALA middle . . 30 A 30 ILE middle . . 31 A 31 LEU middle . . 32 A 32 HIS middle . . 33 A 33 GLU middle . . 34 A 34 LYS middle . . 35 A 35 LYS middle . . 36 A 36 GLY middle . false 37 A 37 ASP middle . . 38 A 38 LYS middle . . 39 A 39 MET middle . . 40 A 40 CYS middle -HG . 41 A 41 PRO middle . false 42 A 42 GLY middle . false 43 A 43 CYS middle -HG . 44 A 44 SER middle . . 45 A 45 ASP middle . . 46 A 46 PRO middle . false 47 A 47 VAL middle . . 48 A 48 GLN middle . . 49 A 49 ARG middle . . 50 A 50 ILE middle . . 51 A 51 GLU middle . . 52 A 52 GLN middle . . 53 A 53 CYS middle . . 54 A 54 THR middle . . 55 A 55 ARG middle . . 56 A 56 GLY middle . false 57 A 57 SER middle . . 58 A 58 LEU middle . . 59 A 59 PHE middle . . 60 A 60 MET middle . . 61 A 61 CYS middle -HG . 62 A 62 SER middle . . 63 A 63 ILE middle . . 64 A 64 VAL middle . . 65 A 65 GLN middle . . 66 A 66 GLY middle . false 67 A 67 CYS middle -HG . 68 A 68 LYS middle . . 69 A 69 ARG middle . . 70 A 70 THR middle . . 71 A 71 TYR middle . . 72 A 72 LEU middle . . 73 A 73 SER middle . . 74 A 74 GLN middle . . 75 A 75 ARG middle . . 76 A 76 ASP middle . . 77 A 77 LEU middle . . 78 A 78 GLN middle . . 79 A 79 ALA middle . . 80 A 80 HIS middle -HE2 . 81 A 81 ILE middle . . 82 A 82 ASN middle . . 83 A 83 HIS middle . . 84 A 84 ARG middle . . 85 A 85 HIS middle -HE2 . 86 A 86 MET middle . . 87 A 87 ARG middle . . 88 A 88 ALA middle . . 89 A 89 GLY end . false 90 B 1 ZN . . . 91 B 2 ZN . . . 92 B 3 ZN . . . 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 VAL H1 H 1 7.819 0.002 A 1 VAL HA H 1 3.923 0.004 A 1 VAL HB H 1 1.765 0.002 A 1 VAL HG1% H 1 0.431 0.003 A 1 VAL HG2% H 1 0.669 0.005 A 1 VAL CG1 C 13 21.002 0.000 A 1 VAL CG2 C 13 21.103 0.000 A 1 VAL N N 15 120.883 0.025 A 2 HIS H H 1 8.415 0.003 A 2 HIS HA H 1 4.747 0.009 A 2 HIS HBy H 1 3.058 0.001 A 2 HIS HBx H 1 2.777 0.011 A 2 HIS HD2 H 1 6.991 0.000 A 2 HIS CB C 13 33.018 0.000 A 2 HIS N N 15 124.505 0.014 A 3 PHE H H 1 8.744 0.008 A 3 PHE HA H 1 4.677 0.002 A 3 PHE HBy H 1 2.694 0.015 A 3 PHE HBx H 1 2.571 0.001 A 3 PHE HDx H 1 7.123 0.001 A 3 PHE N N 15 121.262 0.011 A 4 CYS H H 1 8.882 0.009 A 4 CYS HA H 1 4.501 0.016 A 4 CYS HBy H 1 3.690 0.002 A 4 CYS HBx H 1 2.749 0.007 A 4 CYS CA C 13 59.926 0.000 A 4 CYS CB C 13 31.658 0.000 A 4 CYS N N 15 126.122 0.025 A 5 ASP H H 1 9.971 0.017 A 5 ASP HA H 1 4.552 0.000 A 5 ASP HBy H 1 2.879 0.003 A 5 ASP HBx H 1 2.665 0.004 A 5 ASP N N 15 131.680 7.966 A 6 LYS H H 1 9.426 0.002 A 6 LYS HA H 1 4.604 0.000 A 6 LYS HBy H 1 2.379 0.000 A 6 LYS HBx H 1 1.911 0.008 A 6 LYS HDy H 1 1.522 0.004 A 6 LYS HEy H 1 3.158 0.000 A 6 LYS HGy H 1 1.400 0.000 A 6 LYS HGx H 1 1.271 0.001 A 6 LYS N N 15 121.428 0.091 A 7 CYS H H 1 8.253 0.002 A 7 CYS HA H 1 4.832 0.004 A 7 CYS HBy H 1 3.182 0.003 A 7 CYS HBx H 1 2.621 0.003 A 7 CYS N N 15 117.863 0.016 A 8 GLY H H 1 8.146 0.002 A 8 GLY HAy H 1 4.157 0.002 A 8 GLY HAx H 1 3.983 0.003 A 8 GLY N N 15 112.656 0.014 A 9 LEU H H 1 8.430 0.001 A 9 LEU HA H 1 4.781 0.000 A 9 LEU HBy H 1 2.053 0.004 A 9 LEU HBx H 1 1.461 0.002 A 9 LEU HD1% H 1 0.969 0.012 A 9 LEU HD2% H 1 1.008 0.000 A 9 LEU HG H 1 1.818 0.001 A 9 LEU CD1 C 13 22.486 0.112 A 9 LEU CD2 C 13 25.450 0.000 A 9 LEU N N 15 123.069 0.015 A 10 PRO HA H 1 4.051 0.002 A 10 PRO HBy H 1 1.752 0.004 A 10 PRO HBx H 1 1.577 0.006 A 10 PRO HDx H 1 3.923 0.000 A 10 PRO CD C 13 50.328 0.000 A 11 ILE H H 1 8.440 0.002 A 11 ILE HA H 1 3.455 0.002 A 11 ILE HB H 1 1.062 0.002 A 11 ILE HD1% H 1 0.422 0.006 A 11 ILE HG1y H 1 1.611 0.019 A 11 ILE HG1x H 1 0.477 0.008 A 11 ILE HG2% H 1 -0.262 0.004 A 11 ILE CD1 C 13 13.298 0.065 A 11 ILE CG2 C 13 16.918 0.072 A 11 ILE N N 15 124.059 0.116 A 12 LYS H H 1 8.709 0.004 A 12 LYS HA H 1 4.280 0.003 A 12 LYS HBy H 1 1.815 0.002 A 12 LYS HEy H 1 2.953 0.000 A 12 LYS HGy H 1 1.438 0.001 A 12 LYS HGx H 1 1.318 0.001 A 12 LYS N N 15 128.422 0.042 A 13 VAL H H 1 7.555 0.003 A 13 VAL HA H 1 4.098 0.007 A 13 VAL HB H 1 1.907 0.005 A 13 VAL HG1% H 1 0.774 0.014 A 13 VAL HG2% H 1 0.823 0.005 A 13 VAL CG1 C 13 21.329 0.000 A 13 VAL CG2 C 13 21.142 0.083 A 13 VAL N N 15 119.415 0.017 A 14 TYR H H 1 8.889 0.004 A 14 TYR HA H 1 4.723 0.009 A 14 TYR HBy H 1 2.797 0.006 A 14 TYR HBx H 1 2.586 0.004 A 14 TYR HDx H 1 6.712 0.006 A 14 TYR HEy H 1 6.512 0.007 A 14 TYR CA C 13 57.992 0.000 A 14 TYR CD2 C 13 133.701 0.000 A 14 TYR CE2 C 13 117.990 0.037 A 14 TYR N N 15 124.898 0.007 A 15 GLY H H 1 9.162 0.001 A 15 GLY HAy H 1 5.114 0.007 A 15 GLY HAx H 1 3.036 0.003 A 15 GLY CA C 13 45.975 0.000 A 15 GLY N N 15 107.261 0.016 A 16 ARG H H 1 9.340 0.003 A 16 ARG HA H 1 4.838 0.002 A 16 ARG HBx H 1 1.005 0.000 A 16 ARG HBy H 1 1.924 0.000 A 16 ARG HDy H 1 2.571 0.000 A 16 ARG HE H 1 5.985 0.003 A 16 ARG HGy H 1 1.006 0.001 A 16 ARG HGx H 1 0.867 0.014 A 16 ARG N N 15 127.282 0.028 A 16 ARG NE N 15 129.974 0.014 A 17 MET H H 1 9.169 0.002 A 17 MET HA H 1 4.542 0.001 A 17 MET HBy H 1 2.827 0.005 A 17 MET HBx H 1 1.959 0.003 A 17 MET HE% H 1 2.000 0.006 A 17 MET HGx H 1 3.389 0.000 A 17 MET CE C 13 19.741 0.100 A 17 MET N N 15 126.130 0.019 A 18 ILE H H 1 8.458 0.003 A 18 ILE HA H 1 4.680 0.013 A 18 ILE HB H 1 2.072 0.006 A 18 ILE HD1% H 1 0.557 0.003 A 18 ILE HG1y H 1 1.502 0.001 A 18 ILE HG1x H 1 1.070 0.005 A 18 ILE HG2% H 1 0.831 0.009 A 18 ILE CD1 C 13 9.254 0.000 A 18 ILE CG2 C 13 15.886 0.000 A 18 ILE N N 15 123.341 0.010 A 19 PRO HA H 1 4.689 0.000 A 19 PRO HBy H 1 2.231 0.000 A 19 PRO HBx H 1 2.129 0.000 A 19 PRO HDy H 1 3.985 0.001 A 19 PRO HDx H 1 3.425 0.006 A 19 PRO HGy H 1 1.947 0.000 A 19 PRO HGx H 1 1.865 0.000 A 20 CYS H H 1 8.633 0.006 A 20 CYS HA H 1 4.233 0.001 A 20 CYS HBy H 1 2.907 0.003 A 20 CYS HBx H 1 2.588 0.004 A 20 CYS N N 15 124.522 0.119 A 21 LYS H H 1 8.279 0.002 A 21 LYS HA H 1 3.609 0.003 A 21 LYS HBy H 1 2.269 0.002 A 21 LYS HBx H 1 1.831 0.002 A 21 LYS HDy H 1 1.348 0.000 A 21 LYS HDx H 1 1.111 0.000 A 21 LYS HGy H 1 1.462 0.000 A 21 LYS HGx H 1 0.747 0.001 A 21 LYS N N 15 111.843 0.007 A 22 HIS H H 1 7.950 0.003 A 22 HIS HA H 1 4.824 0.001 A 22 HIS HBy H 1 3.282 0.002 A 22 HIS HBx H 1 3.020 0.002 A 22 HIS HD2 H 1 7.013 0.000 A 22 HIS N N 15 122.289 0.018 A 23 VAL H H 1 8.912 0.008 A 23 VAL HA H 1 5.617 0.002 A 23 VAL HB H 1 2.002 0.000 A 23 VAL HG1% H 1 0.656 0.001 A 23 VAL HG2% H 1 0.653 0.006 A 23 VAL CG1 C 13 19.096 0.073 A 23 VAL CG2 C 13 21.852 0.098 A 23 VAL N N 15 111.859 0.021 A 24 PHE H H 1 8.266 0.002 A 24 PHE HA H 1 4.822 0.004 A 24 PHE HBy H 1 3.691 0.002 A 24 PHE HBx H 1 2.417 0.001 A 24 PHE HDy H 1 7.187 0.001 A 24 PHE HEx H 1 7.289 0.006 A 24 PHE HZ H 1 6.929 0.002 A 24 PHE N N 15 118.549 0.021 A 25 CYS H H 1 9.985 0.004 A 25 CYS HA H 1 4.943 0.008 A 25 CYS HBy H 1 3.649 0.005 A 25 CYS HBx H 1 2.973 0.010 A 25 CYS CA C 13 59.593 0.003 A 25 CYS CB C 13 30.178 0.013 A 25 CYS N N 15 122.755 0.080 A 26 TYR H H 1 8.573 0.005 A 26 TYR HA H 1 3.797 0.000 A 26 TYR HBy H 1 2.828 0.012 A 26 TYR HBx H 1 2.675 0.012 A 26 TYR HDx H 1 6.986 0.005 A 26 TYR HEy H 1 6.642 0.006 A 26 TYR CD2 C 13 132.578 0.059 A 26 TYR CE2 C 13 118.083 0.000 A 26 TYR N N 15 123.736 0.026 A 27 ASP H H 1 7.940 0.001 A 27 ASP HA H 1 4.217 0.003 A 27 ASP HBy H 1 2.879 0.002 A 27 ASP HBx H 1 2.615 0.000 A 27 ASP N N 15 116.153 0.011 A 28 CYS H H 1 9.017 0.003 A 28 CYS HA H 1 3.865 0.005 A 28 CYS HBy H 1 3.138 0.003 A 28 CYS HBx H 1 2.605 0.002 A 28 CYS N N 15 122.608 0.014 A 29 ALA H H 1 8.431 0.003 A 29 ALA HA H 1 3.756 0.007 A 29 ALA HB% H 1 1.419 0.003 A 29 ALA CB C 13 19.441 0.103 A 29 ALA N N 15 121.855 0.011 A 30 ILE H H 1 7.982 0.003 A 30 ILE HA H 1 3.853 0.004 A 30 ILE HB H 1 1.639 0.004 A 30 ILE HD1% H 1 0.648 0.000 A 30 ILE HG1y H 1 1.093 0.002 A 30 ILE HG1x H 1 0.998 0.001 A 30 ILE HG2% H 1 0.624 0.004 A 30 ILE CD1 C 13 12.678 0.000 A 30 ILE CG2 C 13 18.043 0.000 A 30 ILE N N 15 113.808 0.042 A 31 LEU H H 1 7.356 0.001 A 31 LEU HA H 1 3.947 0.003 A 31 LEU HBy H 1 1.627 0.001 A 31 LEU HBx H 1 1.454 0.001 A 31 LEU HD1% H 1 0.746 0.014 A 31 LEU HD2% H 1 0.801 0.009 A 31 LEU HG H 1 1.559 0.002 A 31 LEU CD1 C 13 24.238 0.000 A 31 LEU CD2 C 13 24.875 0.000 A 31 LEU N N 15 122.944 0.006 A 32 HIS H H 1 7.919 0.004 A 32 HIS HA H 1 4.262 0.012 A 32 HIS HBy H 1 3.247 0.001 A 32 HIS HBx H 1 2.910 0.002 A 32 HIS HD2 H 1 7.010 0.009 A 32 HIS N N 15 118.053 0.045 A 33 GLU H H 1 7.881 0.005 A 33 GLU HA H 1 4.039 0.000 A 33 GLU HBy H 1 2.111 0.000 A 33 GLU HBx H 1 1.982 0.009 A 33 GLU HGy H 1 2.116 0.004 A 33 GLU CB C 13 30.068 0.000 A 33 GLU N N 15 120.900 0.044 A 34 LYS H H 1 7.982 0.011 A 34 LYS HA H 1 4.066 0.005 A 34 LYS HBy H 1 1.828 0.000 A 34 LYS HDy H 1 1.620 0.002 A 34 LYS HEy H 1 2.918 0.000 A 34 LYS HG2 H 1 1.515 0.000 A 34 LYS HG3 H 1 1.419 0.007 A 34 LYS N N 15 118.986 0.017 A 35 LYS H H 1 7.903 0.005 A 35 LYS HA H 1 4.152 0.006 A 35 LYS HBy H 1 1.804 0.005 A 35 LYS HDy H 1 1.603 0.007 A 35 LYS HEy H 1 2.911 0.000 A 35 LYS HGy H 1 1.451 0.006 A 35 LYS HGx H 1 1.376 0.008 A 35 LYS N N 15 118.849 0.027 A 36 GLY H H 1 7.958 0.005 A 36 GLY HAy H 1 4.010 0.002 A 36 GLY HAx H 1 3.790 0.002 A 36 GLY N N 15 107.805 0.094 A 37 ASP H H 1 7.879 0.005 A 37 ASP HA H 1 4.531 0.001 A 37 ASP HBy H 1 2.532 0.002 A 37 ASP HBx H 1 2.463 0.003 A 37 ASP N N 15 120.100 0.008 A 38 LYS H H 1 8.404 0.001 A 38 LYS HA H 1 4.176 0.001 A 38 LYS HBy H 1 2.010 0.004 A 38 LYS HBx H 1 1.776 0.010 A 38 LYS HDy H 1 1.651 0.000 A 38 LYS HEy H 1 3.239 0.002 A 38 LYS HEx H 1 2.926 0.014 A 38 LYS HGy H 1 1.344 0.003 A 38 LYS N N 15 119.749 0.007 A 39 MET H H 1 7.966 0.003 A 39 MET HA H 1 4.874 0.005 A 39 MET HBy H 1 1.745 0.005 A 39 MET HBx H 1 1.608 0.003 A 39 MET HE% H 1 2.023 0.017 A 39 MET HGy H 1 2.423 0.007 A 39 MET HGx H 1 2.315 0.013 A 39 MET CE C 13 17.802 0.000 A 39 MET N N 15 119.409 0.008 A 40 CYS H H 1 8.900 0.002 A 40 CYS HA H 1 4.325 0.004 A 40 CYS HBy H 1 3.264 0.002 A 40 CYS HBx H 1 2.905 0.004 A 40 CYS N N 15 127.068 0.032 A 41 PRO HA H 1 4.117 0.000 A 41 PRO HBy H 1 1.602 0.000 A 41 PRO HBx H 1 1.098 0.000 A 41 PRO HDy H 1 3.629 0.007 A 41 PRO HDx H 1 3.370 0.003 A 41 PRO HGy H 1 0.912 0.000 A 41 PRO HGx H 1 0.477 0.000 A 42 GLY H H 1 9.505 0.001 A 42 GLY HAy H 1 4.186 0.003 A 42 GLY HAx H 1 3.874 0.002 A 42 GLY N N 15 111.867 0.010 A 43 CYS H H 1 8.455 0.004 A 43 CYS HA H 1 4.956 0.001 A 43 CYS HBy H 1 3.430 0.018 A 43 CYS HBx H 1 2.685 0.005 A 43 CYS N N 15 121.915 0.025 A 44 SER H H 1 8.108 0.020 A 44 SER HA H 1 4.186 0.001 A 44 SER HBy H 1 4.100 0.006 A 44 SER N N 15 114.723 0.019 A 45 ASP H H 1 8.614 0.002 A 45 ASP HA H 1 4.971 0.000 A 45 ASP HBy H 1 2.927 0.001 A 45 ASP HBx H 1 2.577 0.000 A 45 ASP N N 15 124.170 0.016 A 46 PRO HA H 1 4.763 0.000 A 46 PRO HBy H 1 2.351 0.000 A 46 PRO HBx H 1 1.786 0.000 A 46 PRO HDy H 1 3.920 0.000 A 46 PRO HDx H 1 3.574 0.000 A 47 VAL H H 1 8.223 0.003 A 47 VAL HA H 1 4.325 0.001 A 47 VAL HB H 1 1.651 0.002 A 47 VAL HG1% H 1 0.878 0.006 A 47 VAL HG2% H 1 0.892 0.000 A 47 VAL CG1 C 13 21.873 0.000 A 47 VAL CG2 C 13 22.540 0.000 A 47 VAL N N 15 124.308 0.036 A 48 GLN H H 1 9.746 0.002 A 48 GLN HA H 1 4.311 0.004 A 48 GLN HBy H 1 2.054 0.002 A 48 GLN HBx H 1 1.872 0.004 A 48 GLN HE2x H 1 6.784 0.000 A 48 GLN HE2y H 1 7.490 0.001 A 48 GLN HGy H 1 2.396 0.001 A 48 GLN N N 15 126.687 0.003 A 48 GLN NE2 N 15 111.057 0.022 A 49 ARG H H 1 7.781 0.002 A 49 ARG HA H 1 4.577 0.001 A 49 ARG HBy H 1 1.946 0.015 A 49 ARG HBx H 1 1.701 0.007 A 49 ARG HDy H 1 3.193 0.000 A 49 ARG HDx H 1 3.118 0.000 A 49 ARG HGy H 1 1.336 0.002 A 49 ARG HGx H 1 1.234 0.000 A 49 ARG N N 15 114.333 0.007 A 50 ILE H H 1 8.429 0.004 A 50 ILE HA H 1 4.811 0.005 A 50 ILE HB H 1 1.608 0.003 A 50 ILE HD1% H 1 0.700 0.005 A 50 ILE HG1y H 1 1.444 0.007 A 50 ILE HG1x H 1 1.077 0.003 A 50 ILE HG2% H 1 0.706 0.006 A 50 ILE CD1 C 13 15.013 0.084 A 50 ILE CG2 C 13 17.833 0.088 A 50 ILE N N 15 119.290 0.025 A 51 GLU H H 1 9.404 0.003 A 51 GLU HA H 1 4.649 0.001 A 51 GLU HBy H 1 1.938 0.000 A 51 GLU HGy H 1 2.112 0.003 A 51 GLU N N 15 127.647 0.024 A 52 GLN H H 1 8.856 0.003 A 52 GLN HA H 1 5.121 0.001 A 52 GLN HBy H 1 1.932 0.002 A 52 GLN HBx H 1 1.679 0.000 A 52 GLN HE2x H 1 5.651 0.001 A 52 GLN HE2y H 1 6.600 0.003 A 52 GLN HGy H 1 1.581 0.003 A 52 GLN N N 15 124.651 0.008 A 52 GLN NE2 N 15 109.676 0.185 A 53 CYS H H 1 8.600 0.004 A 53 CYS HA H 1 5.036 0.010 A 53 CYS HBy H 1 2.926 0.002 A 53 CYS HBx H 1 2.464 0.002 A 53 CYS N N 15 123.201 0.007 A 54 THR H H 1 8.496 0.005 A 54 THR HA H 1 4.688 0.003 A 54 THR HB H 1 4.361 0.003 A 54 THR HG2% H 1 1.273 0.005 A 54 THR CG2 C 13 22.127 0.088 A 54 THR N N 15 114.463 0.030 A 55 ARG H H 1 8.652 0.006 A 55 ARG HA H 1 4.023 0.006 A 55 ARG HBy H 1 1.923 0.002 A 55 ARG HBx H 1 1.840 0.001 A 55 ARG HDy H 1 3.196 0.000 A 55 ARG HGy H 1 1.728 0.000 A 55 ARG HGx H 1 1.631 0.000 A 55 ARG CA C 13 58.690 0.000 A 55 ARG N N 15 122.555 0.012 A 56 GLY H H 1 8.752 0.002 A 56 GLY HAy H 1 4.181 0.008 A 56 GLY HAx H 1 3.740 0.002 A 56 GLY N N 15 111.748 0.000 A 57 SER H H 1 7.669 0.002 A 57 SER HA H 1 4.401 0.001 A 57 SER HBy H 1 3.851 0.008 A 57 SER CB C 13 64.887 0.000 A 57 SER N N 15 113.654 0.022 A 58 LEU H H 1 6.986 0.002 A 58 LEU HA H 1 4.802 0.004 A 58 LEU HBy H 1 1.131 0.005 A 58 LEU HBx H 1 0.867 0.011 A 58 LEU HD1% H 1 -0.014 0.003 A 58 LEU HD2% H 1 0.366 0.005 A 58 LEU HG H 1 1.045 0.014 A 58 LEU CD1 C 13 25.230 0.088 A 58 LEU CD2 C 13 23.925 0.000 A 58 LEU N N 15 117.584 0.012 A 59 PHE H H 1 8.980 0.003 A 59 PHE HA H 1 4.448 0.003 A 59 PHE HBy H 1 2.889 0.005 A 59 PHE HBx H 1 2.579 0.001 A 59 PHE HDy H 1 7.064 0.007 A 59 PHE HEx H 1 7.203 0.000 A 59 PHE N N 15 121.892 0.010 A 60 MET H H 1 8.985 0.006 A 60 MET HA H 1 4.705 0.006 A 60 MET HBy H 1 1.897 0.008 A 60 MET HBx H 1 1.475 0.000 A 60 MET HE% H 1 1.570 0.005 A 60 MET HGy H 1 2.252 0.005 A 60 MET HGx H 1 2.067 0.001 A 60 MET CA C 13 54.738 0.000 A 60 MET CB C 13 35.571 0.000 A 60 MET CE C 13 16.146 0.086 A 60 MET N N 15 125.165 0.010 A 61 CYS H H 1 8.981 0.003 A 61 CYS HA H 1 4.366 0.005 A 61 CYS HBy H 1 3.279 0.001 A 61 CYS HBx H 1 2.773 0.005 A 61 CYS CA C 13 62.054 0.060 A 61 CYS CB C 13 29.410 0.000 A 61 CYS N N 15 129.989 0.029 A 62 SER H H 1 8.749 0.004 A 62 SER HA H 1 4.846 0.000 A 62 SER N N 15 124.327 0.093 A 63 ILE H H 1 8.160 0.006 A 63 ILE HA H 1 3.962 0.000 A 63 ILE HB H 1 1.685 0.000 A 63 ILE HD1% H 1 0.829 0.003 A 63 ILE HG1y H 1 1.615 0.000 A 63 ILE HG1x H 1 1.349 0.000 A 63 ILE HG2% H 1 0.824 0.003 A 63 ILE CD1 C 13 11.725 0.108 A 63 ILE CG2 C 13 18.530 0.000 A 63 ILE N N 15 123.145 0.021 A 64 VAL HG1% H 1 0.467 0.006 A 64 VAL HG2% H 1 0.758 0.001 A 64 VAL CG1 C 13 20.183 0.000 A 64 VAL CG2 C 13 21.643 0.000 A 65 GLN HA H 1 4.034 0.001 A 65 GLN HE2x H 1 6.851 0.006 A 65 GLN HE2y H 1 7.524 0.000 A 65 GLN NE2 N 15 112.374 0.034 A 66 GLY H H 1 8.599 0.007 A 66 GLY HAy H 1 3.919 0.004 A 66 GLY HAx H 1 3.846 0.010 A 66 GLY N N 15 107.573 0.009 A 67 CYS H H 1 7.586 0.004 A 67 CYS HA H 1 4.627 0.004 A 67 CYS HBy H 1 3.163 0.005 A 67 CYS HBx H 1 2.888 0.003 A 67 CYS N N 15 122.673 0.010 A 68 LYS H H 1 8.470 0.014 A 68 LYS HA H 1 4.355 0.000 A 69 ARG H H 1 7.840 0.003 A 69 ARG HA H 1 3.782 0.000 A 69 ARG HBy H 1 1.363 0.005 A 69 ARG HBx H 1 1.269 0.005 A 69 ARG HGy H 1 1.931 0.000 A 69 ARG HGx H 1 1.592 0.000 A 69 ARG N N 15 120.756 0.030 A 70 THR H H 1 7.304 0.003 A 70 THR HA H 1 5.153 0.002 A 70 THR HB H 1 3.659 0.008 A 70 THR HG2% H 1 0.992 0.007 A 70 THR CG2 C 13 22.673 0.078 A 70 THR N N 15 109.114 0.015 A 71 TYR H H 1 8.709 0.002 A 71 TYR HA H 1 4.332 0.003 A 71 TYR HBy H 1 3.294 0.005 A 71 TYR HBx H 1 2.542 0.002 A 71 TYR HDy H 1 6.961 0.003 A 71 TYR N N 15 118.532 0.009 A 72 LEU H H 1 9.603 0.003 A 72 LEU HA H 1 4.939 0.003 A 72 LEU HBy H 1 1.890 0.005 A 72 LEU HBx H 1 1.791 0.003 A 72 LEU HD1% H 1 0.757 0.004 A 72 LEU HD2% H 1 0.927 0.002 A 72 LEU HG H 1 1.522 0.002 A 72 LEU CD1 C 13 22.540 0.139 A 72 LEU CD2 C 13 25.536 0.000 A 72 LEU N N 15 119.755 0.006 A 73 SER H H 1 7.419 0.002 A 73 SER HA H 1 4.325 0.000 A 73 SER HBy H 1 3.938 0.001 A 73 SER HBx H 1 3.857 0.002 A 73 SER N N 15 109.858 0.081 A 74 GLN H H 1 8.338 0.005 A 74 GLN HA H 1 3.320 0.005 A 74 GLN HBy H 1 1.704 0.000 A 74 GLN HBx H 1 1.646 0.000 A 74 GLN HE2y H 1 7.206 0.000 A 74 GLN HGy H 1 2.022 0.002 A 74 GLN N N 15 123.286 0.021 A 74 GLN NE2 N 15 111.115 0.000 A 75 ARG H H 1 8.166 0.002 A 75 ARG HA H 1 3.910 0.004 A 75 ARG HBy H 1 1.758 0.018 A 75 ARG HBx H 1 1.637 0.004 A 75 ARG HD2 H 1 3.107 0.001 A 75 ARG HGy H 1 1.504 0.007 A 75 ARG N N 15 119.374 0.037 A 76 ASP H H 1 7.751 0.002 A 76 ASP HA H 1 4.282 0.004 A 76 ASP HBy H 1 2.830 0.003 A 76 ASP HBx H 1 2.724 0.006 A 76 ASP N N 15 121.109 0.037 A 77 LEU H H 1 7.420 0.002 A 77 LEU HA H 1 3.467 0.002 A 77 LEU HBy H 1 1.912 0.007 A 77 LEU HBx H 1 1.343 0.001 A 77 LEU HD1% H 1 0.990 0.008 A 77 LEU HD2% H 1 1.052 0.013 A 77 LEU HG H 1 1.534 0.003 A 77 LEU CD1 C 13 26.793 0.106 A 77 LEU CD2 C 13 22.715 0.093 A 77 LEU CG C 13 27.515 0.000 A 77 LEU N N 15 122.814 0.068 A 78 GLN H H 1 8.572 0.002 A 78 GLN HA H 1 3.755 0.002 A 78 GLN HBy H 1 2.090 0.006 A 78 GLN HBx H 1 2.000 0.006 A 78 GLN HE2x H 1 6.859 0.000 A 78 GLN HE2y H 1 7.300 0.000 A 78 GLN HGy H 1 2.339 0.002 A 78 GLN N N 15 118.892 0.024 A 78 GLN NE2 N 15 113.083 0.003 A 79 ALA H H 1 7.831 0.003 A 79 ALA HA H 1 4.026 0.003 A 79 ALA HB% H 1 1.400 0.007 A 79 ALA CB C 13 17.935 0.000 A 79 ALA N N 15 121.251 0.009 A 80 HIS H H 1 7.323 0.002 A 80 HIS HA H 1 4.477 0.003 A 80 HIS HBy H 1 3.089 0.005 A 80 HIS HBx H 1 2.822 0.006 A 80 HIS HD2 H 1 7.027 0.009 A 80 HIS CD2 C 13 127.312 0.025 A 80 HIS N N 15 119.414 0.042 A 81 ILE H H 1 8.589 0.001 A 81 ILE HA H 1 3.193 0.003 A 81 ILE HB H 1 1.857 0.000 A 81 ILE HD1% H 1 0.966 0.002 A 81 ILE HG1y H 1 2.105 0.004 A 81 ILE HG1x H 1 1.299 0.000 A 81 ILE HG2% H 1 0.941 0.008 A 81 ILE CD1 C 13 14.287 0.064 A 81 ILE CG2 C 13 17.715 0.000 A 81 ILE N N 15 121.812 0.005 A 82 ASN H H 1 8.279 0.003 A 82 ASN HA H 1 4.329 0.003 A 82 ASN HBy H 1 2.725 0.003 A 82 ASN HD2x H 1 6.880 0.002 A 82 ASN HD2y H 1 7.412 0.003 A 82 ASN N N 15 117.184 0.036 A 82 ASN ND2 N 15 110.896 0.222 A 83 HIS H H 1 7.803 0.004 A 83 HIS HA H 1 4.597 0.002 A 83 HIS HBy H 1 3.186 0.004 A 83 HIS HD2 H 1 6.910 0.281 A 83 HIS CD2 C 13 127.936 0.000 A 83 HIS N N 15 115.810 0.031 A 84 ARG H H 1 8.332 0.003 A 84 ARG HA H 1 4.072 0.001 A 84 ARG HBy H 1 1.137 0.004 A 84 ARG HBx H 1 0.417 0.003 A 84 ARG HDy H 1 2.804 0.000 A 84 ARG HDx H 1 2.569 0.003 A 84 ARG HGy H 1 1.473 0.001 A 84 ARG N N 15 112.636 0.086 A 85 HIS H H 1 7.874 0.004 A 85 HIS HA H 1 5.219 0.005 A 85 HIS HBy H 1 3.200 0.001 A 85 HIS HBx H 1 3.053 0.003 A 85 HIS HD2 H 1 6.498 0.000 A 85 HIS N N 15 114.050 0.102 A 86 MET H H 1 7.703 0.005 A 86 MET HA H 1 4.575 0.006 A 86 MET HBy H 1 2.095 0.002 A 86 MET HE% H 1 2.009 0.000 A 86 MET HGy H 1 2.600 0.008 A 86 MET HGx H 1 2.480 0.003 A 86 MET CE C 13 17.339 0.000 A 86 MET N N 15 118.908 0.008 A 87 ARG H H 1 8.129 0.007 A 87 ARG HA H 1 4.330 0.000 A 87 ARG HBy H 1 1.829 0.001 A 87 ARG HBx H 1 1.728 0.000 A 87 ARG HGy H 1 1.567 0.000 A 87 ARG N N 15 121.346 0.008 A 88 ALA H H 1 8.325 0.004 A 88 ALA HA H 1 4.330 0.002 A 88 ALA HB% H 1 1.352 0.004 A 88 ALA CB C 13 19.070 0.000 A 88 ALA N N 15 126.172 0.035 A 89 GLY H H 1 7.896 0.002 A 89 GLY HAy H 1 3.708 0.000 A 89 GLY N N 15 114.781 0.029 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 VAL HA A 2 HIS H 1.0 1.8 2.9 2 2 A 1 VAL HA A 3 PHE H 1.0 1.8 5.0 3 3 A 2 HIS H A 1 VAL HB 1.0 1.8 3.5 4 4 A 2 HIS H A 1 VAL HG1% 1.0 1.8 5.3 5 4 A 2 HIS H A 1 VAL HG2% 1.0 1.8 5.3 6 5 A 2 HIS H A 2 HIS HA 1.0 1.8 3.5 7 6 A 3 PHE H A 2 HIS HA 1.0 1.8 3.5 8 7 A 11 ILE H A 2 HIS HBy 1.0 1.8 6.0 9 7 A 2 HIS HBx A 11 ILE H 1.0 1.8 6.0 10 8 A 2 HIS H A 2 HIS HBy 1.0 1.8 3.5 11 8 A 2 HIS H A 2 HIS HBx 1.0 1.8 3.5 12 9 A 3 PHE H A 2 HIS HBy 1.0 1.8 4.5 13 9 A 3 PHE H A 2 HIS HBx 1.0 1.8 4.5 14 10 A 3 PHE H A 2 HIS HD2 1.0 1.8 3.5 15 11 A 2 HIS H A 11 ILE HB 1.0 1.8 5.0 16 12 A 2 HIS H A 11 ILE HD1% 1.0 1.8 6.5 17 13 A 2 HIS H A 14 TYR HE% 1.0 1.8 7.0 18 14 A 2 HIS H A 3 PHE H 1.0 1.8 3.5 19 15 A 11 ILE H A 3 PHE HA 1.0 1.8 5.0 20 16 A 3 PHE H A 3 PHE HA 1.0 1.8 2.9 21 17 A 3 PHE HA A 4 CYS H 1.0 1.8 2.9 22 18 A 3 PHE H A 3 PHE HBy 1.0 1.8 3.5 23 18 A 3 PHE H A 3 PHE HBx 1.0 1.8 3.5 24 19 A 4 CYS H A 3 PHE HBy 1.0 1.8 4.5 25 19 A 4 CYS H A 3 PHE HBx 1.0 1.8 4.5 26 20 A 3 PHE H A 3 PHE HD% 1.0 1.8 5.5 27 21 A 4 CYS H A 3 PHE HD% 1.0 1.8 7.0 28 22 A 3 PHE H A 10 PRO HA 1.0 1.8 5.0 29 23 A 3 PHE H A 10 PRO HBy 1.0 1.8 6.0 30 23 A 3 PHE H A 10 PRO HBx 1.0 1.8 6.0 31 24 A 3 PHE H A 11 ILE HD1% 1.0 1.8 5.0 32 25 A 3 PHE H A 4 CYS H 1.0 1.8 5.0 33 26 A 4 CYS HA A 25 CYS H 1.0 1.8 5.0 34 27 A 4 CYS H A 4 CYS HA 1.0 1.8 3.5 35 28 A 4 CYS HA A 5 ASP H 1.0 1.8 2.9 36 29 A 4 CYS HA A 6 LYS H 1.0 1.8 5.0 37 30 A 25 CYS H A 4 CYS HBy 1.0 1.8 4.5 38 30 A 25 CYS H A 4 CYS HBx 1.0 1.8 4.5 39 31 A 4 CYS H A 4 CYS HBy 1.0 1.8 3.5 40 31 A 4 CYS H A 4 CYS HBx 1.0 1.8 3.5 41 32 A 5 ASP H A 4 CYS HBy 1.0 1.8 4.5 42 32 A 5 ASP H A 4 CYS HBx 1.0 1.8 4.5 43 33 A 6 LYS H A 4 CYS HBy 1.0 1.8 6.0 44 33 A 6 LYS H A 4 CYS HBx 1.0 1.8 6.0 45 34 A 7 CYS H A 4 CYS HBy 1.0 1.8 4.5 46 34 A 4 CYS HBx A 7 CYS H 1.0 1.8 4.5 47 35 A 8 GLY H A 4 CYS HBy 1.0 1.8 3.9 48 35 A 4 CYS HBx A 8 GLY H 1.0 1.8 3.9 49 36 A 9 LEU H A 4 CYS HBy 1.0 1.8 3.9 50 36 A 4 CYS HBx A 9 LEU H 1.0 1.8 3.9 51 37 A 4 CYS H A 10 PRO HA 1.0 1.8 3.5 52 38 A 4 CYS H A 11 ILE HA 1.0 1.8 5.0 53 39 A 11 ILE HB A 4 CYS H 1.0 1.8 5.0 54 40 A 11 ILE HD1% A 4 CYS H 1.0 1.8 5.0 55 41 A 4 CYS H A 11 ILE HG1x 1.0 1.8 5.0 56 42 A 4 CYS H A 11 ILE HG1y 1.0 1.8 3.5 57 43 A 4 CYS H A 11 ILE HG2% 1.0 1.8 6.5 58 44 A 11 ILE H A 4 CYS H 1.0 1.8 3.5 59 45 A 4 CYS H A 25 CYS HBy 1.0 1.8 6.0 60 45 A 4 CYS H A 25 CYS HBx 1.0 1.8 6.0 61 46 A 4 CYS H A 5 ASP H 1.0 1.8 5.0 62 47 A 4 CYS H A 8 GLY H 1.0 1.8 5.0 63 48 A 4 CYS H A 9 LEU HBy 1.0 1.8 6.0 64 48 A 4 CYS H A 9 LEU HBx 1.0 1.8 6.0 65 49 A 4 CYS H A 9 LEU H 1.0 1.8 3.5 66 50 A 5 ASP H A 5 ASP HA 1.0 1.8 2.9 67 51 A 6 LYS H A 5 ASP HA 1.0 1.8 5.0 68 52 A 8 GLY H A 5 ASP HA 1.0 1.8 5.0 69 53 A 5 ASP H A 5 ASP HBy 1.0 1.8 3.5 70 53 A 5 ASP H A 5 ASP HBx 1.0 1.8 3.5 71 54 A 6 LYS H A 5 ASP HBy 1.0 1.8 4.5 72 54 A 6 LYS H A 5 ASP HBx 1.0 1.8 4.5 73 55 A 11 ILE HD1% A 5 ASP H 1.0 1.8 5.0 74 56 A 5 ASP H A 24 PHE HA 1.0 1.8 5.0 75 57 A 5 ASP H A 24 PHE HD% 1.0 1.8 5.5 76 58 A 5 ASP H A 24 PHE HE% 1.0 1.8 7.0 77 59 A 5 ASP H A 6 LYS H 1.0 1.8 2.9 78 60 A 25 CYS H A 5 ASP H 1.0 1.8 5.0 79 61 A 5 ASP H A 7 CYS H 1.0 1.8 5.0 80 62 A 5 ASP H A 8 GLY H 1.0 1.8 5.0 81 63 A 6 LYS H A 6 LYS HA 1.0 1.8 2.9 82 64 A 7 CYS H A 6 LYS HA 1.0 1.8 3.5 83 65 A 6 LYS H A 6 LYS HBy 1.0 1.8 3.5 84 65 A 6 LYS H A 6 LYS HBx 1.0 1.8 3.5 85 66 A 7 CYS H A 6 LYS HBy 1.0 1.8 3.9 86 66 A 7 CYS H A 6 LYS HBx 1.0 1.8 3.9 87 67 A 8 GLY H A 6 LYS HBy 1.0 1.8 6.0 88 67 A 8 GLY H A 6 LYS HBx 1.0 1.8 6.0 89 68 A 6 LYS H A 6 LYS HDx 1.0 1.8 6.0 90 68 A 6 LYS H A 6 LYS HDy 1.0 1.8 6.0 91 69 A 7 CYS H A 6 LYS HDx 1.0 1.8 6.0 92 69 A 7 CYS H A 6 LYS HDy 1.0 1.8 6.0 93 70 A 6 LYS H A 6 LYS HEx 1.0 1.8 6.0 94 70 A 6 LYS H A 6 LYS HEy 1.0 1.8 6.0 95 71 A 6 LYS H A 6 LYS HGy 1.0 1.8 4.5 96 71 A 6 LYS H A 6 LYS HGx 1.0 1.8 4.5 97 72 A 7 CYS H A 6 LYS HGy 1.0 1.8 6.0 98 72 A 7 CYS H A 6 LYS HGx 1.0 1.8 6.0 99 73 A 6 LYS H A 24 PHE HBy 1.0 1.8 6.0 100 73 A 6 LYS H A 24 PHE HBx 1.0 1.8 6.0 101 74 A 6 LYS H A 24 PHE HD% 1.0 1.8 4.9 102 75 A 6 LYS H A 24 PHE HE% 1.0 1.8 5.5 103 76 A 6 LYS H A 7 CYS HA 1.0 1.8 5.0 104 77 A 6 LYS H A 7 CYS H 1.0 1.8 2.9 105 78 A 6 LYS H A 8 GLY H 1.0 1.8 3.5 106 79 A 25 CYS H A 6 LYS H 1.0 1.8 5.0 107 80 A 7 CYS H A 7 CYS HA 1.0 1.8 2.9 108 81 A 8 GLY H A 7 CYS HA 1.0 1.8 3.5 109 82 A 8 GLY H A 7 CYS HBy 1.0 1.8 4.5 110 82 A 8 GLY H A 7 CYS HBx 1.0 1.8 4.5 111 83 A 9 LEU H A 7 CYS HBy 1.0 1.8 6.0 112 83 A 9 LEU H A 7 CYS HBx 1.0 1.8 6.0 113 84 A 7 CYS H A 24 PHE HD% 1.0 1.8 7.0 114 85 A 7 CYS H A 8 GLY HAy 1.0 1.8 6.0 115 85 A 7 CYS H A 8 GLY HAx 1.0 1.8 6.0 116 86 A 7 CYS H A 8 GLY H 1.0 1.8 2.9 117 87 A 7 CYS H A 9 LEU H 1.0 1.8 5.0 118 88 A 8 GLY H A 8 GLY HAy 1.0 1.8 3.5 119 88 A 8 GLY H A 8 GLY HAx 1.0 1.8 3.5 120 89 A 9 LEU H A 8 GLY HAy 1.0 1.8 4.5 121 89 A 9 LEU H A 8 GLY HAx 1.0 1.8 4.5 122 90 A 8 GLY H A 9 LEU H 1.0 1.8 2.9 123 91 A 9 LEU H A 9 LEU HA 1.0 1.8 3.5 124 92 A 9 LEU H A 9 LEU HBy 1.0 1.8 3.5 125 92 A 9 LEU H A 9 LEU HBx 1.0 1.8 3.5 126 93 A 9 LEU H A 9 LEU HD1% 1.0 1.8 5.2 127 93 A 9 LEU H A 9 LEU HD2% 1.0 1.8 5.2 128 94 A 9 LEU H A 10 PRO HDx 1.0 1.8 6.5 129 94 A 9 LEU H A 10 PRO HDy 1.0 1.8 6.5 130 95 A 9 LEU HA A 10 PRO HDx 1.0 1.8 6.5 131 95 A 9 LEU HA A 10 PRO HDy 1.0 1.8 6.5 132 96 A 11 ILE H A 10 PRO HA 1.0 1.8 2.9 133 97 A 11 ILE H A 10 PRO HBy 1.0 1.8 3.9 134 97 A 11 ILE H A 10 PRO HBx 1.0 1.8 3.9 135 98 A 11 ILE H A 11 ILE HA 1.0 1.8 2.9 136 99 A 11 ILE HA A 12 LYS H 1.0 1.8 3.5 137 100 A 11 ILE HA A 13 VAL H 1.0 1.8 3.5 138 101 A 11 ILE HB A 12 LYS H 1.0 1.8 5.0 139 102 A 11 ILE HD1% A 12 LYS H 1.0 1.8 6.5 140 103 A 11 ILE HD1% A 24 PHE H 1.0 1.8 6.5 141 104 A 11 ILE HD1% A 25 CYS H 1.0 1.8 5.0 142 105 A 11 ILE HD1% A 26 TYR H 1.0 1.8 6.5 143 106 A 25 CYS H A 11 ILE HG1x 1.0 1.8 5.0 144 107 A 11 ILE HG1y A 12 LYS H 1.0 1.8 5.0 145 108 A 11 ILE HG1y A 13 VAL H 1.0 1.8 5.0 146 109 A 25 CYS H A 11 ILE HG1y 1.0 1.8 5.0 147 110 A 11 ILE H A 11 ILE HG2% 1.0 1.8 5.0 148 111 A 11 ILE HG2% A 12 LYS H 1.0 1.8 5.0 149 112 A 11 ILE HG2% A 13 VAL H 1.0 1.8 4.4 150 113 A 11 ILE HG2% A 14 TYR H 1.0 1.8 5.0 151 114 A 11 ILE HG2% A 15 GLY H 1.0 1.8 5.0 152 115 A 25 CYS H A 11 ILE HG2% 1.0 1.8 6.5 153 116 A 11 ILE HG2% A 26 TYR H 1.0 1.8 5.0 154 117 A 11 ILE HG2% A 27 ASP H 1.0 1.8 6.5 155 118 A 11 ILE H A 12 LYS H 1.0 1.8 5.0 156 119 A 12 LYS H A 12 LYS HA 1.0 1.8 3.5 157 120 A 13 VAL H A 12 LYS HA 1.0 1.8 3.5 158 121 A 12 LYS H A 12 LYS HBx 1.0 1.8 4.1 159 121 A 12 LYS H A 12 LYS HBy 1.0 1.8 4.1 160 122 A 13 VAL H A 12 LYS HBx 1.0 1.8 3.9 161 122 A 13 VAL H A 12 LYS HBy 1.0 1.8 3.9 162 123 A 12 LYS H A 12 LYS HEx 1.0 1.8 6.0 163 123 A 12 LYS H A 12 LYS HEy 1.0 1.8 6.0 164 124 A 13 VAL H A 12 LYS HEx 1.0 1.8 6.0 165 124 A 13 VAL H A 12 LYS HEy 1.0 1.8 6.0 166 125 A 12 LYS H A 12 LYS HGy 1.0 1.8 6.0 167 125 A 12 LYS H A 12 LYS HGx 1.0 1.8 6.0 168 126 A 13 VAL H A 12 LYS HGy 1.0 1.8 4.5 169 126 A 13 VAL H A 12 LYS HGx 1.0 1.8 4.5 170 127 A 12 LYS H A 13 VAL H 1.0 1.8 2.9 171 128 A 13 VAL H A 13 VAL HA 1.0 1.8 2.9 172 129 A 14 TYR H A 13 VAL HA 1.0 1.8 2.9 173 130 A 13 VAL HA A 53 CYS H 1.0 1.8 5.0 174 131 A 13 VAL HA A 55 ARG H 1.0 1.8 5.0 175 132 A 13 VAL H A 13 VAL HB 1.0 1.8 2.9 176 133 A 14 TYR H A 13 VAL HB 1.0 1.8 3.5 177 134 A 26 TYR H A 13 VAL HB 1.0 1.8 3.5 178 135 A 27 ASP H A 13 VAL HB 1.0 1.8 5.0 179 136 A 13 VAL H A 13 VAL HG1% 1.0 1.8 4.6 180 136 A 13 VAL H A 13 VAL HG2% 1.0 1.8 4.6 181 137 A 14 TYR H A 13 VAL HG1% 1.0 1.8 5.3 182 137 A 14 TYR H A 13 VAL HG2% 1.0 1.8 5.3 183 138 A 26 TYR H A 13 VAL HG1% 1.0 1.8 5.9 184 138 A 26 TYR H A 13 VAL HG2% 1.0 1.8 5.9 185 139 A 27 ASP H A 13 VAL HG1% 1.0 1.8 7.4 186 139 A 27 ASP H A 13 VAL HG2% 1.0 1.8 7.4 187 140 A 52 GLN HE2x A 13 VAL HG1% 1.0 1.8 5.9 188 140 A 13 VAL HG2% A 52 GLN HE2x 1.0 1.8 5.9 189 141 A 52 GLN HE2y A 13 VAL HG1% 1.0 1.8 5.9 190 141 A 13 VAL HG2% A 52 GLN HE2y 1.0 1.8 5.9 191 142 A 53 CYS H A 13 VAL HG1% 1.0 1.8 5.9 192 142 A 53 CYS H A 13 VAL HG2% 1.0 1.8 5.9 193 143 A 63 ILE HG2% A 86 MET H 1.0 1.8 6.5 194 144 A 13 VAL H A 14 TYR HA 1.0 1.8 5.0 195 145 A 13 VAL H A 14 TYR HD% 1.0 1.8 7.0 196 146 A 13 VAL H A 14 TYR H 1.0 1.8 5.0 197 147 A 13 VAL H A 25 CYS HA 1.0 1.8 5.0 198 148 A 13 VAL H A 25 CYS HBy 1.0 1.8 6.0 199 148 A 25 CYS HBx A 13 VAL H 1.0 1.8 6.0 200 149 A 13 VAL H A 26 TYR HBy 1.0 1.8 6.0 201 149 A 13 VAL H A 26 TYR HBx 1.0 1.8 6.0 202 150 A 13 VAL H A 26 TYR H 1.0 1.8 5.0 203 151 A 14 TYR H A 14 TYR HA 1.0 1.8 3.5 204 152 A 15 GLY H A 14 TYR HA 1.0 1.8 3.5 205 153 A 24 PHE H A 14 TYR HA 1.0 1.8 5.0 206 154 A 26 TYR H A 14 TYR HA 1.0 1.8 5.0 207 155 A 14 TYR H A 14 TYR HBy 1.0 1.8 3.5 208 155 A 14 TYR H A 14 TYR HBx 1.0 1.8 3.5 209 156 A 15 GLY H A 14 TYR HBy 1.0 1.8 3.9 210 156 A 15 GLY H A 14 TYR HBx 1.0 1.8 3.9 211 157 A 24 PHE H A 14 TYR HBy 1.0 1.8 6.0 212 157 A 24 PHE H A 14 TYR HBx 1.0 1.8 6.0 213 158 A 53 CYS H A 14 TYR HBy 1.0 1.8 4.5 214 158 A 53 CYS H A 14 TYR HBx 1.0 1.8 4.5 215 159 A 14 TYR H A 14 TYR HD% 1.0 1.8 4.9 216 160 A 15 GLY H A 14 TYR HD% 1.0 1.8 5.5 217 161 A 24 PHE H A 14 TYR HD% 1.0 1.8 5.5 218 162 A 53 CYS H A 14 TYR HD% 1.0 1.8 7.0 219 163 A 55 ARG H A 14 TYR HD% 1.0 1.8 7.0 220 164 A 14 TYR HE% A 14 TYR H 1.0 1.8 5.5 221 165 A 14 TYR HE% A 55 ARG H 1.0 1.8 5.5 222 166 A 14 TYR HE% A 57 SER H 1.0 1.8 5.5 223 167 A 14 TYR HE% A 58 LEU H 1.0 1.8 7.0 224 168 A 14 TYR H A 15 GLY H 1.0 1.8 5.0 225 169 A 26 TYR H A 14 TYR H 1.0 1.8 5.0 226 170 A 14 TYR H A 52 GLN HA 1.0 1.8 5.0 227 171 A 14 TYR H A 53 CYS HA 1.0 1.8 5.0 228 172 A 14 TYR H A 54 THR HA 1.0 1.8 5.0 229 173 A 14 TYR H A 53 CYS HBy 1.0 1.8 4.5 230 173 A 14 TYR H A 53 CYS HBx 1.0 1.8 4.5 231 174 A 14 TYR H A 53 CYS H 1.0 1.8 3.5 232 175 A 14 TYR H A 54 THR HG2% 1.0 1.8 6.5 233 176 A 14 TYR H A 58 LEU HD1% 1.0 1.8 7.4 234 176 A 14 TYR H A 58 LEU HD2% 1.0 1.8 7.4 235 177 A 15 GLY H A 15 GLY HAy 1.0 1.8 3.5 236 177 A 15 GLY H A 15 GLY HAx 1.0 1.8 3.5 237 178 A 16 ARG H A 15 GLY HAy 1.0 1.8 3.9 238 178 A 15 GLY HAx A 16 ARG H 1.0 1.8 3.9 239 179 A 24 PHE H A 15 GLY HAy 1.0 1.8 6.0 240 179 A 24 PHE H A 15 GLY HAx 1.0 1.8 6.0 241 180 A 26 TYR H A 15 GLY HAy 1.0 1.8 6.0 242 180 A 26 TYR H A 15 GLY HAx 1.0 1.8 6.0 243 181 A 51 GLU H A 15 GLY HAy 1.0 1.8 6.0 244 181 A 15 GLY HAx A 51 GLU H 1.0 1.8 6.0 245 182 A 53 CYS H A 15 GLY HAy 1.0 1.8 6.0 246 182 A 53 CYS H A 15 GLY HAx 1.0 1.8 6.0 247 183 A 15 GLY H A 16 ARG H 1.0 1.8 5.0 248 184 A 15 GLY H A 23 VAL HA 1.0 1.8 5.0 249 185 A 15 GLY H A 23 VAL HB 1.0 1.8 5.0 250 186 A 15 GLY H A 23 VAL HG1% 1.0 1.8 5.9 251 186 A 15 GLY H A 23 VAL HG2% 1.0 1.8 5.9 252 187 A 24 PHE HA A 15 GLY H 1.0 1.8 5.0 253 188 A 24 PHE H A 15 GLY H 1.0 1.8 3.5 254 189 A 15 GLY H A 24 PHE HBy 1.0 1.8 6.0 255 189 A 24 PHE HBx A 15 GLY H 1.0 1.8 6.0 256 190 A 15 GLY H A 25 CYS HA 1.0 1.8 3.5 257 191 A 15 GLY H A 26 TYR HA 1.0 1.8 5.0 258 192 A 15 GLY H A 26 TYR HBy 1.0 1.8 4.5 259 192 A 15 GLY H A 26 TYR HBx 1.0 1.8 4.5 260 193 A 15 GLY H A 26 TYR HD% 1.0 1.8 5.5 261 194 A 26 TYR H A 15 GLY H 1.0 1.8 3.5 262 195 A 15 GLY H A 29 ALA HB% 1.0 1.8 5.0 263 196 A 16 ARG HA A 16 ARG HE 1.0 1.8 5.0 264 197 A 24 PHE HE% A 16 ARG HA 1.0 1.8 7.0 265 198 A 16 ARG H A 16 ARG HA 1.0 1.8 3.5 266 199 A 16 ARG HA A 17 MET H 1.0 1.8 2.9 267 200 A 51 GLU H A 16 ARG HA 1.0 1.8 5.0 268 201 A 16 ARG H A 16 ARG HBx 1.0 1.8 3.5 269 201 A 16 ARG H A 16 ARG HBy 1.0 1.8 3.5 270 202 A 16 ARG H A 16 ARG HDx 1.0 1.8 6.0 271 202 A 16 ARG H A 16 ARG HDy 1.0 1.8 6.0 272 203 A 16 ARG HE A 23 VAL HG1% 1.0 1.8 7.4 273 203 A 23 VAL HG2% A 16 ARG HE 1.0 1.8 7.4 274 204 A 16 ARG HE A 58 LEU HD1% 1.0 1.8 7.4 275 204 A 58 LEU HD2% A 16 ARG HE 1.0 1.8 7.4 276 205 A 16 ARG HE A 70 THR HB 1.0 1.8 5.0 277 206 A 16 ARG HE A 71 TYR HA 1.0 1.8 5.0 278 207 A 16 ARG HE A 72 LEU HD1% 1.0 1.8 7.4 279 207 A 16 ARG HE A 72 LEU HD2% 1.0 1.8 7.4 280 208 A 16 ARG H A 16 ARG HGy 1.0 1.8 4.5 281 208 A 16 ARG H A 16 ARG HGx 1.0 1.8 4.5 282 209 A 17 MET H A 16 ARG HGy 1.0 1.8 3.9 283 209 A 17 MET H A 16 ARG HGx 1.0 1.8 3.9 284 210 A 21 LYS H A 16 ARG HGy 1.0 1.8 6.0 285 210 A 16 ARG HGx A 21 LYS H 1.0 1.8 6.0 286 211 A 22 HIS H A 16 ARG HGy 1.0 1.8 6.0 287 211 A 16 ARG HGx A 22 HIS H 1.0 1.8 6.0 288 212 A 51 GLU H A 16 ARG HGy 1.0 1.8 4.5 289 212 A 51 GLU H A 16 ARG HGx 1.0 1.8 4.5 290 213 A 16 ARG H A 17 MET H 1.0 1.8 5.0 291 214 A 16 ARG H A 23 VAL HA 1.0 1.8 5.0 292 215 A 16 ARG H A 23 VAL HG1% 1.0 1.8 7.4 293 215 A 16 ARG H A 23 VAL HG2% 1.0 1.8 7.4 294 216 A 16 ARG H A 26 TYR HD% 1.0 1.8 5.5 295 217 A 16 ARG H A 26 TYR HE% 1.0 1.8 7.0 296 218 A 16 ARG H A 29 ALA HB% 1.0 1.8 6.5 297 219 A 16 ARG H A 50 ILE HG2% 1.0 1.8 4.4 298 220 A 16 ARG H A 51 GLU HA 1.0 1.8 5.0 299 221 A 16 ARG H A 51 GLU HGx 1.0 1.8 6.0 300 221 A 16 ARG H A 51 GLU HGy 1.0 1.8 6.0 301 222 A 16 ARG H A 51 GLU H 1.0 1.8 3.5 302 223 A 16 ARG H A 23 VAL HA 1.0 1.8 5.0 303 224 A 52 GLN HA A 16 ARG H 1.0 1.8 3.5 304 225 A 16 ARG H A 52 GLN H 1.0 1.8 5.0 305 226 A 53 CYS H A 16 ARG H 1.0 1.8 5.0 306 227 A 17 MET H A 17 MET HA 1.0 1.8 2.9 307 228 A 17 MET HA A 18 ILE H 1.0 1.8 2.9 308 229 A 51 GLU H A 17 MET HA 1.0 1.8 3.5 309 230 A 17 MET H A 17 MET HBy 1.0 1.8 3.5 310 230 A 17 MET H A 17 MET HBx 1.0 1.8 3.5 311 231 A 18 ILE H A 17 MET HBy 1.0 1.8 3.9 312 231 A 18 ILE H A 17 MET HBx 1.0 1.8 3.9 313 232 A 21 LYS H A 17 MET HBy 1.0 1.8 4.5 314 232 A 21 LYS H A 17 MET HBx 1.0 1.8 4.5 315 233 A 22 HIS H A 17 MET HBy 1.0 1.8 4.5 316 233 A 22 HIS H A 17 MET HBx 1.0 1.8 4.5 317 234 A 17 MET HE% A 29 ALA H 1.0 1.8 6.5 318 235 A 51 GLU H A 17 MET HE% 1.0 1.8 6.5 319 236 A 17 MET HE% A 42 GLY H 1.0 1.8 6.5 320 237 A 17 MET H A 18 ILE H 1.0 1.8 5.0 321 238 A 17 MET H A 21 LYS HA 1.0 1.8 5.0 322 239 A 17 MET H A 21 LYS HGy 1.0 1.8 6.0 323 239 A 17 MET H A 21 LYS HGx 1.0 1.8 6.0 324 240 A 17 MET H A 21 LYS H 1.0 1.8 5.0 325 241 A 17 MET H A 22 HIS HBy 1.0 1.8 4.5 326 241 A 17 MET H A 22 HIS HBx 1.0 1.8 4.5 327 242 A 17 MET H A 22 HIS H 1.0 1.8 3.5 328 243 A 23 VAL HA A 17 MET H 1.0 1.8 3.5 329 244 A 17 MET H A 23 VAL HG1% 1.0 1.8 5.3 330 244 A 23 VAL HG2% A 17 MET H 1.0 1.8 5.3 331 245 A 24 PHE HD% A 17 MET H 1.0 1.8 7.0 332 246 A 24 PHE HE% A 17 MET H 1.0 1.8 7.0 333 247 A 18 ILE HA A 48 GLN H 1.0 1.8 5.0 334 248 A 18 ILE HA A 49 ARG H 1.0 1.8 5.0 335 249 A 18 ILE H A 18 ILE HA 1.0 1.8 2.9 336 250 A 18 ILE HA A 20 CYS H 1.0 1.8 5.0 337 251 A 21 LYS H A 18 ILE HA 1.0 1.8 3.5 338 252 A 18 ILE H A 18 ILE HB 1.0 1.8 5.0 339 253 A 49 ARG H A 18 ILE HB 1.0 1.8 3.5 340 254 A 18 ILE H A 18 ILE HD1% 1.0 1.8 5.0 341 255 A 49 ARG H A 18 ILE HD1% 1.0 1.8 6.5 342 256 A 51 GLU H A 18 ILE HD1% 1.0 1.8 6.5 343 257 A 18 ILE H A 18 ILE HG1x 1.0 1.8 2.9 344 258 A 49 ARG H A 18 ILE HG1x 1.0 1.8 3.5 345 259 A 18 ILE H A 18 ILE HG1y 1.0 1.8 2.9 346 260 A 49 ARG H A 18 ILE HG1y 1.0 1.8 3.5 347 261 A 18 ILE H A 18 ILE HG2% 1.0 1.8 5.0 348 262 A 21 LYS H A 18 ILE HG2% 1.0 1.8 5.0 349 263 A 49 ARG H A 18 ILE HG2% 1.0 1.8 6.5 350 264 A 18 ILE H A 20 CYS H 1.0 1.8 5.0 351 265 A 21 LYS H A 18 ILE H 1.0 1.8 5.0 352 266 A 18 ILE H A 47 VAL HA 1.0 1.8 5.0 353 267 A 18 ILE H A 47 VAL HG1% 1.0 1.8 5.3 354 267 A 18 ILE H A 47 VAL HG2% 1.0 1.8 5.3 355 268 A 18 ILE H A 48 GLN H 1.0 1.8 5.0 356 269 A 18 ILE H A 48 GLN HBy 1.0 1.8 6.0 357 269 A 18 ILE H A 48 GLN HBx 1.0 1.8 6.0 358 270 A 18 ILE H A 49 ARG HBy 1.0 1.8 6.0 359 270 A 18 ILE H A 49 ARG HBx 1.0 1.8 6.0 360 271 A 18 ILE H A 49 ARG HGy 1.0 1.8 6.0 361 271 A 18 ILE H A 49 ARG HGx 1.0 1.8 6.0 362 272 A 18 ILE H A 49 ARG H 1.0 1.8 2.9 363 273 A 18 ILE H A 50 ILE HA 1.0 1.8 3.5 364 274 A 50 ILE HG2% A 18 ILE H 1.0 1.8 6.5 365 275 A 51 GLU H A 18 ILE H 1.0 1.8 5.0 366 276 A 20 CYS H A 19 PRO HA 1.0 1.8 3.5 367 277 A 20 CYS H A 19 PRO HBy 1.0 1.8 6.0 368 277 A 20 CYS H A 19 PRO HBx 1.0 1.8 6.0 369 278 A 20 CYS H A 19 PRO HDy 1.0 1.8 4.5 370 278 A 20 CYS H A 19 PRO HDx 1.0 1.8 4.5 371 279 A 48 GLN HE2y A 19 PRO HDy 1.0 1.8 6.0 372 279 A 19 PRO HDx A 48 GLN HE2y 1.0 1.8 6.0 373 280 A 48 GLN H A 19 PRO HDy 1.0 1.8 3.9 374 280 A 48 GLN H A 19 PRO HDx 1.0 1.8 3.9 375 281 A 49 ARG H A 19 PRO HDy 1.0 1.8 6.0 376 281 A 49 ARG H A 19 PRO HDx 1.0 1.8 6.0 377 282 A 20 CYS H A 19 PRO HGy 1.0 1.8 4.5 378 282 A 20 CYS H A 19 PRO HGx 1.0 1.8 4.5 379 283 A 20 CYS H A 20 CYS HA 1.0 1.8 2.9 380 284 A 21 LYS H A 20 CYS HA 1.0 1.8 3.5 381 285 A 20 CYS H A 20 CYS HBy 1.0 1.8 3.5 382 285 A 20 CYS H A 20 CYS HBx 1.0 1.8 3.5 383 286 A 21 LYS H A 20 CYS HBy 1.0 1.8 6.0 384 286 A 21 LYS H A 20 CYS HBx 1.0 1.8 6.0 385 287 A 22 HIS H A 20 CYS HBy 1.0 1.8 6.0 386 287 A 22 HIS H A 20 CYS HBx 1.0 1.8 6.0 387 288 A 21 LYS HA A 20 CYS H 1.0 1.8 5.0 388 289 A 21 LYS H A 20 CYS H 1.0 1.8 2.9 389 290 A 20 CYS H A 47 VAL HG1% 1.0 1.8 7.4 390 290 A 20 CYS H A 47 VAL HG2% 1.0 1.8 7.4 391 291 A 21 LYS H A 21 LYS HA 1.0 1.8 2.9 392 292 A 22 HIS H A 21 LYS HA 1.0 1.8 3.5 393 293 A 21 LYS H A 21 LYS HBy 1.0 1.8 4.1 394 293 A 21 LYS H A 21 LYS HBx 1.0 1.8 4.1 395 294 A 22 HIS H A 21 LYS HBy 1.0 1.8 6.0 396 294 A 22 HIS H A 21 LYS HBx 1.0 1.8 6.0 397 295 A 21 LYS H A 21 LYS HDy 1.0 1.8 6.0 398 295 A 21 LYS H A 21 LYS HDx 1.0 1.8 6.0 399 296 A 21 LYS H A 22 HIS HA 1.0 1.8 5.0 400 297 A 21 LYS H A 22 HIS H 1.0 1.8 2.9 401 298 A 22 HIS H A 22 HIS HA 1.0 1.8 3.5 402 299 A 22 HIS HA A 23 VAL H 1.0 1.8 3.5 403 300 A 22 HIS H A 22 HIS HBy 1.0 1.8 3.5 404 300 A 22 HIS H A 22 HIS HBx 1.0 1.8 3.5 405 301 A 23 VAL H A 22 HIS HBy 1.0 1.8 6.0 406 301 A 22 HIS HBx A 23 VAL H 1.0 1.8 6.0 407 302 A 22 HIS H A 22 HIS HD2 1.0 1.8 5.0 408 303 A 22 HIS H A 23 VAL HG1% 1.0 1.8 7.4 409 303 A 23 VAL HG2% A 22 HIS H 1.0 1.8 7.4 410 304 A 22 HIS H A 23 VAL H 1.0 1.8 5.0 411 305 A 23 VAL HA A 23 VAL H 1.0 1.8 5.0 412 306 A 24 PHE H A 23 VAL HA 1.0 1.8 2.9 413 307 A 24 PHE H A 23 VAL HB 1.0 1.8 2.9 414 308 A 23 VAL H A 23 VAL HG1% 1.0 1.8 5.2 415 308 A 23 VAL HG2% A 23 VAL H 1.0 1.8 5.2 416 309 A 24 PHE H A 23 VAL HG1% 1.0 1.8 5.3 417 309 A 24 PHE H A 23 VAL HG2% 1.0 1.8 5.3 418 310 A 24 PHE H A 23 VAL H 1.0 1.8 5.0 419 311 A 24 PHE HA A 24 PHE H 1.0 1.8 2.9 420 312 A 25 CYS H A 24 PHE HA 1.0 1.8 2.9 421 313 A 24 PHE H A 24 PHE HBy 1.0 1.8 4.1 422 313 A 24 PHE HBx A 24 PHE H 1.0 1.8 4.1 423 314 A 25 CYS H A 24 PHE HBy 1.0 1.8 3.9 424 314 A 25 CYS H A 24 PHE HBx 1.0 1.8 3.9 425 315 A 28 CYS H A 24 PHE HBy 1.0 1.8 6.0 426 315 A 24 PHE HBx A 28 CYS H 1.0 1.8 6.0 427 316 A 29 ALA H A 24 PHE HBy 1.0 1.8 4.5 428 316 A 24 PHE HBx A 29 ALA H 1.0 1.8 4.5 429 317 A 24 PHE HD% A 24 PHE H 1.0 1.8 5.5 430 318 A 25 CYS H A 24 PHE HD% 1.0 1.8 5.5 431 319 A 24 PHE HD% A 29 ALA H 1.0 1.8 7.0 432 320 A 24 PHE HE% A 24 PHE H 1.0 1.8 7.0 433 321 A 24 PHE HE% A 42 GLY H 1.0 1.8 5.5 434 322 A 24 PHE HE% A 43 CYS H 1.0 1.8 7.0 435 323 A 25 CYS H A 24 PHE H 1.0 1.8 5.0 436 324 A 24 PHE H A 29 ALA HB% 1.0 1.8 5.0 437 325 A 24 PHE H A 25 CYS HA 1.0 1.8 5.0 438 326 A 42 GLY H A 24 PHE HZ 1.0 1.8 2.9 439 327 A 43 CYS H A 24 PHE HZ 1.0 1.8 3.5 440 328 A 25 CYS H A 25 CYS HA 1.0 1.8 3.5 441 329 A 26 TYR H A 25 CYS HA 1.0 1.8 2.9 442 330 A 27 ASP H A 25 CYS HA 1.0 1.8 5.0 443 331 A 25 CYS H A 25 CYS HBy 1.0 1.8 4.1 444 331 A 25 CYS H A 25 CYS HBx 1.0 1.8 4.1 445 332 A 26 TYR H A 25 CYS HBy 1.0 1.8 3.9 446 332 A 25 CYS HBx A 26 TYR H 1.0 1.8 3.9 447 333 A 27 ASP H A 25 CYS HBy 1.0 1.8 4.5 448 333 A 25 CYS HBx A 27 ASP H 1.0 1.8 4.5 449 334 A 25 CYS H A 26 TYR H 1.0 1.8 5.0 450 335 A 25 CYS H A 28 CYS H 1.0 1.8 5.0 451 336 A 25 CYS H A 29 ALA HB% 1.0 1.8 6.5 452 337 A 25 CYS H A 29 ALA H 1.0 1.8 5.0 453 338 A 26 TYR H A 26 TYR HA 1.0 1.8 2.9 454 339 A 27 ASP H A 26 TYR HA 1.0 1.8 3.5 455 340 A 26 TYR H A 26 TYR HBy 1.0 1.8 3.5 456 340 A 26 TYR H A 26 TYR HBx 1.0 1.8 3.5 457 341 A 27 ASP H A 26 TYR HBy 1.0 1.8 4.5 458 341 A 27 ASP H A 26 TYR HBx 1.0 1.8 4.5 459 342 A 26 TYR H A 26 TYR HD% 1.0 1.8 5.5 460 343 A 27 ASP H A 26 TYR HD% 1.0 1.8 5.5 461 344 A 26 TYR HD% A 52 GLN H 1.0 1.8 7.0 462 345 A 53 CYS H A 26 TYR HD% 1.0 1.8 7.0 463 346 A 27 ASP H A 26 TYR HE% 1.0 1.8 7.0 464 347 A 26 TYR HE% A 52 GLN H 1.0 1.8 5.5 465 348 A 53 CYS H A 26 TYR HE% 1.0 1.8 7.0 466 349 A 26 TYR H A 27 ASP H 1.0 1.8 3.5 467 350 A 26 TYR H A 29 ALA HB% 1.0 1.8 6.5 468 351 A 27 ASP H A 27 ASP HA 1.0 1.8 2.9 469 352 A 28 CYS H A 27 ASP HA 1.0 1.8 3.5 470 353 A 29 ALA H A 27 ASP HA 1.0 1.8 5.0 471 354 A 27 ASP HA A 30 ILE H 1.0 1.8 3.5 472 355 A 27 ASP H A 27 ASP HBy 1.0 1.8 3.5 473 355 A 27 ASP H A 27 ASP HBx 1.0 1.8 3.5 474 356 A 28 CYS H A 27 ASP HBy 1.0 1.8 3.9 475 356 A 28 CYS H A 27 ASP HBx 1.0 1.8 3.9 476 357 A 27 ASP H A 28 CYS HBy 1.0 1.8 6.0 477 357 A 27 ASP H A 28 CYS HBx 1.0 1.8 6.0 478 358 A 27 ASP H A 28 CYS H 1.0 1.8 2.9 479 359 A 27 ASP H A 29 ALA HB% 1.0 1.8 6.5 480 360 A 27 ASP H A 29 ALA H 1.0 1.8 3.5 481 361 A 27 ASP H A 30 ILE HG2% 1.0 1.8 6.5 482 362 A 28 CYS H A 28 CYS HA 1.0 1.8 2.9 483 363 A 29 ALA H A 28 CYS HA 1.0 1.8 3.5 484 364 A 28 CYS HA A 31 LEU H 1.0 1.8 2.9 485 365 A 28 CYS H A 28 CYS HBy 1.0 1.8 3.5 486 365 A 28 CYS H A 28 CYS HBx 1.0 1.8 3.5 487 366 A 29 ALA H A 28 CYS HBy 1.0 1.8 3.9 488 366 A 29 ALA H A 28 CYS HBx 1.0 1.8 3.9 489 367 A 28 CYS H A 29 ALA HA 1.0 1.8 5.0 490 368 A 29 ALA HB% A 28 CYS H 1.0 1.8 5.0 491 369 A 29 ALA H A 28 CYS H 1.0 1.8 2.9 492 370 A 28 CYS H A 30 ILE HG2% 1.0 1.8 6.5 493 371 A 28 CYS H A 30 ILE H 1.0 1.8 5.0 494 372 A 28 CYS H A 31 LEU HD1% 1.0 1.8 7.4 495 372 A 28 CYS H A 31 LEU HD2% 1.0 1.8 7.4 496 373 A 29 ALA H A 29 ALA HA 1.0 1.8 2.9 497 374 A 30 ILE H A 29 ALA HA 1.0 1.8 3.5 498 375 A 31 LEU H A 29 ALA HA 1.0 3.3 5.0 499 376 A 29 ALA HA A 32 HIS H 1.0 1.8 3.5 500 377 A 29 ALA HB% A 29 ALA H 1.0 1.8 4.0 501 378 A 29 ALA HB% A 30 ILE H 1.0 1.8 4.4 502 379 A 29 ALA H A 30 ILE HG1y 1.0 1.8 5.0 503 380 A 29 ALA H A 30 ILE HG2% 1.0 1.8 5.0 504 381 A 50 ILE HG2% A 29 ALA H 1.0 1.8 6.5 505 382 A 29 ALA H A 30 ILE H 1.0 1.8 2.9 506 383 A 29 ALA H A 31 LEU H 1.0 1.8 5.0 507 384 A 30 ILE H A 30 ILE HA 1.0 1.8 2.9 508 385 A 32 HIS H A 30 ILE HA 1.0 1.8 5.0 509 386 A 30 ILE HA A 33 GLU H 1.0 1.8 3.5 510 387 A 30 ILE HA A 34 LYS H 1.0 1.8 5.0 511 388 A 30 ILE H A 30 ILE HB 1.0 1.8 3.5 512 389 A 31 LEU H A 30 ILE HG1x 1.0 1.8 3.5 513 390 A 31 LEU H A 30 ILE HG1y 1.0 1.8 3.5 514 391 A 30 ILE H A 30 ILE HG2% 1.0 1.8 4.4 515 392 A 30 ILE HG2% A 31 LEU H 1.0 1.8 4.4 516 393 A 30 ILE HG2% A 32 HIS H 1.0 1.8 6.5 517 394 A 30 ILE HG2% A 34 LYS H 1.0 1.8 6.5 518 395 A 30 ILE H A 31 LEU H 1.0 1.8 2.9 519 396 A 30 ILE H A 50 ILE HD1% 1.0 1.8 5.0 520 397 A 31 LEU H A 31 LEU HA 1.0 1.8 2.9 521 398 A 32 HIS H A 31 LEU HA 1.0 1.8 3.5 522 399 A 34 LYS H A 31 LEU HA 1.0 1.8 3.5 523 400 A 31 LEU H A 31 LEU HBy 1.0 1.8 3.5 524 400 A 31 LEU H A 31 LEU HBx 1.0 1.8 3.5 525 401 A 32 HIS H A 31 LEU HBy 1.0 1.8 3.9 526 401 A 32 HIS H A 31 LEU HBx 1.0 1.8 3.9 527 402 A 31 LEU H A 31 LEU HD1% 1.0 1.8 5.2 528 402 A 31 LEU H A 31 LEU HD2% 1.0 1.8 5.2 529 403 A 32 HIS H A 31 LEU HD1% 1.0 1.8 7.4 530 403 A 31 LEU HD2% A 32 HIS H 1.0 1.8 7.4 531 404 A 31 LEU H A 31 LEU HG 1.0 1.8 2.9 532 405 A 32 HIS H A 31 LEU HG 1.0 1.8 5.0 533 406 A 31 LEU H A 32 HIS HBy 1.0 1.8 6.0 534 406 A 31 LEU H A 32 HIS HBx 1.0 1.8 6.0 535 407 A 31 LEU H A 32 HIS HD2 1.0 1.8 5.0 536 408 A 31 LEU H A 32 HIS H 1.0 1.8 2.9 537 409 A 32 HIS H A 32 HIS HA 1.0 1.8 2.9 538 410 A 33 GLU H A 32 HIS HA 1.0 1.8 3.5 539 411 A 34 LYS H A 32 HIS HA 1.0 1.8 5.0 540 412 A 32 HIS HA A 35 LYS H 1.0 1.8 3.5 541 413 A 32 HIS HA A 37 ASP H 1.0 1.8 5.0 542 414 A 32 HIS H A 32 HIS HBy 1.0 1.8 3.5 543 414 A 32 HIS H A 32 HIS HBx 1.0 1.8 3.5 544 415 A 33 GLU H A 32 HIS HBy 1.0 1.8 4.5 545 415 A 33 GLU H A 32 HIS HBx 1.0 1.8 4.5 546 416 A 32 HIS H A 32 HIS HD2 1.0 1.8 3.5 547 417 A 32 HIS H A 33 GLU HBy 1.0 1.8 6.0 548 417 A 32 HIS H A 33 GLU HBx 1.0 1.8 6.0 549 418 A 32 HIS H A 33 GLU HGx 1.0 1.8 6.0 550 418 A 32 HIS H A 33 GLU HGy 1.0 1.8 6.0 551 419 A 32 HIS H A 34 LYS H 1.0 1.8 5.0 552 420 A 32 HIS H A 35 LYS H 1.0 1.8 5.0 553 421 A 33 GLU H A 35 LYS H 1.0 1.8 5.0 554 422 A 31 LEU H A 33 GLU H 1.0 1.8 5.0 555 423 A 33 GLU H A 33 GLU HA 1.0 1.8 2.9 556 424 A 33 GLU H A 33 GLU HBy 1.0 1.8 3.5 557 424 A 33 GLU H A 33 GLU HBx 1.0 1.8 3.5 558 425 A 34 LYS H A 33 GLU HBy 1.0 1.8 3.9 559 425 A 34 LYS H A 33 GLU HBx 1.0 1.8 3.9 560 426 A 33 GLU H A 33 GLU HGx 1.0 1.8 3.9 561 426 A 33 GLU H A 33 GLU HGy 1.0 1.8 3.9 562 427 A 33 GLU H A 34 LYS HDx 1.0 1.8 6.0 563 427 A 33 GLU H A 34 LYS HDy 1.0 1.8 6.0 564 428 A 33 GLU H A 34 LYS HG2 1.0 1.8 6.0 565 428 A 33 GLU H A 34 LYS HG3 1.0 1.8 6.0 566 429 A 33 GLU H A 34 LYS H 1.0 1.8 2.9 567 430 A 33 GLU H A 50 ILE HD1% 1.0 1.8 5.0 568 431 A 34 LYS H A 34 LYS HA 1.0 1.8 2.9 569 432 A 35 LYS H A 34 LYS HA 1.0 1.8 3.5 570 433 A 33 GLU HA A 38 LYS H 1.0 1.8 5.0 571 434 A 34 LYS H A 34 LYS HBx 1.0 1.8 3.5 572 434 A 34 LYS H A 34 LYS HBy 1.0 1.8 3.5 573 435 A 34 LYS H A 34 LYS HDx 1.0 1.8 4.5 574 435 A 34 LYS H A 34 LYS HDy 1.0 1.8 4.5 575 436 A 34 LYS H A 34 LYS HEx 1.0 1.8 6.0 576 436 A 34 LYS H A 34 LYS HEy 1.0 1.8 6.0 577 437 A 34 LYS H A 34 LYS HG2 1.0 1.8 3.9 578 437 A 34 LYS H A 34 LYS HG3 1.0 1.8 3.9 579 438 A 34 LYS H A 35 LYS HA 1.0 1.8 5.0 580 439 A 34 LYS H A 35 LYS H 1.0 1.8 2.9 581 440 A 34 LYS H A 36 GLY H 1.0 1.8 5.0 582 441 A 34 LYS H A 50 ILE HD1% 1.0 1.8 6.5 583 442 A 35 LYS H A 35 LYS HA 1.0 1.8 2.9 584 443 A 35 LYS HA A 36 GLY H 1.0 1.8 3.5 585 444 A 37 ASP H A 35 LYS HA 1.0 1.8 5.0 586 445 A 35 LYS H A 35 LYS HBx 1.0 1.8 3.5 587 445 A 35 LYS H A 35 LYS HBy 1.0 1.8 3.5 588 446 A 36 GLY H A 35 LYS HBx 1.0 1.8 4.5 589 446 A 36 GLY H A 35 LYS HBy 1.0 1.8 4.5 590 447 A 35 LYS H A 35 LYS HDx 1.0 1.8 4.5 591 447 A 35 LYS H A 35 LYS HDy 1.0 1.8 4.5 592 448 A 35 LYS H A 35 LYS HGy 1.0 1.8 4.5 593 448 A 35 LYS H A 35 LYS HGx 1.0 1.8 4.5 594 449 A 36 GLY H A 35 LYS HGy 1.0 1.8 6.0 595 449 A 36 GLY H A 35 LYS HGx 1.0 1.8 6.0 596 450 A 35 LYS H A 36 GLY H 1.0 1.8 2.9 597 451 A 36 GLY H A 36 GLY HAy 1.0 1.8 3.5 598 451 A 36 GLY H A 36 GLY HAx 1.0 1.8 3.5 599 452 A 37 ASP H A 36 GLY HAy 1.0 1.8 3.9 600 452 A 37 ASP H A 36 GLY HAx 1.0 1.8 3.9 601 453 A 38 LYS H A 36 GLY HAy 1.0 1.8 4.5 602 453 A 38 LYS H A 36 GLY HAx 1.0 1.8 4.5 603 454 A 37 ASP H A 36 GLY H 1.0 1.8 2.9 604 455 A 38 LYS H A 36 GLY H 1.0 1.8 5.0 605 456 A 37 ASP H A 37 ASP HA 1.0 1.8 2.9 606 457 A 38 LYS H A 37 ASP HA 1.0 1.8 3.5 607 458 A 37 ASP HA A 39 MET H 1.0 1.8 5.0 608 459 A 37 ASP H A 37 ASP HBy 1.0 1.8 3.5 609 459 A 37 ASP H A 37 ASP HBx 1.0 1.8 3.5 610 460 A 38 LYS H A 37 ASP HBy 1.0 1.8 6.0 611 460 A 38 LYS H A 37 ASP HBx 1.0 1.8 6.0 612 461 A 39 MET H A 37 ASP HBy 1.0 1.8 6.0 613 461 A 39 MET H A 37 ASP HBx 1.0 1.8 6.0 614 462 A 37 ASP H A 38 LYS HBy 1.0 1.8 6.0 615 462 A 37 ASP H A 38 LYS HBx 1.0 1.8 6.0 616 463 A 37 ASP H A 38 LYS HGx 1.0 1.8 4.5 617 463 A 37 ASP H A 38 LYS HGy 1.0 1.8 4.5 618 464 A 37 ASP H A 38 LYS H 1.0 1.8 2.9 619 465 A 38 LYS H A 38 LYS HA 1.0 1.8 2.9 620 466 A 39 MET H A 38 LYS HA 1.0 1.8 3.5 621 467 A 38 LYS HA A 47 VAL H 1.0 1.8 5.0 622 468 A 47 VAL H A 38 LYS HBy 1.0 1.8 5.0 623 468 A 38 LYS HBx A 47 VAL H 1.0 1.8 5.0 624 469 A 38 LYS H A 38 LYS HBy 1.0 1.8 3.5 625 469 A 38 LYS H A 38 LYS HBx 1.0 1.8 3.5 626 470 A 39 MET H A 38 LYS HBy 1.0 1.8 4.5 627 470 A 39 MET H A 38 LYS HBx 1.0 1.8 4.5 628 471 A 38 LYS H A 38 LYS HEy 1.0 1.8 6.0 629 471 A 38 LYS H A 38 LYS HEx 1.0 1.8 6.0 630 472 A 39 MET H A 38 LYS HEy 1.0 1.8 6.0 631 472 A 39 MET H A 38 LYS HEx 1.0 1.8 6.0 632 473 A 39 MET H A 38 LYS HGx 1.0 1.8 4.5 633 473 A 39 MET H A 38 LYS HGy 1.0 1.8 4.5 634 474 A 47 VAL H A 38 LYS HGx 1.0 1.8 6.0 635 474 A 38 LYS HGy A 47 VAL H 1.0 1.8 6.0 636 475 A 38 LYS H A 39 MET HGy 1.0 1.8 6.0 637 475 A 38 LYS H A 39 MET HGx 1.0 1.8 6.0 638 476 A 38 LYS H A 39 MET H 1.0 1.8 2.9 639 477 A 39 MET H A 39 MET HA 1.0 1.8 2.9 640 478 A 39 MET HA A 40 CYS H 1.0 1.8 2.9 641 479 A 39 MET HA A 45 ASP H 1.0 1.8 5.0 642 480 A 47 VAL H A 39 MET HA 1.0 1.8 2.9 643 481 A 39 MET H A 39 MET HBy 1.0 1.8 3.5 644 481 A 39 MET H A 39 MET HBx 1.0 1.8 3.5 645 482 A 40 CYS H A 39 MET HBy 1.0 1.8 3.9 646 482 A 40 CYS H A 39 MET HBx 1.0 1.8 3.9 647 483 A 44 SER H A 39 MET HBy 1.0 1.8 6.0 648 483 A 39 MET HBx A 44 SER H 1.0 1.8 6.0 649 484 A 45 ASP H A 39 MET HBy 1.0 1.8 6.0 650 484 A 45 ASP H A 39 MET HBx 1.0 1.8 6.0 651 485 A 40 CYS H A 39 MET HE% 1.0 1.8 6.5 652 486 A 39 MET H A 39 MET HGy 1.0 1.8 4.5 653 486 A 39 MET H A 39 MET HGx 1.0 1.8 4.5 654 487 A 40 CYS H A 39 MET HGy 1.0 1.8 4.5 655 487 A 39 MET HGx A 40 CYS H 1.0 1.8 4.5 656 488 A 39 MET H A 40 CYS H 1.0 1.8 5.0 657 489 A 39 MET H A 47 VAL HG1% 1.0 1.8 5.9 658 489 A 47 VAL HG2% A 39 MET H 1.0 1.8 5.9 659 490 A 39 MET H A 47 VAL H 1.0 1.8 5.0 660 491 A 40 CYS H A 40 CYS HA 1.0 1.8 2.9 661 492 A 42 GLY H A 40 CYS HA 1.0 1.8 5.0 662 493 A 43 CYS H A 40 CYS HA 1.0 1.8 5.0 663 494 A 44 SER H A 40 CYS HA 1.0 1.8 5.0 664 495 A 40 CYS H A 40 CYS HBy 1.0 1.8 3.5 665 495 A 40 CYS H A 40 CYS HBx 1.0 1.8 3.5 666 496 A 42 GLY H A 40 CYS HBy 1.0 1.8 4.5 667 496 A 42 GLY H A 40 CYS HBx 1.0 1.8 4.5 668 497 A 43 CYS H A 40 CYS HBy 1.0 1.8 3.9 669 497 A 43 CYS H A 40 CYS HBx 1.0 1.8 3.9 670 498 A 44 SER H A 40 CYS HBy 1.0 1.8 3.9 671 498 A 44 SER H A 40 CYS HBx 1.0 1.8 3.9 672 499 A 45 ASP H A 40 CYS HBy 1.0 1.8 3.9 673 499 A 45 ASP H A 40 CYS HBx 1.0 1.8 3.9 674 500 A 43 CYS H A 40 CYS H 1.0 1.8 5.0 675 501 A 40 CYS H A 46 PRO HA 1.0 1.8 5.0 676 502 A 40 CYS H A 44 SER H 1.0 1.8 5.0 677 503 A 40 CYS H A 45 ASP H 1.0 1.8 2.9 678 504 A 40 CYS H A 47 VAL HG1% 1.0 1.8 5.3 679 504 A 47 VAL HG2% A 40 CYS H 1.0 1.8 5.3 680 505 A 47 VAL H A 40 CYS H 1.0 1.8 3.5 681 506 A 42 GLY H A 41 PRO HA 1.0 1.8 3.5 682 507 A 42 GLY H A 41 PRO HBy 1.0 1.8 4.5 683 507 A 42 GLY H A 41 PRO HBx 1.0 1.8 4.5 684 508 A 42 GLY H A 41 PRO HDy 1.0 1.8 4.5 685 508 A 42 GLY H A 41 PRO HDx 1.0 1.8 4.5 686 509 A 43 CYS H A 41 PRO HDy 1.0 1.8 6.0 687 509 A 43 CYS H A 41 PRO HDx 1.0 1.8 6.0 688 510 A 42 GLY H A 41 PRO HGy 1.0 1.8 4.5 689 510 A 42 GLY H A 41 PRO HGx 1.0 1.8 4.5 690 511 A 42 GLY H A 42 GLY HAy 1.0 1.8 3.5 691 511 A 42 GLY H A 42 GLY HAx 1.0 1.8 3.5 692 512 A 43 CYS H A 42 GLY HAy 1.0 1.8 3.9 693 512 A 43 CYS H A 42 GLY HAx 1.0 1.8 3.9 694 513 A 44 SER H A 42 GLY HAy 1.0 1.8 6.0 695 513 A 44 SER H A 42 GLY HAx 1.0 1.8 6.0 696 514 A 42 GLY H A 43 CYS HA 1.0 1.8 5.0 697 515 A 42 GLY H A 43 CYS HBy 1.0 1.8 6.0 698 515 A 42 GLY H A 43 CYS HBx 1.0 1.8 6.0 699 516 A 42 GLY H A 43 CYS H 1.0 1.8 2.9 700 517 A 42 GLY H A 44 SER H 1.0 1.8 3.5 701 518 A 43 CYS H A 44 SER HA 1.0 1.8 5.0 702 519 A 43 CYS H A 43 CYS HA 1.0 1.8 2.9 703 520 A 44 SER H A 43 CYS HA 1.0 1.8 3.5 704 521 A 43 CYS H A 43 CYS HBy 1.0 1.8 3.5 705 521 A 43 CYS H A 43 CYS HBx 1.0 1.8 3.5 706 522 A 44 SER H A 43 CYS HBy 1.0 1.8 4.5 707 522 A 44 SER H A 43 CYS HBx 1.0 1.8 4.5 708 523 A 45 ASP H A 43 CYS HBy 1.0 1.8 6.0 709 523 A 45 ASP H A 43 CYS HBx 1.0 1.8 6.0 710 524 A 43 CYS H A 44 SER H 1.0 1.8 2.9 711 525 A 43 CYS H A 45 ASP H 1.0 1.8 5.0 712 526 A 44 SER H A 44 SER HA 1.0 1.8 2.9 713 527 A 45 ASP H A 44 SER HA 1.0 1.8 3.5 714 528 A 44 SER H A 44 SER HBx 1.0 1.8 3.5 715 528 A 44 SER H A 44 SER HBy 1.0 1.8 3.5 716 529 A 45 ASP H A 44 SER HBx 1.0 1.8 4.5 717 529 A 45 ASP H A 44 SER HBy 1.0 1.8 4.5 718 530 A 45 ASP H A 44 SER H 1.0 1.8 3.5 719 531 A 44 SER H A 47 VAL HG1% 1.0 1.8 7.4 720 531 A 47 VAL HG2% A 44 SER H 1.0 1.8 7.4 721 532 A 45 ASP H A 45 ASP HA 1.0 1.8 2.9 722 533 A 45 ASP H A 45 ASP HBy 1.0 1.8 3.5 723 533 A 45 ASP H A 45 ASP HBx 1.0 1.8 3.5 724 534 A 47 VAL H A 45 ASP HBy 1.0 1.8 6.0 725 534 A 47 VAL H A 45 ASP HBx 1.0 1.8 6.0 726 535 A 45 ASP H A 46 PRO HDy 1.0 1.8 6.0 727 535 A 45 ASP H A 46 PRO HDx 1.0 1.8 6.0 728 536 A 45 ASP H A 47 VAL HG1% 1.0 1.8 5.9 729 536 A 47 VAL HG2% A 45 ASP H 1.0 1.8 5.9 730 537 A 47 VAL H A 46 PRO HA 1.0 1.8 2.9 731 538 A 47 VAL H A 46 PRO HBy 1.0 1.8 4.5 732 538 A 47 VAL H A 46 PRO HBx 1.0 1.8 4.5 733 539 A 47 VAL HA A 47 VAL H 1.0 1.8 2.9 734 540 A 48 GLN H A 47 VAL HB 1.0 1.8 5.0 735 541 A 47 VAL H A 47 VAL HG1% 1.0 1.8 4.6 736 541 A 47 VAL HG2% A 47 VAL H 1.0 1.8 4.6 737 542 A 48 GLN H A 47 VAL HG1% 1.0 1.8 5.3 738 542 A 48 GLN H A 47 VAL HG2% 1.0 1.8 5.3 739 543 A 49 ARG H A 47 VAL HG1% 1.0 1.8 5.3 740 543 A 49 ARG H A 47 VAL HG2% 1.0 1.8 5.3 741 544 A 50 ILE H A 47 VAL HG1% 1.0 1.8 5.9 742 544 A 47 VAL HG2% A 50 ILE H 1.0 1.8 5.9 743 545 A 48 GLN H A 47 VAL H 1.0 1.8 5.0 744 546 A 48 GLN H A 48 GLN HA 1.0 1.8 2.9 745 547 A 49 ARG H A 48 GLN HA 1.0 1.8 3.5 746 548 A 49 ARG H A 47 VAL HA 1.0 1.8 5.0 747 549 A 49 ARG H A 48 GLN HBy 1.0 1.8 3.9 748 549 A 49 ARG H A 48 GLN HBx 1.0 1.8 3.9 749 550 A 49 ARG H A 48 GLN HGx 1.0 1.8 4.5 750 550 A 49 ARG H A 48 GLN HGy 1.0 1.8 4.5 751 551 A 48 GLN H A 49 ARG HA 1.0 1.8 5.0 752 552 A 48 GLN H A 49 ARG H 1.0 1.8 3.5 753 553 A 49 ARG H A 49 ARG HA 1.0 1.8 2.9 754 554 A 50 ILE H A 49 ARG HA 1.0 1.8 2.9 755 555 A 49 ARG H A 49 ARG HBy 1.0 1.8 4.1 756 555 A 49 ARG H A 49 ARG HBx 1.0 1.8 4.1 757 556 A 50 ILE H A 49 ARG HBy 1.0 1.8 3.9 758 556 A 49 ARG HBx A 50 ILE H 1.0 1.8 3.9 759 557 A 50 ILE H A 49 ARG HDy 1.0 1.8 6.0 760 557 A 50 ILE H A 49 ARG HDx 1.0 1.8 6.0 761 558 A 49 ARG H A 49 ARG HGy 1.0 1.8 3.9 762 558 A 49 ARG H A 49 ARG HGx 1.0 1.8 3.9 763 559 A 50 ILE H A 49 ARG HGy 1.0 1.8 6.0 764 559 A 49 ARG HGx A 50 ILE H 1.0 1.8 6.0 765 560 A 49 ARG H A 50 ILE HA 1.0 1.8 5.0 766 561 A 49 ARG H A 50 ILE H 1.0 1.8 5.0 767 562 A 50 ILE HA A 50 ILE H 1.0 1.8 2.9 768 563 A 51 GLU H A 50 ILE HA 1.0 1.8 2.9 769 564 A 50 ILE H A 50 ILE HB 1.0 1.8 3.5 770 565 A 51 GLU H A 50 ILE HB 1.0 1.8 3.5 771 566 A 50 ILE HD1% A 50 ILE H 1.0 1.8 4.4 772 567 A 51 GLU H A 50 ILE HD1% 1.0 1.8 6.5 773 568 A 50 ILE H A 50 ILE HG1x 1.0 1.8 3.5 774 569 A 51 GLU H A 50 ILE HG1x 1.0 1.8 5.0 775 570 A 50 ILE H A 50 ILE HG1y 1.0 1.8 2.9 776 571 A 51 GLU H A 50 ILE HG2% 1.0 1.8 6.5 777 572 A 51 GLU H A 50 ILE HG1y 1.0 1.8 5.0 778 573 A 50 ILE HG2% A 52 GLN H 1.0 1.8 6.5 779 574 A 50 ILE H A 51 GLU HGx 1.0 1.8 4.5 780 574 A 51 GLU HGy A 50 ILE H 1.0 1.8 4.5 781 575 A 51 GLU H A 50 ILE H 1.0 1.8 5.0 782 576 A 51 GLU H A 51 GLU HA 1.0 1.8 2.9 783 577 A 51 GLU HA A 52 GLN H 1.0 1.8 2.9 784 578 A 51 GLU H A 51 GLU HBx 1.0 1.8 3.5 785 578 A 51 GLU H A 51 GLU HBy 1.0 1.8 3.5 786 579 A 51 GLU H A 51 GLU HGx 1.0 1.8 3.9 787 579 A 51 GLU H A 51 GLU HGy 1.0 1.8 3.9 788 580 A 52 GLN H A 51 GLU HGx 1.0 1.8 4.5 789 580 A 51 GLU HGy A 52 GLN H 1.0 1.8 4.5 790 581 A 51 GLU H A 52 GLN H 1.0 1.8 5.0 791 582 A 52 GLN HA A 52 GLN H 1.0 1.8 2.9 792 583 A 53 CYS H A 52 GLN HA 1.0 1.8 2.9 793 584 A 52 GLN H A 52 GLN HBy 1.0 1.8 3.5 794 584 A 52 GLN H A 52 GLN HBx 1.0 1.8 3.5 795 585 A 53 CYS H A 52 GLN HBy 1.0 1.8 4.5 796 585 A 53 CYS H A 52 GLN HBx 1.0 1.8 4.5 797 586 A 52 GLN H A 52 GLN HGx 1.0 1.8 4.5 798 586 A 52 GLN H A 52 GLN HGy 1.0 1.8 4.5 799 587 A 53 CYS H A 52 GLN HGx 1.0 1.8 4.5 800 587 A 53 CYS H A 52 GLN HGy 1.0 1.8 4.5 801 588 A 53 CYS H A 52 GLN H 1.0 1.8 5.0 802 589 A 53 CYS H A 53 CYS HA 1.0 1.8 2.9 803 590 A 53 CYS HA A 54 THR H 1.0 1.8 2.9 804 591 A 53 CYS H A 53 CYS HBy 1.0 1.8 3.5 805 591 A 53 CYS H A 53 CYS HBx 1.0 1.8 3.5 806 592 A 54 THR H A 53 CYS HBy 1.0 1.8 4.5 807 592 A 53 CYS HBx A 54 THR H 1.0 1.8 4.5 808 593 A 53 CYS H A 54 THR H 1.0 1.8 5.0 809 594 A 53 CYS H A 58 LEU HD1% 1.0 1.8 7.4 810 594 A 53 CYS H A 58 LEU HD2% 1.0 1.8 7.4 811 595 A 54 THR HA A 54 THR H 1.0 1.8 2.9 812 596 A 55 ARG H A 54 THR HA 1.0 1.8 2.9 813 597 A 54 THR H A 54 THR HB 1.0 1.8 3.5 814 598 A 55 ARG H A 54 THR HB 1.0 1.8 2.9 815 599 A 54 THR HG2% A 54 THR H 1.0 1.8 4.4 816 600 A 55 ARG H A 54 THR HG2% 1.0 1.8 5.0 817 601 A 57 SER H A 54 THR HG2% 1.0 1.8 6.5 818 602 A 55 ARG H A 54 THR H 1.0 1.8 5.0 819 603 A 54 THR H A 57 SER HBx 1.0 1.8 6.0 820 603 A 54 THR H A 57 SER HBy 1.0 1.8 6.0 821 604 A 55 ARG H A 55 ARG HA 1.0 1.8 2.9 822 605 A 57 SER H A 55 ARG HA 1.0 1.8 3.5 823 606 A 58 LEU H A 55 ARG HA 1.0 1.8 5.0 824 607 A 55 ARG H A 55 ARG HBy 1.0 1.8 3.5 825 607 A 55 ARG H A 55 ARG HBx 1.0 1.8 3.5 826 608 A 57 SER H A 55 ARG HBy 1.0 1.8 6.0 827 608 A 57 SER H A 55 ARG HBx 1.0 1.8 6.0 828 609 A 55 ARG H A 55 ARG HDx 1.0 1.8 6.0 829 609 A 55 ARG H A 55 ARG HDy 1.0 1.8 6.0 830 610 A 55 ARG H A 55 ARG HGy 1.0 1.8 4.5 831 610 A 55 ARG H A 55 ARG HGx 1.0 1.8 4.5 832 611 A 55 ARG H A 56 GLY H 1.0 1.8 3.5 833 612 A 57 SER H A 56 GLY HAy 1.0 1.8 3.9 834 612 A 57 SER H A 56 GLY HAx 1.0 1.8 3.9 835 613 A 58 LEU H A 56 GLY HAy 1.0 1.8 6.0 836 613 A 58 LEU H A 56 GLY HAx 1.0 1.8 6.0 837 614 A 57 SER H A 56 GLY H 1.0 1.8 3.5 838 615 A 57 SER H A 57 SER HA 1.0 1.8 2.9 839 616 A 58 LEU H A 57 SER HA 1.0 1.8 3.5 840 617 A 57 SER H A 57 SER HBx 1.0 1.8 3.5 841 617 A 57 SER H A 57 SER HBy 1.0 1.8 3.5 842 618 A 58 LEU H A 57 SER HBx 1.0 1.8 4.5 843 618 A 58 LEU H A 57 SER HBy 1.0 1.8 4.5 844 619 A 57 SER H A 58 LEU HA 1.0 1.8 5.0 845 620 A 57 SER H A 58 LEU HBy 1.0 1.8 6.0 846 620 A 57 SER H A 58 LEU HBx 1.0 1.8 6.0 847 621 A 57 SER H A 58 LEU HD1% 1.0 1.8 7.4 848 621 A 57 SER H A 58 LEU HD2% 1.0 1.8 7.4 849 622 A 57 SER H A 58 LEU HG 1.0 1.8 3.5 850 623 A 57 SER H A 58 LEU H 1.0 1.8 2.9 851 624 A 58 LEU H A 58 LEU HA 1.0 1.8 3.5 852 625 A 58 LEU HA A 59 PHE H 1.0 1.8 2.9 853 626 A 58 LEU HA A 71 TYR H 1.0 1.8 5.0 854 627 A 58 LEU H A 58 LEU HBy 1.0 1.8 3.5 855 627 A 58 LEU H A 58 LEU HBx 1.0 1.8 3.5 856 628 A 59 PHE H A 58 LEU HBy 1.0 1.8 3.9 857 628 A 58 LEU HBx A 59 PHE H 1.0 1.8 3.9 858 629 A 71 TYR H A 58 LEU HBy 1.0 1.8 4.5 859 629 A 58 LEU HBx A 71 TYR H 1.0 1.8 4.5 860 630 A 58 LEU H A 58 LEU HD1% 1.0 1.8 5.2 861 630 A 58 LEU H A 58 LEU HD2% 1.0 1.8 5.2 862 631 A 59 PHE H A 58 LEU HD1% 1.0 1.8 5.3 863 631 A 58 LEU HD2% A 59 PHE H 1.0 1.8 5.3 864 632 A 71 TYR H A 58 LEU HD1% 1.0 1.8 5.9 865 632 A 58 LEU HD2% A 71 TYR H 1.0 1.8 5.9 866 633 A 72 LEU H A 58 LEU HD1% 1.0 1.8 7.4 867 633 A 58 LEU HD2% A 72 LEU H 1.0 1.8 7.4 868 634 A 58 LEU H A 58 LEU HG 1.0 1.8 2.9 869 635 A 58 LEU HG A 59 PHE H 1.0 1.8 5.0 870 636 A 58 LEU H A 59 PHE H 1.0 1.8 5.0 871 637 A 59 PHE H A 59 PHE HA 1.0 1.8 2.9 872 638 A 59 PHE HA A 60 MET H 1.0 1.8 2.9 873 639 A 71 TYR H A 59 PHE HA 1.0 1.8 5.0 874 640 A 59 PHE H A 59 PHE HBy 1.0 1.8 3.5 875 640 A 59 PHE H A 59 PHE HBx 1.0 1.8 3.5 876 641 A 60 MET H A 59 PHE HBy 1.0 1.8 4.5 877 641 A 60 MET H A 59 PHE HBx 1.0 1.8 4.5 878 642 A 77 LEU H A 59 PHE HBy 1.0 1.8 6.0 879 642 A 59 PHE HBx A 77 LEU H 1.0 1.8 6.0 880 643 A 71 TYR H A 59 PHE HBy 1.0 1.8 6.0 881 643 A 71 TYR H A 59 PHE HBx 1.0 1.8 6.0 882 644 A 59 PHE H A 59 PHE HD% 1.0 1.8 4.9 883 645 A 60 MET H A 59 PHE HD% 1.0 1.8 5.5 884 646 A 71 TYR H A 59 PHE HD% 1.0 1.8 5.5 885 647 A 59 PHE HD% A 77 LEU HD1% 1.0 2.4 7.0 886 647 A 59 PHE HD% A 77 LEU HD2% 1.0 2.4 7.0 887 648 A 59 PHE HD% A 74 GLN H 1.0 1.8 7.0 888 649 A 59 PHE H A 70 THR HA 1.0 1.8 5.0 889 650 A 70 THR HB A 59 PHE H 1.0 1.8 3.5 890 651 A 59 PHE H A 70 THR HG2% 1.0 1.8 5.0 891 652 A 71 TYR HA A 59 PHE H 1.0 1.8 5.0 892 653 A 59 PHE H A 71 TYR HBy 1.0 1.8 6.0 893 653 A 59 PHE H A 71 TYR HBx 1.0 1.8 6.0 894 654 A 59 PHE H A 71 TYR H 1.0 1.8 2.9 895 655 A 59 PHE H A 72 LEU HA 1.0 1.8 5.0 896 656 A 59 PHE H A 72 LEU HD1% 1.0 1.8 7.4 897 656 A 72 LEU HD2% A 59 PHE H 1.0 1.8 7.4 898 657 A 59 PHE H A 72 LEU H 1.0 1.8 5.0 899 658 A 59 PHE H A 77 LEU HD1% 1.0 1.8 8.0 900 658 A 59 PHE H A 77 LEU HD2% 1.0 1.8 8.0 901 659 A 60 MET H A 60 MET HA 1.0 1.8 3.5 902 660 A 60 MET HA A 61 CYS H 1.0 1.8 3.5 903 661 A 60 MET HA A 70 THR H 1.0 1.8 5.0 904 662 A 71 TYR H A 60 MET HA 1.0 1.8 5.0 905 663 A 60 MET H A 60 MET HBy 1.0 1.8 3.5 906 663 A 60 MET H A 60 MET HBx 1.0 1.8 3.5 907 664 A 60 MET H A 60 MET HE% 1.0 1.8 6.5 908 665 A 60 MET H A 60 MET HGy 1.0 1.8 4.5 909 665 A 60 MET H A 60 MET HGx 1.0 1.8 4.5 910 666 A 61 CYS H A 60 MET HGy 1.0 1.8 6.0 911 666 A 61 CYS H A 60 MET HGx 1.0 1.8 6.0 912 667 A 60 MET H A 70 THR HA 1.0 1.8 5.0 913 668 A 60 MET H A 70 THR HG2% 1.0 1.8 5.0 914 669 A 61 CYS H A 61 CYS HA 1.0 1.8 5.0 915 670 A 61 CYS HA A 62 SER H 1.0 1.8 3.5 916 671 A 61 CYS HA A 63 ILE H 1.0 1.8 5.0 917 672 A 61 CYS H A 61 CYS HBy 1.0 1.8 4.1 918 672 A 61 CYS H A 61 CYS HBx 1.0 1.8 4.1 919 673 A 69 ARG H A 61 CYS HBy 1.0 1.8 3.9 920 673 A 61 CYS HBx A 69 ARG H 1.0 1.8 3.9 921 674 A 61 CYS H A 69 ARG H 1.0 1.8 5.0 922 675 A 70 THR HA A 61 CYS H 1.0 1.8 5.0 923 676 A 61 CYS H A 77 LEU HD1% 1.0 1.8 7.4 924 676 A 77 LEU HD2% A 61 CYS H 1.0 1.8 7.4 925 677 A 63 ILE H A 62 SER HA 1.0 1.8 3.5 926 678 A 62 SER H A 63 ILE H 1.0 1.8 3.5 927 679 A 63 ILE H A 63 ILE HA 1.0 1.8 3.5 928 680 A 63 ILE H A 63 ILE HB 1.0 1.8 2.9 929 681 A 63 ILE H A 63 ILE HG1x 1.0 1.8 5.0 930 682 A 63 ILE H A 63 ILE HG1y 1.0 1.8 3.5 931 683 A 63 ILE HG2% A 63 ILE H 1.0 1.8 5.0 932 684 A 63 ILE HG2% A 85 HIS H 1.0 1.8 6.5 933 685 A 63 ILE HG2% A 86 MET H 1.0 1.8 6.5 934 686 A 67 CYS H A 64 VAL HG1% 1.0 1.8 7.4 935 686 A 64 VAL HG2% A 67 CYS H 1.0 1.8 7.4 936 687 A 65 GLN HA A 66 GLY H 1.0 1.8 5.0 937 688 A 67 CYS H A 65 GLN HA 1.0 1.8 5.0 938 689 A 66 GLY H A 66 GLY HAy 1.0 1.8 5.6 939 689 A 66 GLY H A 66 GLY HAx 1.0 1.8 5.6 940 690 A 67 CYS H A 66 GLY HAy 1.0 1.8 6.0 941 690 A 67 CYS H A 66 GLY HAx 1.0 1.8 6.0 942 691 A 67 CYS H A 66 GLY H 1.0 1.8 5.0 943 692 A 67 CYS H A 67 CYS HA 1.0 1.8 3.5 944 693 A 69 ARG H A 67 CYS HA 1.0 1.8 5.0 945 694 A 67 CYS H A 67 CYS HBy 1.0 1.8 4.1 946 694 A 67 CYS H A 67 CYS HBx 1.0 1.8 4.1 947 695 A 69 ARG H A 67 CYS HBy 1.0 1.8 4.5 948 695 A 69 ARG H A 67 CYS HBx 1.0 1.8 4.5 949 696 A 67 CYS H A 68 LYS H 1.0 1.8 5.0 950 697 A 69 ARG H A 68 LYS H 1.0 1.8 2.9 951 698 A 69 ARG H A 68 LYS HA 1.0 1.8 5.0 952 699 A 69 ARG H A 69 ARG HA 1.0 1.8 2.9 953 700 A 70 THR H A 69 ARG HA 1.0 1.8 3.5 954 701 A 69 ARG H A 69 ARG HBy 1.0 1.8 3.5 955 701 A 69 ARG H A 69 ARG HBx 1.0 1.8 3.5 956 702 A 70 THR H A 69 ARG HBy 1.0 1.8 4.5 957 702 A 70 THR H A 69 ARG HBx 1.0 1.8 4.5 958 703 A 69 ARG H A 69 ARG HGy 1.0 1.8 3.9 959 703 A 69 ARG H A 69 ARG HGx 1.0 1.8 3.9 960 704 A 70 THR H A 69 ARG H 1.0 1.8 5.0 961 705 A 69 ARG H A 80 HIS HD2 1.0 1.8 5.0 962 706 A 70 THR HA A 70 THR H 1.0 1.8 5.0 963 707 A 71 TYR H A 70 THR HA 1.0 1.8 2.9 964 708 A 70 THR HB A 70 THR H 1.0 1.8 5.0 965 709 A 70 THR HB A 71 TYR H 1.0 1.8 2.9 966 710 A 70 THR HG2% A 70 THR H 1.0 1.8 5.0 967 711 A 71 TYR H A 70 THR HG2% 1.0 1.8 4.4 968 712 A 74 GLN HE2y A 77 LEU HD1% 1.0 1.8 5.0 969 712 A 77 LEU HD2% A 74 GLN HE2y 1.0 1.8 5.0 970 713 A 71 TYR H A 70 THR H 1.0 1.8 5.0 971 714 A 71 TYR HA A 71 TYR H 1.0 1.8 2.9 972 715 A 71 TYR HA A 72 LEU H 1.0 1.8 2.9 973 716 A 71 TYR HA A 73 SER H 1.0 1.8 5.0 974 717 A 71 TYR H A 71 TYR HBy 1.0 1.8 3.5 975 717 A 71 TYR H A 71 TYR HBx 1.0 1.8 3.5 976 718 A 72 LEU H A 71 TYR HBy 1.0 1.8 3.9 977 718 A 72 LEU H A 71 TYR HBx 1.0 1.8 3.9 978 719 A 73 SER H A 71 TYR HBy 1.0 1.8 3.9 979 719 A 71 TYR HBx A 73 SER H 1.0 1.8 3.9 980 720 A 76 ASP H A 71 TYR HBy 1.0 1.8 4.5 981 720 A 71 TYR HBx A 76 ASP H 1.0 1.8 4.5 982 721 A 77 LEU H A 71 TYR HBy 1.0 1.8 3.9 983 721 A 77 LEU H A 71 TYR HBx 1.0 1.8 3.9 984 722 A 78 GLN H A 71 TYR HBy 1.0 1.8 6.0 985 722 A 71 TYR HBx A 78 GLN H 1.0 1.8 6.0 986 723 A 71 TYR H A 71 TYR HD% 1.0 1.8 4.9 987 724 A 72 LEU H A 71 TYR HD% 1.0 1.8 5.5 988 725 A 73 SER H A 71 TYR HD% 1.0 1.8 5.5 989 726 A 76 ASP H A 71 TYR HD% 1.0 1.8 7.0 990 727 A 71 TYR H A 72 LEU H 1.0 1.8 5.0 991 728 A 71 TYR H A 73 SER H 1.0 1.8 5.0 992 729 A 71 TYR H A 77 LEU HBy 1.0 1.8 6.0 993 729 A 71 TYR H A 77 LEU HBx 1.0 1.8 6.0 994 730 A 72 LEU H A 72 LEU HA 1.0 1.8 2.9 995 731 A 72 LEU HA A 73 SER H 1.0 1.8 3.5 996 732 A 72 LEU H A 72 LEU HBy 1.0 1.8 3.5 997 732 A 72 LEU H A 72 LEU HBx 1.0 1.8 3.5 998 733 A 73 SER H A 72 LEU HBy 1.0 1.8 4.5 999 733 A 73 SER H A 72 LEU HBx 1.0 1.8 4.5 1000 734 A 72 LEU HD2% A 72 LEU H 1.0 1.8 5.0 1001 735 A 72 LEU HD2% A 73 SER H 1.0 1.8 6.5 1002 736 A 72 LEU H A 72 LEU HD1% 1.0 1.8 5.2 1003 736 A 72 LEU HD2% A 72 LEU H 1.0 1.8 5.2 1004 737 A 73 SER H A 72 LEU HD1% 1.0 1.8 5.9 1005 737 A 72 LEU HD2% A 73 SER H 1.0 1.8 5.9 1006 738 A 72 LEU H A 72 LEU HG 1.0 1.8 2.9 1007 739 A 73 SER H A 72 LEU HG 1.0 1.8 3.5 1008 740 A 72 LEU H A 73 SER H 1.0 1.8 2.9 1009 741 A 72 LEU H A 76 ASP HBy 1.0 1.8 4.5 1010 741 A 72 LEU H A 76 ASP HBx 1.0 1.8 4.5 1011 742 A 72 LEU H A 76 ASP H 1.0 1.8 5.0 1012 743 A 72 LEU H A 77 LEU H 1.0 1.8 5.0 1013 744 A 74 GLN H A 73 SER HA 1.0 1.8 2.9 1014 745 A 73 SER HA A 75 ARG H 1.0 1.8 5.0 1015 746 A 73 SER H A 73 SER HBy 1.0 1.8 3.5 1016 746 A 73 SER H A 73 SER HBx 1.0 1.8 3.5 1017 747 A 74 GLN H A 73 SER HBy 1.0 1.8 4.5 1018 747 A 74 GLN H A 73 SER HBx 1.0 1.8 4.5 1019 748 A 76 ASP H A 73 SER HBy 1.0 1.8 4.5 1020 748 A 76 ASP H A 73 SER HBx 1.0 1.8 4.5 1021 749 A 74 GLN H A 73 SER H 1.0 1.8 5.0 1022 750 A 73 SER H A 75 ARG HBy 1.0 1.8 6.0 1023 750 A 73 SER H A 75 ARG HBx 1.0 1.8 6.0 1024 751 A 73 SER H A 76 ASP HBy 1.0 1.8 3.9 1025 751 A 73 SER H A 76 ASP HBx 1.0 1.8 3.9 1026 752 A 73 SER H A 76 ASP H 1.0 1.8 3.5 1027 753 A 73 SER H A 77 LEU HBy 1.0 1.8 6.0 1028 753 A 73 SER H A 77 LEU HBx 1.0 1.8 6.0 1029 754 A 73 SER H A 77 LEU HD1% 1.0 1.8 7.4 1030 754 A 77 LEU HD2% A 73 SER H 1.0 1.8 7.4 1031 755 A 74 GLN H A 74 GLN HA 1.0 1.8 3.5 1032 756 A 75 ARG H A 74 GLN HA 1.0 1.8 5.0 1033 757 A 77 LEU H A 74 GLN HA 1.0 1.8 3.5 1034 758 A 78 GLN H A 74 GLN HA 1.0 1.8 3.5 1035 759 A 74 GLN H A 74 GLN HBy 1.0 1.8 3.5 1036 759 A 74 GLN H A 74 GLN HBx 1.0 1.8 3.5 1037 760 A 74 GLN H A 74 GLN HE2y 1.0 1.8 5.0 1038 761 A 74 GLN H A 74 GLN HGx 1.0 1.8 6.0 1039 761 A 74 GLN H A 74 GLN HGy 1.0 1.8 6.0 1040 762 A 77 LEU H A 74 GLN HGx 1.0 1.8 6.0 1041 762 A 77 LEU H A 74 GLN HGy 1.0 1.8 6.0 1042 763 A 74 GLN H A 75 ARG H 1.0 1.8 3.5 1043 764 A 75 ARG H A 75 ARG HA 1.0 1.8 2.9 1044 765 A 76 ASP H A 75 ARG HA 1.0 1.8 3.5 1045 766 A 77 LEU H A 75 ARG HA 1.0 1.8 5.0 1046 767 A 78 GLN H A 75 ARG HA 1.0 1.8 3.5 1047 768 A 75 ARG HA A 79 ALA H 1.0 1.8 5.0 1048 769 A 75 ARG H A 75 ARG HBy 1.0 1.8 3.5 1049 769 A 75 ARG H A 75 ARG HBx 1.0 1.8 3.5 1050 770 A 76 ASP H A 75 ARG HBy 1.0 1.8 3.9 1051 770 A 76 ASP H A 75 ARG HBx 1.0 1.8 3.9 1052 771 A 78 GLN H A 75 ARG HBy 1.0 1.8 6.0 1053 771 A 78 GLN H A 75 ARG HBx 1.0 1.8 6.0 1054 772 A 79 ALA H A 75 ARG HBy 1.0 1.8 6.0 1055 772 A 75 ARG HBx A 79 ALA H 1.0 1.8 6.0 1056 773 A 75 ARG H A 75 ARG HD2 1.0 1.8 6.0 1057 773 A 75 ARG H A 75 ARG HDy 1.0 1.8 6.0 1058 774 A 76 ASP H A 75 ARG HD2 1.0 1.8 4.5 1059 774 A 76 ASP H A 75 ARG HDy 1.0 1.8 4.5 1060 775 A 75 ARG H A 75 ARG HGx 1.0 1.8 6.0 1061 775 A 75 ARG H A 75 ARG HGy 1.0 1.8 6.0 1062 776 A 76 ASP H A 75 ARG HGx 1.0 1.8 4.5 1063 776 A 76 ASP H A 75 ARG HGy 1.0 1.8 4.5 1064 777 A 79 ALA H A 75 ARG HGx 1.0 1.8 6.0 1065 777 A 79 ALA H A 75 ARG HGy 1.0 1.8 6.0 1066 778 A 76 ASP H A 75 ARG H 1.0 1.8 2.9 1067 779 A 77 LEU H A 75 ARG H 1.0 1.8 5.0 1068 780 A 76 ASP H A 76 ASP HA 1.0 1.8 2.9 1069 781 A 77 LEU H A 76 ASP HA 1.0 1.8 3.5 1070 782 A 78 GLN H A 76 ASP HA 1.0 1.8 5.0 1071 783 A 79 ALA H A 76 ASP HA 1.0 1.8 3.5 1072 784 A 76 ASP HA A 80 HIS H 1.0 1.8 5.0 1073 785 A 76 ASP H A 76 ASP HBy 1.0 1.8 3.5 1074 785 A 76 ASP H A 76 ASP HBx 1.0 1.8 3.5 1075 786 A 77 LEU H A 76 ASP HBy 1.0 1.8 3.9 1076 786 A 77 LEU H A 76 ASP HBx 1.0 1.8 3.9 1077 787 A 78 GLN H A 76 ASP HBy 1.0 1.8 6.0 1078 787 A 78 GLN H A 76 ASP HBx 1.0 1.8 6.0 1079 788 A 76 ASP H A 77 LEU HBy 1.0 1.8 4.5 1080 788 A 76 ASP H A 77 LEU HBx 1.0 1.8 4.5 1081 789 A 77 LEU H A 76 ASP H 1.0 1.8 2.9 1082 790 A 76 ASP H A 78 GLN H 1.0 1.8 3.5 1083 791 A 77 LEU H A 77 LEU HA 1.0 1.8 2.9 1084 792 A 78 GLN H A 77 LEU HA 1.0 1.8 3.5 1085 793 A 79 ALA H A 77 LEU HA 1.0 1.8 5.0 1086 794 A 80 HIS H A 77 LEU HA 1.0 1.8 2.9 1087 795 A 77 LEU HA A 81 ILE H 1.0 1.8 5.0 1088 796 A 77 LEU H A 77 LEU HBy 1.0 1.8 3.5 1089 796 A 77 LEU H A 77 LEU HBx 1.0 1.8 3.5 1090 797 A 78 GLN H A 77 LEU HBy 1.0 1.8 3.9 1091 797 A 78 GLN H A 77 LEU HBx 1.0 1.8 3.9 1092 798 A 77 LEU H A 77 LEU HD1% 1.0 1.8 4.6 1093 798 A 77 LEU H A 77 LEU HD2% 1.0 1.8 4.6 1094 799 A 78 GLN H A 77 LEU HD1% 1.0 1.8 5.9 1095 799 A 77 LEU HD2% A 78 GLN H 1.0 1.8 5.9 1096 800 A 80 HIS H A 77 LEU HD1% 1.0 1.8 5.9 1097 800 A 77 LEU HD2% A 80 HIS H 1.0 1.8 5.9 1098 801 A 81 ILE H A 77 LEU HD1% 1.0 1.8 5.9 1099 801 A 77 LEU HD2% A 81 ILE H 1.0 1.8 5.9 1100 802 A 77 LEU H A 77 LEU HG 1.0 1.8 5.0 1101 803 A 78 GLN H A 77 LEU HG 1.0 1.8 5.0 1102 804 A 81 ILE H A 77 LEU HG 1.0 1.8 5.0 1103 805 A 77 LEU H A 78 GLN HA 1.0 1.8 5.0 1104 806 A 77 LEU H A 78 GLN H 1.0 1.8 2.9 1105 807 A 77 LEU H A 79 ALA H 1.0 1.8 3.5 1106 808 A 78 GLN H A 78 GLN HA 1.0 1.8 2.9 1107 809 A 79 ALA H A 78 GLN HA 1.0 1.8 3.5 1108 810 A 80 HIS H A 78 GLN HA 1.0 1.8 3.5 1109 811 A 81 ILE H A 78 GLN HA 1.0 1.8 3.5 1110 812 A 78 GLN HA A 82 ASN H 1.0 1.8 5.0 1111 813 A 78 GLN H A 78 GLN HBy 1.0 1.8 3.5 1112 813 A 78 GLN H A 78 GLN HBx 1.0 1.8 3.5 1113 814 A 79 ALA H A 78 GLN HBy 1.0 1.8 3.9 1114 814 A 79 ALA H A 78 GLN HBx 1.0 1.8 3.9 1115 815 A 80 HIS H A 78 GLN HBy 1.0 1.8 6.0 1116 815 A 80 HIS H A 78 GLN HBx 1.0 1.8 6.0 1117 816 A 78 GLN HE2x A 81 ILE HG2% 1.0 1.8 4.4 1118 817 A 78 GLN HE2y A 81 ILE HB 1.0 1.8 5.0 1119 818 A 81 ILE HG2% A 78 GLN HE2y 1.0 1.8 5.0 1120 819 A 78 GLN H A 78 GLN HGx 1.0 1.8 4.5 1121 819 A 78 GLN H A 78 GLN HGy 1.0 1.8 4.5 1122 820 A 79 ALA H A 78 GLN HGx 1.0 1.8 4.5 1123 820 A 79 ALA H A 78 GLN HGy 1.0 1.8 4.5 1124 821 A 82 ASN HD2x A 78 GLN HGx 1.0 1.8 4.5 1125 821 A 78 GLN HGy A 82 ASN HD2x 1.0 1.8 4.5 1126 822 A 82 ASN HD2y A 78 GLN HGx 1.0 1.8 4.5 1127 822 A 78 GLN HGy A 82 ASN HD2y 1.0 1.8 4.5 1128 823 A 82 ASN H A 78 GLN HGx 1.0 1.8 6.0 1129 823 A 82 ASN H A 78 GLN HGy 1.0 1.8 6.0 1130 824 A 78 GLN H A 79 ALA HB% 1.0 1.8 5.0 1131 825 A 78 GLN H A 79 ALA H 1.0 1.8 2.9 1132 826 A 78 GLN H A 80 HIS H 1.0 1.8 3.5 1133 827 A 79 ALA H A 79 ALA HA 1.0 1.8 2.9 1134 828 A 80 HIS H A 79 ALA HA 1.0 1.8 3.5 1135 829 A 81 ILE H A 79 ALA HA 1.0 1.8 5.0 1136 830 A 82 ASN HD2x A 79 ALA HA 1.0 1.8 3.5 1137 831 A 82 ASN HD2y A 79 ALA HA 1.0 1.8 3.5 1138 832 A 82 ASN H A 79 ALA HA 1.0 1.8 3.5 1139 833 A 79 ALA HA A 83 HIS H 1.0 1.8 5.0 1140 834 A 79 ALA H A 79 ALA HB% 1.0 1.8 4.0 1141 835 A 80 HIS H A 79 ALA HB% 1.0 1.8 4.4 1142 836 A 79 ALA H A 80 HIS HA 1.0 1.8 5.0 1143 837 A 79 ALA H A 80 HIS H 1.0 1.8 2.9 1144 838 A 80 HIS H A 80 HIS HA 1.0 1.8 2.9 1145 839 A 81 ILE H A 80 HIS HA 1.0 1.8 3.5 1146 840 A 83 HIS H A 80 HIS HA 1.0 1.8 3.5 1147 841 A 82 ASN H A 80 HIS HA 1.0 1.8 5.0 1148 842 A 80 HIS HA A 84 ARG H 1.0 1.8 5.0 1149 843 A 80 HIS H A 80 HIS HBy 1.0 1.8 3.5 1150 843 A 80 HIS H A 80 HIS HBx 1.0 1.8 3.5 1151 844 A 81 ILE H A 80 HIS HBy 1.0 1.8 3.9 1152 844 A 81 ILE H A 80 HIS HBx 1.0 1.8 3.9 1153 845 A 82 ASN H A 80 HIS HBy 1.0 1.8 6.0 1154 845 A 82 ASN H A 80 HIS HBx 1.0 1.8 6.0 1155 846 A 80 HIS HD2 A 80 HIS H 1.0 1.8 5.0 1156 847 A 80 HIS HD2 A 81 ILE H 1.0 1.8 3.5 1157 848 A 80 HIS H A 81 ILE HB 1.0 1.8 5.0 1158 849 A 80 HIS H A 81 ILE HG1y 1.0 1.8 3.5 1159 850 A 80 HIS H A 81 ILE H 1.0 1.8 2.9 1160 851 A 80 HIS H A 82 ASN H 1.0 1.8 5.0 1161 852 A 81 ILE H A 81 ILE HA 1.0 1.8 2.9 1162 853 A 82 ASN H A 81 ILE HA 1.0 1.8 3.5 1163 854 A 83 HIS H A 81 ILE HA 1.0 1.8 5.0 1164 855 A 85 HIS H A 81 ILE HA 1.0 1.8 5.0 1165 856 A 84 ARG H A 81 ILE HA 1.0 1.8 3.5 1166 857 A 86 MET H A 81 ILE HA 1.0 1.8 5.0 1167 858 A 81 ILE H A 81 ILE HB 1.0 1.8 2.9 1168 859 A 82 ASN H A 81 ILE HB 1.0 1.8 2.9 1169 860 A 81 ILE HB A 83 HIS H 1.0 1.8 5.0 1170 861 A 81 ILE H A 81 ILE HG1x 1.0 1.8 3.5 1171 862 A 82 ASN H A 81 ILE HG1x 1.0 1.8 5.0 1172 863 A 81 ILE H A 81 ILE HG1y 1.0 1.8 2.9 1173 864 A 82 ASN H A 81 ILE HG1y 1.0 1.8 3.5 1174 865 A 83 HIS H A 81 ILE HG1y 1.0 1.8 5.0 1175 866 A 81 ILE H A 81 ILE HG2% 1.0 1.8 4.4 1176 867 A 82 ASN H A 81 ILE HG2% 1.0 1.8 4.4 1177 868 A 81 ILE HG2% A 83 HIS H 1.0 1.8 6.5 1178 869 A 85 HIS H A 81 ILE HG2% 1.0 1.8 5.0 1179 870 A 86 MET H A 81 ILE HG2% 1.0 1.8 5.0 1180 871 A 81 ILE H A 82 ASN HBx 1.0 1.8 6.0 1181 871 A 81 ILE H A 82 ASN HBy 1.0 1.8 6.0 1182 872 A 81 ILE H A 82 ASN H 1.0 1.8 2.9 1183 873 A 81 ILE H A 83 HIS H 1.0 1.8 5.0 1184 874 A 81 ILE H A 85 HIS HD2 1.0 1.8 5.0 1185 875 A 82 ASN H A 82 ASN HA 1.0 1.8 2.9 1186 876 A 83 HIS H A 82 ASN HA 1.0 1.8 3.5 1187 877 A 84 ARG H A 82 ASN HA 1.0 1.8 5.0 1188 878 A 85 HIS H A 82 ASN HA 1.0 1.8 5.0 1189 879 A 86 MET H A 82 ASN HA 1.0 1.8 5.0 1190 880 A 82 ASN H A 82 ASN HBx 1.0 1.8 3.5 1191 880 A 82 ASN H A 82 ASN HBy 1.0 1.8 3.5 1192 881 A 83 HIS H A 82 ASN HBx 1.0 1.8 3.9 1193 881 A 83 HIS H A 82 ASN HBy 1.0 1.8 3.9 1194 882 A 82 ASN H A 82 ASN HD2x 1.0 1.8 3.5 1195 883 A 82 ASN H A 82 ASN HD2y 1.0 1.8 3.5 1196 884 A 82 ASN H A 83 HIS HA 1.0 1.8 5.0 1197 885 A 82 ASN H A 83 HIS H 1.0 1.8 2.9 1198 886 A 82 ASN H A 85 HIS HD2 1.0 1.8 5.0 1199 887 A 83 HIS H A 83 HIS HA 1.0 1.8 2.9 1200 888 A 84 ARG H A 83 HIS HA 1.0 1.8 3.5 1201 889 A 83 HIS H A 83 HIS HBx 1.0 1.8 3.5 1202 889 A 83 HIS H A 83 HIS HBy 1.0 1.8 3.5 1203 890 A 84 ARG H A 83 HIS HBx 1.0 1.8 3.9 1204 890 A 84 ARG H A 83 HIS HBy 1.0 1.8 3.9 1205 891 A 83 HIS H A 83 HIS HD2 1.0 1.8 3.5 1206 892 A 84 ARG H A 83 HIS HD2 1.0 1.8 5.0 1207 893 A 83 HIS H A 84 ARG HBy 1.0 1.8 6.0 1208 893 A 83 HIS H A 84 ARG HBx 1.0 1.8 6.0 1209 894 A 83 HIS H A 84 ARG HDy 1.0 1.8 6.0 1210 894 A 83 HIS H A 84 ARG HDx 1.0 1.8 6.0 1211 895 A 83 HIS H A 84 ARG HGx 1.0 1.8 4.5 1212 895 A 83 HIS H A 84 ARG HGy 1.0 1.8 4.5 1213 896 A 83 HIS H A 84 ARG H 1.0 1.8 2.9 1214 897 A 83 HIS H A 80 HIS HA 1.0 1.8 3.5 1215 898 A 84 ARG H A 84 ARG HA 1.0 1.8 2.9 1216 899 A 85 HIS H A 84 ARG HA 1.0 1.8 3.5 1217 900 A 86 MET H A 84 ARG HA 1.0 1.8 5.0 1218 901 A 84 ARG H A 84 ARG HBy 1.0 1.8 3.5 1219 901 A 84 ARG H A 84 ARG HBx 1.0 1.8 3.5 1220 902 A 85 HIS H A 84 ARG HBy 1.0 1.8 4.5 1221 902 A 85 HIS H A 84 ARG HBx 1.0 1.8 4.5 1222 903 A 86 MET H A 84 ARG HBy 1.0 1.8 6.0 1223 903 A 86 MET H A 84 ARG HBx 1.0 1.8 6.0 1224 904 A 84 ARG H A 84 ARG HDy 1.0 1.8 4.5 1225 904 A 84 ARG H A 84 ARG HDx 1.0 1.8 4.5 1226 905 A 84 ARG H A 84 ARG HGx 1.0 1.8 3.9 1227 905 A 84 ARG H A 84 ARG HGy 1.0 1.8 3.9 1228 906 A 85 HIS H A 84 ARG HGx 1.0 1.8 4.5 1229 906 A 85 HIS H A 84 ARG HGy 1.0 1.8 4.5 1230 907 A 84 ARG H A 85 HIS HA 1.0 1.8 5.0 1231 908 A 84 ARG H A 85 HIS HBy 1.0 1.8 6.0 1232 908 A 84 ARG H A 85 HIS HBx 1.0 1.8 6.0 1233 909 A 85 HIS H A 84 ARG H 1.0 1.8 2.9 1234 910 A 86 MET H A 84 ARG H 1.0 1.8 3.5 1235 911 A 85 HIS H A 85 HIS HA 1.0 1.8 2.9 1236 912 A 86 MET H A 85 HIS HA 1.0 1.8 3.5 1237 913 A 85 HIS HA A 87 ARG H 1.0 1.8 5.0 1238 914 A 85 HIS H A 85 HIS HBy 1.0 1.8 3.5 1239 914 A 85 HIS H A 85 HIS HBx 1.0 1.8 3.5 1240 915 A 86 MET H A 85 HIS HBy 1.0 1.8 3.9 1241 915 A 86 MET H A 85 HIS HBx 1.0 1.8 3.9 1242 916 A 85 HIS H A 85 HIS HD2 1.0 1.8 3.5 1243 917 A 85 HIS H A 86 MET HBx 1.0 1.8 4.5 1244 917 A 85 HIS H A 86 MET HBy 1.0 1.8 4.5 1245 918 A 85 HIS H A 86 MET HGy 1.0 1.8 6.0 1246 918 A 85 HIS H A 86 MET HGx 1.0 1.8 6.0 1247 919 A 86 MET H A 85 HIS H 1.0 1.8 2.9 1248 920 A 86 MET H A 86 MET HA 1.0 1.8 2.9 1249 921 A 87 ARG H A 86 MET HA 1.0 1.8 2.9 1250 922 A 86 MET H A 86 MET HBx 1.0 1.8 3.5 1251 922 A 86 MET H A 86 MET HBy 1.0 1.8 3.5 1252 923 A 87 ARG H A 86 MET HBx 1.0 1.8 4.5 1253 923 A 87 ARG H A 86 MET HBy 1.0 1.8 4.5 1254 924 A 86 MET H A 86 MET HGy 1.0 1.8 4.5 1255 924 A 86 MET H A 86 MET HGx 1.0 1.8 4.5 1256 925 A 86 MET H A 87 ARG H 1.0 1.8 2.9 1257 926 A 87 ARG H A 87 ARG HA 1.0 1.8 2.9 1258 927 A 87 ARG H A 87 ARG HBy 1.0 1.8 3.5 1259 927 A 87 ARG H A 87 ARG HBx 1.0 1.8 3.5 1260 928 A 88 ALA H A 87 ARG HBy 1.0 1.8 6.0 1261 928 A 87 ARG HBx A 88 ALA H 1.0 1.8 6.0 1262 929 A 87 ARG H A 87 ARG HGx 1.0 1.8 4.5 1263 929 A 87 ARG H A 87 ARG HGy 1.0 1.8 4.5 1264 930 A 87 ARG H A 88 ALA H 1.0 1.8 5.0 1265 931 A 88 ALA H A 88 ALA HA 1.0 1.8 2.9 1266 932 A 88 ALA H A 88 ALA HB% 1.0 1.8 4.0 1267 933 A 11 ILE HD1% A 4 CYS HA 1.0 1.8 5.0 1268 934 A 11 ILE HD1% A 4 CYS HBy 1.0 1.8 7.5 1269 934 A 11 ILE HD1% A 4 CYS HBx 1.0 1.8 7.5 1270 935 A 9 LEU HD2% A 10 PRO HDx 1.0 1.8 8.4 1271 935 A 9 LEU HD1% A 10 PRO HDx 1.0 1.8 8.4 1272 935 A 10 PRO HDy A 9 LEU HD1% 1.0 1.8 8.4 1273 935 A 9 LEU HD2% A 10 PRO HDy 1.0 1.8 8.4 1274 936 A 11 ILE HD1% A 14 TYR HD% 1.0 1.8 8.5 1275 937 A 11 ILE HD1% A 14 TYR HE% 1.0 1.8 8.5 1276 938 A 11 ILE HD1% A 23 VAL HG1% 1.0 1.8 8.9 1277 938 A 11 ILE HD1% A 23 VAL HG2% 1.0 1.8 8.9 1278 939 A 11 ILE HD1% A 25 CYS HA 1.0 1.8 6.5 1279 940 A 11 ILE HD1% A 25 CYS HBy 1.0 1.8 7.5 1280 940 A 11 ILE HD1% A 25 CYS HBx 1.0 1.8 7.5 1281 941 A 11 ILE HG2% A 14 TYR HA 1.0 1.8 6.5 1282 942 A 11 ILE HG2% A 14 TYR HD% 1.0 1.8 8.5 1283 943 A 14 TYR HE% A 11 ILE HG2% 1.0 1.8 8.5 1284 944 A 11 ILE HG2% A 25 CYS HA 1.0 1.8 5.0 1285 945 A 11 ILE HG2% A 24 PHE HA 1.0 1.8 6.5 1286 946 A 11 ILE HG2% A 25 CYS HBy 1.0 1.8 7.5 1287 946 A 11 ILE HG2% A 25 CYS HBx 1.0 1.8 7.5 1288 947 A 26 TYR HD% A 13 VAL HG1% 1.0 1.8 9.4 1289 947 A 13 VAL HG2% A 26 TYR HD% 1.0 1.8 9.4 1290 948 A 54 THR HG2% A 13 VAL HG1% 1.0 1.8 7.4 1291 948 A 13 VAL HG2% A 54 THR HG2% 1.0 1.8 7.4 1292 949 A 26 TYR HD% A 15 GLY HAy 1.0 1.8 8.0 1293 949 A 15 GLY HAx A 26 TYR HD% 1.0 1.8 8.0 1294 950 A 17 MET HE% A 50 ILE HD1% 1.0 1.8 6.5 1295 951 A 70 THR HG2% A 23 VAL HG1% 1.0 1.8 8.9 1296 951 A 23 VAL HG2% A 70 THR HG2% 1.0 1.8 8.9 1297 952 A 26 TYR HD% A 50 ILE HG2% 1.0 1.8 8.5 1298 953 A 26 TYR HE% A 50 ILE HG2% 1.0 1.8 8.5 1299 954 A 29 ALA HB% A 50 ILE HD1% 1.0 1.8 6.5 1300 955 A 50 ILE HD1% A 33 GLU HBy 1.0 1.8 7.5 1301 955 A 50 ILE HD1% A 33 GLU HBx 1.0 1.8 7.5 1302 956 A 57 SER HBy A 72 LEU HD1% 1.0 1.8 8.4 1303 956 A 57 SER HBx A 72 LEU HD1% 1.0 1.8 8.4 1304 956 A 72 LEU HD2% A 57 SER HBx 1.0 1.8 8.4 1305 956 A 72 LEU HD2% A 57 SER HBy 1.0 1.8 8.4 1306 957 A 70 THR HG2% A 58 LEU HD1% 1.0 1.8 8.9 1307 957 A 58 LEU HD2% A 70 THR HG2% 1.0 1.8 8.9 1308 958 A 70 THR HG2% A 60 MET HA 1.0 1.8 6.5 1309 959 A 70 THR HG2% A 60 MET HBy 1.0 1.8 7.5 1310 959 A 70 THR HG2% A 60 MET HBx 1.0 1.8 7.5 1311 960 A 70 THR HG2% A 60 MET HE% 1.0 1.8 8.0 1312 961 A 61 CYS HA A 77 LEU HD1% 1.0 1.8 7.4 1313 961 A 77 LEU HD2% A 61 CYS HA 1.0 1.8 7.4 1314 962 A 61 CYS HA A 81 ILE HD1% 1.0 1.8 6.5 1315 963 A 61 CYS HBx A 77 LEU HD1% 1.0 1.8 8.4 1316 963 A 61 CYS HBy A 77 LEU HD1% 1.0 1.8 8.4 1317 963 A 77 LEU HD2% A 61 CYS HBy 1.0 1.8 8.4 1318 963 A 77 LEU HD2% A 61 CYS HBx 1.0 1.8 8.4 1319 964 A 81 ILE HD1% A 63 ILE HD1% 1.0 1.8 6.5 1320 965 A 80 HIS HD2 A 77 LEU HD1% 1.0 1.8 7.4 1321 965 A 77 LEU HD2% A 80 HIS HD2 1.0 1.8 7.4 1322 966 A 81 ILE HD1% A 77 LEU HD1% 1.0 1.8 7.4 1323 966 A 77 LEU HD2% A 81 ILE HD1% 1.0 1.8 7.4 1324 967 A 77 LEU HG A 81 ILE HD1% 1.0 1.8 5.0 1325 968 A 80 HIS HD2 A 81 ILE HD1% 1.0 1.8 6.5 1326 969 A 18 ILE HG2% A 50 ILE HA 1.0 1.8 6.5 1327 970 A 18 ILE HG2% A 49 ARG HGy 1.0 1.8 6.5 1328 970 A 18 ILE HG2% A 49 ARG HGx 1.0 1.8 6.5 1329 971 A 81 ILE HA A 63 ILE HD1% 1.0 1.8 5.0 1330 972 A 63 ILE HG2% A 85 HIS HBy 1.0 1.8 5.0 1331 972 A 63 ILE HG2% A 85 HIS HBx 1.0 1.8 5.0 1332 973 A 81 ILE HG2% A 63 ILE HD1% 1.0 1.8 5.0 1333 974 A 81 ILE HD1% A 63 ILE HD1% 1.0 1.8 5.0 1334 975 A 27 ASP HA A 30 ILE HD1% 1.0 1.8 5.0 1335 976 A 27 ASP HA A 30 ILE HG2% 1.0 1.8 6.5 1336 977 A 30 ILE HD1% A 34 LYS HDx 1.0 1.8 6.5 1337 977 A 34 LYS HDy A 30 ILE HD1% 1.0 1.8 6.5 1338 978 A 11 ILE HD1% A 3 PHE HA 1.0 1.8 5.0 1339 979 A 11 ILE HD1% A 24 PHE HA 1.0 1.8 5.0 1340 980 A 11 ILE HD1% A 25 CYS HA 1.0 1.8 5.0 1341 981 A 11 ILE HD1% A 4 CYS HA 1.0 1.8 4.4 1342 982 A 11 ILE HD1% A 2 HIS HBy 1.0 1.8 6.0 1343 982 A 2 HIS HBx A 11 ILE HD1% 1.0 1.8 6.0 1344 983 A 11 ILE HD1% A 5 ASP HBy 1.0 1.8 7.5 1345 983 A 11 ILE HD1% A 5 ASP HBx 1.0 1.8 7.5 1346 984 A 11 ILE HD1% A 25 CYS HBy 1.0 1.8 6.5 1347 984 A 11 ILE HD1% A 25 CYS HBx 1.0 1.8 6.5 1348 985 A 11 ILE HD1% A 4 CYS HBy 1.0 1.8 6.0 1349 985 A 11 ILE HD1% A 4 CYS HBx 1.0 1.8 6.0 1350 986 A 78 GLN HA A 81 ILE HG2% 1.0 1.8 6.5 1351 987 A 81 ILE HG2% A 88 ALA HA 1.0 1.8 6.5 1352 988 A 81 ILE HG2% A 85 HIS HBy 1.0 1.8 7.5 1353 988 A 81 ILE HG2% A 85 HIS HBx 1.0 1.8 7.5 1354 989 A 81 ILE HG2% A 86 MET HGy 1.0 1.8 7.5 1355 989 A 81 ILE HG2% A 86 MET HGx 1.0 1.8 7.5 1356 990 A 81 ILE HG2% A 86 MET HBx 1.0 1.8 7.5 1357 990 A 81 ILE HG2% A 86 MET HBy 1.0 1.8 7.5 1358 991 A 78 GLN HA A 81 ILE HD1% 1.0 1.8 6.5 1359 992 A 77 LEU HG A 81 ILE HD1% 1.0 1.8 6.5 1360 993 A 30 ILE HA A 50 ILE HD1% 1.0 1.8 5.0 1361 994 A 17 MET HA A 50 ILE HD1% 1.0 1.8 6.5 1362 995 A 50 ILE HG2% A 17 MET HA 1.0 1.8 6.5 1363 996 A 50 ILE HG2% A 51 GLU HA 1.0 1.8 6.5 1364 997 A 52 GLN HA A 50 ILE HG2% 1.0 1.8 6.5 1365 998 A 50 ILE HG2% A 17 MET HGx 1.0 1.8 6.5 1366 998 A 50 ILE HG2% A 17 MET HGy 1.0 1.8 6.5 1367 999 A 50 ILE HG2% A 17 MET HE% 1.0 1.8 6.5 1368 1000 A 29 ALA HB% A 50 ILE HG2% 1.0 1.8 6.5 1369 1001 A 29 ALA HB% A 50 ILE HD1% 1.0 1.8 6.5 1370 1002 A 17 MET HE% A 50 ILE HD1% 1.0 1.8 6.5 1371 1003 A 23 VAL HG2% A 60 MET HE% 1.0 1.8 8.0 1372 1004 A 76 ASP HA A 79 ALA HB% 1.0 1.8 5.0 1373 1005 A 79 ALA HB% A 80 HIS HBy 1.0 1.8 7.5 1374 1005 A 79 ALA HB% A 80 HIS HBx 1.0 1.8 7.5 1375 1006 A 70 THR HG2% A 23 VAL HG1% 1.0 1.8 6.5 1376 1006 A 23 VAL HG2% A 70 THR HG2% 1.0 1.8 6.5 1377 1007 A 11 ILE HG2% A 23 VAL HG1% 1.0 1.8 6.5 1378 1007 A 11 ILE HG2% A 23 VAL HG2% 1.0 1.8 6.5 1379 1008 A 11 ILE HD1% A 23 VAL HG1% 1.0 1.8 6.5 1380 1008 A 11 ILE HD1% A 23 VAL HG2% 1.0 1.8 6.5 1381 1009 A 60 MET HE% A 23 VAL HG1% 1.0 1.8 6.5 1382 1009 A 23 VAL HG2% A 60 MET HE% 1.0 1.8 6.5 1383 1010 A 23 VAL HG2% A 58 LEU HD1% 1.0 1.8 6.5 1384 1010 A 23 VAL HG1% A 58 LEU HD1% 1.0 1.8 6.5 1385 1010 A 58 LEU HD2% A 23 VAL HG1% 1.0 1.8 6.5 1386 1010 A 58 LEU HD2% A 23 VAL HG2% 1.0 1.8 6.5 1387 1011 A 16 ARG HA A 23 VAL HG1% 1.0 1.8 5.0 1388 1011 A 23 VAL HG2% A 16 ARG HA 1.0 1.8 5.0 1389 1012 A 14 TYR HA A 23 VAL HG1% 1.0 1.8 5.0 1390 1012 A 14 TYR HA A 23 VAL HG2% 1.0 1.8 5.0 1391 1013 A 29 ALA HB% A 50 ILE HD1% 1.0 1.8 6.5 1392 1014 A 29 ALA HB% A 30 ILE HG2% 1.0 1.8 6.5 1393 1015 A 29 ALA HB% A 17 MET HE% 1.0 1.8 6.5 1394 1016 A 29 ALA HB% A 24 PHE HBy 1.0 1.8 6.5 1395 1016 A 24 PHE HBx A 29 ALA HB% 1.0 1.8 6.5 1396 1017 A 29 ALA HB% A 15 GLY HAy 1.0 1.8 6.5 1397 1017 A 15 GLY HAx A 29 ALA HB% 1.0 1.8 6.5 1398 1018 A 17 MET HE% A 47 VAL HA 1.0 1.8 5.0 1399 1019 A 17 MET HE% A 41 PRO HDy 1.0 1.8 6.5 1400 1019 A 17 MET HE% A 41 PRO HDx 1.0 1.8 6.5 1401 1020 A 17 MET HE% A 29 ALA HA 1.0 1.8 5.0 1402 1021 A 17 MET HE% A 47 VAL HG1% 1.0 1.8 6.5 1403 1021 A 17 MET HE% A 47 VAL HG2% 1.0 1.8 6.5 1404 1022 A 64 VAL HG1% A 67 CYS HBy 1.0 1.8 6.0 1405 1022 A 64 VAL HG2% A 67 CYS HBy 1.0 1.8 6.0 1406 1022 A 67 CYS HBx A 64 VAL HG1% 1.0 1.8 6.0 1407 1022 A 64 VAL HG2% A 67 CYS HBx 1.0 1.8 6.0 1408 1023 A 13 VAL HG2% A 26 TYR HBy 1.0 1.8 6.0 1409 1023 A 13 VAL HG1% A 26 TYR HBy 1.0 1.8 6.0 1410 1023 A 26 TYR HBx A 13 VAL HG1% 1.0 1.8 6.0 1411 1023 A 13 VAL HG2% A 26 TYR HBx 1.0 1.8 6.0 1412 1024 A 13 VAL HG2% A 52 GLN HBy 1.0 1.8 6.0 1413 1024 A 13 VAL HG1% A 52 GLN HBy 1.0 1.8 6.0 1414 1024 A 52 GLN HBx A 13 VAL HG1% 1.0 1.8 6.0 1415 1024 A 13 VAL HG2% A 52 GLN HBx 1.0 1.8 6.0 1416 1025 A 13 VAL HG2% A 52 GLN HGx 1.0 1.8 6.0 1417 1025 A 13 VAL HG1% A 52 GLN HGx 1.0 1.8 6.0 1418 1025 A 52 GLN HGy A 13 VAL HG1% 1.0 1.8 6.0 1419 1025 A 13 VAL HG2% A 52 GLN HGy 1.0 1.8 6.0 1420 1026 A 17 MET HBy A 47 VAL HG1% 1.0 1.8 6.0 1421 1026 A 17 MET HBx A 47 VAL HG1% 1.0 1.8 6.0 1422 1026 A 47 VAL HG2% A 17 MET HBy 1.0 1.8 6.0 1423 1026 A 17 MET HBx A 47 VAL HG2% 1.0 1.8 6.0 1424 1027 A 17 MET HGx A 47 VAL HG1% 1.0 1.8 6.0 1425 1027 A 17 MET HGy A 47 VAL HG1% 1.0 1.8 6.0 1426 1027 A 47 VAL HG2% A 17 MET HGx 1.0 1.8 6.0 1427 1027 A 47 VAL HG2% A 17 MET HGy 1.0 1.8 6.0 1428 1028 A 40 CYS HBy A 47 VAL HG1% 1.0 1.8 6.0 1429 1028 A 40 CYS HBx A 47 VAL HG1% 1.0 1.8 6.0 1430 1028 A 47 VAL HG2% A 40 CYS HBy 1.0 1.8 6.0 1431 1028 A 47 VAL HG2% A 40 CYS HBx 1.0 1.8 6.0 1432 1029 A 41 PRO HDy A 47 VAL HG1% 1.0 1.8 6.0 1433 1029 A 41 PRO HDx A 47 VAL HG1% 1.0 1.8 6.0 1434 1029 A 47 VAL HG2% A 41 PRO HDy 1.0 1.8 6.0 1435 1029 A 47 VAL HG2% A 41 PRO HDx 1.0 1.8 6.0 1436 1030 A 39 MET HA A 47 VAL HG1% 1.0 1.8 5.0 1437 1030 A 47 VAL HG2% A 39 MET HA 1.0 1.8 5.0 1438 1031 A 46 PRO HA A 47 VAL HG1% 1.0 1.8 6.5 1439 1031 A 47 VAL HG2% A 46 PRO HA 1.0 1.8 6.5 1440 1032 A 39 MET HGy A 47 VAL HG1% 1.0 1.8 6.0 1441 1032 A 39 MET HGx A 47 VAL HG1% 1.0 1.8 6.0 1442 1032 A 47 VAL HG2% A 39 MET HGy 1.0 1.8 6.0 1443 1032 A 47 VAL HG2% A 39 MET HGx 1.0 1.8 6.0 1444 1033 A 38 LYS HBx A 47 VAL HG1% 1.0 1.8 6.0 1445 1033 A 38 LYS HBy A 47 VAL HG1% 1.0 1.8 6.0 1446 1033 A 47 VAL HG2% A 38 LYS HBy 1.0 1.8 6.0 1447 1033 A 47 VAL HG2% A 38 LYS HBx 1.0 1.8 6.0 1448 1034 A 17 MET HA A 47 VAL HG1% 1.0 1.8 5.0 1449 1034 A 17 MET HA A 47 VAL HG2% 1.0 1.8 5.0 1450 1035 A 72 LEU HA A 58 LEU HD1% 1.0 1.8 5.0 1451 1035 A 58 LEU HD2% A 72 LEU HA 1.0 1.8 5.0 1452 1036 A 58 LEU HD1% A 72 LEU HD1% 1.0 1.8 6.5 1453 1036 A 58 LEU HD2% A 72 LEU HD1% 1.0 1.8 6.5 1454 1036 A 72 LEU HD2% A 58 LEU HD1% 1.0 1.8 6.5 1455 1036 A 58 LEU HD2% A 72 LEU HD2% 1.0 1.8 6.5 1456 1037 A 70 THR HB A 58 LEU HD1% 1.0 1.8 5.0 1457 1037 A 58 LEU HD2% A 70 THR HB 1.0 1.8 5.0 1458 1038 A 53 CYS HBy A 58 LEU HD1% 1.0 1.8 7.5 1459 1038 A 53 CYS HBx A 58 LEU HD1% 1.0 1.8 7.5 1460 1038 A 58 LEU HD2% A 53 CYS HBy 1.0 1.8 7.5 1461 1038 A 53 CYS HBx A 58 LEU HD2% 1.0 1.8 7.5 1462 1039 A 76 ASP HA A 79 ALA HB% 1.0 1.8 5.0 1463 1040 A 59 PHE HBy A 77 LEU HD1% 1.0 1.8 6.0 1464 1040 A 59 PHE HBx A 77 LEU HD1% 1.0 1.8 6.0 1465 1040 A 77 LEU HD2% A 59 PHE HBy 1.0 1.8 6.0 1466 1040 A 59 PHE HBx A 77 LEU HD2% 1.0 1.8 6.0 1467 1041 A 61 CYS HBy A 77 LEU HD1% 1.0 1.8 6.0 1468 1041 A 61 CYS HBx A 77 LEU HD1% 1.0 1.8 6.0 1469 1041 A 77 LEU HD2% A 61 CYS HBy 1.0 1.8 6.0 1470 1041 A 77 LEU HD2% A 61 CYS HBx 1.0 1.8 6.0 1471 1042 A 74 GLN HA A 77 LEU HD1% 1.0 1.8 5.0 1472 1042 A 77 LEU HD2% A 74 GLN HA 1.0 1.8 5.0 1473 1043 A 61 CYS HA A 77 LEU HD1% 1.0 1.8 5.0 1474 1043 A 77 LEU HD2% A 61 CYS HA 1.0 1.8 5.0 1475 1044 A 21 LYS HA A 72 LEU HD1% 1.0 1.8 6.5 1476 1044 A 72 LEU HD2% A 21 LYS HA 1.0 1.8 6.5 1477 1045 A 70 THR HG2% A 60 MET HA 1.0 1.8 5.0 1478 1046 A 70 THR HG2% A 60 MET HBy 1.0 1.8 5.0 1479 1046 A 70 THR HG2% A 60 MET HBx 1.0 1.8 5.0 1480 1047 A 70 THR HG2% A 60 MET HE% 1.0 1.8 5.0 1481 1048 A 70 THR HG2% A 60 MET HGy 1.0 1.8 5.0 1482 1048 A 70 THR HG2% A 60 MET HGx 1.0 1.8 5.0 1483 1049 A 70 THR HG2% A 58 LEU HD1% 1.0 1.8 5.0 1484 1049 A 58 LEU HD2% A 70 THR HG2% 1.0 1.8 5.0 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 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 79 ALA H A 75 ARG O 1.0 1.8 2.2 2 2 A 75 ARG O A 79 ALA N 1.0 2.2 3.3 3 3 A 80 HIS H A 76 ASP O 1.0 1.8 2.2 4 4 A 76 ASP O A 80 HIS N 1.0 2.2 3.3 5 5 A 81 ILE H A 77 LEU O 1.0 1.8 2.2 6 6 A 77 LEU O A 81 ILE N 1.0 2.2 3.3 7 7 A 82 ASN H A 78 GLN O 1.0 1.8 2.2 8 8 A 78 GLN O A 82 ASN N 1.0 2.2 3.3 9 9 A 83 HIS H A 79 ALA O 1.0 1.8 2.2 10 10 A 79 ALA O A 83 HIS N 1.0 2.2 3.3 11 11 A 84 ARG H A 80 HIS O 1.0 1.8 2.2 12 12 A 80 HIS O A 84 ARG N 1.0 2.2 3.3 13 13 A 31 LEU H A 27 ASP O 1.0 1.8 2.2 14 14 A 27 ASP O A 31 LEU N 1.0 2.2 3.3 15 15 A 32 HIS H A 28 CYS O 1.0 1.8 2.2 16 16 A 28 CYS O A 32 HIS N 1.0 2.2 3.3 17 17 A 33 GLU H A 29 ALA O 1.0 1.8 2.2 18 18 A 29 ALA O A 33 GLU N 1.0 2.2 3.3 19 19 A 34 LYS H A 30 ILE O 1.0 1.8 2.2 20 20 A 30 ILE O A 34 LYS N 1.0 2.2 3.3 21 21 A 35 LYS H A 31 LEU O 1.0 1.8 2.2 22 22 A 31 LEU O A 35 LYS N 1.0 2.2 3.3 23 23 A 14 TYR H A 53 CYS O 1.0 1.8 2.2 24 24 A 53 CYS O A 14 TYR N 1.0 2.2 3.3 25 25 A 16 ARG H A 51 GLU O 1.0 1.8 2.2 26 26 A 51 GLU O A 16 ARG N 1.0 2.2 3.3 27 27 A 53 CYS H A 14 TYR O 1.0 1.8 2.2 28 28 A 14 TYR O A 53 CYS N 1.0 2.2 3.3 29 29 A 51 GLU H A 16 ARG O 1.0 1.8 2.2 30 30 A 16 ARG O A 51 GLU N 1.0 2.2 3.3 31 31 A 24 PHE H A 15 GLY O 1.0 1.8 2.2 32 32 A 15 GLY O A 24 PHE N 1.0 2.2 3.3 33 33 A 22 HIS H A 17 MET O 1.0 1.8 2.2 34 34 A 17 MET O A 22 HIS N 1.0 2.2 3.3 35 35 A 15 GLY H A 24 PHE O 1.0 1.8 2.2 36 36 A 24 PHE O A 15 GLY N 1.0 2.2 3.3 37 37 A 17 MET H A 22 HIS O 1.0 1.8 2.2 38 38 A 22 HIS O A 17 MET N 1.0 2.2 3.3 stop_ 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 undefined _nef_distance_restraint_list.potential_type undefined save_ save_CNS/XPLOR_dihedral_5 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_5 _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 2 HIS C A 3 PHE N A 3 PHE CA A 3 PHE C 1.0 -158.0 -58.0 PHI 2 2 A 3 PHE N A 3 PHE CA A 3 PHE C A 4 CYS N 1.0 104.0 160.0 PSI 3 3 A 3 PHE C A 4 CYS N A 4 CYS CA A 4 CYS C 1.0 -147.0 -47.0 PHI 4 4 A 4 CYS N A 4 CYS CA A 4 CYS C A 5 ASP N 1.0 106.0 146.0 PSI 5 5 A 4 CYS C A 5 ASP N A 5 ASP CA A 5 ASP C 1.0 -138.0 -38.0 PHI 6 6 A 13 VAL N A 13 VAL CA A 13 VAL C A 14 TYR N 1.0 117.0 157.0 PSI 7 7 A 13 VAL C A 14 TYR N A 14 TYR CA A 14 TYR C 1.0 -164.0 -64.0 PHI 8 8 A 15 GLY C A 16 ARG N A 16 ARG CA A 16 ARG C 1.0 -156.0 -56.0 PHI 9 9 A 16 ARG N A 16 ARG CA A 16 ARG C A 17 MET N 1.0 99.0 147.0 PSI 10 10 A 16 ARG C A 17 MET N A 17 MET CA A 17 MET C 1.0 -149.0 -49.0 PHI 11 11 A 17 MET N A 17 MET CA A 17 MET C A 18 ILE N 1.0 109.0 149.0 PSI 12 12 A 25 CYS C A 26 TYR N A 26 TYR CA A 26 TYR C 1.0 -77.0 -37.0 PHI 13 13 A 26 TYR N A 26 TYR CA A 26 TYR C A 27 ASP N 1.0 -68.0 -12.0 PSI 14 14 A 26 TYR C A 27 ASP N A 27 ASP CA A 27 ASP C 1.0 -82.0 -42.0 PHI 15 15 A 27 ASP N A 27 ASP CA A 27 ASP C A 28 CYS N 1.0 -59.0 -19.0 PSI 16 16 A 27 ASP C A 28 CYS N A 28 CYS CA A 28 CYS C 1.0 -83.0 -43.0 PHI 17 17 A 28 CYS N A 28 CYS CA A 28 CYS C A 29 ALA N 1.0 -63.0 -23.0 PSI 18 18 A 28 CYS C A 29 ALA N A 29 ALA CA A 29 ALA C 1.0 -81.0 -41.0 PHI 19 19 A 29 ALA N A 29 ALA CA A 29 ALA C A 30 ILE N 1.0 -59.0 -19.0 PSI 20 20 A 29 ALA C A 30 ILE N A 30 ILE CA A 30 ILE C 1.0 -116.4 -26.0 PHI 21 21 A 30 ILE N A 30 ILE CA A 30 ILE C A 31 LEU N 1.0 -61.8 -2.8 PSI 22 22 A 30 ILE C A 31 LEU N A 31 LEU CA A 31 LEU C 1.0 -88.6 -40.2 PHI 23 23 A 31 LEU N A 31 LEU CA A 31 LEU C A 32 HIS N 1.0 -59.5 -19.5 PSI 24 24 A 31 LEU C A 32 HIS N A 32 HIS CA A 32 HIS C 1.0 -85.0 -45.0 PHI 25 25 A 32 HIS N A 32 HIS CA A 32 HIS C A 33 GLU N 1.0 -57.1 -17.1 PSI 26 26 A 32 HIS C A 33 GLU N A 33 GLU CA A 33 GLU C 1.0 -87.6 -47.6 PHI 27 27 A 33 GLU N A 33 GLU CA A 33 GLU C A 34 LYS N 1.0 -63.5 -23.5 PSI 28 28 A 33 GLU C A 34 LYS N A 34 LYS CA A 34 LYS C 1.0 -85.0 -43.0 PHI 29 29 A 34 LYS N A 34 LYS CA A 34 LYS C A 35 LYS N 1.0 -59.0 -19.0 PSI 30 30 A 34 LYS C A 35 LYS N A 35 LYS CA A 35 LYS C 1.0 -81.0 -41.0 PHI 31 31 A 50 ILE N A 50 ILE CA A 50 ILE C A 51 GLU N 1.0 104.0 144.0 PSI 32 32 A 50 ILE C A 51 GLU N A 51 GLU CA A 51 GLU C 1.0 -169.0 -69.0 PHI 33 33 A 51 GLU N A 51 GLU CA A 51 GLU C A 52 GLN N 1.0 102.0 166.0 PSI 34 34 A 51 GLU C A 52 GLN N A 52 GLN CA A 52 GLN C 1.0 -156.0 -56.0 PHI 35 35 A 52 GLN N A 52 GLN CA A 52 GLN C A 53 CYS N 1.0 111.0 151.0 PSI 36 36 A 52 GLN C A 53 CYS N A 53 CYS CA A 53 CYS C 1.0 -159.0 -59.0 PHI 37 37 A 53 CYS N A 53 CYS CA A 53 CYS C A 54 THR N 1.0 93.0 189.0 PSI 38 38 A 57 SER C A 58 LEU N A 58 LEU CA A 58 LEU C 1.0 -166.0 -66.0 PHI 39 39 A 58 LEU N A 58 LEU CA A 58 LEU C A 59 PHE N 1.0 120.0 172.0 PSI 40 40 A 58 LEU C A 59 PHE N A 59 PHE CA A 59 PHE C 1.0 -157.0 -57.0 PHI 41 41 A 59 PHE N A 59 PHE CA A 59 PHE C A 60 MET N 1.0 103.0 155.0 PSI 42 42 A 59 PHE C A 60 MET N A 60 MET CA A 60 MET C 1.0 -152.0 -52.0 PHI 43 43 A 60 MET N A 60 MET CA A 60 MET C A 61 CYS N 1.0 104.0 144.0 PSI 44 44 A 60 MET C A 61 CYS N A 61 CYS CA A 61 CYS C 1.0 -141.0 -51.0 PHI 45 45 A 61 CYS N A 61 CYS CA A 61 CYS C A 62 SER N 1.0 95.0 143.0 PSI 46 46 A 73 SER C A 74 GLN N A 74 GLN CA A 74 GLN C 1.0 -90.0 -36.0 PHI 47 47 A 74 GLN N A 74 GLN CA A 74 GLN C A 75 ARG N 1.0 -58.0 -14.0 PSI 48 48 A 74 GLN C A 75 ARG N A 75 ARG CA A 75 ARG C 1.0 -84.1 -44.1 PHI 49 49 A 75 ARG N A 75 ARG CA A 75 ARG C A 76 ASP N 1.0 -59.6 -19.6 PSI 50 50 A 75 ARG C A 76 ASP N A 76 ASP CA A 76 ASP C 1.0 -88.2 -39.6 PHI 51 51 A 76 ASP N A 76 ASP CA A 76 ASP C A 77 LEU N 1.0 -62.6 -22.6 PSI 52 52 A 76 ASP C A 77 LEU N A 77 LEU CA A 77 LEU C 1.0 -85.8 -45.8 PHI 53 53 A 77 LEU N A 77 LEU CA A 77 LEU C A 78 GLN N 1.0 -61.0 -21.0 PSI 54 54 A 77 LEU C A 78 GLN N A 78 GLN CA A 78 GLN C 1.0 -81.2 -41.2 PHI 55 55 A 78 GLN N A 78 GLN CA A 78 GLN C A 79 ALA N 1.0 -63.0 -23.0 PSI 56 56 A 78 GLN C A 79 ALA N A 79 ALA CA A 79 ALA C 1.0 -84.0 -44.0 PHI 57 57 A 79 ALA N A 79 ALA CA A 79 ALA C A 80 HIS N 1.0 -61.3 -21.3 PSI 58 58 A 79 ALA C A 80 HIS N A 80 HIS CA A 80 HIS C 1.0 -80.9 -40.7 PHI 59 59 A 80 HIS N A 80 HIS CA A 80 HIS C A 81 ILE N 1.0 -69.1 -29.1 PSI 60 60 A 80 HIS C A 81 ILE N A 81 ILE CA A 81 ILE C 1.0 -83.6 -42.8 PHI 61 61 A 81 ILE N A 81 ILE CA A 81 ILE C A 82 ASN N 1.0 -61.3 -21.3 PSI 62 62 A 81 ILE C A 82 ASN N A 82 ASN CA A 82 ASN C 1.0 -82.7 -42.7 PHI 63 63 A 82 ASN N A 82 ASN CA A 82 ASN C A 83 HIS N 1.0 -59.2 -19.2 PSI 64 64 A 82 ASN C A 83 HIS N A 83 HIS CA A 83 HIS C 1.0 -85.0 -37.0 PHI 65 65 A 83 HIS N A 83 HIS CA A 83 HIS C A 84 ARG N 1.0 -65.0 -13.0 PSI 66 66 A 83 HIS C A 84 ARG N A 84 ARG CA A 84 ARG C 1.0 -127.0 -43.0 PHI 67 67 A 84 ARG N A 84 ARG CA A 84 ARG C A 85 HIS N 1.0 -59.0 25.0 PSI stop_ save_