data_nef_c19233_2mgp 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 BMRB 19234 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 8 CYS SG 1 20 CYS SG 1 32 CYS SG 1 44 CYS SG 1 52 CYS SG 1 65 CYS SG 1 59 CYS SG 1 79 CYS SG 1 81 CYS SG 1 95 CYS SG stop_ loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 GLY start . false 2 A 2 VAL middle . . 3 A 3 ASP middle . . 4 A 4 PRO middle . false 5 A 5 LYS middle . . 6 A 6 HIS middle . . 7 A 7 VAL middle . . 8 A 8 CYS middle -HG . 9 A 9 VAL middle . . 10 A 10 ASP middle . . 11 A 11 THR middle . . 12 A 12 ARG middle . . 13 A 13 ASP middle . . 14 A 14 ILE middle . . 15 A 15 PRO middle . false 16 A 16 LYS middle . . 17 A 17 ASN middle . . 18 A 18 ALA middle . . 19 A 19 GLY middle . false 20 A 20 CYS middle -HG . 21 A 21 PHE middle . . 22 A 22 ARG middle . . 23 A 23 ASP middle . . 24 A 24 ASP middle . . 25 A 25 ASP middle . . 26 A 26 GLY middle . false 27 A 27 THR middle . . 28 A 28 GLU middle . . 29 A 29 GLU middle . . 30 A 30 TRP middle . . 31 A 31 ARG middle . . 32 A 32 CYS middle -HG . 33 A 33 LEU middle . . 34 A 34 LEU middle . . 35 A 35 GLY middle . false 36 A 36 TYR middle . . 37 A 37 LYS middle . . 38 A 38 LYS middle . . 39 A 39 GLY middle . false 40 A 40 GLU middle . . 41 A 41 GLY middle . false 42 A 42 ASN middle . . 43 A 43 THR middle . . 44 A 44 CYS middle -HG . 45 A 45 VAL middle . . 46 A 46 GLU middle . . 47 A 47 ASN middle . . 48 A 48 ASN middle . . 49 A 49 ASN middle . . 50 A 50 PRO middle . false 51 A 51 THR middle . . 52 A 52 CYS middle -HG . 53 A 53 ASP middle . . 54 A 54 ILE middle . . 55 A 55 ASN middle . . 56 A 56 ASN middle . . 57 A 57 GLY middle . false 58 A 58 GLY middle . false 59 A 59 CYS middle -HG . 60 A 60 ASP middle . . 61 A 61 PRO middle . false 62 A 62 THR middle . . 63 A 63 ALA middle . . 64 A 64 SER middle . . 65 A 65 CYS middle -HG . 66 A 66 GLN middle . . 67 A 67 ASN middle . . 68 A 68 ALA middle . . 69 A 69 GLU middle . . 70 A 70 SER middle . . 71 A 71 THR middle . . 72 A 72 GLU middle . . 73 A 73 ASN middle . . 74 A 74 SER middle . . 75 A 75 LYS middle . . 76 A 76 LYS middle . . 77 A 77 ILE middle . . 78 A 78 ILE middle . . 79 A 79 CYS middle -HG . 80 A 80 THR middle . . 81 A 81 CYS middle -HG . 82 A 82 LYS middle . . 83 A 83 GLU middle . . 84 A 84 PRO middle . false 85 A 85 THR middle . . 86 A 86 PRO middle . false 87 A 87 ASN middle . . 88 A 88 ALA middle . . 89 A 89 TYR middle . . 90 A 90 TYR middle . . 91 A 91 GLU middle . . 92 A 92 GLY middle . false 93 A 93 VAL middle . . 94 A 94 PHE middle . . 95 A 95 CYS middle -HG . 96 A 96 SER middle . . 97 A 97 SER middle . . 98 A 98 SER middle . . 99 A 99 SER end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 GLY H1 H 1 8.491 0.025 A 1 GLY HA2 H 1 3.923 0.025 A 1 GLY HA3 H 1 3.969 0.025 A 1 GLY C C 13 176.567 0.10 A 1 GLY CA C 13 45.258 0.10 A 1 GLY N N 15 110.297 0.10 A 2 VAL H H 1 7.975 0.025 A 2 VAL HA H 1 4.183 0.025 A 2 VAL HB H 1 2.053 0.025 A 2 VAL HGx% H 1 0.913 0.025 A 2 VAL HGy% H 1 0.923 0.025 A 2 VAL C C 13 175.051 0.10 A 2 VAL CA C 13 61.652 0.10 A 2 VAL CB C 13 33.263 0.10 A 2 VAL CG1 C 13 21.299 0.10 A 2 VAL CG2 C 13 20.579 0.10 A 2 VAL N N 15 118.903 0.10 A 3 ASP H H 1 8.492 0.025 A 3 ASP HA H 1 4.869 0.025 A 3 ASP HBy H 1 2.834 0.025 A 3 ASP HBx H 1 2.726 0.025 A 3 ASP C C 13 175.260 0.10 A 3 ASP CA C 13 52.066 0.10 A 3 ASP CB C 13 41.482 0.10 A 3 ASP N N 15 126.208 0.10 A 4 PRO HA H 1 3.701 0.025 A 4 PRO HBx H 1 1.615 0.025 A 4 PRO HBy H 1 2.048 0.025 A 4 PRO HGy H 1 2.085 0.025 A 4 PRO HGx H 1 1.756 0.025 A 4 PRO HDx H 1 3.127 0.025 A 4 PRO HDy H 1 3.536 0.025 A 4 PRO CA C 13 64.945 0.10 A 4 PRO CB C 13 32.972 0.10 A 4 PRO CG C 13 26.342 0.10 A 4 PRO CD C 13 49.937 0.10 A 5 LYS H H 1 8.405 0.025 A 5 LYS HA H 1 4.015 0.025 A 5 LYS HBx H 1 1.401 0.025 A 5 LYS HBy H 1 1.633 0.025 A 5 LYS HGy H 1 1.021 0.025 A 5 LYS HGx H 1 0.784 0.025 A 5 LYS HDy H 1 1.557 0.025 A 5 LYS HDx H 1 1.556 0.025 A 5 LYS HEx H 1 2.874 0.025 A 5 LYS HEy H 1 2.883 0.025 A 5 LYS CA C 13 57.948 0.10 A 5 LYS CB C 13 32.136 0.10 A 5 LYS CG C 13 24.246 0.10 A 5 LYS CD C 13 29.102 0.10 A 5 LYS CE C 13 41.929 0.10 A 5 LYS N N 15 118.344 0.10 A 6 HIS H H 1 8.073 0.025 A 6 HIS HA H 1 4.794 0.025 A 6 HIS HBx H 1 2.727 0.025 A 6 HIS HD2 H 1 7.449 0.025 A 6 HIS HE1 H 1 8.733 0.025 A 6 HIS C C 13 176.828 0.10 A 6 HIS CB C 13 28.571 0.10 A 6 HIS CD2 C 13 121.387 0.10 A 6 HIS CE1 C 13 108.947 0.10 A 6 HIS N N 15 113.277 0.10 A 7 VAL H H 1 7.177 0.025 A 7 VAL HA H 1 4.080 0.025 A 7 VAL HB H 1 1.961 0.025 A 7 VAL HGx% H 1 1.012 0.025 A 7 VAL HGy% H 1 0.962 0.025 A 7 VAL C C 13 174.385 0.10 A 7 VAL CA C 13 62.087 0.10 A 7 VAL CB C 13 32.636 0.10 A 7 VAL CG1 C 13 22.592 0.10 A 7 VAL CG2 C 13 20.964 0.10 A 7 VAL N N 15 122.965 0.10 A 8 CYS H H 1 9.071 0.025 A 8 CYS HA H 1 4.034 0.025 A 8 CYS HBx H 1 3.162 0.025 A 8 CYS HBy H 1 3.313 0.025 A 8 CYS C C 13 175.733 0.10 A 8 CYS CA C 13 56.550 0.10 A 8 CYS CB C 13 41.750 0.10 A 8 CYS N N 15 124.558 0.10 A 9 VAL H H 1 9.996 0.025 A 9 VAL HA H 1 4.330 0.025 A 9 VAL HB H 1 2.041 0.025 A 9 VAL HGx% H 1 0.823 0.025 A 9 VAL HGy% H 1 0.783 0.025 A 9 VAL C C 13 173.766 0.10 A 9 VAL CA C 13 62.281 0.10 A 9 VAL CB C 13 34.698 0.10 A 9 VAL CG1 C 13 21.560 0.10 A 9 VAL CG2 C 13 19.111 0.10 A 9 VAL N N 15 119.612 0.10 A 10 ASP H H 1 9.317 0.025 A 10 ASP HA H 1 4.786 0.025 A 10 ASP HBx H 1 2.420 0.025 A 10 ASP HBy H 1 2.756 0.025 A 10 ASP C C 13 176.034 0.10 A 10 ASP CA C 13 55.768 0.10 A 10 ASP CB C 13 41.948 0.10 A 10 ASP N N 15 124.847 0.10 A 11 THR H H 1 8.592 0.025 A 11 THR HA H 1 4.120 0.025 A 11 THR HB H 1 4.120 0.025 A 11 THR HG2% H 1 1.239 0.025 A 11 THR C C 13 176.811 0.10 A 11 THR CA C 13 63.739 0.10 A 11 THR CB C 13 68.978 0.10 A 11 THR CG2 C 13 21.764 0.10 A 11 THR N N 15 119.344 0.10 A 12 ARG H H 1 8.574 0.025 A 12 ARG HA H 1 4.260 0.025 A 12 ARG HBy H 1 1.869 0.025 A 12 ARG HBx H 1 1.723 0.025 A 12 ARG HGx H 1 1.619 0.025 A 12 ARG HGy H 1 1.672 0.025 A 12 ARG HDy H 1 3.189 0.025 A 12 ARG HDx H 1 3.185 0.025 A 12 ARG HE H 1 7.230 0.025 A 12 ARG C C 13 174.027 0.10 A 12 ARG CA C 13 56.194 0.10 A 12 ARG CB C 13 31.306 0.10 A 12 ARG CG C 13 27.057 0.10 A 12 ARG CD C 13 43.122 0.10 A 12 ARG N N 15 126.311 0.10 A 12 ARG NE N 15 84.812 0.10 A 13 ASP H H 1 8.227 0.025 A 13 ASP HA H 1 4.503 0.025 A 13 ASP HBy H 1 2.592 0.025 A 13 ASP HBx H 1 2.531 0.025 A 13 ASP C C 13 175.618 0.10 A 13 ASP CA C 13 53.514 0.10 A 13 ASP CB C 13 40.257 0.10 A 13 ASP N N 15 118.704 0.10 A 14 ILE H H 1 7.804 0.025 A 14 ILE HA H 1 3.501 0.025 A 14 ILE HB H 1 1.481 0.025 A 14 ILE HG1y H 1 1.345 0.025 A 14 ILE HG1x H 1 0.665 0.025 A 14 ILE HG2% H 1 0.588 0.025 A 14 ILE HD1% H 1 0.817 0.025 A 14 ILE C C 13 174.568 0.10 A 14 ILE CA C 13 58.657 0.10 A 14 ILE CB C 13 38.666 0.10 A 14 ILE CG1 C 13 28.376 0.10 A 14 ILE CG2 C 13 17.090 0.10 A 14 ILE CD1 C 13 13.777 0.10 A 14 ILE N N 15 122.294 0.10 A 15 PRO HA H 1 4.005 0.025 A 15 PRO HBy H 1 1.906 0.025 A 15 PRO HBx H 1 1.085 0.025 A 15 PRO HGx H 1 -0.087 0.025 A 15 PRO HGy H 1 0.783 0.025 A 15 PRO HDx H 1 1.550 0.025 A 15 PRO HDy H 1 2.455 0.025 A 15 PRO CA C 13 62.651 0.10 A 15 PRO CB C 13 31.934 0.10 A 15 PRO CG C 13 26.250 0.10 A 15 PRO CD C 13 49.767 0.10 A 16 LYS H H 1 7.920 0.025 A 16 LYS HA H 1 3.957 0.025 A 16 LYS HBy H 1 1.655 0.025 A 16 LYS HBx H 1 1.589 0.025 A 16 LYS HGx H 1 1.393 0.025 A 16 LYS HGy H 1 1.464 0.025 A 16 LYS HDx H 1 1.677 0.025 A 16 LYS HDy H 1 1.677 0.025 A 16 LYS HEx H 1 3.001 0.025 A 16 LYS HEy H 1 3.004 0.025 A 16 LYS C C 13 175.712 0.10 A 16 LYS CA C 13 57.240 0.10 A 16 LYS CB C 13 32.144 0.10 A 16 LYS CG C 13 24.904 0.10 A 16 LYS CD C 13 29.006 0.10 A 16 LYS CE C 13 42.431 0.10 A 16 LYS N N 15 120.683 0.10 A 17 ASN H H 1 8.764 0.025 A 17 ASN HA H 1 3.772 0.025 A 17 ASN HBy H 1 2.372 0.025 A 17 ASN HBx H 1 1.119 0.025 A 17 ASN HD2y H 1 7.067 0.025 A 17 ASN HD2x H 1 6.818 0.025 A 17 ASN C C 13 177.727 0.10 A 17 ASN CA C 13 54.876 0.10 A 17 ASN CB C 13 35.967 0.10 A 17 ASN N N 15 115.246 0.10 A 17 ASN ND2 N 15 115.380 0.10 A 18 ALA H H 1 7.187 0.025 A 18 ALA HA H 1 5.110 0.025 A 18 ALA HB% H 1 1.242 0.025 A 18 ALA C C 13 170.958 0.10 A 18 ALA CA C 13 50.632 0.10 A 18 ALA CB C 13 24.297 0.10 A 18 ALA N N 15 115.740 0.10 A 19 GLY H H 1 8.765 0.025 A 19 GLY HA2 H 1 2.259 0.025 A 19 GLY HA3 H 1 4.287 0.025 A 19 GLY C C 13 176.426 0.10 A 19 GLY CA C 13 43.292 0.10 A 19 GLY N N 15 105.452 0.10 A 20 CYS H H 1 8.583 0.025 A 20 CYS HA H 1 5.534 0.025 A 20 CYS HBx H 1 2.569 0.025 A 20 CYS HBy H 1 3.307 0.025 A 20 CYS C C 13 171.146 0.10 A 20 CYS CA C 13 55.675 0.10 A 20 CYS CB C 13 41.317 0.10 A 20 CYS N N 15 121.792 0.10 A 21 PHE H H 1 8.982 0.025 A 21 PHE HA H 1 4.575 0.025 A 21 PHE HBy H 1 1.776 0.025 A 21 PHE HBx H 1 1.219 0.025 A 21 PHE HD1 H 1 6.583 0.025 A 21 PHE HD2 H 1 6.583 0.025 A 21 PHE HE1 H 1 6.062 0.025 A 21 PHE HE2 H 1 6.062 0.025 A 21 PHE HZ H 1 6.232 0.025 A 21 PHE C C 13 171.816 0.10 A 21 PHE CA C 13 57.263 0.10 A 21 PHE CB C 13 41.938 0.10 A 21 PHE CD1 C 13 130.877 0.10 A 21 PHE CE1 C 13 130.743 0.10 A 21 PHE CZ C 13 128.291 0.10 A 21 PHE N N 15 133.349 0.10 A 22 ARG H H 1 7.442 0.025 A 22 ARG HA H 1 4.852 0.025 A 22 ARG HBx H 1 0.933 0.025 A 22 ARG HBy H 1 1.101 0.025 A 22 ARG HGx H 1 1.342 0.025 A 22 ARG HGy H 1 1.481 0.025 A 22 ARG HDx H 1 2.984 0.025 A 22 ARG HDy H 1 3.353 0.025 A 22 ARG HE H 1 7.126 0.025 A 22 ARG C C 13 172.076 0.10 A 22 ARG CA C 13 53.707 0.10 A 22 ARG CB C 13 32.382 0.10 A 22 ARG CG C 13 27.897 0.10 A 22 ARG CD C 13 43.612 0.10 A 22 ARG N N 15 131.250 0.10 A 22 ARG NE N 15 85.232 0.10 A 23 ASP H H 1 8.705 0.025 A 23 ASP HA H 1 4.418 0.025 A 23 ASP HBx H 1 3.089 0.025 A 23 ASP HBy H 1 3.089 0.025 A 23 ASP C C 13 173.939 0.10 A 23 ASP CA C 13 52.925 0.10 A 23 ASP CB C 13 41.820 0.10 A 23 ASP N N 15 127.231 0.10 A 24 ASP H H 1 9.227 0.025 A 24 ASP HA H 1 4.324 0.025 A 24 ASP HBy H 1 2.752 0.025 A 24 ASP HBx H 1 2.670 0.025 A 24 ASP C C 13 177.747 0.10 A 24 ASP CA C 13 57.240 0.10 A 24 ASP CB C 13 40.603 0.10 A 24 ASP N N 15 121.497 0.10 A 25 ASP H H 1 8.241 0.025 A 25 ASP HA H 1 4.601 0.025 A 25 ASP HBy H 1 2.953 0.025 A 25 ASP HBx H 1 2.752 0.025 A 25 ASP C C 13 176.813 0.10 A 25 ASP CA C 13 53.959 0.10 A 25 ASP CB C 13 40.529 0.10 A 25 ASP N N 15 117.119 0.10 A 26 GLY H H 1 8.153 0.025 A 26 GLY HA2 H 1 4.268 0.025 A 26 GLY HA3 H 1 3.410 0.025 A 26 GLY C C 13 176.806 0.10 A 26 GLY CA C 13 45.013 0.10 A 26 GLY N N 15 108.843 0.10 A 27 THR H H 1 8.240 0.025 A 27 THR HA H 1 4.177 0.025 A 27 THR HB H 1 4.289 0.025 A 27 THR HG2% H 1 1.226 0.025 A 27 THR C C 13 173.530 0.10 A 27 THR CA C 13 63.116 0.10 A 27 THR CB C 13 69.167 0.10 A 27 THR CG2 C 13 22.092 0.10 A 27 THR N N 15 117.394 0.10 A 28 GLU H H 1 8.773 0.025 A 28 GLU HA H 1 5.288 0.025 A 28 GLU HBy H 1 1.904 0.025 A 28 GLU HBx H 1 1.801 0.025 A 28 GLU HGy H 1 2.650 0.025 A 28 GLU HGx H 1 2.026 0.025 A 28 GLU C C 13 174.180 0.10 A 28 GLU CA C 13 55.196 0.10 A 28 GLU CB C 13 32.008 0.10 A 28 GLU CG C 13 37.025 0.10 A 28 GLU N N 15 125.068 0.10 A 29 GLU H H 1 8.265 0.025 A 29 GLU HA H 1 4.719 0.025 A 29 GLU HBx H 1 2.148 0.025 A 29 GLU HBy H 1 2.152 0.025 A 29 GLU HGy H 1 2.420 0.025 A 29 GLU HGx H 1 2.219 0.025 A 29 GLU C C 13 175.577 0.10 A 29 GLU CA C 13 55.406 0.10 A 29 GLU CB C 13 34.323 0.10 A 29 GLU CG C 13 36.173 0.10 A 29 GLU N N 15 123.579 0.10 A 30 TRP H H 1 8.325 0.025 A 30 TRP HA H 1 6.307 0.025 A 30 TRP HBy H 1 3.276 0.025 A 30 TRP HBx H 1 2.598 0.025 A 30 TRP HD1 H 1 7.121 0.025 A 30 TRP HE1 H 1 10.205 0.025 A 30 TRP HE3 H 1 6.926 0.025 A 30 TRP HZ2 H 1 7.471 0.025 A 30 TRP HZ3 H 1 6.927 0.025 A 30 TRP HH2 H 1 6.954 0.025 A 30 TRP C C 13 173.804 0.10 A 30 TRP CA C 13 53.497 0.10 A 30 TRP CB C 13 33.775 0.10 A 30 TRP CD1 C 13 127.910 0.10 A 30 TRP CE3 C 13 120.634 0.10 A 30 TRP CZ2 C 13 114.949 0.10 A 30 TRP CZ3 C 13 121.751 0.10 A 30 TRP CH2 C 13 123.710 0.10 A 30 TRP N N 15 120.992 0.10 A 30 TRP NE1 N 15 130.031 0.10 A 31 ARG H H 1 8.909 0.025 A 31 ARG HA H 1 4.543 0.025 A 31 ARG HBy H 1 1.759 0.025 A 31 ARG HBx H 1 0.969 0.025 A 31 ARG HGy H 1 1.607 0.025 A 31 ARG HGx H 1 1.194 0.025 A 31 ARG HDy H 1 2.733 0.025 A 31 ARG HDx H 1 1.025 0.025 A 31 ARG HE H 1 6.875 0.025 A 31 ARG C C 13 174.628 0.10 A 31 ARG CA C 13 54.875 0.10 A 31 ARG CB C 13 35.841 0.10 A 31 ARG CG C 13 28.202 0.10 A 31 ARG CD C 13 42.717 0.10 A 31 ARG N N 15 118.834 0.10 A 31 ARG NE N 15 86.180 0.10 A 32 CYS H H 1 9.221 0.025 A 32 CYS HA H 1 4.994 0.025 A 32 CYS HBy H 1 3.035 0.025 A 32 CYS HBx H 1 2.664 0.025 A 32 CYS C C 13 175.318 0.10 A 32 CYS CA C 13 54.261 0.10 A 32 CYS CB C 13 36.372 0.10 A 32 CYS N N 15 119.717 0.10 A 33 LEU H H 1 8.292 0.025 A 33 LEU HA H 1 4.383 0.025 A 33 LEU HBy H 1 1.873 0.025 A 33 LEU HBx H 1 1.513 0.025 A 33 LEU HG H 1 1.202 0.025 A 33 LEU HDx% H 1 0.775 0.025 A 33 LEU HDy% H 1 0.758 0.025 A 33 LEU C C 13 173.561 0.10 A 33 LEU CA C 13 54.192 0.10 A 33 LEU CB C 13 41.450 0.10 A 33 LEU CG C 13 27.728 0.10 A 33 LEU CD1 C 13 22.077 0.10 A 33 LEU CD2 C 13 25.596 0.10 A 33 LEU N N 15 120.192 0.10 A 34 LEU H H 1 8.516 0.025 A 34 LEU HA H 1 4.312 0.025 A 34 LEU HBx H 1 1.537 0.025 A 34 LEU HBy H 1 1.819 0.025 A 34 LEU HG H 1 1.878 0.025 A 34 LEU HDx% H 1 1.046 0.025 A 34 LEU HDy% H 1 0.753 0.025 A 34 LEU C C 13 175.970 0.10 A 34 LEU CA C 13 56.936 0.10 A 34 LEU CB C 13 40.773 0.10 A 34 LEU CG C 13 26.832 0.10 A 34 LEU CD1 C 13 26.130 0.10 A 34 LEU CD2 C 13 22.100 0.10 A 34 LEU N N 15 117.059 0.10 A 35 GLY H H 1 8.356 0.025 A 35 GLY HA2 H 1 3.055 0.025 A 35 GLY HA3 H 1 3.996 0.025 A 35 GLY C C 13 178.974 0.10 A 35 GLY CA C 13 44.309 0.10 A 35 GLY N N 15 106.613 0.10 A 36 TYR H H 1 8.728 0.025 A 36 TYR HA H 1 5.146 0.025 A 36 TYR HBx H 1 2.676 0.025 A 36 TYR HBy H 1 3.347 0.025 A 36 TYR HD1 H 1 6.636 0.025 A 36 TYR HD2 H 1 6.636 0.025 A 36 TYR HE1 H 1 6.687 0.025 A 36 TYR HE2 H 1 6.687 0.025 A 36 TYR C C 13 172.952 0.10 A 36 TYR CA C 13 56.948 0.10 A 36 TYR CB C 13 41.411 0.10 A 36 TYR CD1 C 13 133.025 0.10 A 36 TYR CE1 C 13 118.006 0.10 A 36 TYR N N 15 119.297 0.10 A 37 LYS H H 1 9.959 0.025 A 37 LYS HA H 1 4.869 0.025 A 37 LYS HBy H 1 1.992 0.025 A 37 LYS HBx H 1 1.593 0.025 A 37 LYS HGx H 1 1.106 0.025 A 37 LYS HGy H 1 1.109 0.025 A 37 LYS HDx H 1 1.344 0.025 A 37 LYS HDy H 1 1.595 0.025 A 37 LYS HEx H 1 2.883 0.025 A 37 LYS HEy H 1 2.950 0.025 A 37 LYS C C 13 174.553 0.10 A 37 LYS CA C 13 53.889 0.10 A 37 LYS CB C 13 36.216 0.10 A 37 LYS CG C 13 23.713 0.10 A 37 LYS CD C 13 29.785 0.10 A 37 LYS CE C 13 42.407 0.10 A 37 LYS N N 15 119.686 0.10 A 38 LYS H H 1 8.714 0.025 A 38 LYS HA H 1 4.918 0.025 A 38 LYS HBy H 1 1.960 0.025 A 38 LYS HBx H 1 1.907 0.025 A 38 LYS HGx H 1 1.904 0.025 A 38 LYS HGy H 1 1.904 0.025 A 38 LYS HDy H 1 1.966 0.025 A 38 LYS HDx H 1 1.816 0.025 A 38 LYS HEx H 1 3.099 0.025 A 38 LYS HEy H 1 3.099 0.025 A 38 LYS C C 13 173.933 0.10 A 38 LYS CA C 13 58.047 0.10 A 38 LYS CB C 13 32.800 0.10 A 38 LYS CG C 13 25.297 0.10 A 38 LYS CD C 13 29.227 0.10 A 38 LYS CE C 13 42.379 0.10 A 38 LYS N N 15 124.099 0.10 A 39 GLY H H 1 8.582 0.025 A 39 GLY HA2 H 1 4.541 0.025 A 39 GLY HA3 H 1 3.561 0.025 A 39 GLY C C 13 178.245 0.10 A 39 GLY CA C 13 43.878 0.10 A 39 GLY N N 15 114.988 0.10 A 40 GLU H H 1 8.355 0.025 A 40 GLU HA H 1 4.272 0.025 A 40 GLU HBx H 1 1.989 0.025 A 40 GLU HBy H 1 1.990 0.025 A 40 GLU HGy H 1 2.320 0.025 A 40 GLU HGx H 1 2.319 0.025 A 40 GLU C C 13 173.330 0.10 A 40 GLU CA C 13 56.853 0.10 A 40 GLU CB C 13 29.925 0.10 A 40 GLU CG C 13 36.178 0.10 A 40 GLU N N 15 120.722 0.10 A 41 GLY H H 1 8.954 0.025 A 41 GLY HA2 H 1 3.944 0.025 A 41 GLY HA3 H 1 3.893 0.025 A 41 GLY C C 13 178.546 0.10 A 41 GLY CA C 13 46.109 0.10 A 41 GLY N N 15 113.727 0.10 A 42 ASN H H 1 8.831 0.025 A 42 ASN HA H 1 4.981 0.025 A 42 ASN HBx H 1 2.861 0.025 A 42 ASN HBy H 1 2.892 0.025 A 42 ASN HD2y H 1 7.737 0.025 A 42 ASN HD2x H 1 7.078 0.025 A 42 ASN C C 13 174.567 0.10 A 42 ASN CA C 13 52.651 0.10 A 42 ASN CB C 13 37.023 0.10 A 42 ASN N N 15 121.167 0.10 A 42 ASN ND2 N 15 113.809 0.10 A 43 THR H H 1 7.364 0.025 A 43 THR HA H 1 4.562 0.025 A 43 THR HB H 1 3.998 0.025 A 43 THR HG2% H 1 1.167 0.025 A 43 THR C C 13 173.690 0.10 A 43 THR CA C 13 59.747 0.10 A 43 THR CB C 13 72.824 0.10 A 43 THR CG2 C 13 21.901 0.10 A 43 THR N N 15 107.732 0.10 A 44 CYS H H 1 8.957 0.025 A 44 CYS HA H 1 5.414 0.025 A 44 CYS HBy H 1 3.002 0.025 A 44 CYS HBx H 1 2.631 0.025 A 44 CYS C C 13 173.834 0.10 A 44 CYS CA C 13 54.753 0.10 A 44 CYS CB C 13 42.023 0.10 A 44 CYS N N 15 120.345 0.10 A 45 VAL H H 1 9.620 0.025 A 45 VAL HA H 1 4.885 0.025 A 45 VAL HB H 1 2.393 0.025 A 45 VAL HGx% H 1 1.007 0.025 A 45 VAL HGy% H 1 0.837 0.025 A 45 VAL C C 13 174.038 0.10 A 45 VAL CA C 13 58.845 0.10 A 45 VAL CB C 13 34.096 0.10 A 45 VAL CG1 C 13 21.623 0.10 A 45 VAL CG2 C 13 18.650 0.10 A 45 VAL N N 15 118.267 0.10 A 46 GLU H H 1 9.118 0.025 A 46 GLU HA H 1 3.554 0.025 A 46 GLU HBy H 1 1.908 0.025 A 46 GLU HBx H 1 1.798 0.025 A 46 GLU HGx H 1 2.167 0.025 A 46 GLU HGy H 1 2.179 0.025 A 46 GLU C C 13 175.678 0.10 A 46 GLU CA C 13 58.782 0.10 A 46 GLU CB C 13 29.800 0.10 A 46 GLU CG C 13 36.643 0.10 A 46 GLU N N 15 122.889 0.10 A 47 ASN H H 1 8.314 0.025 A 47 ASN HA H 1 4.729 0.025 A 47 ASN HBy H 1 2.707 0.025 A 47 ASN HBx H 1 1.831 0.025 A 47 ASN HD2y H 1 7.973 0.025 A 47 ASN HD2x H 1 7.379 0.025 A 47 ASN C C 13 175.176 0.10 A 47 ASN CA C 13 50.135 0.10 A 47 ASN CB C 13 38.412 0.10 A 47 ASN N N 15 121.062 0.10 A 47 ASN ND2 N 15 111.418 0.10 A 48 ASN H H 1 8.556 0.025 A 48 ASN HA H 1 4.600 0.025 A 48 ASN HBx H 1 2.764 0.025 A 48 ASN HBy H 1 2.806 0.025 A 48 ASN HD2y H 1 7.682 0.025 A 48 ASN HD2x H 1 7.000 0.025 A 48 ASN C C 13 173.388 0.10 A 48 ASN CA C 13 53.613 0.10 A 48 ASN CB C 13 38.657 0.10 A 48 ASN N N 15 119.366 0.10 A 48 ASN ND2 N 15 113.198 0.10 A 49 ASN H H 1 7.738 0.025 A 49 ASN HA H 1 5.047 0.025 A 49 ASN HBy H 1 2.745 0.025 A 49 ASN HBx H 1 2.414 0.025 A 49 ASN HD2y H 1 7.499 0.025 A 49 ASN HD2x H 1 6.821 0.025 A 49 ASN C C 13 175.260 0.10 A 49 ASN CA C 13 51.693 0.10 A 49 ASN CB C 13 39.730 0.10 A 49 ASN N N 15 115.522 0.10 A 49 ASN ND2 N 15 112.095 0.10 A 50 PRO HA H 1 4.311 0.025 A 50 PRO HBy H 1 1.969 0.025 A 50 PRO HBx H 1 1.805 0.025 A 50 PRO HGy H 1 2.140 0.025 A 50 PRO HGx H 1 1.876 0.025 A 50 PRO HDy H 1 3.518 0.025 A 50 PRO HDx H 1 3.267 0.025 A 50 PRO CA C 13 63.529 0.10 A 50 PRO CB C 13 31.974 0.10 A 50 PRO CG C 13 28.023 0.10 A 50 PRO CD C 13 49.320 0.10 A 51 THR H H 1 8.531 0.025 A 51 THR HA H 1 4.694 0.025 A 51 THR HB H 1 4.326 0.025 A 51 THR HG2% H 1 1.209 0.025 A 51 THR C C 13 176.493 0.10 A 51 THR CA C 13 59.525 0.10 A 51 THR CB C 13 69.381 0.10 A 51 THR CG2 C 13 20.645 0.10 A 51 THR N N 15 115.962 0.10 A 52 CYS H H 1 8.935 0.025 A 52 CYS HA H 1 4.369 0.025 A 52 CYS HBy H 1 3.056 0.025 A 52 CYS HBx H 1 2.690 0.025 A 52 CYS C C 13 174.297 0.10 A 52 CYS CA C 13 55.998 0.10 A 52 CYS CB C 13 36.852 0.10 A 52 CYS N N 15 125.336 0.10 A 53 ASP H H 1 8.312 0.025 A 53 ASP HA H 1 4.493 0.025 A 53 ASP HBy H 1 2.759 0.025 A 53 ASP HBx H 1 2.601 0.025 A 53 ASP C C 13 175.371 0.10 A 53 ASP CA C 13 55.656 0.10 A 53 ASP CB C 13 40.922 0.10 A 53 ASP N N 15 116.926 0.10 A 54 ILE H H 1 7.550 0.025 A 54 ILE HA H 1 4.350 0.025 A 54 ILE HB H 1 1.714 0.025 A 54 ILE HG1y H 1 1.375 0.025 A 54 ILE HG1x H 1 1.042 0.025 A 54 ILE HG2% H 1 0.893 0.025 A 54 ILE HD11 H 1 0.846 0.025 A 54 ILE HD12 H 1 0.844 0.025 A 54 ILE HD13 H 1 0.846 0.025 A 54 ILE C C 13 175.503 0.10 A 54 ILE CA C 13 60.200 0.10 A 54 ILE CB C 13 39.906 0.10 A 54 ILE CG1 C 13 27.050 0.10 A 54 ILE CG2 C 13 16.849 0.10 A 54 ILE CD1 C 13 12.461 0.10 A 54 ILE N N 15 119.577 0.10 A 55 ASN H H 1 9.522 0.025 A 55 ASN HA H 1 4.466 0.025 A 55 ASN HBx H 1 2.548 0.025 A 55 ASN HBy H 1 3.259 0.025 A 55 ASN HD2x H 1 6.976 0.025 A 55 ASN HD2y H 1 7.578 0.025 A 55 ASN C C 13 176.224 0.10 A 55 ASN CA C 13 54.165 0.10 A 55 ASN CB C 13 37.567 0.10 A 55 ASN N N 15 126.763 0.10 A 55 ASN ND2 N 15 111.838 0.10 A 56 ASN H H 1 9.256 0.025 A 56 ASN HA H 1 4.713 0.025 A 56 ASN HBy H 1 3.196 0.025 A 56 ASN HBx H 1 2.284 0.025 A 56 ASN HD2y H 1 7.024 0.025 A 56 ASN HD2x H 1 6.542 0.025 A 56 ASN C C 13 176.325 0.10 A 56 ASN CA C 13 53.877 0.10 A 56 ASN CB C 13 39.394 0.10 A 56 ASN N N 15 119.872 0.10 A 56 ASN ND2 N 15 111.243 0.10 A 57 GLY H H 1 7.906 0.025 A 57 GLY HA2 H 1 3.514 0.025 A 57 GLY HA3 H 1 4.119 0.025 A 57 GLY C C 13 175.952 0.10 A 57 GLY CA C 13 46.570 0.10 A 57 GLY N N 15 106.053 0.10 A 58 GLY H H 1 8.133 0.025 A 58 GLY HA2 H 1 4.453 0.025 A 58 GLY HA3 H 1 3.506 0.025 A 58 GLY C C 13 172.622 0.10 A 58 GLY CA C 13 44.203 0.10 A 58 GLY N N 15 105.857 0.10 A 59 CYS H H 1 7.838 0.025 A 59 CYS HA H 1 4.321 0.025 A 59 CYS HBy H 1 3.071 0.025 A 59 CYS HBx H 1 2.829 0.025 A 59 CYS C C 13 175.193 0.10 A 59 CYS CA C 13 52.856 0.10 A 59 CYS CB C 13 37.201 0.10 A 59 CYS N N 15 119.082 0.10 A 60 ASP H H 1 8.692 0.025 A 60 ASP HA H 1 4.379 0.025 A 60 ASP HBy H 1 2.416 0.025 A 60 ASP HBx H 1 2.280 0.025 A 60 ASP C C 13 173.626 0.10 A 60 ASP CA C 13 53.889 0.10 A 60 ASP CB C 13 44.657 0.10 A 60 ASP N N 15 123.667 0.10 A 61 PRO HA H 1 4.160 0.025 A 61 PRO HBy H 1 2.440 0.025 A 61 PRO HBx H 1 1.944 0.025 A 61 PRO HGy H 1 2.087 0.025 A 61 PRO HGx H 1 2.061 0.025 A 61 PRO HDy H 1 3.801 0.025 A 61 PRO HDx H 1 3.586 0.025 A 61 PRO CA C 13 65.734 0.10 A 61 PRO CB C 13 32.767 0.10 A 61 PRO CG C 13 27.612 0.10 A 61 PRO CD C 13 50.881 0.10 A 62 THR H H 1 9.126 0.025 A 62 THR HA H 1 4.365 0.025 A 62 THR HB H 1 4.365 0.025 A 62 THR HG2% H 1 1.247 0.025 A 62 THR C C 13 177.498 0.10 A 62 THR CA C 13 62.575 0.10 A 62 THR CB C 13 69.990 0.10 A 62 THR CG2 C 13 21.506 0.10 A 62 THR N N 15 107.843 0.10 A 63 ALA H H 1 8.086 0.025 A 63 ALA HA H 1 4.555 0.025 A 63 ALA HB% H 1 1.402 0.025 A 63 ALA C C 13 175.190 0.10 A 63 ALA CA C 13 51.452 0.10 A 63 ALA CB C 13 19.655 0.10 A 63 ALA N N 15 125.186 0.10 A 64 SER H H 1 8.935 0.025 A 64 SER HA H 1 4.738 0.025 A 64 SER HBx H 1 3.843 0.025 A 64 SER HBy H 1 3.928 0.025 A 64 SER C C 13 178.959 0.10 A 64 SER CA C 13 58.168 0.10 A 64 SER CB C 13 63.911 0.10 A 64 SER N N 15 116.288 0.10 A 65 CYS H H 1 8.772 0.025 A 65 CYS HA H 1 5.190 0.025 A 65 CYS HBy H 1 2.755 0.025 A 65 CYS HBx H 1 2.321 0.025 A 65 CYS C C 13 172.649 0.10 A 65 CYS CA C 13 55.814 0.10 A 65 CYS CB C 13 37.995 0.10 A 65 CYS N N 15 126.968 0.10 A 66 GLN H H 1 8.918 0.025 A 66 GLN HA H 1 4.668 0.025 A 66 GLN HBy H 1 2.393 0.025 A 66 GLN HBx H 1 2.296 0.025 A 66 GLN HGx H 1 1.951 0.025 A 66 GLN HGy H 1 2.050 0.025 A 66 GLN HE2x H 1 6.891 0.025 A 66 GLN HE2y H 1 7.572 0.025 A 66 GLN C C 13 173.806 0.10 A 66 GLN CA C 13 55.693 0.10 A 66 GLN CB C 13 34.083 0.10 A 66 GLN CG C 13 33.353 0.10 A 66 GLN N N 15 129.291 0.10 A 66 GLN NE2 N 15 112.350 0.10 A 67 ASN H H 1 8.732 0.025 A 67 ASN HA H 1 5.161 0.025 A 67 ASN HBy H 1 2.746 0.025 A 67 ASN HBx H 1 2.684 0.025 A 67 ASN HD2y H 1 7.492 0.025 A 67 ASN HD2x H 1 6.923 0.025 A 67 ASN C C 13 173.811 0.10 A 67 ASN CA C 13 53.389 0.10 A 67 ASN CB C 13 39.924 0.10 A 67 ASN N N 15 123.176 0.10 A 67 ASN ND2 N 15 112.910 0.10 A 68 ALA H H 1 8.826 0.025 A 68 ALA HA H 1 4.581 0.025 A 68 ALA HB% H 1 1.312 0.025 A 68 ALA C C 13 174.667 0.10 A 68 ALA CA C 13 50.796 0.10 A 68 ALA CB C 13 21.700 0.10 A 68 ALA N N 15 126.832 0.10 A 69 GLU H H 1 8.444 0.025 A 69 GLU HA H 1 4.407 0.025 A 69 GLU HBx H 1 1.928 0.025 A 69 GLU HBy H 1 1.995 0.025 A 69 GLU HGx H 1 2.214 0.025 A 69 GLU HGy H 1 2.238 0.025 A 69 GLU C C 13 176.187 0.10 A 69 GLU CA C 13 56.071 0.10 A 69 GLU CB C 13 29.768 0.10 A 69 GLU CG C 13 36.216 0.10 A 69 GLU N N 15 120.847 0.10 A 70 SER H H 1 7.927 0.025 A 70 SER HA H 1 4.524 0.025 A 70 SER HBy H 1 3.832 0.025 A 70 SER HBx H 1 3.190 0.025 A 70 SER C C 13 176.076 0.10 A 70 SER CA C 13 57.674 0.10 A 70 SER CB C 13 63.778 0.10 A 70 SER N N 15 117.950 0.10 A 71 THR H H 1 8.191 0.025 A 71 THR HA H 1 4.365 0.025 A 71 THR HB H 1 4.420 0.025 A 71 THR HG2% H 1 1.263 0.025 A 71 THR C C 13 174.256 0.10 A 71 THR CA C 13 62.575 0.10 A 71 THR CB C 13 68.936 0.10 A 71 THR CG2 C 13 21.578 0.10 A 71 THR N N 15 114.523 0.10 A 72 GLU H H 1 8.569 0.025 A 72 GLU HA H 1 4.490 0.025 A 72 GLU HBx H 1 1.872 0.025 A 72 GLU HBy H 1 1.989 0.025 A 72 GLU HGx H 1 2.217 0.025 A 72 GLU HGy H 1 2.217 0.025 A 72 GLU C C 13 175.075 0.10 A 72 GLU CA C 13 55.323 0.10 A 72 GLU CB C 13 30.148 0.10 A 72 GLU CG C 13 36.184 0.10 A 72 GLU N N 15 123.200 0.10 A 73 ASN H H 1 9.062 0.025 A 73 ASN HA H 1 4.213 0.025 A 73 ASN HBy H 1 2.817 0.025 A 73 ASN HBx H 1 2.760 0.025 A 73 ASN HD2x H 1 6.936 0.025 A 73 ASN HD2y H 1 7.500 0.025 A 73 ASN C C 13 177.222 0.10 A 73 ASN CA C 13 57.040 0.10 A 73 ASN CB C 13 38.403 0.10 A 73 ASN N N 15 125.044 0.10 A 73 ASN ND2 N 15 112.474 0.10 A 74 SER H H 1 8.605 0.025 A 74 SER HA H 1 3.928 0.025 A 74 SER HBx H 1 3.957 0.025 A 74 SER HBy H 1 4.070 0.025 A 74 SER C C 13 177.270 0.10 A 74 SER CA C 13 60.099 0.10 A 74 SER CB C 13 63.032 0.10 A 74 SER N N 15 112.095 0.10 A 75 LYS H H 1 7.811 0.025 A 75 LYS HA H 1 4.669 0.025 A 75 LYS HBx H 1 1.893 0.025 A 75 LYS HBy H 1 2.083 0.025 A 75 LYS HGy H 1 1.376 0.025 A 75 LYS HGx H 1 1.276 0.025 A 75 LYS HDx H 1 1.581 0.025 A 75 LYS HDy H 1 1.701 0.025 A 75 LYS HEy H 1 2.979 0.025 A 75 LYS HEx H 1 2.972 0.025 A 75 LYS C C 13 174.739 0.10 A 75 LYS CA C 13 55.682 0.10 A 75 LYS CB C 13 32.773 0.10 A 75 LYS CG C 13 24.897 0.10 A 75 LYS CD C 13 28.538 0.10 A 75 LYS CE C 13 42.421 0.10 A 75 LYS N N 15 121.700 0.10 A 76 LYS H H 1 6.905 0.025 A 76 LYS HA H 1 4.324 0.025 A 76 LYS HBx H 1 1.643 0.025 A 76 LYS HBy H 1 2.199 0.025 A 76 LYS HGy H 1 1.729 0.025 A 76 LYS HGx H 1 1.491 0.025 A 76 LYS HDy H 1 1.838 0.025 A 76 LYS HDx H 1 1.642 0.025 A 76 LYS HEy H 1 3.054 0.025 A 76 LYS HEx H 1 2.787 0.025 A 76 LYS C C 13 175.646 0.10 A 76 LYS CA C 13 58.273 0.10 A 76 LYS CB C 13 34.642 0.10 A 76 LYS CG C 13 26.817 0.10 A 76 LYS CD C 13 30.588 0.10 A 76 LYS CE C 13 42.629 0.10 A 76 LYS N N 15 117.917 0.10 A 77 ILE H H 1 7.646 0.025 A 77 ILE HA H 1 4.847 0.025 A 77 ILE HB H 1 1.864 0.025 A 77 ILE HG1x H 1 1.355 0.025 A 77 ILE HG1y H 1 1.619 0.025 A 77 ILE HG2% H 1 0.956 0.025 A 77 ILE HD11 H 1 0.633 0.025 A 77 ILE HD12 H 1 0.631 0.025 A 77 ILE HD13 H 1 0.633 0.025 A 77 ILE C C 13 174.474 0.10 A 77 ILE CA C 13 57.124 0.10 A 77 ILE CB C 13 39.693 0.10 A 77 ILE CG1 C 13 25.602 0.10 A 77 ILE CG2 C 13 18.831 0.10 A 77 ILE CD1 C 13 10.434 0.10 A 77 ILE N N 15 119.371 0.10 A 78 ILE H H 1 8.922 0.025 A 78 ILE HA H 1 4.205 0.025 A 78 ILE HB H 1 1.597 0.025 A 78 ILE HG1y H 1 1.375 0.025 A 78 ILE HG1x H 1 0.991 0.025 A 78 ILE HG2% H 1 0.812 0.025 A 78 ILE HD11 H 1 0.768 0.025 A 78 ILE HD12 H 1 0.766 0.025 A 78 ILE HD13 H 1 0.768 0.025 A 78 ILE C C 13 175.443 0.10 A 78 ILE CA C 13 60.377 0.10 A 78 ILE CB C 13 40.481 0.10 A 78 ILE CG1 C 13 27.152 0.10 A 78 ILE CG2 C 13 17.450 0.10 A 78 ILE CD1 C 13 13.250 0.10 A 78 ILE N N 15 125.724 0.10 A 79 CYS H H 1 9.249 0.025 A 79 CYS HA H 1 5.532 0.025 A 79 CYS HBx H 1 2.756 0.025 A 79 CYS HBy H 1 3.505 0.025 A 79 CYS C C 13 174.303 0.10 A 79 CYS CA C 13 52.048 0.10 A 79 CYS CB C 13 39.167 0.10 A 79 CYS N N 15 128.647 0.10 A 80 THR H H 1 8.965 0.025 A 80 THR HA H 1 4.637 0.025 A 80 THR HB H 1 3.971 0.025 A 80 THR HG2% H 1 1.259 0.025 A 80 THR C C 13 175.312 0.10 A 80 THR CA C 13 61.766 0.10 A 80 THR CB C 13 70.618 0.10 A 80 THR CG2 C 13 21.022 0.10 A 80 THR N N 15 119.275 0.10 A 81 CYS H H 1 9.268 0.025 A 81 CYS HA H 1 4.617 0.025 A 81 CYS HBx H 1 2.409 0.025 A 81 CYS HBy H 1 3.968 0.025 A 81 CYS C C 13 175.495 0.10 A 81 CYS CA C 13 55.780 0.10 A 81 CYS CB C 13 37.420 0.10 A 81 CYS N N 15 128.422 0.10 A 82 LYS H H 1 8.983 0.025 A 82 LYS HA H 1 4.688 0.025 A 82 LYS HBy H 1 1.897 0.025 A 82 LYS HBx H 1 1.733 0.025 A 82 LYS HGx H 1 1.460 0.025 A 82 LYS HGy H 1 1.460 0.025 A 82 LYS HDy H 1 1.723 0.025 A 82 LYS HDx H 1 1.701 0.025 A 82 LYS HEx H 1 3.025 0.025 A 82 LYS HEy H 1 3.098 0.025 A 82 LYS C C 13 173.604 0.10 A 82 LYS CA C 13 54.264 0.10 A 82 LYS CB C 13 35.826 0.10 A 82 LYS CG C 13 23.934 0.10 A 82 LYS CD C 13 29.176 0.10 A 82 LYS CE C 13 42.392 0.10 A 82 LYS N N 15 121.177 0.10 A 83 GLU H H 1 8.732 0.025 A 83 GLU HA H 1 3.959 0.025 A 83 GLU HBx H 1 1.808 0.025 A 83 GLU HBy H 1 2.003 0.025 A 83 GLU HGx H 1 2.329 0.025 A 83 GLU HGy H 1 2.397 0.025 A 83 GLU C C 13 175.462 0.10 A 83 GLU CA C 13 56.432 0.10 A 83 GLU CB C 13 28.547 0.10 A 83 GLU CG C 13 34.899 0.10 A 83 GLU N N 15 120.465 0.10 A 84 PRO HA H 1 5.198 0.025 A 84 PRO HBy H 1 2.594 0.025 A 84 PRO HBx H 1 2.240 0.025 A 84 PRO HGy H 1 2.079 0.025 A 84 PRO HGx H 1 1.752 0.025 A 84 PRO HDx H 1 3.538 0.025 A 84 PRO HDy H 1 3.691 0.025 A 84 PRO CA C 13 63.921 0.10 A 84 PRO CB C 13 33.147 0.10 A 84 PRO CG C 13 24.641 0.10 A 84 PRO CD C 13 49.941 0.10 A 85 THR H H 1 8.951 0.025 A 85 THR HA H 1 4.347 0.025 A 85 THR HB H 1 3.785 0.025 A 85 THR HG2% H 1 1.052 0.025 A 85 THR C C 13 175.451 0.10 A 85 THR CA C 13 57.125 0.10 A 85 THR CB C 13 68.475 0.10 A 85 THR CG2 C 13 20.936 0.10 A 85 THR N N 15 115.903 0.10 A 86 PRO HA H 1 4.336 0.025 A 86 PRO HBx H 1 1.970 0.025 A 86 PRO HBy H 1 2.330 0.025 A 86 PRO HGy H 1 2.042 0.025 A 86 PRO HGx H 1 2.041 0.025 A 86 PRO HDy H 1 3.956 0.025 A 86 PRO HDx H 1 3.848 0.025 A 86 PRO CA C 13 64.472 0.10 A 86 PRO CB C 13 32.166 0.10 A 86 PRO CG C 13 27.292 0.10 A 86 PRO CD C 13 50.979 0.10 A 87 ASN H H 1 8.005 0.025 A 87 ASN HA H 1 4.695 0.025 A 87 ASN HBy H 1 2.898 0.025 A 87 ASN HBx H 1 2.476 0.025 A 87 ASN HD2y H 1 7.318 0.025 A 87 ASN HD2x H 1 6.711 0.025 A 87 ASN C C 13 175.338 0.10 A 87 ASN CA C 13 53.716 0.10 A 87 ASN CB C 13 39.450 0.10 A 87 ASN N N 15 119.753 0.10 A 87 ASN ND2 N 15 114.541 0.10 A 88 ALA H H 1 8.480 0.025 A 88 ALA HA H 1 5.124 0.025 A 88 ALA HB% H 1 1.257 0.025 A 88 ALA C C 13 172.680 0.10 A 88 ALA CA C 13 52.078 0.10 A 88 ALA CB C 13 21.350 0.10 A 88 ALA N N 15 127.701 0.10 A 89 TYR H H 1 8.836 0.025 A 89 TYR HA H 1 4.579 0.025 A 89 TYR HBy H 1 2.766 0.025 A 89 TYR HBx H 1 2.479 0.025 A 89 TYR HD1 H 1 6.876 0.025 A 89 TYR HD2 H 1 6.876 0.025 A 89 TYR HE1 H 1 6.736 0.025 A 89 TYR HE2 H 1 6.736 0.025 A 89 TYR C C 13 177.578 0.10 A 89 TYR CA C 13 57.280 0.10 A 89 TYR CB C 13 41.114 0.10 A 89 TYR CD1 C 13 133.170 0.10 A 89 TYR CE1 C 13 118.090 0.10 A 89 TYR N N 15 120.206 0.10 A 90 TYR H H 1 9.649 0.025 A 90 TYR HA H 1 4.339 0.025 A 90 TYR HBx H 1 3.249 0.025 A 90 TYR HBy H 1 3.397 0.025 A 90 TYR HD1 H 1 7.266 0.025 A 90 TYR HD2 H 1 7.266 0.025 A 90 TYR HE1 H 1 7.028 0.025 A 90 TYR HE2 H 1 7.028 0.025 A 90 TYR C C 13 176.890 0.10 A 90 TYR CA C 13 59.856 0.10 A 90 TYR CB C 13 35.739 0.10 A 90 TYR CD1 C 13 133.469 0.10 A 90 TYR CE1 C 13 118.463 0.10 A 90 TYR N N 15 123.439 0.10 A 91 GLU H H 1 8.987 0.025 A 91 GLU HA H 1 3.899 0.025 A 91 GLU HBx H 1 2.329 0.025 A 91 GLU HBy H 1 2.528 0.025 A 91 GLU HGx H 1 2.203 0.025 A 91 GLU HGy H 1 2.287 0.025 A 91 GLU C C 13 177.168 0.10 A 91 GLU CA C 13 57.295 0.10 A 91 GLU CB C 13 27.363 0.10 A 91 GLU CG C 13 37.074 0.10 A 91 GLU N N 15 110.283 0.10 A 92 GLY H H 1 7.449 0.025 A 92 GLY HA2 H 1 3.411 0.025 A 92 GLY HA3 H 1 4.131 0.025 A 92 GLY C C 13 175.450 0.10 A 92 GLY CA C 13 45.424 0.10 A 92 GLY N N 15 102.405 0.10 A 93 VAL H H 1 7.470 0.025 A 93 VAL HA H 1 3.745 0.025 A 93 VAL HB H 1 2.147 0.025 A 93 VAL HGx% H 1 0.598 0.025 A 93 VAL HGy% H 1 1.326 0.025 A 93 VAL C C 13 174.163 0.10 A 93 VAL CA C 13 66.006 0.10 A 93 VAL CB C 13 33.474 0.10 A 93 VAL CG1 C 13 22.643 0.10 A 93 VAL CG2 C 13 24.710 0.10 A 93 VAL N N 15 122.265 0.10 A 94 PHE H H 1 7.911 0.025 A 94 PHE HA H 1 4.934 0.025 A 94 PHE HBy H 1 2.337 0.025 A 94 PHE HBx H 1 2.312 0.025 A 94 PHE HD1 H 1 7.120 0.025 A 94 PHE HD2 H 1 7.120 0.025 A 94 PHE HE1 H 1 7.353 0.025 A 94 PHE HE2 H 1 7.353 0.025 A 94 PHE HZ H 1 7.083 0.025 A 94 PHE C C 13 176.237 0.10 A 94 PHE CA C 13 56.783 0.10 A 94 PHE CB C 13 42.276 0.10 A 94 PHE CD1 C 13 132.869 0.10 A 94 PHE CE1 C 13 130.680 0.10 A 94 PHE CZ C 13 130.901 0.10 A 94 PHE N N 15 112.503 0.10 A 95 CYS H H 1 7.987 0.025 A 95 CYS HA H 1 5.563 0.025 A 95 CYS HBx H 1 2.199 0.025 A 95 CYS HBy H 1 3.900 0.025 A 95 CYS C C 13 175.106 0.10 A 95 CYS CA C 13 52.555 0.10 A 95 CYS CB C 13 40.953 0.10 A 95 CYS N N 15 119.598 0.10 A 96 SER H H 1 9.342 0.025 A 96 SER HA H 1 4.910 0.025 A 96 SER HBx H 1 3.640 0.025 A 96 SER HBy H 1 3.716 0.025 A 96 SER C C 13 174.074 0.10 A 96 SER CA C 13 56.234 0.10 A 96 SER CB C 13 65.919 0.10 A 96 SER N N 15 116.667 0.10 A 97 SER H H 1 9.209 0.025 A 97 SER HA H 1 4.695 0.025 A 97 SER HBx H 1 4.188 0.025 A 97 SER HBy H 1 4.270 0.025 A 97 SER C C 13 174.827 0.10 A 97 SER CA C 13 59.508 0.10 A 97 SER CB C 13 63.799 0.10 A 97 SER N N 15 121.133 0.10 A 98 SER H H 1 8.911 0.025 A 98 SER HA H 1 4.707 0.025 A 98 SER HBx H 1 4.022 0.025 A 98 SER HBy H 1 4.041 0.025 A 98 SER CA C 13 58.446 0.10 A 98 SER CB C 13 64.081 0.10 A 98 SER N N 15 118.451 0.10 A 99 SER H H 1 8.437 0.025 A 99 SER HA H 1 4.324 0.025 A 99 SER HBy H 1 3.975 0.025 A 99 SER HBx H 1 3.894 0.025 A 99 SER C C 13 174.340 0.10 A 99 SER CA C 13 60.151 0.10 A 99 SER CB C 13 64.813 0.10 A 99 SER N N 15 125.206 0.10 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 6 HIS HE1 A 6 HIS HA 1.0 0.000 6.000 2 2 A 6 HIS HE1 A 23 ASP HA 1.0 1.972 5.092 3 3 A 6 HIS HE1 A 24 ASP H 1.0 1.936 4.628 4 4 A 42 ASN HD2y A 30 TRP HZ2 1.0 1.842 3.908 5 5 A 17 ASN HBx A 36 TYR HE1 1.0 1.927 4.549 6 6 A 36 TYR HE1 A 33 LEU HBx 1.0 1.909 4.379 7 7 A 36 TYR HE1 A 33 LEU HBy 1.0 1.887 4.213 8 8 A 89 TYR HE1 A 89 TYR HBy 1.0 0.000 6.000 9 9 A 89 TYR HE1 A 87 ASN HBy 1.0 0.000 6.000 10 10 A 36 TYR HE1 A 46 GLU H 1.0 0.000 6.000 11 11 A 36 TYR HE1 A 46 GLU HA 1.0 0.000 6.000 12 12 A 46 GLU HA A 36 TYR HE2 1.0 1.886 4.204 13 12 A 36 TYR HE1 A 46 GLU HA 1.0 1.886 4.204 14 13 A 89 TYR HE1 A 4 PRO HA 1.0 1.792 3.628 15 14 A 90 TYR HE1 A 20 CYS H 1.0 1.917 4.457 16 15 A 32 CYS H A 30 TRP HE3 1.0 1.950 4.778 17 16 A 30 TRP HE3 A 15 PRO HGx 1.0 1.976 5.146 18 17 A 30 TRP HE3 A 30 TRP H 1.0 1.976 5.162 19 18 A 43 THR H A 30 TRP HZ3 1.0 1.938 4.646 20 19 A 6 HIS HD2 A 24 ASP HBy 1.0 1.923 4.511 21 20 A 15 PRO HGx A 30 TRP HZ3 1.0 1.973 5.101 22 21 A 38 LYS HEy A 30 TRP HH2 1.0 1.907 4.367 23 22 A 30 TRP HH2 A 38 LYS HGy 1.0 1.847 3.937 24 22 A 30 TRP HH2 A 38 LYS HGx 1.0 1.847 3.937 25 23 A 30 TRP HD1 A 14 ILE HG2% 1.0 1.956 4.866 26 24 A 21 PHE HZ A 21 PHE HE2 1.0 1.622 2.900 27 24 A 21 PHE HZ A 21 PHE HE1 1.0 1.622 2.900 28 25 A 94 PHE HD1 A 94 PHE HE2 1.0 1.738 3.366 29 25 A 94 PHE HD1 A 94 PHE HE1 1.0 1.738 3.366 30 26 A 94 PHE HZ A 94 PHE HD2 1.0 1.834 3.862 31 26 A 94 PHE HD1 A 94 PHE HZ 1.0 1.834 3.862 32 27 A 94 PHE HD1 A 31 ARG H 1.0 0.000 6.000 33 28 A 21 PHE HE1 A 96 SER HBx 1.0 1.955 4.847 34 29 A 89 TYR HBy A 21 PHE HD1 1.0 1.883 4.177 35 30 A 21 PHE HD1 A 21 PHE HBx 1.0 1.871 4.097 36 31 A 21 PHE HD1 A 21 PHE HA 1.0 1.876 4.128 37 32 A 94 PHE HE1 A 94 PHE H 1.0 1.932 4.584 38 33 A 94 PHE HE1 A 90 TYR HBx 1.0 1.915 4.435 39 34 A 94 PHE HE1 A 94 PHE HA 1.0 0.000 6.000 40 35 A 94 PHE HE1 A 93 VAL HB 1.0 1.911 4.401 41 36 A 96 SER HBx A 89 TYR HD1 1.0 1.952 4.810 42 37 A 46 GLU H A 36 TYR HD1 1.0 0.000 6.000 43 38 A 36 TYR HD1 A 17 ASN HD2y 1.0 0.000 6.000 44 39 A 46 GLU HA A 36 TYR HD1 1.0 0.000 6.000 45 40 A 36 TYR HD1 A 17 ASN HBy 1.0 1.930 4.576 46 41 A 36 TYR HD1 A 45 VAL HA 1.0 0.000 6.000 47 42 A 89 TYR HD1 A 89 TYR HA 1.0 1.912 4.406 48 43 A 4 PRO HA A 89 TYR HD1 1.0 1.935 4.625 49 44 A 90 TYR HD1 A 20 CYS HBx 1.0 0.000 6.000 50 45 A 90 TYR HD1 A 90 TYR HBy 1.0 1.751 3.423 51 46 A 90 TYR HD1 A 90 TYR HA 1.0 0.000 6.000 52 47 A 90 TYR HD1 A 91 GLU HGy 1.0 0.000 6.000 53 48 A 93 VAL HB A 90 TYR HD1 1.0 0.000 6.000 54 49 A 30 TRP HA A 30 TRP HBx 1.0 1.643 2.975 55 50 A 30 TRP HE3 A 30 TRP HBy 1.0 1.701 3.207 56 51 A 30 TRP HE3 A 30 TRP HBx 1.0 0.000 6.000 57 52 A 30 TRP HD1 A 30 TRP HBx 1.0 1.610 2.856 58 53 A 36 TYR HD1 A 36 TYR HBy 1.0 1.669 3.077 59 54 A 36 TYR HD1 A 36 TYR HBx 1.0 1.629 2.927 60 55 A 36 TYR HE1 A 36 TYR HBx 1.0 0.000 6.000 61 56 A 36 TYR HE1 A 36 TYR HBy 1.0 0.000 6.000 62 57 A 36 TYR HD1 A 36 TYR HA 1.0 0.000 6.000 63 58 A 30 TRP HZ2 A 15 PRO HGx 1.0 1.891 4.239 64 59 A 93 VAL H A 93 VAL HGx% 1.0 1.775 3.543 65 60 A 30 TRP HE3 A 14 ILE HG2% 1.0 1.832 3.844 66 61 A 94 PHE H A 93 VAL HGx% 1.0 1.799 3.663 67 62 A 31 ARG H A 93 VAL HGx% 1.0 0.000 6.000 68 63 A 30 TRP HE3 A 18 ALA HB% 1.0 1.514 2.544 69 64 A 20 CYS HA A 14 ILE HD1% 1.0 1.834 3.858 70 65 A 94 PHE HD1 A 94 PHE HA 1.0 1.791 3.625 71 66 A 94 PHE H A 94 PHE HA 1.0 1.791 3.621 72 67 A 94 PHE H A 93 VAL HGy% 1.0 1.833 3.855 73 68 A 23 ASP HA A 21 PHE HE1 1.0 1.717 3.271 74 69 A 4 PRO HA A 21 PHE HZ 1.0 1.846 3.934 75 70 A 21 PHE HZ A 96 SER HBx 1.0 0.000 6.000 76 71 A 36 TYR HD1 A 37 LYS H 1.0 0.000 6.000 77 72 A 36 TYR HD1 A 45 VAL H 1.0 1.919 4.467 78 73 A 20 CYS HA A 21 PHE H 1.0 1.492 2.476 79 74 A 92 GLY H A 92 GLY HA3 1.0 1.745 3.397 80 75 A 21 PHE HZ A 22 ARG H 1.0 1.975 5.129 81 76 A 21 PHE HE1 A 22 ARG H 1.0 1.923 4.507 82 77 A 6 HIS HE1 A 6 HIS HD2 1.0 1.907 4.363 83 78 A 6 HIS HE1 A 21 PHE HZ 1.0 1.837 3.877 84 79 A 6 HIS HE1 A 21 PHE HE1 1.0 1.890 4.230 85 80 A 58 GLY H A 58 GLY HA3 1.0 1.624 2.908 86 81 A 57 GLY H A 57 GLY HA3 1.0 1.597 2.813 87 82 A 80 THR H A 80 THR HB 1.0 1.667 3.065 88 83 A 36 TYR HA A 36 TYR H 1.0 1.723 3.299 89 84 A 36 TYR HE1 A 36 TYR HA 1.0 0.000 6.000 90 85 A 94 PHE HZ A 30 TRP HA 1.0 1.738 3.368 91 86 A 30 TRP HD1 A 30 TRP HA 1.0 0.000 6.000 92 87 A 30 TRP HD1 A 30 TRP HBy 1.0 0.000 6.000 93 88 A 94 PHE HD1 A 90 TYR HBy 1.0 0.000 6.000 94 89 A 89 TYR HBy A 21 PHE HE2 1.0 1.894 4.268 95 89 A 89 TYR HBy A 21 PHE HE1 1.0 1.894 4.268 96 90 A 21 PHE HE2 A 6 HIS HBx 1.0 0.000 6.000 97 90 A 21 PHE HE1 A 6 HIS HBx 1.0 0.000 6.000 98 91 A 21 PHE HE1 A 21 PHE HD1 1.0 1.474 2.422 99 92 A 21 PHE HZ A 21 PHE HE1 1.0 1.505 2.515 100 93 A 94 PHE HZ A 21 PHE H 1.0 1.864 4.054 101 94 A 94 PHE HZ A 31 ARG H 1.0 1.778 3.558 102 95 A 94 PHE HD1 A 94 PHE H 1.0 1.785 3.595 103 96 A 94 PHE HZ A 20 CYS HA 1.0 1.832 3.854 104 97 A 94 PHE HZ A 21 PHE HBy 1.0 1.860 4.022 105 98 A 94 PHE HZ A 31 ARG HGx 1.0 1.768 3.510 106 99 A 94 PHE HZ A 31 ARG HGy 1.0 0.000 6.000 107 100 A 94 PHE HE2 A 21 PHE H 1.0 1.908 4.370 108 100 A 94 PHE HE1 A 21 PHE H 1.0 1.908 4.370 109 101 A 94 PHE HE2 A 31 ARG H 1.0 1.851 3.961 110 101 A 94 PHE HE1 A 31 ARG H 1.0 1.851 3.961 111 102 A 37 LYS H A 37 LYS HA 1.0 1.726 3.316 112 103 A 37 LYS H A 44 CYS HA 1.0 0.000 6.000 113 104 A 36 TYR HBy A 37 LYS H 1.0 1.827 3.823 114 105 A 45 VAL H A 44 CYS HBx 1.0 1.829 3.829 115 106 A 31 ARG H A 31 ARG HA 1.0 1.743 3.389 116 107 A 37 LYS H A 37 LYS HGy 1.0 1.673 3.091 117 108 A 45 VAL H A 45 VAL HB 1.0 1.830 3.836 118 109 A 21 PHE HBx A 21 PHE H 1.0 1.752 3.432 119 110 A 20 CYS HBx A 21 PHE H 1.0 1.871 4.097 120 111 A 21 PHE H A 20 CYS HBy 1.0 1.891 4.245 121 112 A 36 TYR HBx A 36 TYR H 1.0 0.000 6.000 122 113 A 30 TRP HE3 A 30 TRP HA 1.0 1.855 3.987 123 114 A 30 TRP HH2 A 42 ASN HA 1.0 1.706 3.228 124 115 A 89 TYR HE1 A 89 TYR HD1 1.0 1.457 2.377 125 116 A 89 TYR HBy A 89 TYR HD1 1.0 0.000 6.000 126 117 A 89 TYR HD1 A 89 TYR HBx 1.0 0.000 6.000 127 118 A 21 PHE HE1 A 89 TYR HD1 1.0 0.000 6.000 128 119 A 89 TYR HE1 A 21 PHE HE1 1.0 1.850 3.956 129 120 A 30 TRP HA A 20 CYS HA 1.0 1.605 2.841 130 121 A 94 PHE HE2 A 30 TRP HA 1.0 1.820 3.776 131 121 A 94 PHE HE1 A 30 TRP HA 1.0 1.820 3.776 132 122 A 30 TRP HZ2 A 30 TRP HH2 1.0 1.450 2.354 133 123 A 30 TRP HZ2 A 42 ASN HA 1.0 1.619 2.887 134 124 A 30 TRP HZ2 A 30 TRP HE3 1.0 0.000 6.000 135 125 A 30 TRP HZ2 A 30 TRP HZ3 1.0 0.000 6.000 136 126 A 36 TYR HD1 A 44 CYS HA 1.0 0.000 6.000 137 127 A 17 ASN HBx A 36 TYR HD1 1.0 1.794 3.640 138 128 A 36 TYR HD1 A 36 TYR H 1.0 0.000 6.000 139 129 A 89 TYR HE1 A 21 PHE HZ 1.0 1.933 4.605 140 130 A 21 PHE HZ A 89 TYR HD1 1.0 1.968 5.032 141 131 A 21 PHE HD1 A 89 TYR HD1 1.0 0.000 6.000 142 132 A 90 TYR HE1 A 90 TYR HD1 1.0 1.455 2.367 143 133 A 78 ILE H A 78 ILE HD11 1.0 1.741 3.381 144 134 A 19 GLY H A 33 LEU HDy% 1.0 1.732 3.340 145 135 A 34 LEU H A 34 LEU HDy% 1.0 1.670 3.082 146 136 A 33 LEU HDy% A 33 LEU H 1.0 1.687 3.147 147 137 A 34 LEU HDy% A 59 CYS H 1.0 1.873 4.113 148 138 A 33 LEU HDy% A 18 ALA H 1.0 1.801 3.675 149 139 A 36 TYR HE1 A 33 LEU HDy% 1.0 0.000 6.000 150 140 A 36 TYR HD1 A 33 LEU HDy% 1.0 0.000 6.000 151 141 A 30 TRP HD1 A 14 ILE HG1x 1.0 1.801 3.673 152 142 A 94 PHE HE2 A 31 ARG HBx 1.0 1.831 3.841 153 142 A 94 PHE HE1 A 31 ARG HBx 1.0 1.831 3.841 154 143 A 17 ASN HBx A 36 TYR HD2 1.0 1.768 3.506 155 143 A 17 ASN HBx A 36 TYR HD1 1.0 1.768 3.506 156 144 A 21 PHE HBx A 21 PHE HD2 1.0 1.637 2.953 157 144 A 21 PHE HD1 A 21 PHE HBx 1.0 1.637 2.953 158 145 A 90 TYR HD1 A 93 VAL HGy% 1.0 0.000 6.000 159 146 A 33 LEU HBx A 36 TYR HD1 1.0 1.732 3.342 160 147 A 30 TRP HD1 A 15 PRO HDx 1.0 0.000 6.000 161 148 A 94 PHE HD2 A 93 VAL HB 1.0 1.698 3.194 162 148 A 94 PHE HD1 A 93 VAL HB 1.0 1.698 3.194 163 149 A 89 TYR HBx A 21 PHE HD2 1.0 1.916 4.444 164 149 A 21 PHE HD1 A 89 TYR HBx 1.0 1.916 4.444 165 150 A 94 PHE HZ A 31 ARG HDy 1.0 1.934 4.608 166 151 A 59 CYS H A 56 ASN HBx 1.0 1.927 4.551 167 152 A 21 PHE HD2 A 23 ASP HBy 1.0 1.820 3.780 168 152 A 21 PHE HD1 A 23 ASP HBy 1.0 1.820 3.780 169 153 A 36 TYR HE2 A 73 ASN HBy 1.0 1.853 3.981 170 153 A 36 TYR HE1 A 73 ASN HBy 1.0 1.853 3.981 171 154 A 89 TYR HBy A 21 PHE HD2 1.0 1.786 3.596 172 154 A 89 TYR HBy A 21 PHE HD1 1.0 1.786 3.596 173 155 A 30 TRP HD1 A 14 ILE HA 1.0 0.000 6.000 174 156 A 94 PHE H A 90 TYR HBy 1.0 0.000 6.000 175 157 A 58 GLY HA3 A 59 CYS H 1.0 1.743 3.389 176 157 A 59 CYS H A 58 GLY HA2 1.0 1.743 3.389 177 158 A 94 PHE H A 93 VAL HA 1.0 1.858 4.014 178 159 A 46 GLU HA A 36 TYR HD2 1.0 1.611 2.863 179 159 A 46 GLU HA A 36 TYR HD1 1.0 1.611 2.863 180 160 A 96 SER HBx A 21 PHE HD2 1.0 0.000 6.000 181 160 A 96 SER HBx A 21 PHE HD1 1.0 0.000 6.000 182 161 A 59 CYS H A 57 GLY HA2 1.0 1.869 4.085 183 162 A 30 TRP HZ3 A 18 ALA HA 1.0 0.000 6.000 184 163 A 18 ALA H A 32 CYS HA 1.0 0.000 6.000 185 164 A 30 TRP HD1 A 20 CYS HA 1.0 0.000 6.000 186 165 A 94 PHE HZ A 21 PHE HD1 1.0 0.000 6.000 187 166 A 94 PHE HD2 A 94 PHE H 1.0 1.787 3.603 188 166 A 94 PHE HD1 A 94 PHE H 1.0 1.787 3.603 189 167 A 22 ARG H A 21 PHE HD2 1.0 1.893 4.253 190 167 A 21 PHE HD1 A 22 ARG H 1.0 1.893 4.253 191 168 A 94 PHE HZ A 21 PHE HD2 1.0 0.000 6.000 192 168 A 94 PHE HZ A 21 PHE HD1 1.0 0.000 6.000 193 169 A 94 PHE H A 21 PHE HD2 1.0 1.989 6.621 194 169 A 21 PHE HD1 A 94 PHE H 1.0 1.989 6.621 195 170 A 36 TYR HD1 A 33 LEU H 1.0 1.875 4.129 196 171 A 21 PHE HD1 A 29 GLU H 1.0 1.997 5.689 197 172 A 36 TYR HD1 A 34 LEU H 1.0 0.000 6.000 198 173 A 19 GLY H A 18 ALA H 1.0 1.920 4.478 199 174 A 30 TRP HE3 A 19 GLY H 1.0 1.903 4.333 200 175 A 30 TRP HE3 A 31 ARG H 1.0 1.772 3.526 201 176 A 21 PHE HD1 A 21 PHE H 1.0 0.000 6.000 202 177 A 30 TRP HA A 21 PHE H 1.0 1.768 3.510 203 178 A 36 TYR HA A 37 LYS H 1.0 1.608 2.850 204 179 A 36 TYR HA A 45 VAL H 1.0 0.000 6.000 205 180 A 94 PHE H A 88 ALA HA 1.0 0.000 6.000 206 181 A 6 HIS HD2 A 21 PHE HZ 1.0 1.975 5.131 207 182 A 6 HIS HD2 A 21 PHE HE1 1.0 1.926 4.540 208 183 A 89 TYR HA A 89 TYR H 1.0 1.808 3.714 209 184 A 78 ILE H A 78 ILE HA 1.0 1.701 3.205 210 185 A 88 ALA HA A 95 CYS HA 1.0 1.701 3.205 211 186 A 46 GLU HA A 36 TYR HA 1.0 1.614 2.874 212 187 A 50 PRO HDy A 49 ASN HA 1.0 0.000 6.000 213 188 A 20 CYS HA A 10 ASP HBy 1.0 0.000 6.000 214 189 A 36 TYR HA A 47 ASN HBx 1.0 1.797 3.655 215 190 A 67 ASN HA A 77 ILE HD11 1.0 1.627 2.917 216 191 A 34 LEU HDy% A 93 VAL HA 1.0 1.669 3.077 217 192 A 93 VAL HGx% A 93 VAL HA 1.0 1.656 3.024 218 193 A 15 PRO HGx A 43 THR HA 1.0 1.870 4.094 219 194 A 15 PRO HGx A 15 PRO HA 1.0 1.817 3.765 220 195 A 22 ARG HDy A 9 VAL HGy% 1.0 1.690 3.164 221 196 A 14 ILE HG1x A 15 PRO HDy 1.0 1.942 4.698 222 197 A 93 VAL HGx% A 31 ARG HDy 1.0 1.725 3.307 223 198 A 31 ARG HGx A 31 ARG HDy 1.0 1.698 3.192 224 199 A 31 ARG HDy A 31 ARG HDx 1.0 1.531 2.597 225 200 A 22 ARG HDx A 22 ARG HBx 1.0 1.773 3.533 226 201 A 85 THR HG2% A 95 CYS HBx 1.0 1.781 3.571 227 202 A 36 TYR HBy A 33 LEU H 1.0 1.898 4.296 228 203 A 33 LEU H A 32 CYS HBx 1.0 0.000 6.000 229 204 A 63 ALA H A 60 ASP HBy 1.0 1.778 3.560 230 205 A 63 ALA H A 60 ASP HBx 1.0 1.860 4.026 231 206 A 29 GLU H A 29 GLU HBx 1.0 1.736 3.356 232 207 A 21 PHE HE2 A 96 SER HBx 1.0 0.000 6.000 233 207 A 21 PHE HE1 A 96 SER HBx 1.0 0.000 6.000 234 208 A 21 PHE HE1 A 89 TYR HBx 1.0 1.998 5.796 235 209 A 34 LEU H A 34 LEU HBx 1.0 1.715 3.265 236 210 A 63 ALA H A 63 ALA HB% 1.0 1.540 2.624 237 211 A 78 ILE H A 66 GLN HGy 1.0 0.000 6.000 238 212 A 78 ILE H A 66 GLN HGx 1.0 0.000 6.000 239 213 A 31 ARG H A 31 ARG HBy 1.0 1.866 4.066 240 214 A 60 ASP HBy A 60 ASP H 1.0 1.698 3.196 241 215 A 78 ILE H A 66 GLN HBy 1.0 1.848 3.948 242 216 A 19 GLY H A 19 GLY HA3 1.0 1.716 3.268 243 217 A 60 ASP HBx A 60 ASP H 1.0 1.660 3.040 244 218 A 31 ARG H A 30 TRP HBx 1.0 0.000 6.000 245 219 A 37 LYS H A 38 LYS HDx 1.0 0.000 6.000 246 220 A 37 LYS H A 37 LYS HBx 1.0 1.829 3.831 247 221 A 93 VAL HA A 60 ASP H 1.0 0.000 6.000 248 222 A 80 THR H A 64 SER HBx 1.0 1.838 3.882 249 223 A 63 ALA H A 61 PRO HA 1.0 1.891 4.245 250 224 A 58 GLY H A 57 GLY HA2 1.0 1.871 4.095 251 225 A 36 TYR H A 35 GLY HA2 1.0 1.840 3.896 252 226 A 30 TRP HA A 29 GLU H 1.0 2.000 5.900 253 227 A 89 TYR HD1 A 89 TYR H 1.0 1.851 3.963 254 228 A 94 PHE HE2 A 19 GLY H 1.0 1.976 5.144 255 228 A 94 PHE HE1 A 19 GLY H 1.0 1.976 5.144 256 229 A 59 CYS H A 60 ASP H 1.0 1.941 4.685 257 230 A 34 LEU H A 33 LEU H 1.0 1.928 4.556 258 231 A 37 LYS H A 36 TYR H 1.0 1.916 4.438 259 232 A 63 ALA H A 60 ASP H 1.0 1.939 4.663 260 233 A 45 VAL H A 43 THR HB 1.0 1.979 5.209 261 234 A 36 TYR HBy A 45 VAL H 1.0 1.971 5.071 262 235 A 46 GLU HA A 37 LYS H 1.0 1.837 3.877 263 236 A 37 LYS H A 45 VAL HB 1.0 1.992 5.490 264 237 A 21 PHE HE2 A 21 PHE HD1 1.0 1.505 2.517 265 237 A 21 PHE HE2 A 21 PHE HD2 1.0 1.505 2.517 266 237 A 21 PHE HE1 A 21 PHE HD2 1.0 1.505 2.517 267 237 A 21 PHE HE1 A 21 PHE HD1 1.0 1.505 2.517 268 238 A 21 PHE HZ A 21 PHE HD2 1.0 0.000 6.000 269 238 A 21 PHE HZ A 21 PHE HD1 1.0 0.000 6.000 270 239 A 45 VAL H A 37 LYS HGx 1.0 1.879 4.149 271 240 A 31 ARG H A 18 ALA HB% 1.0 1.756 3.452 272 241 A 15 PRO HGx A 14 ILE HG2% 1.0 1.939 4.665 273 242 A 19 GLY H A 33 LEU H 1.0 1.858 4.014 274 243 A 89 TYR HBy A 90 TYR HD1 1.0 0.000 6.000 275 244 A 90 TYR HBx A 90 TYR HD1 1.0 1.630 2.930 276 245 A 30 TRP HA A 19 GLY H 1.0 0.000 6.000 277 246 A 21 PHE HD1 A 21 PHE HBy 1.0 1.625 2.913 278 247 A 15 PRO HGx A 30 TRP HD1 1.0 0.000 6.000 279 248 A 37 LYS H A 45 VAL HGx% 1.0 0.000 6.000 280 249 A 93 VAL HGx% A 34 LEU H 1.0 1.943 4.703 281 250 A 93 VAL HGx% A 60 ASP H 1.0 0.000 6.000 282 251 A 58 GLY H A 34 LEU HDy% 1.0 1.951 4.791 283 252 A 58 GLY H A 77 ILE HG2% 1.0 1.949 4.767 284 253 A 93 VAL HGx% A 59 CYS H 1.0 1.971 5.057 285 254 A 59 CYS H A 77 ILE HG2% 1.0 1.862 4.040 286 255 A 59 CYS H A 63 ALA HB% 1.0 0.000 6.000 287 256 A 22 ARG H A 22 ARG HBx 1.0 1.869 4.079 288 257 A 93 VAL HGy% A 33 LEU H 1.0 1.947 4.753 289 258 A 29 GLU H A 28 GLU HGx 1.0 1.917 4.447 290 259 A 57 GLY H A 54 ILE HB 1.0 1.972 5.088 291 260 A 93 VAL H A 34 LEU HG 1.0 1.840 3.902 292 261 A 30 TRP HZ2 A 38 LYS HDy 1.0 1.925 4.527 293 262 A 57 GLY H A 55 ASN HA 1.0 0.000 6.000 294 263 A 58 GLY HA3 A 59 CYS H 1.0 1.826 3.812 295 264 A 57 GLY H A 52 CYS HA 1.0 1.680 3.120 296 265 A 59 CYS H A 59 CYS HA 1.0 1.731 3.333 297 266 A 63 ALA H A 62 THR HB 1.0 0.000 6.000 298 267 A 63 ALA H A 63 ALA HA 1.0 1.711 3.249 299 268 A 58 GLY H A 59 CYS HBy 1.0 1.956 4.852 300 269 A 58 GLY H A 59 CYS HBx 1.0 1.996 5.662 301 270 A 63 ALA H A 59 CYS HBx 1.0 1.956 4.864 302 271 A 58 GLY H A 56 ASN HBx 1.0 1.982 5.242 303 272 A 6 HIS HE1 A 21 PHE HD2 1.0 0.000 6.000 304 272 A 6 HIS HE1 A 21 PHE HD1 1.0 0.000 6.000 305 273 A 21 PHE H A 22 ARG H 1.0 1.990 5.448 306 274 A 94 PHE HD2 A 89 TYR H 1.0 1.991 5.489 307 274 A 94 PHE HD1 A 89 TYR H 1.0 1.991 5.489 308 275 A 93 VAL H A 34 LEU H 1.0 2.000 6.110 309 276 A 89 TYR HE1 A 89 TYR H 1.0 1.989 5.425 310 277 A 58 GLY H A 57 GLY H 1.0 1.699 3.199 311 278 A 80 THR H A 63 ALA H 1.0 0.000 6.000 312 279 A 17 ASN HBy A 33 LEU H 1.0 1.985 5.311 313 280 A 93 VAL HB A 34 LEU H 1.0 1.995 5.593 314 281 A 36 TYR H A 34 LEU H 1.0 1.957 4.861 315 282 A 31 ARG H A 19 GLY H 1.0 1.733 3.345 316 283 A 94 PHE H A 95 CYS HA 1.0 1.994 5.582 317 284 A 36 TYR HE1 A 33 LEU H 1.0 1.915 4.429 318 285 A 36 TYR HA A 36 TYR HD2 1.0 1.751 3.427 319 285 A 36 TYR HD1 A 36 TYR HA 1.0 1.751 3.427 320 286 A 4 PRO HA A 21 PHE HE2 1.0 1.926 4.538 321 286 A 4 PRO HA A 21 PHE HE1 1.0 1.926 4.538 322 287 A 36 TYR HE2 A 17 ASN HA 1.0 1.887 4.209 323 287 A 36 TYR HE1 A 17 ASN HA 1.0 1.887 4.209 324 288 A 36 TYR HBy A 36 TYR HD2 1.0 1.705 3.219 325 288 A 36 TYR HD1 A 36 TYR HBy 1.0 1.705 3.219 326 289 A 36 TYR HE2 A 74 SER HBy 1.0 1.929 4.569 327 289 A 36 TYR HE1 A 74 SER HBy 1.0 1.929 4.569 328 290 A 23 ASP HA A 21 PHE HD2 1.0 1.858 4.014 329 290 A 23 ASP HA A 21 PHE HD1 1.0 1.858 4.014 330 291 A 21 PHE HBy A 21 PHE HD2 1.0 1.682 3.126 331 291 A 21 PHE HD1 A 21 PHE HBy 1.0 1.682 3.126 332 292 A 94 PHE HE2 A 94 PHE HZ 1.0 1.552 2.662 333 292 A 94 PHE HE1 A 94 PHE HZ 1.0 1.552 2.662 334 293 A 94 PHE HE1 A 30 TRP HA 1.0 0.000 6.000 335 294 A 21 PHE HZ A 6 HIS HBx 1.0 1.997 5.687 336 295 A 31 ARG H A 20 CYS HA 1.0 1.710 3.246 337 296 A 20 CYS HA A 29 GLU H 1.0 1.965 4.983 338 297 A 21 PHE H A 28 GLU HA 1.0 1.957 4.869 339 298 A 94 PHE HZ A 19 GLY H 1.0 1.993 5.531 340 299 A 31 ARG H A 32 CYS HA 1.0 1.957 4.875 341 300 A 20 CYS HA A 19 GLY H 1.0 1.993 5.539 342 301 A 92 GLY HA3 A 89 TYR H 1.0 1.975 5.131 343 301 A 89 TYR H A 92 GLY HA2 1.0 1.975 5.131 344 302 A 34 LEU H A 93 VAL HA 1.0 1.990 5.460 345 303 A 60 ASP H A 61 PRO HDx 1.0 1.950 4.782 346 304 A 94 PHE HZ A 31 ARG HBx 1.0 1.825 3.805 347 305 A 21 PHE HD2 A 22 ARG HBx 1.0 0.000 6.000 348 305 A 21 PHE HD1 A 22 ARG HBx 1.0 0.000 6.000 349 306 A 44 CYS HA A 39 GLY HA2 1.0 1.985 5.313 350 307 A 28 GLU HA A 28 GLU HGy 1.0 1.791 3.625 351 308 A 49 ASN HA A 49 ASN HBy 1.0 1.506 2.520 352 309 A 28 GLU HA A 22 ARG HGy 1.0 1.994 5.562 353 310 A 28 GLU HA A 22 ARG HGx 1.0 1.956 4.864 354 311 A 95 CYS HA A 95 CYS HBx 1.0 1.749 3.419 355 312 A 95 CYS HA A 85 THR HB 1.0 1.973 5.093 356 313 A 78 ILE HA A 79 CYS HA 1.0 1.997 5.655 357 314 A 36 TYR HE2 A 48 ASN HA 1.0 0.000 6.000 358 314 A 36 TYR HE1 A 48 ASN HA 1.0 0.000 6.000 359 315 A 22 ARG H A 8 CYS HA 1.0 1.946 4.746 360 316 A 23 ASP HA A 6 HIS HD2 1.0 1.933 4.599 361 317 A 94 PHE HD2 A 93 VAL HA 1.0 1.976 5.152 362 317 A 94 PHE HD1 A 93 VAL HA 1.0 1.976 5.152 363 318 A 30 TRP HD1 A 11 THR HB 1.0 1.854 3.984 364 319 A 36 TYR HD2 A 33 LEU HA 1.0 1.963 4.947 365 319 A 36 TYR HD1 A 33 LEU HA 1.0 1.963 4.947 366 320 A 18 ALA H A 15 PRO HBy 1.0 1.964 4.954 367 321 A 18 ALA H A 44 CYS HBy 1.0 1.972 5.070 368 322 A 17 ASN HBy A 18 ALA H 1.0 1.922 4.502 369 323 A 94 PHE HE1 A 93 VAL HGx% 1.0 1.742 3.388 370 324 A 23 ASP HA A 21 PHE HZ 1.0 1.832 3.844 371 325 A 23 ASP HA A 21 PHE HE2 1.0 1.671 3.085 372 325 A 23 ASP HA A 21 PHE HE1 1.0 1.671 3.085 373 326 A 84 PRO HDy A 84 PRO HA 1.0 1.906 4.362 374 327 A 28 GLU HA A 27 THR HG2% 1.0 1.875 4.129 375 328 A 37 LYS H A 37 LYS HBy 1.0 1.892 4.250 376 329 A 37 LYS H A 32 CYS HBy 1.0 1.906 4.362 377 330 A 33 LEU H A 17 ASN HA 1.0 1.978 5.180 378 331 A 94 PHE HA A 63 ALA H 1.0 1.994 5.562 379 332 A 63 ALA H A 81 CYS HA 1.0 1.950 4.780 380 333 A 59 CYS H A 93 VAL HA 1.0 1.952 4.804 381 334 A 45 VAL HA A 45 VAL H 1.0 1.683 3.133 382 335 A 94 PHE HA A 60 ASP H 1.0 1.876 4.136 383 336 A 19 GLY H A 19 GLY HA2 1.0 1.690 3.162 384 337 A 30 TRP HA A 31 ARG HGy 1.0 1.992 5.498 385 338 A 94 PHE HZ A 29 GLU H 1.0 1.999 6.199 386 339 A 30 TRP HD1 A 21 PHE H 1.0 0.000 6.000 387 340 A 30 TRP HD1 A 31 ARG H 1.0 0.000 6.000 388 341 A 30 TRP HD1 A 29 GLU H 1.0 0.000 6.000 389 342 A 80 THR H A 63 ALA HB% 1.0 1.682 3.130 390 343 A 78 ILE H A 68 ALA HB% 1.0 1.846 3.932 391 344 A 34 LEU H A 34 LEU HDx% 1.0 1.770 3.516 392 345 A 94 PHE H A 88 ALA HB% 1.0 1.937 4.643 393 346 A 77 ILE HD11 A 77 ILE HA 1.0 1.592 2.794 394 347 A 57 GLY HA3 A 77 ILE HD11 1.0 1.732 3.342 395 347 A 57 GLY HA2 A 77 ILE HD11 1.0 1.732 3.342 396 348 A 77 ILE HD11 A 52 CYS HBy 1.0 1.946 4.740 397 349 A 77 ILE HD11 A 67 ASN HBy 1.0 1.861 4.029 398 350 A 77 ILE HD11 A 50 PRO HGy 1.0 1.866 4.064 399 351 A 77 ILE HD11 A 50 PRO HBy 1.0 1.823 3.797 400 352 A 77 ILE HD11 A 50 PRO HBx 1.0 1.657 3.033 401 353 A 77 ILE HD11 A 77 ILE HG1y 1.0 1.574 2.736 402 354 A 77 ILE HD11 A 77 ILE HG1x 1.0 1.584 2.766 403 355 A 77 ILE HD11 A 51 THR HG2% 1.0 0.000 6.000 404 356 A 77 ILE HD11 A 67 ASN H 1.0 1.944 4.710 405 357 A 77 ILE HD11 A 51 THR H 1.0 1.855 3.993 406 358 A 57 GLY H A 77 ILE HD11 1.0 1.944 4.710 407 359 A 77 ILE HD11 A 77 ILE H 1.0 1.830 3.838 408 360 A 77 ILE HD11 A 67 ASN HD2y 1.0 1.972 5.078 409 361 A 94 PHE HD2 A 21 PHE H 1.0 0.000 6.000 410 361 A 94 PHE HD1 A 21 PHE H 1.0 0.000 6.000 411 362 A 21 PHE H A 21 PHE HD2 1.0 1.952 4.812 412 362 A 21 PHE HD1 A 21 PHE H 1.0 1.952 4.812 413 363 A 18 ALA HB% A 15 PRO HDx 1.0 1.688 3.152 414 364 A 15 PRO HDx A 15 PRO HGy 1.0 1.728 3.322 415 365 A 14 ILE HG2% A 15 PRO HDx 1.0 1.701 3.203 416 366 A 15 PRO HGx A 15 PRO HDx 1.0 1.739 3.373 417 367 A 15 PRO HDy A 15 PRO HBy 1.0 1.892 4.248 418 368 A 15 PRO HDx A 15 PRO HDy 1.0 1.481 2.441 419 369 A 15 PRO HDy A 14 ILE HG1y 1.0 1.895 4.275 420 370 A 15 PRO HDy A 15 PRO HGy 1.0 1.684 3.140 421 371 A 15 PRO HGx A 15 PRO HDy 1.0 1.752 3.430 422 372 A 15 PRO HDx A 15 PRO HA 1.0 1.923 4.507 423 373 A 58 GLY H A 56 ASN HA 1.0 1.948 4.762 424 374 A 15 PRO HDy A 14 ILE H 1.0 0.000 6.000 425 375 A 30 TRP HBy A 15 PRO HDx 1.0 1.941 4.687 426 376 A 15 PRO HDy A 15 PRO HBx 1.0 1.850 3.960 427 377 A 4 PRO HDx A 99 SER HBy 1.0 1.687 3.147 428 378 A 57 GLY H A 56 ASN HA 1.0 1.772 3.526 429 379 A 4 PRO HDx A 4 PRO HGy 1.0 1.682 3.128 430 380 A 4 PRO HDx A 4 PRO HGx 1.0 1.729 3.327 431 381 A 4 PRO HDx A 4 PRO HBx 1.0 1.827 3.821 432 382 A 84 PRO HDy A 84 PRO HBx 1.0 0.000 6.000 433 383 A 84 PRO HDy A 84 PRO HGy 1.0 1.657 3.033 434 384 A 85 THR HG2% A 84 PRO HDy 1.0 1.914 4.432 435 385 A 57 GLY H A 77 ILE HG2% 1.0 1.946 4.744 436 386 A 84 PRO HBx A 84 PRO HDx 1.0 0.000 6.000 437 387 A 4 PRO HBx A 4 PRO HDy 1.0 1.841 3.905 438 388 A 34 LEU H A 35 GLY H 1.0 1.910 4.396 439 389 A 84 PRO HA A 84 PRO HDx 1.0 1.815 3.755 440 390 A 36 TYR HBy A 35 GLY H 1.0 1.977 5.149 441 391 A 84 PRO HDy A 84 PRO HDx 1.0 1.410 2.246 442 392 A 4 PRO HDx A 4 PRO HDy 1.0 1.520 2.560 443 393 A 87 ASN HBy A 4 PRO HDy 1.0 1.955 4.841 444 394 A 43 THR H A 42 ASN H 1.0 1.928 4.554 445 395 A 50 PRO HDy A 48 ASN HA 1.0 1.855 3.993 446 396 A 43 THR H A 30 TRP HH2 1.0 1.856 4.000 447 397 A 50 PRO HDy A 73 ASN HA 1.0 1.949 4.781 448 398 A 50 PRO HDy A 50 PRO HDx 1.0 1.403 2.225 449 399 A 50 PRO HDy A 76 LYS HEy 1.0 1.929 4.565 450 400 A 50 PRO HDy A 50 PRO HGy 1.0 1.698 3.192 451 401 A 50 PRO HDy A 50 PRO HGx 1.0 1.624 2.906 452 402 A 50 PRO HDy A 76 LYS HDx 1.0 1.799 3.663 453 403 A 43 THR H A 45 VAL HGx% 1.0 0.000 6.000 454 404 A 48 ASN HA A 50 PRO HDx 1.0 1.894 4.262 455 405 A 50 PRO HDx A 50 PRO HA 1.0 1.924 4.522 456 406 A 73 ASN HA A 50 PRO HDx 1.0 1.939 4.655 457 407 A 61 PRO HA A 62 THR H 1.0 1.896 4.284 458 408 A 61 PRO HDx A 62 THR H 1.0 1.889 4.225 459 409 A 50 PRO HGy A 50 PRO HDx 1.0 1.675 3.103 460 410 A 60 ASP HBx A 62 THR H 1.0 1.958 4.876 461 411 A 50 PRO HDx A 76 LYS HDx 1.0 1.743 3.389 462 412 A 50 PRO HDx A 76 LYS HGx 1.0 1.945 4.725 463 413 A 50 PRO HDy A 50 PRO HBy 1.0 1.813 3.741 464 414 A 50 PRO HBy A 50 PRO HDx 1.0 1.838 3.888 465 415 A 50 PRO HDx A 76 LYS HEy 1.0 1.921 4.493 466 416 A 50 PRO HDy A 48 ASN H 1.0 1.967 5.011 467 417 A 26 GLY H A 26 GLY HA3 1.0 1.656 3.026 468 417 A 26 GLY H A 26 GLY HA2 1.0 1.656 3.026 469 418 A 50 PRO HDy A 47 ASN HD2y 1.0 1.951 4.797 470 419 A 50 PRO HDx A 49 ASN H 1.0 1.778 3.556 471 420 A 22 ARG HGx A 26 GLY H 1.0 1.965 4.977 472 421 A 86 PRO HDy A 3 ASP HA 1.0 0.000 6.000 473 422 A 22 ARG HGy A 26 GLY H 1.0 1.974 5.114 474 423 A 86 PRO HDy A 3 ASP HBy 1.0 0.000 6.000 475 424 A 86 PRO HDy A 3 ASP HBx 1.0 0.000 6.000 476 425 A 3 ASP HA A 86 PRO HDx 1.0 1.565 2.705 477 426 A 86 PRO HDy A 86 PRO HDx 1.0 1.373 2.147 478 427 A 3 ASP HBx A 86 PRO HDx 1.0 0.000 6.000 479 428 A 89 TYR HA A 91 GLU H 1.0 0.000 6.000 480 429 A 60 ASP HBx A 61 PRO HDy 1.0 1.916 4.440 481 430 A 61 PRO HDy A 61 PRO HGy 1.0 1.567 2.713 482 431 A 61 PRO HDy A 61 PRO HBx 1.0 1.792 3.628 483 432 A 61 PRO HA A 61 PRO HDx 1.0 1.900 4.310 484 433 A 61 PRO HDx A 61 PRO HDy 1.0 1.441 2.329 485 434 A 59 CYS HBy A 56 ASN HD2y 1.0 1.867 4.065 486 435 A 60 ASP HBx A 61 PRO HDx 1.0 1.899 4.301 487 436 A 61 PRO HDx A 61 PRO HBx 1.0 0.000 6.000 488 437 A 68 ALA HA A 69 GLU HBx 1.0 0.000 6.000 489 438 A 56 ASN HA A 56 ASN HD2y 1.0 1.959 4.895 490 439 A 4 PRO HDx A 85 THR H 1.0 0.000 6.000 491 440 A 84 PRO HDx A 85 THR H 1.0 1.819 3.777 492 441 A 4 PRO HDy A 87 ASN HD2y 1.0 1.959 4.895 493 442 A 4 PRO HDy A 87 ASN HD2x 1.0 1.936 4.638 494 443 A 77 ILE HD11 A 68 ALA H 1.0 1.855 3.991 495 444 A 19 GLY H A 18 ALA HA 1.0 1.600 2.824 496 445 A 33 LEU H A 18 ALA HA 1.0 1.638 2.958 497 446 A 18 ALA HB% A 18 ALA HA 1.0 1.536 2.608 498 447 A 33 LEU HDy% A 18 ALA HA 1.0 1.708 3.238 499 448 A 68 ALA HA A 68 ALA H 1.0 1.715 3.265 500 449 A 63 ALA HA A 64 SER H 1.0 1.517 2.553 501 450 A 37 LYS HBx A 47 ASN HD2y 1.0 1.880 4.160 502 451 A 62 THR H A 61 PRO HDy 1.0 1.936 4.624 503 452 A 60 ASP H A 61 PRO HDy 1.0 0.000 6.000 504 453 A 50 PRO HBy A 47 ASN HD2x 1.0 1.877 4.143 505 454 A 86 PRO HDy A 99 SER H 1.0 1.930 4.568 506 455 A 86 PRO HDx A 5 LYS H 1.0 0.000 6.000 507 456 A 63 ALA H A 61 PRO HDy 1.0 1.952 4.810 508 457 A 61 PRO HDy A 55 ASN HD2x 1.0 0.000 6.000 509 458 A 61 PRO HDx A 55 ASN HD2x 1.0 1.864 4.048 510 459 A 95 CYS HA A 96 SER H 1.0 1.573 2.731 511 460 A 89 TYR H A 95 CYS HA 1.0 1.856 3.994 512 461 A 95 CYS HA A 95 CYS H 1.0 1.794 3.640 513 462 A 95 CYS HA A 95 CYS HBy 1.0 1.727 3.319 514 463 A 95 CYS HA A 88 ALA HB% 1.0 1.878 4.144 515 464 A 79 CYS HA A 79 CYS H 1.0 1.762 3.480 516 465 A 80 THR H A 79 CYS HA 1.0 1.527 2.585 517 466 A 79 CYS HA A 65 CYS HA 1.0 1.719 3.279 518 467 A 58 GLY H A 55 ASN HD2y 1.0 1.930 4.570 519 468 A 79 CYS HA A 79 CYS HBy 1.0 1.748 3.408 520 469 A 79 CYS HA A 79 CYS HBx 1.0 1.684 3.136 521 470 A 55 ASN HA A 55 ASN HD2x 1.0 1.914 4.434 522 471 A 58 GLY HA3 A 55 ASN HD2y 1.0 1.828 3.826 523 472 A 77 ILE HG2% A 79 CYS HA 1.0 1.906 4.366 524 473 A 79 CYS HA A 78 ILE HG2% 1.0 1.891 4.241 525 474 A 55 ASN HD2x A 55 ASN HBy 1.0 1.759 3.465 526 475 A 88 ALA HA A 89 TYR H 1.0 1.542 2.628 527 476 A 55 ASN HD2x A 55 ASN HBx 1.0 1.889 4.229 528 477 A 88 ALA HA A 88 ALA HB% 1.0 1.546 2.642 529 478 A 49 ASN HA A 49 ASN H 1.0 1.647 2.995 530 479 A 49 ASN HA A 50 PRO HDx 1.0 1.552 2.660 531 480 A 49 ASN HA A 49 ASN HBx 1.0 0.000 6.000 532 481 A 42 ASN HA A 42 ASN H 1.0 1.661 3.045 533 482 A 43 THR H A 42 ASN HA 1.0 1.565 2.707 534 483 A 60 ASP H A 59 CYS HA 1.0 1.584 2.766 535 484 A 23 ASP HA A 24 ASP H 1.0 1.595 2.805 536 485 A 94 PHE HE2 A 94 PHE H 1.0 0.000 6.000 537 485 A 94 PHE HE1 A 94 PHE H 1.0 0.000 6.000 538 486 A 94 PHE H A 60 ASP H 1.0 1.979 5.199 539 487 A 23 ASP HA A 23 ASP HBy 1.0 1.550 2.656 540 487 A 23 ASP HA A 23 ASP HBx 1.0 1.550 2.656 541 488 A 63 ALA HB% A 59 CYS HA 1.0 1.827 3.815 542 489 A 60 ASP HBx A 59 CYS HA 1.0 1.877 4.139 543 490 A 59 CYS HA A 59 CYS HBx 1.0 1.683 3.133 544 491 A 93 VAL HA A 59 CYS HA 1.0 1.628 2.920 545 492 A 23 ASP HA A 22 ARG HA 1.0 0.000 6.000 546 493 A 31 ARG H A 30 TRP HA 1.0 1.592 2.794 547 494 A 20 CYS H A 30 TRP HA 1.0 1.950 4.784 548 495 A 30 TRP H A 30 TRP HA 1.0 1.809 3.721 549 496 A 30 TRP HA A 30 TRP HBy 1.0 1.656 3.024 550 497 A 94 PHE H A 34 LEU HDy% 1.0 1.980 5.222 551 498 A 94 PHE HD2 A 30 TRP HA 1.0 0.000 6.000 552 498 A 94 PHE HD1 A 30 TRP HA 1.0 0.000 6.000 553 499 A 6 HIS HBx A 6 HIS H 1.0 1.891 4.239 554 500 A 30 TRP HA A 31 ARG HBx 1.0 1.953 4.819 555 501 A 30 TRP HA A 14 ILE HD1% 1.0 0.000 6.000 556 502 A 14 ILE HG2% A 30 TRP HA 1.0 1.885 4.193 557 503 A 67 ASN HA A 68 ALA H 1.0 1.479 2.439 558 504 A 67 ASN HA A 67 ASN H 1.0 1.699 3.199 559 505 A 67 ASN HA A 77 ILE HA 1.0 1.705 3.223 560 506 A 67 ASN HA A 67 ASN HBy 1.0 1.591 2.791 561 507 A 67 ASN HA A 77 ILE HG2% 1.0 1.885 4.197 562 508 A 61 PRO HDy A 60 ASP HA 1.0 1.537 2.615 563 509 A 60 ASP H A 60 ASP HA 1.0 1.731 3.333 564 510 A 61 PRO HDx A 60 ASP HA 1.0 1.594 2.800 565 511 A 60 ASP HBy A 60 ASP HA 1.0 1.748 3.410 566 512 A 60 ASP HBx A 60 ASP HA 1.0 1.712 3.254 567 513 A 33 LEU HDy% A 33 LEU HA 1.0 1.504 2.510 568 514 A 33 LEU HBy A 33 LEU HA 1.0 1.622 2.902 569 515 A 33 LEU HBx A 33 LEU HA 1.0 1.719 3.283 570 516 A 33 LEU HA A 33 LEU HG 1.0 0.000 6.000 571 517 A 34 LEU H A 33 LEU HA 1.0 1.609 2.853 572 518 A 33 LEU H A 33 LEU HA 1.0 1.778 3.554 573 519 A 55 ASN HA A 55 ASN HBx 1.0 1.588 2.782 574 520 A 55 ASN HA A 55 ASN H 1.0 1.592 2.794 575 521 A 87 ASN HD2y A 87 ASN HA 1.0 0.000 6.000 576 522 A 55 ASN HA A 56 ASN H 1.0 1.710 3.246 577 523 A 55 ASN HA A 54 ILE HG2% 1.0 0.000 6.000 578 524 A 20 CYS H A 20 CYS HA 1.0 1.843 3.919 579 525 A 20 CYS HA A 20 CYS HBy 1.0 1.723 3.301 580 526 A 14 ILE HG2% A 20 CYS HA 1.0 1.910 4.394 581 527 A 20 CYS HA A 21 PHE HBy 1.0 1.917 4.453 582 528 A 29 GLU H A 28 GLU HA 1.0 1.563 2.695 583 529 A 28 GLU HA A 22 ARG HA 1.0 1.679 3.117 584 530 A 4 PRO HGx A 87 ASN HD2y 1.0 1.970 5.046 585 531 A 28 GLU HGx A 28 GLU HA 1.0 1.733 3.345 586 532 A 28 GLU HA A 28 GLU HBy 1.0 1.724 3.304 587 533 A 28 GLU HA A 28 GLU HBx 1.0 1.751 3.429 588 534 A 45 VAL H A 44 CYS HA 1.0 1.478 2.436 589 535 A 44 CYS HA A 44 CYS H 1.0 1.782 3.578 590 536 A 44 CYS HA A 39 GLY H 1.0 1.771 3.523 591 537 A 43 THR HA A 39 GLY H 1.0 0.000 6.000 592 538 A 43 THR HB A 39 GLY H 1.0 1.950 4.786 593 539 A 44 CYS HA A 44 CYS HBx 1.0 1.690 3.158 594 540 A 38 LYS HGy A 39 GLY H 1.0 1.711 3.251 595 540 A 38 LYS HGx A 39 GLY H 1.0 1.711 3.251 596 541 A 18 ALA HA A 32 CYS HA 1.0 1.575 2.737 597 542 A 19 GLY H A 32 CYS HA 1.0 1.767 3.503 598 543 A 33 LEU H A 32 CYS HA 1.0 1.584 2.768 599 544 A 32 CYS HA A 32 CYS HBy 1.0 1.700 3.204 600 545 A 17 ASN HD2y A 17 ASN HD2x 1.0 1.401 2.221 601 546 A 18 ALA HB% A 32 CYS HA 1.0 1.627 2.919 602 547 A 17 ASN HD2x A 17 ASN H 1.0 1.968 5.020 603 548 A 33 LEU HDy% A 32 CYS HA 1.0 1.828 3.828 604 549 A 17 ASN HD2x A 16 LYS HA 1.0 1.978 5.174 605 550 A 13 ASP H A 13 ASP HA 1.0 0.000 6.000 606 551 A 14 ILE H A 13 ASP HA 1.0 1.514 2.542 607 552 A 13 ASP HA A 13 ASP HBy 1.0 1.523 2.571 608 553 A 48 ASN HA A 49 ASN H 1.0 0.000 6.000 609 554 A 67 ASN HBy A 68 ALA HA 1.0 0.000 6.000 610 555 A 48 ASN HA A 48 ASN HD2x 1.0 0.000 6.000 611 556 A 87 ASN HA A 88 ALA H 1.0 0.000 6.000 612 557 A 17 ASN HD2x A 16 LYS HBx 1.0 1.907 4.363 613 558 A 17 ASN HBx A 17 ASN HD2x 1.0 1.853 3.975 614 559 A 85 THR H A 82 LYS HA 1.0 0.000 6.000 615 560 A 82 LYS HA A 83 GLU H 1.0 1.519 2.559 616 561 A 82 LYS HA A 82 LYS HBy 1.0 1.567 2.713 617 562 A 18 ALA HB% A 17 ASN H 1.0 1.979 5.211 618 563 A 30 TRP HE3 A 31 ARG HA 1.0 1.749 3.419 619 564 A 31 ARG HGx A 31 ARG HA 1.0 1.735 3.353 620 565 A 31 ARG HA A 31 ARG HBx 1.0 1.702 3.210 621 566 A 31 ARG HGy A 31 ARG HA 1.0 1.701 3.207 622 567 A 31 ARG HA A 31 ARG HBy 1.0 1.697 3.191 623 568 A 72 GLU HA A 72 GLU HBy 1.0 1.618 2.884 624 569 A 72 GLU HA A 72 GLU HBx 1.0 1.686 3.144 625 570 A 72 GLU HA A 73 ASN H 1.0 1.614 2.870 626 571 A 53 ASP HA A 53 ASP HBy 1.0 0.000 6.000 627 572 A 53 ASP HA A 53 ASP HBx 1.0 1.610 2.854 628 573 A 53 ASP HA A 53 ASP H 1.0 1.673 3.095 629 574 A 65 CYS HA A 66 GLN H 1.0 1.474 2.422 630 575 A 65 CYS HA A 65 CYS H 1.0 1.780 3.562 631 576 A 17 ASN HD2y A 18 ALA H 1.0 1.863 4.041 632 577 A 65 CYS HA A 65 CYS HBx 1.0 1.652 3.010 633 578 A 65 CYS HA A 65 CYS HBy 1.0 1.694 3.176 634 579 A 77 ILE HG2% A 65 CYS HA 1.0 1.871 4.097 635 580 A 36 TYR HBy A 36 TYR HA 1.0 1.766 3.498 636 581 A 36 TYR HA A 47 ASN H 1.0 0.000 6.000 637 582 A 36 TYR HA A 37 LYS HGy 1.0 1.914 4.430 638 583 A 51 THR H A 47 ASN HD2x 1.0 1.921 4.483 639 584 A 51 THR H A 47 ASN HD2y 1.0 1.955 4.847 640 585 A 51 THR H A 51 THR HA 1.0 1.756 3.450 641 586 A 51 THR H A 50 PRO HA 1.0 1.501 2.501 642 587 A 57 GLY HA3 A 51 THR H 1.0 1.887 4.209 643 588 A 51 THR H A 50 PRO HDx 1.0 0.000 6.000 644 589 A 30 TRP H A 29 GLU HA 1.0 1.484 2.452 645 590 A 75 LYS HA A 75 LYS HBy 1.0 1.520 2.560 646 591 A 66 GLN HGx A 66 GLN HA 1.0 0.000 6.000 647 592 A 66 GLN HBy A 66 GLN HA 1.0 1.766 3.496 648 593 A 75 LYS HA A 75 LYS HDx 1.0 1.737 3.361 649 594 A 84 PRO HA A 85 THR H 1.0 1.798 3.662 650 595 A 75 LYS HA A 75 LYS HGy 1.0 0.000 6.000 651 596 A 67 ASN H A 66 GLN HA 1.0 1.453 2.365 652 597 A 75 LYS HA A 75 LYS H 1.0 1.687 3.145 653 598 A 69 GLU HBx A 69 GLU HA 1.0 0.000 6.000 654 599 A 69 GLU HA A 76 LYS HDy 1.0 0.000 6.000 655 600 A 69 GLU HA A 69 GLU H 1.0 1.610 2.856 656 601 A 63 ALA HB% A 64 SER H 1.0 0.000 6.000 657 602 A 52 CYS HA A 51 THR H 1.0 0.000 6.000 658 603 A 68 ALA HB% A 69 GLU HA 1.0 1.859 4.021 659 604 A 52 CYS HA A 54 ILE H 1.0 1.868 4.078 660 605 A 57 GLY HA3 A 52 CYS HA 1.0 1.757 3.457 661 605 A 57 GLY HA2 A 52 CYS HA 1.0 1.757 3.457 662 606 A 88 ALA HA A 96 SER H 1.0 1.919 4.475 663 607 A 52 CYS HA A 52 CYS HBy 1.0 1.650 3.002 664 608 A 52 CYS HA A 52 CYS HBx 1.0 1.680 3.120 665 609 A 77 ILE HG2% A 52 CYS HA 1.0 1.884 4.190 666 610 A 77 ILE HD11 A 52 CYS HA 1.0 1.834 3.858 667 611 A 12 ARG HA A 12 ARG HBy 1.0 1.567 2.709 668 612 A 12 ARG HA A 12 ARG HBx 1.0 1.588 2.782 669 613 A 12 ARG HA A 12 ARG H 1.0 1.714 3.260 670 614 A 13 ASP H A 12 ARG HA 1.0 0.000 6.000 671 615 A 12 ARG HA A 11 THR HG2% 1.0 1.887 4.209 672 616 A 85 THR H A 83 GLU HA 1.0 0.000 6.000 673 617 A 83 GLU H A 83 GLU HA 1.0 1.733 3.345 674 618 A 52 CYS HA A 53 ASP H 1.0 1.782 3.574 675 619 A 84 PRO HA A 83 GLU HA 1.0 0.000 6.000 676 620 A 84 PRO HDy A 83 GLU HA 1.0 1.895 4.275 677 621 A 84 PRO HDx A 83 GLU HA 1.0 0.000 6.000 678 622 A 53 ASP H A 54 ILE HG1y 1.0 1.958 4.878 679 623 A 83 GLU HA A 84 PRO HBy 1.0 0.000 6.000 680 624 A 83 GLU HA A 83 GLU HGx 1.0 1.767 3.503 681 625 A 83 GLU HA A 83 GLU HBy 1.0 1.642 2.972 682 626 A 83 GLU HA A 83 GLU HBx 1.0 1.680 3.122 683 627 A 22 ARG HGy A 8 CYS HA 1.0 1.926 4.540 684 628 A 22 ARG HGx A 8 CYS HA 1.0 1.916 4.442 685 629 A 8 CYS HA A 22 ARG HBy 1.0 1.806 3.700 686 630 A 22 ARG HBx A 8 CYS HA 1.0 1.707 3.231 687 631 A 9 VAL HGy% A 8 CYS HA 1.0 1.739 3.371 688 632 A 8 CYS HA A 8 CYS HBy 1.0 1.652 3.010 689 633 A 8 CYS HA A 8 CYS HBx 1.0 1.742 3.382 690 634 A 34 LEU H A 33 LEU HG 1.0 0.000 6.000 691 635 A 8 CYS HA A 9 VAL H 1.0 1.561 2.691 692 636 A 8 CYS HA A 10 ASP H 1.0 0.000 6.000 693 637 A 8 CYS HA A 8 CYS H 1.0 1.771 3.521 694 638 A 73 ASN HA A 76 LYS HEy 1.0 1.574 2.732 695 639 A 76 LYS H A 70 SER HBx 1.0 1.987 5.365 696 640 A 34 LEU H A 34 LEU HA 1.0 1.555 2.669 697 641 A 70 SER HBx A 76 LYS HA 1.0 1.814 3.748 698 642 A 76 LYS HA A 76 LYS HBx 1.0 1.637 2.953 699 643 A 76 LYS HGx A 76 LYS HA 1.0 1.660 3.042 700 644 A 68 ALA HB% A 76 LYS HA 1.0 1.650 3.004 701 645 A 70 SER H A 69 GLU HBy 1.0 1.829 3.831 702 646 A 76 LYS HA A 76 LYS HBy 1.0 1.658 3.034 703 647 A 77 ILE H A 76 LYS HA 1.0 1.763 3.485 704 648 A 76 LYS H A 76 LYS HA 1.0 1.753 3.435 705 649 A 70 SER HBx A 70 SER H 1.0 1.823 3.799 706 650 A 6 HIS H A 5 LYS HA 1.0 1.857 4.005 707 651 A 69 GLU HA A 70 SER H 1.0 1.510 2.532 708 652 A 91 GLU H A 91 GLU HA 1.0 0.000 6.000 709 653 A 17 ASN H A 16 LYS HA 1.0 0.000 6.000 710 654 A 16 LYS HA A 16 LYS H 1.0 1.673 3.093 711 655 A 92 GLY H A 91 GLU HA 1.0 1.736 3.354 712 656 A 18 ALA H A 16 LYS HA 1.0 1.757 3.453 713 657 A 17 ASN HA A 16 LYS HA 1.0 0.000 6.000 714 658 A 91 GLU HA A 91 GLU HBy 1.0 1.673 3.091 715 659 A 91 GLU HA A 91 GLU HBx 1.0 1.546 2.644 716 660 A 91 GLU HA A 91 GLU HGx 1.0 1.654 3.020 717 661 A 16 LYS HA A 16 LYS HBy 1.0 1.549 2.653 718 662 A 88 ALA HB% A 91 GLU HA 1.0 0.000 6.000 719 663 A 18 ALA HB% A 16 LYS HA 1.0 1.922 4.502 720 664 A 89 TYR HA A 90 TYR H 1.0 1.584 2.768 721 665 A 71 THR H A 70 SER HA 1.0 1.581 2.757 722 666 A 21 PHE HA A 22 ARG H 1.0 1.611 2.861 723 667 A 21 PHE HA A 21 PHE HBy 1.0 1.757 3.453 724 668 A 21 PHE HBx A 21 PHE HA 1.0 1.692 3.168 725 669 A 89 TYR HBy A 89 TYR HA 1.0 1.680 3.118 726 670 A 89 TYR HA A 89 TYR HBx 1.0 1.813 3.741 727 671 A 89 TYR HA A 90 TYR HA 1.0 0.000 6.000 728 672 A 31 ARG H A 18 ALA HA 1.0 1.979 5.205 729 673 A 21 PHE HA A 21 PHE H 1.0 1.757 3.455 730 674 A 24 ASP H A 24 ASP HA 1.0 1.677 3.107 731 675 A 24 ASP HA A 25 ASP H 1.0 1.821 3.783 732 676 A 24 ASP HA A 24 ASP HBx 1.0 1.624 2.908 733 677 A 85 THR H A 85 THR HA 1.0 1.759 3.465 734 678 A 85 THR HA A 97 SER HA 1.0 0.000 6.000 735 679 A 86 PRO HDy A 85 THR HA 1.0 1.866 4.064 736 680 A 4 PRO HDy A 85 THR HA 1.0 1.655 3.023 737 681 A 4 PRO HDx A 85 THR HA 1.0 1.703 3.215 738 682 A 85 THR HG2% A 85 THR HA 1.0 1.592 2.794 739 683 A 4 PRO HGx A 85 THR HA 1.0 1.866 4.064 740 684 A 73 ASN HA A 69 GLU HA 1.0 0.000 6.000 741 685 A 73 ASN HA A 72 GLU HA 1.0 0.000 6.000 742 686 A 24 ASP HBy A 24 ASP HA 1.0 1.570 2.718 743 687 A 2 VAL H A 1 GLY H1 1.0 1.922 4.496 744 688 A 40 GLU HA A 40 GLU HBy 1.0 1.475 2.427 745 688 A 40 GLU HA A 40 GLU HBx 1.0 1.475 2.427 746 689 A 40 GLU HA A 41 GLY H 1.0 1.529 2.589 747 690 A 13 ASP H A 12 ARG HBy 1.0 0.000 6.000 748 691 A 35 GLY H A 34 LEU HA 1.0 1.547 2.647 749 692 A 2 VAL H A 2 VAL HB 1.0 1.785 3.591 750 693 A 34 LEU HBx A 34 LEU HA 1.0 1.676 3.104 751 694 A 93 VAL HGy% A 34 LEU HA 1.0 1.816 3.760 752 695 A 34 LEU HDx% A 34 LEU HA 1.0 0.000 6.000 753 696 A 14 ILE HG2% A 13 ASP H 1.0 0.000 6.000 754 697 A 73 ASN HA A 73 ASN HBx 1.0 1.582 2.760 755 698 A 73 ASN HA A 73 ASN H 1.0 1.836 3.868 756 699 A 73 ASN HA A 74 SER H 1.0 1.897 4.287 757 700 A 8 CYS HA A 10 ASP HBx 1.0 0.000 6.000 758 701 A 73 ASN HA A 76 LYS HGx 1.0 1.788 3.610 759 702 A 59 CYS H A 56 ASN HBy 1.0 1.878 4.146 760 703 A 70 SER HA A 70 SER HBy 1.0 1.617 2.881 761 704 A 70 SER H A 70 SER HA 1.0 1.742 3.384 762 705 A 70 SER HBx A 70 SER HA 1.0 1.689 3.157 763 706 A 99 SER H A 98 SER HA 1.0 0.000 6.000 764 707 A 65 CYS H A 64 SER HA 1.0 1.511 2.533 765 708 A 64 SER HA A 64 SER HBy 1.0 1.601 2.827 766 709 A 39 GLY H A 38 LYS HA 1.0 1.478 2.434 767 710 A 44 CYS HA A 38 LYS HA 1.0 1.643 2.977 768 711 A 38 LYS HA A 38 LYS H 1.0 1.660 3.044 769 712 A 46 GLU H A 45 VAL HA 1.0 1.530 2.590 770 713 A 80 THR H A 65 CYS HA 1.0 1.918 4.468 771 714 A 45 VAL HA A 45 VAL HB 1.0 1.540 2.626 772 715 A 80 THR H A 80 THR HA 1.0 1.796 3.650 773 716 A 45 VAL HA A 46 GLU HBy 1.0 0.000 6.000 774 717 A 46 GLU HA A 47 ASN H 1.0 1.492 2.476 775 718 A 46 GLU H A 46 GLU HA 1.0 1.687 3.147 776 719 A 14 ILE HA A 14 ILE H 1.0 1.752 3.430 777 720 A 36 TYR HBy A 36 TYR H 1.0 1.714 3.262 778 721 A 46 GLU HA A 45 VAL HA 1.0 1.881 4.167 779 722 A 46 GLU HA A 36 TYR HBy 1.0 1.918 4.464 780 723 A 46 GLU HA A 36 TYR HBx 1.0 1.820 3.776 781 724 A 14 ILE HA A 15 PRO HDy 1.0 1.518 2.556 782 725 A 80 THR H A 80 THR HG2% 1.0 1.890 4.232 783 726 A 46 GLU HA A 46 GLU HBy 1.0 1.654 3.020 784 727 A 46 GLU HA A 46 GLU HBx 1.0 1.629 2.925 785 728 A 15 PRO HDx A 14 ILE HA 1.0 1.582 2.758 786 729 A 14 ILE HA A 14 ILE HG1y 1.0 1.752 3.432 787 730 A 14 ILE HA A 11 THR HG2% 1.0 1.765 3.489 788 731 A 14 ILE HG2% A 14 ILE HA 1.0 1.607 2.845 789 732 A 15 PRO HGx A 14 ILE HA 1.0 0.000 6.000 790 733 A 51 THR HA A 51 THR HB 1.0 1.468 2.406 791 734 A 97 SER HA A 97 SER HBx 1.0 1.672 3.086 792 735 A 77 ILE HD11 A 51 THR HA 1.0 1.637 2.953 793 736 A 43 THR HA A 44 CYS H 1.0 1.548 2.648 794 737 A 43 THR H A 43 THR HA 1.0 1.749 3.415 795 738 A 43 THR HA A 43 THR HB 1.0 1.550 2.656 796 739 A 43 THR HA A 43 THR HG2% 1.0 1.534 2.602 797 740 A 43 THR HA A 15 PRO HBy 1.0 1.667 3.069 798 741 A 90 TYR HBy A 90 TYR HA 1.0 1.682 3.128 799 742 A 90 TYR HBx A 90 TYR HA 1.0 1.746 3.404 800 743 A 99 SER HA A 99 SER HBx 1.0 1.586 2.774 801 744 A 99 SER HBy A 99 SER HA 1.0 1.585 2.771 802 745 A 99 SER H A 99 SER HA 1.0 1.704 3.218 803 746 A 10 ASP HBx A 11 THR H 1.0 1.812 3.736 804 747 A 51 THR HG2% A 54 ILE HA 1.0 0.000 6.000 805 748 A 90 TYR HA A 90 TYR H 1.0 1.610 2.856 806 749 A 90 TYR HA A 91 GLU H 1.0 1.696 3.186 807 750 A 11 THR HG2% A 11 THR H 1.0 1.836 3.872 808 751 A 14 ILE HD1% A 11 THR H 1.0 1.895 4.269 809 752 A 78 ILE HA A 78 ILE HG1x 1.0 1.668 3.074 810 753 A 78 ILE HA A 78 ILE HB 1.0 1.744 3.394 811 754 A 78 ILE HA A 78 ILE HG1y 1.0 0.000 6.000 812 755 A 78 ILE HA A 79 CYS H 1.0 1.494 2.482 813 756 A 53 ASP HA A 54 ILE H 1.0 1.822 3.794 814 757 A 74 SER HBy A 74 SER HA 1.0 1.602 2.828 815 758 A 74 SER H A 74 SER HA 1.0 1.801 3.675 816 759 A 75 LYS H A 74 SER HA 1.0 1.878 4.152 817 760 A 76 LYS HEy A 74 SER HA 1.0 0.000 6.000 818 761 A 34 LEU HBx A 74 SER HA 1.0 1.894 4.268 819 762 A 35 GLY H A 74 SER HA 1.0 0.000 6.000 820 763 A 54 ILE H A 54 ILE HG1y 1.0 1.796 3.646 821 764 A 54 ILE HB A 54 ILE HA 1.0 1.763 3.483 822 765 A 55 ASN HBx A 54 ILE HA 1.0 0.000 6.000 823 766 A 54 ILE HG1y A 54 ILE HA 1.0 1.728 3.322 824 767 A 54 ILE HA A 54 ILE HG1x 1.0 1.665 3.061 825 768 A 54 ILE HG2% A 54 ILE HA 1.0 1.547 2.645 826 769 A 54 ILE H A 54 ILE HA 1.0 1.743 3.391 827 770 A 56 ASN H A 54 ILE HA 1.0 1.868 4.076 828 771 A 94 PHE HA A 95 CYS H 1.0 1.639 2.961 829 772 A 87 ASN HA A 87 ASN H 1.0 1.737 3.361 830 773 A 80 THR HA A 81 CYS H 1.0 1.512 2.538 831 774 A 4 PRO HDy A 87 ASN H 1.0 1.829 3.831 832 775 A 3 ASP H A 2 VAL HA 1.0 1.514 2.540 833 776 A 2 VAL H A 2 VAL HA 1.0 1.728 3.320 834 777 A 2 VAL HB A 2 VAL HA 1.0 1.653 3.013 835 778 A 2 VAL HA A 2 VAL HGy% 1.0 1.532 2.600 836 779 A 4 PRO HBx A 87 ASN H 1.0 1.954 4.836 837 780 A 7 VAL H A 7 VAL HA 1.0 1.785 3.593 838 781 A 7 VAL HA A 7 VAL HB 1.0 1.707 3.233 839 782 A 7 VAL HA A 7 VAL HGx% 1.0 1.520 2.562 840 783 A 37 LYS H A 45 VAL H 1.0 1.716 3.268 841 784 A 72 GLU H A 71 THR HA 1.0 1.784 3.590 842 785 A 71 THR H A 71 THR HA 1.0 1.778 3.556 843 786 A 62 THR HA A 82 LYS HEy 1.0 1.853 3.983 844 787 A 9 VAL H A 9 VAL HA 1.0 1.770 3.516 845 788 A 10 ASP H A 9 VAL HA 1.0 1.808 3.710 846 789 A 62 THR H A 62 THR HA 1.0 1.754 3.436 847 790 A 63 ALA H A 62 THR HA 1.0 1.820 3.778 848 791 A 9 VAL HA A 9 VAL HGx% 1.0 1.516 2.550 849 792 A 37 LYS H A 47 ASN HBx 1.0 1.885 4.193 850 793 A 15 PRO HA A 16 LYS H 1.0 1.481 2.445 851 794 A 15 PRO HA A 15 PRO HDy 1.0 1.861 4.031 852 795 A 15 PRO HA A 15 PRO HBy 1.0 1.572 2.726 853 796 A 15 PRO HA A 16 LYS HBy 1.0 0.000 6.000 854 797 A 14 ILE HA A 15 PRO HA 1.0 1.925 4.525 855 798 A 15 PRO HA A 16 LYS HBx 1.0 0.000 6.000 856 799 A 18 ALA HB% A 15 PRO HA 1.0 1.893 4.255 857 800 A 15 PRO HA A 15 PRO HBx 1.0 1.672 3.090 858 801 A 37 LYS H A 47 ASN H 1.0 1.883 4.179 859 802 A 15 PRO HA A 15 PRO HGy 1.0 1.783 3.579 860 803 A 28 GLU HGy A 27 THR HA 1.0 1.913 4.411 861 804 A 27 THR HA A 28 GLU H 1.0 1.500 2.500 862 805 A 27 THR HA A 27 THR H 1.0 1.762 3.478 863 806 A 32 CYS H A 31 ARG HA 1.0 1.557 2.679 864 807 A 74 SER HBy A 74 SER HBx 1.0 1.406 2.234 865 808 A 58 GLY H A 56 ASN H 1.0 1.979 5.205 866 809 A 74 SER H A 74 SER HBx 1.0 1.791 3.619 867 810 A 74 SER HBy A 74 SER H 1.0 1.799 3.665 868 811 A 50 PRO HA A 47 ASN HD2x 1.0 1.673 3.093 869 812 A 50 PRO HA A 47 ASN HD2y 1.0 1.758 3.462 870 813 A 50 PRO HDy A 50 PRO HA 1.0 1.823 3.799 871 814 A 50 PRO HGy A 50 PRO HA 1.0 1.820 3.780 872 815 A 50 PRO HBy A 50 PRO HA 1.0 1.618 2.886 873 816 A 51 THR HG2% A 50 PRO HA 1.0 1.812 3.734 874 817 A 97 SER HA A 97 SER HBy 1.0 1.666 3.066 875 818 A 97 SER HBy A 97 SER H 1.0 1.800 3.668 876 819 A 97 SER HBx A 97 SER H 1.0 1.817 3.761 877 820 A 97 SER HBy A 98 SER H 1.0 1.885 4.199 878 821 A 97 SER HBx A 98 SER H 1.0 1.875 4.127 879 822 A 57 GLY H A 56 ASN H 1.0 1.768 3.508 880 823 A 56 ASN H A 54 ILE H 1.0 1.927 4.543 881 824 A 97 SER HBx A 97 SER HBy 1.0 1.340 2.064 882 825 A 85 THR HG2% A 97 SER HBy 1.0 1.797 3.655 883 826 A 11 THR HA A 10 ASP HA 1.0 0.000 6.000 884 827 A 13 ASP H A 11 THR HA 1.0 1.902 4.326 885 828 A 11 THR HA A 12 ARG HGy 1.0 1.882 4.170 886 829 A 11 THR HG2% A 11 THR HA 1.0 0.000 6.000 887 830 A 14 ILE HD1% A 11 THR HA 1.0 0.000 6.000 888 831 A 14 ILE HG1x A 11 THR HA 1.0 0.000 6.000 889 832 A 75 LYS HA A 70 SER HBx 1.0 1.969 5.033 890 833 A 70 SER HBx A 75 LYS HBx 1.0 1.843 3.919 891 834 A 33 LEU HBy A 33 LEU H 1.0 1.803 3.689 892 835 A 70 SER HBx A 75 LYS HGx 1.0 1.944 4.714 893 836 A 33 LEU H A 33 LEU HG 1.0 1.620 2.892 894 837 A 70 SER HBx A 70 SER HBy 1.0 1.465 2.397 895 838 A 70 SER HBy A 72 GLU H 1.0 1.877 4.139 896 839 A 71 THR H A 70 SER HBy 1.0 1.918 4.464 897 840 A 70 SER H A 70 SER HBy 1.0 1.842 3.910 898 841 A 16 LYS H A 16 LYS HBy 1.0 1.581 2.759 899 842 A 75 LYS HBy A 70 SER HBy 1.0 0.000 6.000 900 843 A 70 SER HBy A 75 LYS HBx 1.0 0.000 6.000 901 844 A 15 PRO HGy A 16 LYS H 1.0 1.944 4.720 902 845 A 14 ILE HG2% A 16 LYS H 1.0 1.993 5.531 903 846 A 76 LYS HA A 70 SER HBy 1.0 1.857 4.005 904 847 A 63 ALA HA A 64 SER HBy 1.0 0.000 6.000 905 848 A 40 GLU HBy A 40 GLU H 1.0 1.546 2.640 906 848 A 40 GLU HBx A 40 GLU H 1.0 1.546 2.640 907 849 A 64 SER HBy A 80 THR HG2% 1.0 1.861 4.027 908 850 A 40 GLU HA A 40 GLU H 1.0 1.725 3.311 909 851 A 64 SER HBx A 64 SER HA 1.0 1.703 3.213 910 852 A 64 SER H A 64 SER HBy 1.0 1.682 3.128 911 853 A 65 CYS H A 64 SER HBy 1.0 0.000 6.000 912 854 A 64 SER HBx A 64 SER H 1.0 1.670 3.082 913 855 A 64 SER HBx A 65 CYS H 1.0 0.000 6.000 914 856 A 30 TRP H A 30 TRP HD1 1.0 1.814 3.746 915 857 A 47 ASN HD2y A 47 ASN H 1.0 1.936 4.636 916 858 A 64 SER HBx A 64 SER HBy 1.0 1.307 1.985 917 859 A 47 ASN H A 47 ASN HBy 1.0 1.691 3.165 918 860 A 47 ASN HBx A 47 ASN H 1.0 1.685 3.139 919 861 A 86 PRO HA A 86 PRO HBx 1.0 1.622 2.898 920 862 A 68 ALA H A 69 GLU H 1.0 1.923 4.503 921 863 A 69 GLU H A 69 GLU HGx 1.0 1.743 3.389 922 864 A 99 SER HBy A 87 ASN HD2y 1.0 1.958 4.872 923 865 A 87 ASN HD2y A 99 SER HBx 1.0 1.922 4.498 924 866 A 87 ASN HD2x A 99 SER HBx 1.0 1.962 4.924 925 867 A 45 VAL H A 47 ASN H 1.0 1.991 5.499 926 868 A 24 ASP H A 25 ASP H 1.0 1.767 3.501 927 869 A 99 SER HBy A 99 SER HBx 1.0 1.235 1.819 928 870 A 4 PRO HA A 4 PRO HDx 1.0 1.926 4.534 929 871 A 83 GLU H A 82 LYS H 1.0 1.950 4.788 930 872 A 4 PRO HA A 4 PRO HBy 1.0 1.648 2.998 931 873 A 4 PRO HA A 4 PRO HGx 1.0 0.000 6.000 932 874 A 4 PRO HA A 4 PRO HBx 1.0 1.645 2.983 933 875 A 82 LYS H A 81 CYS HBy 1.0 1.752 3.430 934 876 A 84 PRO HDy A 82 LYS H 1.0 1.864 4.054 935 877 A 6 HIS HE1 A 4 PRO HA 1.0 0.000 6.000 936 878 A 61 PRO HA A 56 ASN HD2y 1.0 1.814 3.746 937 879 A 61 PRO HA A 56 ASN HD2x 1.0 1.775 3.543 938 880 A 61 PRO HA A 61 PRO HDy 1.0 0.000 6.000 939 881 A 61 PRO HA A 56 ASN HBy 1.0 0.000 6.000 940 882 A 61 PRO HA A 61 PRO HBy 1.0 1.551 2.659 941 883 A 56 ASN HBx A 61 PRO HA 1.0 1.809 3.719 942 884 A 61 PRO HA A 61 PRO HGx 1.0 1.679 3.115 943 885 A 61 PRO HA A 61 PRO HBx 1.0 1.656 3.028 944 886 A 24 ASP H A 23 ASP HBx 1.0 1.662 3.050 945 887 A 24 ASP H A 24 ASP HBx 1.0 1.668 3.074 946 888 A 93 VAL H A 93 VAL HA 1.0 1.758 3.460 947 889 A 87 ASN HD2x A 96 SER HBy 1.0 0.000 6.000 948 890 A 96 SER HBy A 96 SER HA 1.0 1.815 3.751 949 891 A 96 SER HBx A 96 SER HA 1.0 1.805 3.693 950 892 A 3 ASP HA A 96 SER HBy 1.0 1.866 4.062 951 893 A 96 SER HBx A 87 ASN HD2x 1.0 0.000 6.000 952 894 A 96 SER HBx A 96 SER H 1.0 1.831 3.845 953 895 A 96 SER HBx A 97 SER H 1.0 1.901 4.321 954 896 A 97 SER H A 96 SER HBy 1.0 1.929 4.559 955 897 A 87 ASN HBy A 96 SER HBy 1.0 0.000 6.000 956 898 A 87 ASN HBy A 96 SER HBx 1.0 0.000 6.000 957 899 A 75 LYS H A 74 SER H 1.0 1.812 3.732 958 900 A 96 SER HBx A 96 SER HBy 1.0 1.501 2.503 959 901 A 6 HIS HE1 A 96 SER HBy 1.0 1.708 3.232 960 902 A 93 VAL HB A 93 VAL HA 1.0 1.806 3.704 961 903 A 75 LYS H A 70 SER HBx 1.0 1.974 5.124 962 904 A 75 LYS HBy A 75 LYS H 1.0 1.790 3.616 963 905 A 85 THR HB A 95 CYS HBy 1.0 1.714 3.262 964 906 A 85 THR HB A 4 PRO HDy 1.0 1.915 4.437 965 907 A 85 THR HB A 96 SER HA 1.0 0.000 6.000 966 908 A 85 THR HB A 97 SER HA 1.0 1.848 3.948 967 909 A 85 THR HB A 85 THR HA 1.0 1.660 3.040 968 910 A 85 THR HB A 96 SER H 1.0 1.883 4.179 969 911 A 85 THR HB A 97 SER H 1.0 0.000 6.000 970 912 A 85 THR HB A 85 THR H 1.0 1.894 4.268 971 913 A 71 THR HB A 71 THR HG2% 1.0 1.468 2.406 972 914 A 72 GLU H A 71 THR HB 1.0 1.877 4.139 973 915 A 71 THR H A 71 THR HB 1.0 1.903 4.335 974 916 A 70 SER HA A 71 THR HB 1.0 0.000 6.000 975 917 A 11 THR HB A 11 THR HG2% 1.0 1.538 2.618 976 918 A 14 ILE HG1x A 11 THR HB 1.0 1.924 4.516 977 919 A 93 VAL HB A 93 VAL H 1.0 1.615 2.875 978 920 A 11 THR HB A 10 ASP HA 1.0 0.000 6.000 979 921 A 11 THR HB A 11 THR H 1.0 1.598 2.814 980 922 A 93 VAL H A 34 LEU HDx% 1.0 1.937 4.639 981 923 A 93 VAL H A 34 LEU HDy% 1.0 1.908 4.376 982 924 A 27 THR HA A 27 THR HB 1.0 0.000 6.000 983 925 A 51 THR HB A 52 CYS H 1.0 0.000 6.000 984 926 A 51 THR H A 51 THR HB 1.0 1.866 4.064 985 927 A 83 GLU H A 83 GLU HBx 1.0 1.639 2.959 986 928 A 77 ILE HD11 A 51 THR HB 1.0 0.000 6.000 987 929 A 54 ILE H A 51 THR HB 1.0 0.000 6.000 988 930 A 80 THR HB A 80 THR HA 1.0 1.784 3.590 989 931 A 80 THR HB A 64 SER HBx 1.0 1.661 3.047 990 932 A 20 CYS H A 20 CYS HBy 1.0 0.000 6.000 991 933 A 20 CYS H A 20 CYS HBx 1.0 1.774 3.536 992 934 A 43 THR HB A 44 CYS H 1.0 1.634 2.944 993 935 A 46 GLU H A 46 GLU HGy 1.0 1.727 3.315 994 936 A 62 THR HB A 62 THR HG2% 1.0 1.534 2.602 995 937 A 62 THR HB A 62 THR H 1.0 1.906 4.354 996 938 A 95 CYS HBx A 81 CYS HBy 1.0 1.923 4.507 997 939 A 81 CYS HA A 81 CYS HBy 1.0 1.713 3.259 998 940 A 81 CYS H A 81 CYS HBy 1.0 1.793 3.631 999 941 A 85 THR H A 81 CYS HBy 1.0 0.000 6.000 1000 942 A 30 TRP HBx A 30 TRP HBy 1.0 1.520 2.560 1001 943 A 30 TRP HBy A 14 ILE HD1% 1.0 1.915 4.435 1002 944 A 30 TRP HBy A 20 CYS HA 1.0 1.843 3.919 1003 945 A 29 GLU H A 28 GLU H 1.0 1.937 4.643 1004 946 A 30 TRP H A 30 TRP HBy 1.0 1.881 4.169 1005 947 A 30 TRP HBy A 31 ARG HA 1.0 1.962 4.944 1006 948 A 30 TRP HBx A 15 PRO HDx 1.0 1.965 4.969 1007 949 A 30 TRP HBx A 14 ILE HD1% 1.0 1.891 4.239 1008 950 A 14 ILE HG2% A 30 TRP HBx 1.0 1.791 3.621 1009 951 A 71 THR H A 72 GLU H 1.0 1.768 3.504 1010 952 A 75 LYS H A 72 GLU H 1.0 1.966 4.990 1011 953 A 30 TRP H A 30 TRP HBx 1.0 1.893 4.253 1012 954 A 67 ASN H A 67 ASN HD2x 1.0 1.940 4.672 1013 955 A 30 TRP HBx A 20 CYS HA 1.0 1.856 3.996 1014 956 A 70 SER HBx A 72 GLU H 1.0 1.843 3.911 1015 957 A 90 TYR HBx A 90 TYR HBy 1.0 1.540 2.624 1016 958 A 72 GLU H A 71 THR HG2% 1.0 1.876 4.134 1017 959 A 66 GLN HGy A 67 ASN H 1.0 0.000 6.000 1018 960 A 90 TYR HBy A 93 VAL HGx% 1.0 0.000 6.000 1019 961 A 90 TYR HBx A 93 VAL HGx% 1.0 0.000 6.000 1020 962 A 90 TYR HBx A 90 TYR H 1.0 1.936 4.634 1021 963 A 90 TYR HBy A 90 TYR H 1.0 1.953 4.819 1022 964 A 90 TYR HBy A 91 GLU H 1.0 0.000 6.000 1023 965 A 90 TYR HBx A 91 GLU H 1.0 1.946 4.744 1024 966 A 60 ASP H A 59 CYS HBx 1.0 1.772 3.528 1025 967 A 34 LEU HDy% A 60 ASP H 1.0 1.984 5.292 1026 968 A 94 PHE HD2 A 90 TYR HBy 1.0 0.000 6.000 1027 968 A 94 PHE HD1 A 90 TYR HBy 1.0 0.000 6.000 1028 969 A 79 CYS H A 79 CYS HBy 1.0 1.739 3.371 1029 970 A 80 THR H A 79 CYS HBy 1.0 1.887 4.215 1030 971 A 37 LYS HGx A 38 LYS H 1.0 1.850 3.960 1031 972 A 91 GLU H A 90 TYR H 1.0 0.000 6.000 1032 973 A 79 CYS HBy A 79 CYS HBx 1.0 1.518 2.554 1033 974 A 92 GLY HA3 A 79 CYS HBx 1.0 1.704 3.218 1034 974 A 92 GLY HA2 A 79 CYS HBx 1.0 1.704 3.218 1035 975 A 63 ALA HB% A 79 CYS HBx 1.0 1.778 3.556 1036 976 A 91 GLU HA A 90 TYR H 1.0 0.000 6.000 1037 977 A 79 CYS H A 79 CYS HBx 1.0 1.783 3.583 1038 978 A 80 THR H A 79 CYS HBx 1.0 1.827 3.815 1039 979 A 60 ASP HBy A 60 ASP HBx 1.0 1.546 2.644 1040 980 A 72 GLU HBx A 73 ASN H 1.0 1.978 5.176 1041 981 A 60 ASP HBy A 59 CYS HBx 1.0 1.956 4.854 1042 982 A 60 ASP HBy A 61 PRO HDy 1.0 1.924 4.522 1043 983 A 60 ASP HBy A 61 PRO HDx 1.0 1.956 4.858 1044 984 A 28 GLU H A 27 THR HB 1.0 0.000 6.000 1045 985 A 94 PHE HA A 60 ASP HBy 1.0 1.871 4.097 1046 986 A 94 PHE HA A 60 ASP HBx 1.0 0.000 6.000 1047 987 A 51 THR H A 52 CYS H 1.0 1.933 4.601 1048 988 A 60 ASP HBy A 95 CYS H 1.0 1.894 4.270 1049 989 A 60 ASP HBx A 95 CYS H 1.0 1.860 4.026 1050 990 A 51 THR HA A 52 CYS H 1.0 1.536 2.612 1051 991 A 18 ALA HB% A 19 GLY HA2 1.0 1.893 4.259 1052 991 A 18 ALA HB% A 19 GLY HA3 1.0 1.893 4.259 1053 992 A 33 LEU HDy% A 19 GLY HA3 1.0 1.719 3.281 1054 992 A 33 LEU HDy% A 19 GLY HA2 1.0 1.719 3.281 1055 993 A 14 ILE HG2% A 19 GLY HA3 1.0 1.861 4.035 1056 993 A 14 ILE HG2% A 19 GLY HA2 1.0 1.861 4.035 1057 994 A 19 GLY H A 19 GLY HA3 1.0 1.711 3.251 1058 994 A 19 GLY H A 19 GLY HA2 1.0 1.711 3.251 1059 995 A 20 CYS H A 19 GLY HA3 1.0 1.625 2.911 1060 995 A 20 CYS H A 19 GLY HA2 1.0 1.625 2.911 1061 996 A 99 SER H A 99 SER HBx 1.0 1.828 3.828 1062 997 A 63 ALA H A 62 THR H 1.0 1.653 3.015 1063 998 A 63 ALA H A 64 SER H 1.0 1.911 4.399 1064 999 A 63 ALA H A 56 ASN HD2y 1.0 0.000 6.000 1065 1000 A 63 ALA H A 56 ASN HD2x 1.0 0.000 6.000 1066 1001 A 50 PRO HGx A 35 GLY HA3 1.0 1.910 4.388 1067 1002 A 22 ARG HDx A 22 ARG HGy 1.0 1.799 3.661 1068 1003 A 22 ARG HDx A 22 ARG HGx 1.0 1.799 3.661 1069 1004 A 22 ARG HDx A 22 ARG HBy 1.0 1.813 3.739 1070 1005 A 63 ALA H A 59 CYS HBy 1.0 1.985 5.323 1071 1006 A 9 VAL HGy% A 22 ARG HDx 1.0 1.813 3.739 1072 1007 A 22 ARG HDy A 22 ARG HGx 1.0 1.830 3.834 1073 1008 A 22 ARG HDy A 22 ARG HBy 1.0 1.848 3.950 1074 1009 A 22 ARG HDy A 22 ARG HBx 1.0 1.823 3.801 1075 1010 A 22 ARG HDx A 28 GLU HGx 1.0 1.919 4.467 1076 1011 A 22 ARG HDx A 28 GLU HGy 1.0 1.938 4.648 1077 1012 A 20 CYS HBy A 10 ASP H 1.0 1.875 4.125 1078 1013 A 22 ARG HDy A 22 ARG HDx 1.0 1.570 2.718 1079 1014 A 22 ARG HDy A 8 CYS HA 1.0 1.870 4.086 1080 1015 A 22 ARG HDx A 8 CYS HA 1.0 1.878 4.144 1081 1016 A 22 ARG HDy A 22 ARG HA 1.0 0.000 6.000 1082 1017 A 14 ILE HD1% A 10 ASP H 1.0 1.719 3.281 1083 1018 A 9 VAL H A 8 CYS H 1.0 1.970 5.056 1084 1019 A 8 CYS H A 7 VAL H 1.0 1.930 4.578 1085 1020 A 22 ARG HDy A 9 VAL H 1.0 1.955 4.849 1086 1021 A 21 PHE HBx A 21 PHE HBy 1.0 1.583 2.765 1087 1022 A 8 CYS HBx A 8 CYS H 1.0 1.658 3.032 1088 1023 A 8 CYS H A 7 VAL HGy% 1.0 1.628 2.922 1089 1024 A 8 CYS H A 9 VAL HGx% 1.0 1.884 4.190 1090 1025 A 2 VAL H A 3 ASP H 1.0 1.951 4.795 1091 1026 A 94 PHE HE2 A 21 PHE HBy 1.0 1.897 4.285 1092 1026 A 94 PHE HE1 A 21 PHE HBy 1.0 1.897 4.285 1093 1027 A 99 SER HBy A 3 ASP H 1.0 1.955 4.847 1094 1028 A 33 LEU HBy A 33 LEU HDx% 1.0 1.587 2.779 1095 1029 A 12 ARG H A 11 THR HA 1.0 1.587 2.779 1096 1030 A 33 LEU HBx A 93 VAL HGy% 1.0 1.894 4.270 1097 1031 A 33 LEU HBy A 93 VAL HGy% 1.0 1.878 4.150 1098 1032 A 2 VAL HB A 3 ASP H 1.0 1.885 4.201 1099 1033 A 33 LEU HBx A 33 LEU HBy 1.0 1.551 2.659 1100 1034 A 12 ARG H A 11 THR HG2% 1.0 1.766 3.500 1101 1035 A 33 LEU HBy A 18 ALA HA 1.0 0.000 6.000 1102 1036 A 33 LEU HBx A 18 ALA HA 1.0 1.961 4.929 1103 1037 A 33 LEU HBy A 34 LEU HDx% 1.0 0.000 6.000 1104 1038 A 33 LEU HBy A 34 LEU H 1.0 1.750 3.422 1105 1039 A 33 LEU HBx A 34 LEU H 1.0 0.000 6.000 1106 1040 A 77 ILE HA A 68 ALA H 1.0 1.799 3.663 1107 1041 A 39 GLY HA2 A 40 GLU H 1.0 1.602 2.828 1108 1042 A 68 ALA H A 76 LYS HA 1.0 1.834 3.864 1109 1043 A 67 ASN HBy A 68 ALA H 1.0 1.753 3.435 1110 1044 A 58 GLY H A 58 GLY HA3 1.0 1.639 2.963 1111 1044 A 58 GLY H A 58 GLY HA2 1.0 1.639 2.963 1112 1045 A 58 GLY HA3 A 55 ASN HD2y 1.0 1.822 3.790 1113 1045 A 58 GLY HA2 A 55 ASN HD2y 1.0 1.822 3.790 1114 1046 A 58 GLY HA3 A 56 ASN HD2y 1.0 0.000 6.000 1115 1046 A 58 GLY HA2 A 56 ASN HD2y 1.0 0.000 6.000 1116 1047 A 28 GLU HA A 23 ASP H 1.0 1.925 4.525 1117 1048 A 22 ARG HA A 23 ASP H 1.0 1.671 3.087 1118 1049 A 58 GLY HA3 A 34 LEU HDy% 1.0 1.790 3.616 1119 1049 A 34 LEU HDy% A 58 GLY HA2 1.0 1.790 3.616 1120 1050 A 23 ASP HBy A 23 ASP H 1.0 1.719 3.285 1121 1051 A 28 GLU HGx A 23 ASP H 1.0 1.977 5.163 1122 1052 A 22 ARG HGx A 23 ASP H 1.0 1.920 4.484 1123 1053 A 22 ARG HBy A 23 ASP H 1.0 1.980 5.208 1124 1054 A 22 ARG HBx A 23 ASP H 1.0 1.951 4.801 1125 1055 A 89 TYR H A 88 ALA H 1.0 1.959 4.895 1126 1056 A 88 ALA H A 87 ASN H 1.0 1.948 4.758 1127 1057 A 88 ALA HA A 88 ALA H 1.0 1.828 3.822 1128 1058 A 92 GLY HA3 A 89 TYR H 1.0 1.891 4.245 1129 1059 A 94 PHE H A 92 GLY HA3 1.0 1.899 4.307 1130 1060 A 92 GLY HA3 A 88 ALA HA 1.0 1.874 4.122 1131 1061 A 90 TYR HBy A 92 GLY HA3 1.0 0.000 6.000 1132 1061 A 90 TYR HBy A 92 GLY HA2 1.0 0.000 6.000 1133 1062 A 92 GLY HA3 A 88 ALA HB% 1.0 1.739 3.371 1134 1062 A 92 GLY HA2 A 88 ALA HB% 1.0 1.739 3.371 1135 1063 A 92 GLY HA3 A 79 CYS HBy 1.0 1.653 3.017 1136 1063 A 92 GLY HA2 A 79 CYS HBy 1.0 1.653 3.017 1137 1064 A 79 CYS H A 78 ILE HG1x 1.0 0.000 6.000 1138 1065 A 66 GLN H A 65 CYS H 1.0 0.000 6.000 1139 1066 A 79 CYS HA A 66 GLN H 1.0 1.918 4.458 1140 1067 A 77 ILE HA A 66 GLN H 1.0 1.907 4.369 1141 1068 A 66 GLN H A 66 GLN HA 1.0 1.743 3.389 1142 1069 A 66 GLN HGx A 66 GLN H 1.0 0.000 6.000 1143 1070 A 66 GLN H A 78 ILE HB 1.0 1.866 4.068 1144 1071 A 57 GLY HA3 A 77 ILE HG1y 1.0 1.856 3.994 1145 1071 A 57 GLY HA2 A 77 ILE HG1y 1.0 1.856 3.994 1146 1072 A 77 ILE HG2% A 66 GLN H 1.0 1.837 3.883 1147 1073 A 77 ILE HD11 A 66 GLN H 1.0 1.980 5.220 1148 1074 A 57 GLY HA3 A 77 ILE HB 1.0 1.896 4.278 1149 1074 A 57 GLY HA2 A 77 ILE HB 1.0 1.896 4.278 1150 1075 A 92 GLY H A 91 GLU H 1.0 1.797 3.657 1151 1076 A 57 GLY HA3 A 51 THR H 1.0 1.890 4.232 1152 1076 A 57 GLY HA2 A 51 THR H 1.0 1.890 4.232 1153 1077 A 58 GLY H A 57 GLY HA3 1.0 1.881 4.169 1154 1077 A 58 GLY H A 57 GLY HA2 1.0 1.881 4.169 1155 1078 A 57 GLY H A 57 GLY HA3 1.0 1.675 3.101 1156 1078 A 57 GLY H A 57 GLY HA2 1.0 1.675 3.101 1157 1079 A 92 GLY H A 93 VAL HA 1.0 1.984 5.286 1158 1080 A 42 ASN H A 41 GLY HA3 1.0 1.726 3.316 1159 1081 A 92 GLY H A 91 GLU HBy 1.0 1.968 5.022 1160 1082 A 92 GLY H A 91 GLU HBx 1.0 1.938 4.644 1161 1083 A 93 VAL HB A 92 GLY H 1.0 1.900 4.316 1162 1084 A 93 VAL HGx% A 92 GLY H 1.0 1.993 5.537 1163 1085 A 30 TRP H A 30 TRP HE1 1.0 1.952 4.818 1164 1086 A 42 ASN HD2y A 30 TRP HE1 1.0 1.972 5.088 1165 1087 A 30 TRP HZ2 A 30 TRP HE1 1.0 1.657 3.031 1166 1088 A 30 TRP HD1 A 30 TRP HE1 1.0 1.551 2.661 1167 1089 A 14 ILE HA A 30 TRP HE1 1.0 1.941 4.687 1168 1090 A 31 ARG HDx A 31 ARG HBy 1.0 1.815 3.755 1169 1091 A 31 ARG HGx A 31 ARG HDx 1.0 1.794 3.634 1170 1092 A 15 PRO HDy A 30 TRP HE1 1.0 1.921 4.487 1171 1093 A 93 VAL HGx% A 31 ARG HDx 1.0 1.759 3.465 1172 1094 A 31 ARG HDy A 31 ARG HE 1.0 1.738 3.364 1173 1095 A 31 ARG HDy A 31 ARG HBy 1.0 1.763 3.487 1174 1096 A 31 ARG HGy A 31 ARG HDy 1.0 1.751 3.429 1175 1097 A 22 ARG H A 22 ARG HBy 1.0 1.897 4.281 1176 1098 A 95 CYS HBy A 81 CYS HBx 1.0 1.854 3.986 1177 1099 A 95 CYS HBx A 95 CYS HBy 1.0 1.536 2.612 1178 1100 A 95 CYS HBx A 95 CYS H 1.0 1.803 3.689 1179 1101 A 44 CYS H A 45 VAL HGy% 1.0 1.979 5.203 1180 1102 A 95 CYS HBx A 96 SER HA 1.0 0.000 6.000 1181 1103 A 95 CYS HBx A 96 SER H 1.0 1.886 4.204 1182 1104 A 95 CYS HBx A 85 THR HB 1.0 1.797 3.657 1183 1105 A 48 ASN HA A 48 ASN HD2y 1.0 1.865 4.055 1184 1106 A 73 ASN HA A 48 ASN HD2y 1.0 1.969 5.041 1185 1107 A 76 LYS HEy A 48 ASN HD2y 1.0 1.972 5.076 1186 1108 A 73 ASN HA A 76 LYS HEx 1.0 0.000 6.000 1187 1109 A 46 GLU HBy A 48 ASN HD2y 1.0 1.961 4.919 1188 1110 A 76 LYS HEy A 70 SER H 1.0 1.966 4.984 1189 1111 A 48 ASN HD2x A 46 GLU HBy 1.0 1.976 5.146 1190 1112 A 76 LYS HDy A 76 LYS HEx 1.0 1.686 3.146 1191 1113 A 76 LYS HDx A 76 LYS HEx 1.0 1.632 2.938 1192 1114 A 76 LYS HGx A 76 LYS HEx 1.0 0.000 6.000 1193 1115 A 50 PRO HDx A 76 LYS HEx 1.0 1.897 4.287 1194 1116 A 76 LYS HEy A 76 LYS HDx 1.0 1.650 3.002 1195 1117 A 9 VAL H A 10 ASP HBx 1.0 1.901 4.321 1196 1118 A 10 ASP H A 10 ASP HBx 1.0 1.695 3.181 1197 1119 A 10 ASP HBy A 9 VAL H 1.0 1.924 4.516 1198 1120 A 10 ASP HBy A 10 ASP H 1.0 1.739 3.371 1199 1121 A 10 ASP HBy A 11 THR H 1.0 1.831 3.843 1200 1122 A 10 ASP HBx A 10 ASP HA 1.0 1.675 3.101 1201 1123 A 10 ASP HBy A 10 ASP HA 1.0 1.631 2.933 1202 1124 A 10 ASP HBy A 11 THR HB 1.0 1.926 4.534 1203 1125 A 48 ASN HA A 73 ASN HD2x 1.0 1.982 5.258 1204 1126 A 5 LYS H A 6 HIS H 1.0 1.820 3.782 1205 1127 A 14 ILE HD1% A 10 ASP HBx 1.0 1.921 4.493 1206 1128 A 14 ILE HD1% A 10 ASP HBy 1.0 1.915 4.437 1207 1129 A 5 LYS H A 5 LYS HA 1.0 1.757 3.451 1208 1130 A 5 LYS H A 5 LYS HBx 1.0 1.790 3.616 1209 1131 A 5 LYS H A 5 LYS HGy 1.0 1.837 3.877 1210 1132 A 89 TYR HBy A 94 PHE HBx 1.0 1.783 3.585 1211 1133 A 89 TYR HBx A 94 PHE HBx 1.0 1.692 3.166 1212 1134 A 37 LYS H A 44 CYS HBx 1.0 1.936 4.624 1213 1135 A 44 CYS HBx A 44 CYS H 1.0 1.850 3.956 1214 1136 A 45 VAL H A 44 CYS HBy 1.0 1.904 4.344 1215 1137 A 44 CYS HBy A 44 CYS H 1.0 1.828 3.828 1216 1138 A 27 THR HB A 22 ARG HE 1.0 0.000 6.000 1217 1139 A 22 ARG HDy A 22 ARG HE 1.0 1.775 3.541 1218 1140 A 22 ARG HDx A 22 ARG HE 1.0 1.732 3.340 1219 1141 A 44 CYS HA A 44 CYS HBy 1.0 1.802 3.684 1220 1142 A 36 TYR HBy A 44 CYS HBx 1.0 1.821 3.785 1221 1143 A 22 ARG HGx A 22 ARG HE 1.0 1.905 4.349 1222 1144 A 17 ASN HBy A 44 CYS HBx 1.0 0.000 6.000 1223 1145 A 17 ASN HBx A 44 CYS HBx 1.0 1.828 3.826 1224 1146 A 31 ARG HGx A 31 ARG HE 1.0 1.715 3.263 1225 1147 A 31 ARG HDx A 31 ARG HE 1.0 1.785 3.593 1226 1148 A 58 GLY H A 56 ASN HBy 1.0 1.932 4.594 1227 1149 A 56 ASN HD2y A 56 ASN HBy 1.0 1.797 3.653 1228 1150 A 56 ASN HBy A 56 ASN HD2x 1.0 1.724 3.306 1229 1151 A 94 PHE HD2 A 31 ARG HE 1.0 1.961 4.909 1230 1151 A 94 PHE HD1 A 31 ARG HE 1.0 1.961 4.909 1231 1152 A 93 VAL HGx% A 31 ARG HE 1.0 1.961 4.925 1232 1153 A 49 ASN HA A 49 ASN HD2x 1.0 1.989 5.403 1233 1154 A 49 ASN HA A 49 ASN HD2y 1.0 1.968 5.026 1234 1155 A 56 ASN HBx A 56 ASN HD2y 1.0 1.838 3.886 1235 1156 A 56 ASN HBx A 56 ASN HD2x 1.0 0.000 6.000 1236 1157 A 56 ASN HBx A 56 ASN HA 1.0 1.756 3.448 1237 1158 A 56 ASN HA A 56 ASN HBy 1.0 1.802 3.684 1238 1159 A 89 TYR HA A 92 GLY H 1.0 1.986 5.336 1239 1160 A 59 CYS HBx A 56 ASN HBy 1.0 1.928 4.552 1240 1161 A 37 LYS HBy A 37 LYS HEx 1.0 1.893 4.259 1241 1162 A 37 LYS HEx A 37 LYS HDx 1.0 1.708 3.236 1242 1163 A 37 LYS HGx A 37 LYS HEx 1.0 1.617 2.881 1243 1164 A 45 VAL HGy% A 37 LYS HEy 1.0 1.724 3.306 1244 1165 A 37 LYS H A 37 LYS HEy 1.0 1.954 4.836 1245 1166 A 37 LYS H A 37 LYS HEx 1.0 0.000 6.000 1246 1167 A 24 ASP H A 23 ASP HBy 1.0 1.711 3.247 1247 1167 A 24 ASP H A 23 ASP HBx 1.0 1.711 3.247 1248 1168 A 23 ASP HBy A 23 ASP H 1.0 1.722 3.292 1249 1168 A 23 ASP HBx A 23 ASP H 1.0 1.722 3.292 1250 1169 A 23 ASP HBy A 25 ASP H 1.0 1.756 3.448 1251 1169 A 23 ASP HBx A 25 ASP H 1.0 1.756 3.448 1252 1170 A 23 ASP HBy A 27 THR HB 1.0 1.836 3.872 1253 1170 A 23 ASP HBx A 27 THR HB 1.0 1.836 3.872 1254 1171 A 23 ASP HBy A 24 ASP HBx 1.0 1.878 4.148 1255 1171 A 23 ASP HBx A 24 ASP HBx 1.0 1.878 4.148 1256 1172 A 21 PHE HE1 A 23 ASP HBy 1.0 1.912 4.408 1257 1172 A 21 PHE HE2 A 23 ASP HBy 1.0 1.912 4.408 1258 1172 A 21 PHE HE2 A 23 ASP HBx 1.0 1.912 4.408 1259 1172 A 21 PHE HE1 A 23 ASP HBx 1.0 1.912 4.408 1260 1173 A 8 CYS HBx A 9 VAL H 1.0 1.894 4.264 1261 1174 A 8 CYS HBy A 10 ASP H 1.0 0.000 6.000 1262 1175 A 8 CYS HBy A 8 CYS H 1.0 1.723 3.299 1263 1176 A 20 CYS H A 8 CYS HBx 1.0 1.907 4.361 1264 1177 A 8 CYS HBx A 10 ASP H 1.0 0.000 6.000 1265 1178 A 8 CYS HBx A 7 VAL HA 1.0 0.000 6.000 1266 1179 A 8 CYS HBy A 7 VAL HA 1.0 0.000 6.000 1267 1180 A 21 PHE HBx A 8 CYS HBx 1.0 1.939 4.655 1268 1181 A 21 PHE HBx A 8 CYS HBy 1.0 1.905 4.347 1269 1182 A 22 ARG HBx A 8 CYS HBy 1.0 1.890 4.232 1270 1183 A 34 LEU HA A 34 LEU HBy 1.0 1.798 3.662 1271 1184 A 93 VAL HGy% A 34 LEU HBx 1.0 1.873 4.113 1272 1185 A 34 LEU HDx% A 34 LEU HBy 1.0 1.662 3.050 1273 1186 A 34 LEU HDy% A 34 LEU HBy 1.0 1.755 3.443 1274 1187 A 34 LEU H A 34 LEU HBy 1.0 1.758 3.462 1275 1188 A 35 GLY H A 34 LEU HBy 1.0 1.907 4.369 1276 1189 A 77 ILE HA A 78 ILE HB 1.0 0.000 6.000 1277 1190 A 78 ILE H A 78 ILE HB 1.0 1.621 2.895 1278 1191 A 66 GLN HBy A 78 ILE HB 1.0 1.838 3.882 1279 1192 A 66 GLN HGy A 78 ILE HB 1.0 1.692 3.168 1280 1193 A 66 GLN HGx A 78 ILE HB 1.0 1.690 3.162 1281 1194 A 78 ILE HG1x A 78 ILE HB 1.0 1.718 3.278 1282 1195 A 54 ILE HB A 54 ILE HG1x 1.0 1.720 3.284 1283 1196 A 78 ILE H A 77 ILE HB 1.0 1.874 4.120 1284 1197 A 77 ILE HA A 77 ILE HB 1.0 1.785 3.593 1285 1198 A 77 ILE HG1y A 77 ILE HB 1.0 1.653 3.013 1286 1199 A 77 ILE HG1x A 77 ILE HB 1.0 1.655 3.023 1287 1200 A 77 ILE HD11 A 77 ILE HB 1.0 1.765 3.491 1288 1201 A 34 LEU HA A 77 ILE HB 1.0 1.966 4.990 1289 1202 A 13 ASP HA A 14 ILE HB 1.0 1.931 4.581 1290 1203 A 14 ILE HA A 14 ILE HB 1.0 1.764 3.486 1291 1204 A 15 PRO HDy A 14 ILE HB 1.0 0.000 6.000 1292 1205 A 14 ILE HG1y A 14 ILE HB 1.0 1.640 2.966 1293 1206 A 14 ILE HG1x A 14 ILE HB 1.0 1.705 3.219 1294 1207 A 37 LYS HA A 47 ASN HBx 1.0 1.935 4.627 1295 1208 A 47 ASN HBx A 47 ASN HA 1.0 1.782 3.578 1296 1209 A 47 ASN HBx A 37 LYS HBx 1.0 1.782 3.580 1297 1210 A 47 ASN HBx A 37 LYS HDx 1.0 1.855 3.991 1298 1211 A 37 LYS HGy A 47 ASN HBx 1.0 1.759 3.463 1299 1212 A 47 ASN HBx A 37 LYS HBy 1.0 1.848 3.950 1300 1213 A 47 ASN HBx A 47 ASN HD2y 1.0 1.770 3.514 1301 1214 A 47 ASN HBx A 47 ASN HD2x 1.0 1.836 3.872 1302 1215 A 37 LYS H A 47 ASN HBy 1.0 1.936 4.638 1303 1216 A 36 TYR H A 47 ASN HBy 1.0 1.954 4.832 1304 1217 A 47 ASN HD2y A 47 ASN HBy 1.0 1.748 3.414 1305 1218 A 47 ASN HD2x A 47 ASN HBy 1.0 1.842 3.908 1306 1219 A 36 TYR HA A 47 ASN HBy 1.0 1.885 4.195 1307 1220 A 47 ASN HBy A 47 ASN HA 1.0 1.794 3.636 1308 1221 A 50 PRO HDy A 47 ASN HBy 1.0 1.868 4.076 1309 1222 A 37 LYS HBx A 47 ASN HBy 1.0 1.816 3.760 1310 1223 A 37 LYS HGy A 47 ASN HBy 1.0 1.827 3.819 1311 1224 A 50 PRO HBy A 47 ASN HBy 1.0 1.830 3.840 1312 1225 A 73 ASN HBy A 72 GLU HA 1.0 0.000 6.000 1313 1226 A 50 PRO HDx A 47 ASN HBy 1.0 1.954 4.836 1314 1227 A 47 ASN HBx A 37 LYS HEy 1.0 1.956 4.854 1315 1228 A 8 CYS HA A 22 ARG HE 1.0 1.982 5.264 1316 1229 A 89 TYR HBy A 94 PHE HE2 1.0 1.891 4.243 1317 1229 A 89 TYR HBy A 94 PHE HE1 1.0 1.891 4.243 1318 1230 A 89 TYR HBy A 31 ARG HE 1.0 0.000 6.000 1319 1231 A 3 ASP HBy A 87 ASN HD2x 1.0 1.849 3.953 1320 1232 A 89 TYR HBx A 31 ARG HE 1.0 0.000 6.000 1321 1233 A 89 TYR HBx A 90 TYR H 1.0 1.953 4.827 1322 1234 A 89 TYR HBx A 89 TYR H 1.0 1.865 4.057 1323 1235 A 89 TYR HBy A 90 TYR H 1.0 1.858 4.008 1324 1236 A 89 TYR HBy A 89 TYR H 1.0 1.890 4.236 1325 1237 A 25 ASP HBx A 25 ASP HA 1.0 1.595 2.805 1326 1238 A 25 ASP HA A 25 ASP HBy 1.0 0.000 6.000 1327 1239 A 14 ILE HG2% A 20 CYS HBx 1.0 1.764 3.490 1328 1240 A 14 ILE HG2% A 20 CYS HBy 1.0 1.799 3.669 1329 1241 A 20 CYS HBx A 30 TRP HA 1.0 1.908 4.376 1330 1242 A 20 CYS HBx A 20 CYS HA 1.0 1.782 3.574 1331 1243 A 94 PHE HE2 A 89 TYR HBx 1.0 1.922 4.490 1332 1243 A 94 PHE HE1 A 89 TYR HBx 1.0 1.922 4.490 1333 1244 A 36 TYR HBx A 36 TYR HA 1.0 1.744 3.392 1334 1245 A 36 TYR HBx A 44 CYS HA 1.0 1.931 4.581 1335 1246 A 36 TYR HBx A 36 TYR HD2 1.0 1.788 3.606 1336 1246 A 36 TYR HD1 A 36 TYR HBx 1.0 1.788 3.606 1337 1247 A 36 TYR HE2 A 36 TYR HBx 1.0 0.000 6.000 1338 1247 A 36 TYR HE1 A 36 TYR HBx 1.0 0.000 6.000 1339 1248 A 21 PHE HD2 A 8 CYS HBy 1.0 1.848 3.946 1340 1248 A 21 PHE HD1 A 8 CYS HBy 1.0 1.848 3.946 1341 1249 A 36 TYR HE2 A 36 TYR HBy 1.0 0.000 6.000 1342 1249 A 36 TYR HE1 A 36 TYR HBy 1.0 0.000 6.000 1343 1250 A 36 TYR HBx A 45 VAL H 1.0 1.912 4.408 1344 1251 A 36 TYR HBx A 47 ASN H 1.0 1.879 4.159 1345 1252 A 36 TYR HBy A 44 CYS HA 1.0 0.000 6.000 1346 1253 A 36 TYR HBy A 32 CYS HBy 1.0 1.709 3.239 1347 1254 A 36 TYR HBx A 32 CYS HBy 1.0 1.725 3.309 1348 1255 A 3 ASP HA A 3 ASP HBx 1.0 1.738 3.364 1349 1256 A 3 ASP HA A 3 ASP HBy 1.0 1.732 3.340 1350 1257 A 99 SER HBy A 3 ASP HBy 1.0 1.872 4.106 1351 1258 A 3 ASP HBy A 86 PRO HDx 1.0 1.836 3.876 1352 1259 A 3 ASP HBy A 3 ASP H 1.0 1.745 3.401 1353 1260 A 18 ALA HB% A 44 CYS HBy 1.0 1.670 3.080 1354 1261 A 53 ASP HBy A 53 ASP H 1.0 0.000 6.000 1355 1262 A 53 ASP HBy A 54 ILE H 1.0 1.870 4.096 1356 1263 A 53 ASP HBy A 54 ILE HG1y 1.0 1.863 4.041 1357 1264 A 20 CYS HBx A 14 ILE HG1y 1.0 1.862 4.038 1358 1265 A 53 ASP HBy A 54 ILE HG1x 1.0 1.938 4.652 1359 1266 A 24 ASP H A 24 ASP HBy 1.0 1.727 3.317 1360 1267 A 25 ASP H A 24 ASP HBx 1.0 1.857 4.005 1361 1268 A 55 ASN HD2y A 55 ASN HBy 1.0 1.600 2.820 1362 1269 A 55 ASN HBx A 55 ASN H 1.0 1.816 3.754 1363 1270 A 55 ASN HBx A 56 ASN H 1.0 1.935 4.627 1364 1271 A 58 GLY H A 55 ASN HBx 1.0 1.903 4.337 1365 1272 A 57 GLY H A 55 ASN HBx 1.0 0.000 6.000 1366 1273 A 55 ASN HD2y A 55 ASN HBx 1.0 1.694 3.178 1367 1274 A 56 ASN HD2y A 55 ASN HBx 1.0 0.000 6.000 1368 1275 A 58 GLY H A 55 ASN HBy 1.0 1.832 3.848 1369 1276 A 57 GLY H A 55 ASN HBy 1.0 1.905 4.349 1370 1277 A 56 ASN HD2y A 55 ASN HBy 1.0 0.000 6.000 1371 1278 A 55 ASN HBy A 55 ASN H 1.0 1.870 4.086 1372 1279 A 55 ASN HBy A 56 ASN H 1.0 1.953 4.823 1373 1280 A 55 ASN HA A 55 ASN HBy 1.0 1.649 2.999 1374 1281 A 58 GLY HA3 A 55 ASN HBx 1.0 1.907 4.369 1375 1281 A 58 GLY HA2 A 55 ASN HBx 1.0 1.907 4.369 1376 1282 A 58 GLY HA3 A 55 ASN HBy 1.0 1.855 3.987 1377 1282 A 58 GLY HA2 A 55 ASN HBy 1.0 1.855 3.987 1378 1283 A 55 ASN HBy A 54 ILE HG2% 1.0 1.672 3.086 1379 1284 A 87 ASN HA A 87 ASN HBx 1.0 1.694 3.180 1380 1285 A 4 PRO HA A 87 ASN HBx 1.0 0.000 6.000 1381 1286 A 87 ASN HBy A 87 ASN HA 1.0 1.741 3.381 1382 1287 A 87 ASN HBy A 88 ALA H 1.0 1.905 4.347 1383 1288 A 87 ASN HBy A 87 ASN HD2y 1.0 1.824 3.800 1384 1289 A 87 ASN HBy A 87 ASN HD2x 1.0 1.674 3.098 1385 1290 A 88 ALA H A 87 ASN HBx 1.0 1.855 3.989 1386 1291 A 87 ASN H A 87 ASN HBx 1.0 0.000 6.000 1387 1292 A 87 ASN HD2y A 87 ASN HBx 1.0 1.882 4.176 1388 1293 A 87 ASN HD2x A 87 ASN HBx 1.0 1.720 3.290 1389 1294 A 96 SER H A 87 ASN HBx 1.0 0.000 6.000 1390 1295 A 87 ASN HBy A 96 SER H 1.0 0.000 6.000 1391 1296 A 13 ASP H A 13 ASP HBy 1.0 1.731 3.333 1392 1297 A 13 ASP H A 13 ASP HBx 1.0 1.739 3.371 1393 1298 A 14 ILE H A 13 ASP HBx 1.0 0.000 6.000 1394 1299 A 14 ILE H A 13 ASP HBy 1.0 0.000 6.000 1395 1300 A 13 ASP HBy A 12 ARG HBy 1.0 1.954 4.836 1396 1301 A 13 ASP HA A 13 ASP HBx 1.0 0.000 6.000 1397 1302 A 50 PRO HDy A 49 ASN HBx 1.0 1.913 4.411 1398 1303 A 50 PRO HDx A 49 ASN HBx 1.0 0.000 6.000 1399 1304 A 49 ASN HBy A 50 PRO HDx 1.0 0.000 6.000 1400 1305 A 49 ASN H A 49 ASN HBx 1.0 1.707 3.231 1401 1306 A 49 ASN HBx A 49 ASN HD2y 1.0 0.000 6.000 1402 1307 A 49 ASN HBx A 49 ASN HD2x 1.0 1.838 3.882 1403 1308 A 49 ASN HBy A 49 ASN H 1.0 1.706 3.228 1404 1309 A 67 ASN HBy A 67 ASN HD2y 1.0 1.646 2.988 1405 1310 A 49 ASN HBy A 49 ASN HD2x 1.0 1.791 3.621 1406 1311 A 50 PRO HDy A 49 ASN HBy 1.0 0.000 6.000 1407 1312 A 51 THR HG2% A 49 ASN HBx 1.0 0.000 6.000 1408 1313 A 67 ASN HA A 67 ASN HBx 1.0 1.670 3.082 1409 1314 A 68 ALA H A 67 ASN HBx 1.0 1.772 3.528 1410 1315 A 67 ASN H A 67 ASN HBx 1.0 0.000 6.000 1411 1316 A 67 ASN HD2y A 67 ASN HBx 1.0 1.783 3.585 1412 1317 A 67 ASN HD2x A 67 ASN HBx 1.0 1.860 4.020 1413 1318 A 67 ASN HBy A 67 ASN H 1.0 0.000 6.000 1414 1319 A 67 ASN HBy A 67 ASN HD2x 1.0 1.846 3.936 1415 1320 A 51 THR HA A 67 ASN HBx 1.0 1.899 4.307 1416 1321 A 67 ASN HBy A 51 THR HA 1.0 1.883 4.179 1417 1322 A 77 ILE HD11 A 67 ASN HBx 1.0 1.942 4.698 1418 1323 A 73 ASN HBy A 73 ASN HA 1.0 1.687 3.147 1419 1324 A 48 ASN HA A 48 ASN HBx 1.0 1.603 2.833 1420 1325 A 48 ASN HA A 48 ASN HBy 1.0 0.000 6.000 1421 1326 A 73 ASN HBy A 73 ASN HD2y 1.0 1.752 3.430 1422 1327 A 73 ASN HBx A 73 ASN HD2y 1.0 1.767 3.507 1423 1328 A 73 ASN HBx A 48 ASN HD2y 1.0 1.674 3.096 1424 1329 A 48 ASN HD2x A 73 ASN HBx 1.0 1.766 3.498 1425 1330 A 73 ASN HBy A 76 LYS HEy 1.0 1.782 3.576 1426 1331 A 76 LYS HEy A 73 ASN HBx 1.0 1.683 3.135 1427 1332 A 76 LYS HDx A 73 ASN HBx 1.0 1.907 4.361 1428 1333 A 56 ASN HA A 65 CYS HBx 1.0 1.870 4.086 1429 1334 A 59 CYS HBy A 65 CYS HBx 1.0 1.763 3.487 1430 1335 A 56 ASN HA A 65 CYS HBy 1.0 1.864 4.046 1431 1336 A 66 GLN H A 65 CYS HBx 1.0 1.827 3.821 1432 1337 A 65 CYS H A 65 CYS HBx 1.0 1.694 3.178 1433 1338 A 56 ASN HD2y A 65 CYS HBx 1.0 1.934 4.610 1434 1339 A 65 CYS H A 65 CYS HBy 1.0 1.676 3.106 1435 1340 A 66 GLN H A 65 CYS HBy 1.0 1.855 3.993 1436 1341 A 53 ASP HBy A 54 ILE HD11 1.0 0.000 6.000 1437 1342 A 54 ILE HB A 54 ILE HD11 1.0 1.570 2.718 1438 1343 A 54 ILE HG1y A 54 ILE HD11 1.0 1.470 2.410 1439 1344 A 54 ILE HG1x A 54 ILE HD11 1.0 1.381 2.167 1440 1345 A 54 ILE H A 54 ILE HD11 1.0 1.820 3.780 1441 1346 A 78 ILE HD11 A 68 ALA HA 1.0 1.845 3.927 1442 1347 A 78 ILE HD11 A 76 LYS HA 1.0 1.958 4.886 1443 1348 A 78 ILE HD11 A 78 ILE HA 1.0 1.771 3.523 1444 1349 A 78 ILE HD11 A 79 CYS H 1.0 1.947 4.753 1445 1350 A 78 ILE HD11 A 66 GLN HBx 1.0 1.869 4.079 1446 1351 A 78 ILE HD11 A 76 LYS HBy 1.0 1.946 4.740 1447 1352 A 78 ILE HD11 A 66 GLN HGy 1.0 1.831 3.841 1448 1353 A 78 ILE HD11 A 66 GLN HGx 1.0 1.813 3.743 1449 1354 A 78 ILE HD11 A 78 ILE HB 1.0 1.579 2.751 1450 1355 A 78 ILE HD11 A 78 ILE HG1x 1.0 1.440 2.328 1451 1356 A 78 ILE HD11 A 77 ILE HD11 1.0 0.000 6.000 1452 1357 A 14 ILE HD1% A 14 ILE H 1.0 1.746 3.404 1453 1358 A 30 TRP HD1 A 14 ILE HD1% 1.0 1.946 4.744 1454 1359 A 14 ILE HD1% A 13 ASP HA 1.0 1.967 5.001 1455 1360 A 14 ILE HD1% A 19 GLY HA2 1.0 1.885 4.193 1456 1360 A 14 ILE HD1% A 19 GLY HA3 1.0 1.885 4.193 1457 1361 A 14 ILE HD1% A 11 THR HB 1.0 1.739 3.375 1458 1362 A 14 ILE HD1% A 14 ILE HA 1.0 0.000 6.000 1459 1363 A 14 ILE HD1% A 20 CYS HBy 1.0 1.617 2.881 1460 1364 A 20 CYS HBx A 14 ILE HD1% 1.0 1.647 2.993 1461 1365 A 14 ILE HD1% A 14 ILE HB 1.0 1.546 2.642 1462 1366 A 14 ILE HD1% A 14 ILE HG1y 1.0 1.457 2.373 1463 1367 A 14 ILE HD1% A 11 THR HG2% 1.0 1.584 2.768 1464 1368 A 14 ILE HD1% A 14 ILE HG1x 1.0 1.391 2.195 1465 1369 A 14 ILE HG2% A 14 ILE HD1% 1.0 0.000 6.000 1466 1370 A 55 ASN H A 54 ILE HG2% 1.0 1.741 3.377 1467 1371 A 57 GLY H A 54 ILE HG2% 1.0 1.944 4.714 1468 1372 A 54 ILE HG2% A 53 ASP HBy 1.0 0.000 6.000 1469 1373 A 55 ASN HBx A 54 ILE HG2% 1.0 1.609 2.855 1470 1374 A 54 ILE HB A 54 ILE HG2% 1.0 1.451 2.357 1471 1375 A 54 ILE HG2% A 54 ILE HG1y 1.0 0.000 6.000 1472 1376 A 51 THR HG2% A 54 ILE HG2% 1.0 0.000 6.000 1473 1377 A 54 ILE HG2% A 54 ILE HG1x 1.0 1.474 2.424 1474 1378 A 14 ILE HG2% A 14 ILE H 1.0 0.000 6.000 1475 1379 A 14 ILE HG2% A 19 GLY H 1.0 1.941 4.691 1476 1380 A 20 CYS H A 14 ILE HG2% 1.0 1.875 4.129 1477 1381 A 14 ILE HG2% A 18 ALA H 1.0 1.855 3.993 1478 1382 A 30 TRP HH2 A 14 ILE HG2% 1.0 0.000 6.000 1479 1383 A 14 ILE HG2% A 18 ALA HA 1.0 1.945 4.729 1480 1384 A 14 ILE HG2% A 11 THR HB 1.0 1.956 4.854 1481 1385 A 14 ILE HG2% A 30 TRP HBy 1.0 1.689 3.153 1482 1386 A 14 ILE HG2% A 15 PRO HDy 1.0 1.697 3.189 1483 1387 A 14 ILE HG2% A 15 PRO HBy 1.0 1.928 4.562 1484 1388 A 14 ILE HG2% A 14 ILE HB 1.0 1.485 2.457 1485 1389 A 14 ILE HG2% A 14 ILE HG1y 1.0 1.652 3.010 1486 1390 A 14 ILE HG2% A 18 ALA HB% 1.0 1.505 2.515 1487 1391 A 14 ILE HG2% A 15 PRO HBx 1.0 1.872 4.102 1488 1392 A 79 CYS H A 78 ILE HG2% 1.0 0.000 6.000 1489 1393 A 65 CYS HA A 78 ILE HG2% 1.0 1.961 4.929 1490 1394 A 77 ILE HA A 78 ILE HG2% 1.0 0.000 6.000 1491 1395 A 78 ILE HA A 78 ILE HG2% 1.0 1.554 2.668 1492 1396 A 79 CYS HBy A 78 ILE HG2% 1.0 1.965 4.979 1493 1397 A 66 GLN HBy A 78 ILE HG2% 1.0 1.876 4.136 1494 1398 A 78 ILE HG2% A 66 GLN HBx 1.0 0.000 6.000 1495 1399 A 78 ILE HG2% A 78 ILE HB 1.0 1.461 2.385 1496 1400 A 78 ILE HG2% A 78 ILE HG1y 1.0 1.616 2.876 1497 1401 A 78 ILE HG2% A 78 ILE HG1x 1.0 1.530 2.590 1498 1402 A 77 ILE HD11 A 78 ILE HG2% 1.0 0.000 6.000 1499 1403 A 66 GLN HGx A 78 ILE HG2% 1.0 1.809 3.717 1500 1404 A 43 THR HA A 45 VAL HGy% 1.0 0.000 6.000 1501 1405 A 44 CYS HA A 45 VAL HGy% 1.0 1.738 3.364 1502 1406 A 36 TYR HA A 45 VAL HGy% 1.0 1.949 4.769 1503 1407 A 45 VAL HGy% A 47 ASN HA 1.0 1.938 4.652 1504 1408 A 43 THR HB A 45 VAL HGy% 1.0 1.944 4.714 1505 1409 A 45 VAL HB A 45 VAL HGy% 1.0 1.458 2.376 1506 1410 A 45 VAL HGy% A 37 LYS HEx 1.0 1.683 3.135 1507 1411 A 45 VAL HGy% A 37 LYS HDx 1.0 1.817 3.765 1508 1412 A 45 VAL HGx% A 45 VAL HGy% 1.0 1.382 2.170 1509 1413 A 37 LYS H A 45 VAL HGy% 1.0 1.753 3.435 1510 1414 A 45 VAL H A 45 VAL HGy% 1.0 1.501 2.505 1511 1415 A 46 GLU H A 45 VAL HGy% 1.0 0.000 6.000 1512 1416 A 39 GLY H A 45 VAL HGy% 1.0 1.822 3.790 1513 1417 A 77 ILE HG2% A 65 CYS HBx 1.0 1.927 4.543 1514 1418 A 77 ILE HG2% A 50 PRO HGy 1.0 0.000 6.000 1515 1419 A 77 ILE HG2% A 77 ILE HB 1.0 1.514 2.544 1516 1420 A 77 ILE HG2% A 77 ILE HG1y 1.0 1.600 2.820 1517 1421 A 77 ILE HG2% A 77 ILE HG1x 1.0 0.000 6.000 1518 1422 A 77 ILE HG2% A 78 ILE HG2% 1.0 0.000 6.000 1519 1423 A 77 ILE HD11 A 77 ILE HG2% 1.0 1.494 2.482 1520 1424 A 77 ILE HG2% A 77 ILE HA 1.0 1.621 2.897 1521 1425 A 57 GLY HA2 A 77 ILE HG2% 1.0 1.680 3.118 1522 1425 A 57 GLY HA3 A 77 ILE HG2% 1.0 1.680 3.118 1523 1426 A 77 ILE HG2% A 79 CYS H 1.0 1.896 4.280 1524 1427 A 77 ILE HG2% A 77 ILE H 1.0 1.840 3.898 1525 1428 A 63 ALA HB% A 79 CYS HA 1.0 1.809 3.717 1526 1429 A 63 ALA HB% A 81 CYS H 1.0 1.889 4.229 1527 1430 A 63 ALA HB% A 62 THR H 1.0 1.848 3.946 1528 1431 A 63 ALA HB% A 60 ASP H 1.0 1.756 3.452 1529 1432 A 63 ALA HB% A 56 ASN HD2y 1.0 1.799 3.665 1530 1433 A 63 ALA HB% A 56 ASN HD2x 1.0 0.000 6.000 1531 1434 A 63 ALA HB% A 65 CYS HA 1.0 1.962 4.944 1532 1435 A 94 PHE HA A 63 ALA HB% 1.0 1.935 4.627 1533 1436 A 63 ALA HB% A 63 ALA HA 1.0 1.523 2.569 1534 1437 A 63 ALA HB% A 92 GLY HA2 1.0 1.875 4.125 1535 1437 A 92 GLY HA3 A 63 ALA HB% 1.0 1.875 4.125 1536 1438 A 63 ALA HB% A 79 CYS HBy 1.0 1.807 3.709 1537 1439 A 63 ALA HB% A 59 CYS HBy 1.0 1.676 3.102 1538 1440 A 63 ALA HB% A 59 CYS HBx 1.0 1.587 2.775 1539 1441 A 60 ASP HBy A 63 ALA HB% 1.0 1.643 2.979 1540 1442 A 60 ASP HBx A 63 ALA HB% 1.0 1.732 3.338 1541 1443 A 93 VAL HA A 63 ALA HB% 1.0 1.928 4.556 1542 1444 A 63 ALA HB% A 64 SER HBx 1.0 0.000 6.000 1543 1445 A 9 VAL HGy% A 9 VAL HA 1.0 0.000 6.000 1544 1446 A 9 VAL HGy% A 9 VAL H 1.0 1.590 2.788 1545 1447 A 9 VAL HGy% A 10 ASP H 1.0 0.000 6.000 1546 1448 A 9 VAL HGy% A 22 ARG HE 1.0 1.873 4.113 1547 1449 A 9 VAL HGy% A 10 ASP HA 1.0 1.870 4.094 1548 1450 A 9 VAL HGy% A 8 CYS HBx 1.0 1.955 4.841 1549 1451 A 9 VAL HGy% A 28 GLU HGy 1.0 1.924 4.510 1550 1452 A 9 VAL HGy% A 10 ASP HBx 1.0 0.000 6.000 1551 1453 A 9 VAL HGy% A 9 VAL HB 1.0 1.483 2.447 1552 1454 A 91 GLU HGy A 91 GLU HA 1.0 0.000 6.000 1553 1455 A 91 GLU HGy A 91 GLU H 1.0 1.776 3.546 1554 1456 A 91 GLU H A 91 GLU HGx 1.0 1.749 3.417 1555 1457 A 90 TYR HA A 91 GLU HGx 1.0 1.886 4.204 1556 1458 A 91 GLU HGy A 91 GLU HBy 1.0 1.567 2.711 1557 1459 A 91 GLU HBy A 91 GLU HGx 1.0 0.000 6.000 1558 1460 A 91 GLU HGy A 34 LEU HDx% 1.0 1.825 3.805 1559 1461 A 28 GLU HGy A 22 ARG HA 1.0 1.847 3.941 1560 1462 A 28 GLU HGy A 8 CYS HA 1.0 0.000 6.000 1561 1463 A 28 GLU HGx A 22 ARG HA 1.0 1.823 3.797 1562 1464 A 28 GLU HGx A 8 CYS HA 1.0 1.946 4.740 1563 1465 A 22 ARG HDy A 28 GLU HGx 1.0 1.932 4.590 1564 1466 A 22 ARG HDy A 28 GLU HGy 1.0 1.908 4.376 1565 1467 A 28 GLU HGy A 28 GLU H 1.0 1.806 3.702 1566 1468 A 28 GLU HGy A 28 GLU HBy 1.0 1.749 3.417 1567 1469 A 28 GLU HGy A 28 GLU HBx 1.0 1.741 3.381 1568 1470 A 28 GLU HGy A 22 ARG HGy 1.0 1.881 4.167 1569 1471 A 28 GLU HGy A 22 ARG HGx 1.0 1.822 3.792 1570 1472 A 28 GLU HGy A 22 ARG HBy 1.0 1.939 4.655 1571 1473 A 22 ARG HBx A 28 GLU HGy 1.0 1.866 4.064 1572 1474 A 28 GLU HGx A 22 ARG HGx 1.0 1.852 3.972 1573 1475 A 28 GLU HGx A 22 ARG HBy 1.0 1.894 4.270 1574 1476 A 22 ARG HBx A 28 GLU HGx 1.0 1.854 3.980 1575 1477 A 28 GLU HGx A 28 GLU HBy 1.0 1.776 3.544 1576 1478 A 28 GLU HGx A 28 GLU HBx 1.0 1.767 3.501 1577 1479 A 81 CYS H A 81 CYS HBx 1.0 1.707 3.229 1578 1480 A 85 THR H A 81 CYS HBx 1.0 0.000 6.000 1579 1481 A 81 CYS HA A 81 CYS HBx 1.0 1.712 3.254 1580 1482 A 88 ALA HA A 81 CYS HBx 1.0 1.964 4.964 1581 1483 A 88 ALA HB% A 81 CYS HBx 1.0 1.809 3.719 1582 1484 A 60 ASP H A 59 CYS HBy 1.0 1.844 3.922 1583 1485 A 32 CYS H A 32 CYS HBy 1.0 0.000 6.000 1584 1486 A 33 LEU H A 32 CYS HBy 1.0 1.794 3.636 1585 1487 A 37 LYS H A 32 CYS HBx 1.0 1.952 4.806 1586 1488 A 32 CYS HA A 32 CYS HBx 1.0 1.750 3.420 1587 1489 A 37 LYS HA A 32 CYS HBx 1.0 1.844 3.922 1588 1490 A 31 ARG HA A 32 CYS HBx 1.0 0.000 6.000 1589 1491 A 36 TYR HBy A 32 CYS HBx 1.0 1.792 3.630 1590 1492 A 36 TYR HD2 A 32 CYS HBy 1.0 1.963 4.949 1591 1492 A 36 TYR HD1 A 32 CYS HBy 1.0 1.963 4.949 1592 1493 A 52 CYS HBy A 52 CYS H 1.0 1.739 3.375 1593 1494 A 52 CYS HBx A 52 CYS H 1.0 1.709 3.239 1594 1495 A 52 CYS HBy A 67 ASN HD2y 1.0 1.951 4.797 1595 1496 A 52 CYS HBy A 67 ASN HD2x 1.0 1.940 4.680 1596 1497 A 59 CYS HBy A 56 ASN HD2x 1.0 1.834 3.860 1597 1498 A 59 CYS HBx A 56 ASN HD2x 1.0 0.000 6.000 1598 1499 A 53 ASP H A 52 CYS HBx 1.0 1.903 4.335 1599 1500 A 52 CYS HBy A 53 ASP H 1.0 1.893 4.255 1600 1501 A 52 CYS HBx A 67 ASN HD2x 1.0 1.950 4.784 1601 1502 A 59 CYS HA A 59 CYS HBy 1.0 1.719 3.281 1602 1503 A 37 LYS HBy A 38 LYS H 1.0 1.711 3.249 1603 1504 A 37 LYS HBx A 38 LYS H 1.0 1.786 3.600 1604 1505 A 37 LYS HBx A 47 ASN HD2x 1.0 1.946 4.736 1605 1506 A 37 LYS HBy A 47 ASN HD2y 1.0 1.939 4.665 1606 1507 A 37 LYS HA A 37 LYS HBx 1.0 1.682 3.128 1607 1508 A 37 LYS HA A 37 LYS HBy 1.0 1.663 3.053 1608 1509 A 37 LYS HBx A 37 LYS HEx 1.0 1.952 4.810 1609 1510 A 37 LYS HBx A 37 LYS HDx 1.0 1.773 3.531 1610 1511 A 30 TRP H A 29 GLU HGy 1.0 1.759 3.461 1611 1512 A 40 GLU H A 40 GLU HGx 1.0 1.704 3.220 1612 1513 A 69 GLU H A 69 GLU HGy 1.0 0.000 6.000 1613 1514 A 70 SER H A 69 GLU HGy 1.0 0.000 6.000 1614 1515 A 94 PHE HZ A 29 GLU HGy 1.0 1.901 4.321 1615 1516 A 31 ARG HE A 29 GLU HGy 1.0 1.936 4.638 1616 1517 A 29 GLU HA A 29 GLU HGy 1.0 1.761 3.475 1617 1518 A 29 GLU HGy A 29 GLU HGx 1.0 1.372 2.144 1618 1519 A 31 ARG HGx A 29 GLU HGy 1.0 1.858 4.010 1619 1520 A 31 ARG HGy A 29 GLU HGy 1.0 1.936 4.638 1620 1521 A 68 ALA HA A 69 GLU HGy 1.0 0.000 6.000 1621 1522 A 69 GLU HA A 69 GLU HGy 1.0 1.728 3.322 1622 1523 A 68 ALA HA A 69 GLU HGx 1.0 1.858 4.008 1623 1524 A 69 GLU HBy A 69 GLU HGy 1.0 1.527 2.581 1624 1525 A 75 LYS HGy A 72 GLU HGy 1.0 1.839 3.889 1625 1526 A 72 GLU HA A 72 GLU HGx 1.0 1.586 2.772 1626 1527 A 29 GLU HA A 29 GLU HGx 1.0 1.804 3.694 1627 1528 A 17 ASN HBx A 17 ASN H 1.0 1.875 4.129 1628 1529 A 17 ASN HBx A 18 ALA H 1.0 1.922 4.496 1629 1530 A 17 ASN HBx A 17 ASN HD2y 1.0 1.771 3.521 1630 1531 A 17 ASN HBx A 36 TYR HE2 1.0 1.881 4.167 1631 1531 A 17 ASN HBx A 36 TYR HE1 1.0 1.881 4.167 1632 1532 A 17 ASN HBx A 45 VAL HA 1.0 1.933 4.597 1633 1533 A 17 ASN HBx A 17 ASN HA 1.0 1.703 3.215 1634 1534 A 17 ASN HBx A 44 CYS HBy 1.0 1.808 3.714 1635 1535 A 17 ASN HBy A 17 ASN HA 1.0 1.864 4.054 1636 1536 A 17 ASN HBy A 17 ASN HD2x 1.0 1.885 4.199 1637 1537 A 17 ASN HBy A 17 ASN H 1.0 1.962 4.924 1638 1538 A 31 ARG HGy A 31 ARG HBx 1.0 1.836 3.868 1639 1539 A 31 ARG HGx A 31 ARG HBy 1.0 1.787 3.601 1640 1540 A 31 ARG HBx A 31 ARG HDy 1.0 1.851 3.967 1641 1541 A 32 CYS H A 31 ARG HBx 1.0 1.908 4.376 1642 1542 A 82 LYS HA A 82 LYS HBx 1.0 1.710 3.242 1643 1543 A 85 THR H A 82 LYS HBx 1.0 0.000 6.000 1644 1544 A 83 GLU H A 82 LYS HBx 1.0 1.756 3.446 1645 1545 A 85 THR H A 82 LYS HBy 1.0 0.000 6.000 1646 1546 A 83 GLU H A 82 LYS HBy 1.0 1.724 3.306 1647 1547 A 76 LYS H A 76 LYS HBy 1.0 1.830 3.834 1648 1548 A 50 PRO HDx A 76 LYS HBy 1.0 1.965 4.979 1649 1549 A 76 LYS HEy A 76 LYS HBy 1.0 1.924 4.510 1650 1550 A 50 PRO HDx A 76 LYS HBx 1.0 1.936 4.630 1651 1551 A 76 LYS HGx A 76 LYS HBx 1.0 1.696 3.186 1652 1552 A 77 ILE HG1x A 76 LYS HBx 1.0 1.901 4.321 1653 1553 A 76 LYS HDy A 76 LYS HBy 1.0 1.707 3.229 1654 1554 A 76 LYS HGx A 76 LYS HBy 1.0 1.700 3.202 1655 1555 A 77 ILE HG1x A 76 LYS HBy 1.0 1.882 4.170 1656 1556 A 77 ILE HD11 A 76 LYS HBy 1.0 1.954 4.836 1657 1557 A 9 VAL H A 9 VAL HB 1.0 1.808 3.710 1658 1558 A 10 ASP H A 9 VAL HB 1.0 0.000 6.000 1659 1559 A 9 VAL HA A 9 VAL HB 1.0 1.525 2.575 1660 1560 A 8 CYS HA A 9 VAL HB 1.0 0.000 6.000 1661 1561 A 22 ARG HDy A 9 VAL HB 1.0 1.954 4.832 1662 1562 A 83 GLU H A 83 GLU HGy 1.0 1.676 3.104 1663 1563 A 82 LYS HA A 83 GLU HGy 1.0 0.000 6.000 1664 1564 A 82 LYS HA A 83 GLU HGx 1.0 1.921 4.493 1665 1565 A 83 GLU HA A 83 GLU HGy 1.0 1.795 3.643 1666 1566 A 83 GLU HBy A 83 GLU HGy 1.0 1.627 2.917 1667 1567 A 83 GLU HGx A 83 GLU HBy 1.0 1.646 2.988 1668 1568 A 83 GLU HBx A 83 GLU HGy 1.0 1.622 2.900 1669 1569 A 83 GLU HGx A 83 GLU HBx 1.0 1.630 2.930 1670 1570 A 46 GLU H A 45 VAL HB 1.0 0.000 6.000 1671 1571 A 66 GLN HBy A 67 ASN H 1.0 1.855 3.993 1672 1572 A 67 ASN H A 66 GLN HBx 1.0 1.866 4.068 1673 1573 A 66 GLN HBx A 66 GLN HE2y 1.0 0.000 6.000 1674 1574 A 66 GLN HBy A 66 GLN HE2x 1.0 1.922 4.502 1675 1575 A 66 GLN HBx A 66 GLN HE2x 1.0 1.897 4.285 1676 1576 A 66 GLN HA A 66 GLN HBx 1.0 1.810 3.726 1677 1577 A 78 ILE HB A 66 GLN HBx 1.0 1.836 3.874 1678 1578 A 68 ALA HB% A 66 GLN HBx 1.0 0.000 6.000 1679 1579 A 78 ILE HD11 A 66 GLN HBy 1.0 1.854 3.980 1680 1580 A 66 GLN HGy A 66 GLN HBy 1.0 1.669 3.077 1681 1581 A 66 GLN HGy A 66 GLN HBx 1.0 1.637 2.957 1682 1582 A 66 GLN HGx A 66 GLN HBx 1.0 1.681 3.123 1683 1583 A 66 GLN HGx A 66 GLN HBy 1.0 1.691 3.163 1684 1584 A 66 GLN HGy A 66 GLN H 1.0 1.750 3.424 1685 1585 A 66 GLN HGy A 65 CYS HA 1.0 1.915 4.435 1686 1586 A 66 GLN HGy A 66 GLN HA 1.0 1.674 3.096 1687 1587 A 94 PHE HE2 A 93 VAL HB 1.0 1.894 4.270 1688 1587 A 94 PHE HE1 A 93 VAL HB 1.0 1.894 4.270 1689 1588 A 93 VAL HB A 90 TYR HBy 1.0 1.739 3.371 1690 1589 A 90 TYR HBx A 93 VAL HB 1.0 0.000 6.000 1691 1590 A 93 VAL HB A 31 ARG HBx 1.0 1.966 4.984 1692 1591 A 94 PHE HZ A 93 VAL HB 1.0 0.000 6.000 1693 1592 A 84 PRO HA A 84 PRO HBy 1.0 1.675 3.099 1694 1593 A 84 PRO HA A 84 PRO HBx 1.0 1.681 3.121 1695 1594 A 84 PRO HBx A 84 PRO HGy 1.0 1.639 2.963 1696 1595 A 84 PRO HBx A 84 PRO HGx 1.0 1.705 3.221 1697 1596 A 85 THR HG2% A 84 PRO HBx 1.0 1.949 4.773 1698 1597 A 84 PRO HDy A 84 PRO HBy 1.0 1.846 3.932 1699 1598 A 84 PRO HDx A 84 PRO HBy 1.0 1.808 3.714 1700 1599 A 84 PRO HGy A 84 PRO HBy 1.0 1.630 2.930 1701 1600 A 84 PRO HBy A 84 PRO HGx 1.0 1.667 3.067 1702 1601 A 61 PRO HDy A 61 PRO HBy 1.0 0.000 6.000 1703 1602 A 61 PRO HDx A 61 PRO HBy 1.0 1.837 3.885 1704 1603 A 61 PRO HBx A 61 PRO HBy 1.0 1.368 2.134 1705 1604 A 61 PRO HBy A 62 THR HG2% 1.0 0.000 6.000 1706 1605 A 34 LEU HDx% A 91 GLU HBx 1.0 1.744 3.396 1707 1606 A 91 GLU HBy A 91 GLU HBx 1.0 1.436 2.314 1708 1607 A 91 GLU H A 91 GLU HBy 1.0 1.887 4.215 1709 1608 A 91 GLU H A 91 GLU HBx 1.0 1.887 4.213 1710 1609 A 85 THR HG2% A 84 PRO HGy 1.0 1.864 4.048 1711 1610 A 84 PRO HGy A 84 PRO HGx 1.0 1.489 2.467 1712 1611 A 84 PRO HDy A 84 PRO HGx 1.0 1.704 3.220 1713 1612 A 84 PRO HGy A 84 PRO HDx 1.0 1.681 3.125 1714 1613 A 84 PRO HDx A 84 PRO HGx 1.0 1.735 3.355 1715 1614 A 84 PRO HA A 84 PRO HGx 1.0 1.933 4.601 1716 1615 A 84 PRO HA A 84 PRO HGy 1.0 1.897 4.287 1717 1616 A 77 ILE HG1y A 77 ILE HG1x 1.0 1.562 2.694 1718 1617 A 77 ILE HA A 77 ILE HG1y 1.0 1.916 4.442 1719 1618 A 77 ILE HA A 77 ILE HG1x 1.0 1.890 4.234 1720 1619 A 77 ILE HG1y A 77 ILE H 1.0 1.941 4.683 1721 1620 A 4 PRO HGy A 4 PRO HGx 1.0 1.524 2.574 1722 1621 A 4 PRO HGy A 4 PRO HBx 1.0 1.675 3.103 1723 1622 A 4 PRO HGy A 4 PRO HDy 1.0 1.740 3.378 1724 1623 A 4 PRO HGx A 4 PRO HDy 1.0 1.793 3.631 1725 1624 A 4 PRO HGx A 87 ASN HA 1.0 1.927 4.547 1726 1625 A 14 ILE HG1x A 14 ILE HG1y 1.0 1.455 2.369 1727 1626 A 14 ILE HG1x A 14 ILE HA 1.0 1.807 3.707 1728 1627 A 11 THR HB A 14 ILE HG1y 1.0 1.916 4.442 1729 1628 A 30 TRP HBx A 14 ILE HG1y 1.0 1.890 4.232 1730 1629 A 12 ARG HBy A 12 ARG HBx 1.0 1.322 2.020 1731 1630 A 12 ARG HBy A 11 THR HA 1.0 0.000 6.000 1732 1631 A 12 ARG HBy A 12 ARG H 1.0 1.774 3.538 1733 1632 A 12 ARG HBx A 13 ASP HBx 1.0 1.948 4.764 1734 1633 A 14 ILE HG1x A 11 THR HG2% 1.0 1.727 3.315 1735 1634 A 37 LYS HDx A 37 LYS HEy 1.0 1.731 3.335 1736 1635 A 37 LYS H A 37 LYS HDx 1.0 1.928 4.562 1737 1636 A 38 LYS H A 37 LYS HDx 1.0 0.000 6.000 1738 1637 A 47 ASN HD2y A 37 LYS HDx 1.0 1.948 4.756 1739 1638 A 47 ASN HD2x A 37 LYS HDx 1.0 1.946 4.736 1740 1639 A 37 LYS HA A 37 LYS HDx 1.0 0.000 6.000 1741 1640 A 37 LYS HDx A 47 ASN HA 1.0 1.904 4.344 1742 1641 A 47 ASN HBy A 37 LYS HDx 1.0 1.889 4.229 1743 1642 A 37 LYS HA A 37 LYS HDy 1.0 0.000 6.000 1744 1643 A 37 LYS HEx A 37 LYS HDy 1.0 1.729 3.325 1745 1644 A 47 ASN HBy A 37 LYS HDy 1.0 0.000 6.000 1746 1645 A 37 LYS HGy A 37 LYS HDx 1.0 1.596 2.806 1747 1646 A 45 VAL HGy% A 37 LYS HDy 1.0 1.893 4.257 1748 1647 A 37 LYS HBy A 37 LYS HDy 1.0 1.695 3.183 1749 1648 A 37 LYS HBy A 37 LYS HDx 1.0 1.712 3.256 1750 1649 A 47 ASN HD2y A 37 LYS HDy 1.0 1.968 5.016 1751 1650 A 46 GLU H A 46 GLU HBx 1.0 0.000 6.000 1752 1651 A 47 ASN H A 46 GLU HBy 1.0 0.000 6.000 1753 1652 A 47 ASN H A 46 GLU HBx 1.0 1.811 3.727 1754 1653 A 48 ASN HD2x A 46 GLU HBx 1.0 1.962 4.924 1755 1654 A 36 TYR HE2 A 46 GLU HBx 1.0 1.928 4.552 1756 1654 A 36 TYR HE1 A 46 GLU HBx 1.0 1.928 4.552 1757 1655 A 36 TYR HE2 A 46 GLU HBy 1.0 0.000 6.000 1758 1655 A 36 TYR HE1 A 46 GLU HBy 1.0 0.000 6.000 1759 1656 A 45 VAL HA A 46 GLU HBx 1.0 0.000 6.000 1760 1657 A 73 ASN HBx A 46 GLU HBx 1.0 1.962 4.938 1761 1658 A 46 GLU HBx A 46 GLU HGx 1.0 1.585 2.769 1762 1659 A 46 GLU HBy A 46 GLU HBx 1.0 1.288 1.938 1763 1660 A 72 GLU HBy A 74 SER H 1.0 0.000 6.000 1764 1661 A 86 PRO HA A 86 PRO HBy 1.0 0.000 6.000 1765 1662 A 86 PRO HDy A 86 PRO HBy 1.0 1.799 3.663 1766 1663 A 86 PRO HDx A 86 PRO HBy 1.0 1.817 3.765 1767 1664 A 5 LYS H A 86 PRO HBy 1.0 0.000 6.000 1768 1665 A 50 PRO HBy A 35 GLY HA3 1.0 1.770 3.518 1769 1666 A 86 PRO HDx A 86 PRO HBx 1.0 0.000 6.000 1770 1667 A 50 PRO HBy A 35 GLY H 1.0 1.789 3.611 1771 1668 A 4 PRO HGx A 4 PRO HBx 1.0 1.664 3.056 1772 1669 A 4 PRO HBx A 87 ASN HA 1.0 1.914 4.424 1773 1670 A 6 HIS HE1 A 4 PRO HBx 1.0 1.926 4.534 1774 1671 A 4 PRO HDy A 4 PRO HBy 1.0 1.885 4.191 1775 1672 A 4 PRO HDx A 4 PRO HBy 1.0 1.832 3.852 1776 1673 A 4 PRO HGx A 4 PRO HBy 1.0 1.624 2.910 1777 1674 A 5 LYS H A 5 LYS HBy 1.0 1.762 3.480 1778 1675 A 6 HIS H A 5 LYS HBy 1.0 0.000 6.000 1779 1676 A 6 HIS H A 5 LYS HBx 1.0 1.931 4.581 1780 1677 A 5 LYS HA A 5 LYS HBx 1.0 1.751 3.427 1781 1678 A 5 LYS HA A 5 LYS HBy 1.0 1.677 3.109 1782 1679 A 17 ASN H A 16 LYS HBy 1.0 1.855 3.991 1783 1680 A 17 ASN H A 16 LYS HBx 1.0 1.843 3.917 1784 1681 A 16 LYS HBx A 16 LYS H 1.0 1.652 3.012 1785 1682 A 17 ASN HD2x A 16 LYS HBy 1.0 1.962 4.944 1786 1683 A 16 LYS HA A 16 LYS HBx 1.0 1.643 2.975 1787 1684 A 15 PRO HBy A 44 CYS H 1.0 1.863 4.041 1788 1685 A 50 PRO HBx A 47 ASN HD2y 1.0 1.930 4.572 1789 1686 A 50 PRO HBx A 47 ASN HD2x 1.0 1.942 4.698 1790 1687 A 50 PRO HBx A 50 PRO HA 1.0 1.681 3.123 1791 1688 A 50 PRO HDy A 50 PRO HBx 1.0 1.825 3.807 1792 1689 A 50 PRO HBx A 50 PRO HDx 1.0 1.858 4.014 1793 1690 A 77 ILE HG2% A 50 PRO HBx 1.0 1.876 4.136 1794 1691 A 50 PRO HBy A 77 ILE HG1x 1.0 1.845 3.931 1795 1692 A 50 PRO HBx A 77 ILE HG1x 1.0 1.746 3.404 1796 1693 A 50 PRO HBx A 77 ILE HG1y 1.0 1.671 3.081 1797 1694 A 77 ILE HG2% A 50 PRO HBy 1.0 0.000 6.000 1798 1695 A 50 PRO HGy A 50 PRO HBx 1.0 1.637 2.955 1799 1696 A 15 PRO HBy A 15 PRO HGy 1.0 1.692 3.168 1800 1697 A 15 PRO HGx A 15 PRO HBy 1.0 1.762 3.478 1801 1698 A 18 ALA HB% A 15 PRO HBy 1.0 1.761 3.473 1802 1699 A 15 PRO HDx A 15 PRO HBy 1.0 1.802 3.686 1803 1700 A 28 GLU HBy A 10 ASP HBx 1.0 1.845 3.923 1804 1701 A 15 PRO HBy A 16 LYS H 1.0 1.749 3.419 1805 1702 A 15 PRO HGx A 15 PRO HBx 1.0 1.757 3.453 1806 1703 A 15 PRO HDx A 15 PRO HBx 1.0 1.782 3.576 1807 1704 A 43 THR HA A 15 PRO HBx 1.0 1.818 3.764 1808 1705 A 18 ALA H A 15 PRO HBx 1.0 1.957 4.863 1809 1706 A 15 PRO HBx A 16 LYS H 1.0 1.814 3.746 1810 1707 A 15 PRO HBx A 44 CYS H 1.0 1.927 4.547 1811 1708 A 14 ILE HA A 15 PRO HBx 1.0 0.000 6.000 1812 1709 A 14 ILE HA A 15 PRO HBy 1.0 0.000 6.000 1813 1710 A 22 ARG HBx A 22 ARG HGx 1.0 1.861 4.031 1814 1711 A 22 ARG HA A 22 ARG HBy 1.0 1.916 4.448 1815 1712 A 22 ARG HBx A 22 ARG HA 1.0 1.870 4.096 1816 1713 A 14 ILE HA A 15 PRO HGy 1.0 1.901 4.319 1817 1714 A 33 LEU HBy A 33 LEU HDy% 1.0 0.000 6.000 1818 1715 A 33 LEU HBx A 33 LEU HDy% 1.0 0.000 6.000 1819 1716 A 33 LEU HDy% A 33 LEU HG 1.0 1.516 2.548 1820 1717 A 33 LEU HDy% A 31 ARG HBx 1.0 0.000 6.000 1821 1718 A 33 LEU HDy% A 17 ASN HA 1.0 0.000 6.000 1822 1719 A 90 TYR HBy A 33 LEU HDy% 1.0 1.922 4.502 1823 1720 A 91 GLU HGy A 33 LEU HDy% 1.0 1.879 4.153 1824 1721 A 33 LEU HDy% A 34 LEU H 1.0 1.839 3.891 1825 1722 A 34 LEU HDx% A 91 GLU HBy 1.0 1.643 2.975 1826 1723 A 34 LEU HBx A 34 LEU HDx% 1.0 1.618 2.886 1827 1724 A 93 VAL HGx% A 34 LEU HDx% 1.0 0.000 6.000 1828 1725 A 92 GLY HA3 A 34 LEU HDx% 1.0 1.952 4.806 1829 1725 A 92 GLY HA2 A 34 LEU HDx% 1.0 1.952 4.806 1830 1726 A 34 LEU HDx% A 79 CYS HBy 1.0 1.928 4.552 1831 1727 A 34 LEU HDx% A 79 CYS HBx 1.0 1.949 4.773 1832 1728 A 34 LEU HDx% A 77 ILE HA 1.0 0.000 6.000 1833 1729 A 34 LEU HDx% A 35 GLY H 1.0 0.000 6.000 1834 1730 A 34 LEU HDx% A 79 CYS H 1.0 1.920 4.484 1835 1731 A 78 ILE HG1x A 78 ILE HG1y 1.0 1.397 2.209 1836 1732 A 66 GLN HGx A 78 ILE HG1x 1.0 1.945 4.729 1837 1733 A 78 ILE H A 78 ILE HG1x 1.0 1.835 3.865 1838 1734 A 54 ILE HG1y A 54 ILE HG1x 1.0 1.424 2.284 1839 1735 A 51 THR HG2% A 54 ILE HG1x 1.0 1.773 3.533 1840 1736 A 53 ASP HBx A 54 ILE HG1x 1.0 0.000 6.000 1841 1737 A 37 LYS HGy A 47 ASN HA 1.0 1.914 4.430 1842 1738 A 93 VAL HGx% A 34 LEU HDy% 1.0 1.608 2.850 1843 1739 A 93 VAL HGx% A 31 ARG HBx 1.0 1.589 2.785 1844 1740 A 93 VAL HGx% A 31 ARG HGx 1.0 1.779 3.563 1845 1741 A 93 VAL HGx% A 31 ARG HBy 1.0 1.674 3.094 1846 1742 A 93 VAL HGx% A 31 ARG HGy 1.0 1.868 4.076 1847 1743 A 93 VAL HB A 93 VAL HGx% 1.0 1.606 2.842 1848 1744 A 93 VAL HGx% A 31 ARG HA 1.0 1.896 4.276 1849 1745 A 93 VAL HGx% A 33 LEU HA 1.0 1.789 3.615 1850 1746 A 94 PHE HD2 A 93 VAL HGx% 1.0 1.921 4.487 1851 1746 A 94 PHE HD1 A 93 VAL HGx% 1.0 1.921 4.487 1852 1747 A 94 PHE HE2 A 93 VAL HGx% 1.0 1.793 3.633 1853 1747 A 94 PHE HE1 A 93 VAL HGx% 1.0 1.793 3.633 1854 1748 A 7 VAL HGx% A 5 LYS HBx 1.0 1.847 3.941 1855 1749 A 7 VAL HGx% A 5 LYS HBy 1.0 1.941 4.683 1856 1750 A 7 VAL HB A 7 VAL HGx% 1.0 1.501 2.503 1857 1751 A 7 VAL H A 7 VAL HGx% 1.0 1.658 3.036 1858 1752 A 6 HIS H A 7 VAL HGx% 1.0 1.916 4.446 1859 1753 A 5 LYS H A 7 VAL HGx% 1.0 0.000 6.000 1860 1754 A 8 CYS H A 7 VAL HGx% 1.0 1.819 3.769 1861 1755 A 77 ILE HD11 A 50 PRO HGx 1.0 1.933 4.597 1862 1756 A 50 PRO HGy A 77 ILE HG1x 1.0 1.914 4.424 1863 1757 A 77 ILE HG1x A 50 PRO HGx 1.0 1.907 4.369 1864 1758 A 50 PRO HGy A 76 LYS HGx 1.0 1.922 4.498 1865 1759 A 50 PRO HGx A 76 LYS HGx 1.0 0.000 6.000 1866 1760 A 50 PRO HGy A 50 PRO HBy 1.0 0.000 6.000 1867 1761 A 50 PRO HGy A 50 PRO HGx 1.0 1.440 2.328 1868 1762 A 76 LYS HEy A 50 PRO HGx 1.0 1.882 4.176 1869 1763 A 50 PRO HDx A 50 PRO HGx 1.0 1.697 3.189 1870 1764 A 50 PRO HGx A 50 PRO HA 1.0 1.828 3.824 1871 1765 A 49 ASN HA A 50 PRO HGy 1.0 0.000 6.000 1872 1766 A 49 ASN HA A 50 PRO HGx 1.0 0.000 6.000 1873 1767 A 50 PRO HGx A 47 ASN HD2y 1.0 1.949 4.769 1874 1768 A 50 PRO HGx A 49 ASN H 1.0 1.956 4.854 1875 1769 A 50 PRO HGx A 47 ASN HD2x 1.0 0.000 6.000 1876 1770 A 50 PRO HGy A 76 LYS HEy 1.0 1.947 4.753 1877 1771 A 54 ILE HB A 51 THR HG2% 1.0 0.000 6.000 1878 1772 A 51 THR HG2% A 54 ILE HD11 1.0 1.516 2.550 1879 1773 A 51 THR HG2% A 53 ASP HBy 1.0 1.753 3.437 1880 1774 A 51 THR HG2% A 53 ASP HBx 1.0 1.705 3.223 1881 1775 A 51 THR HG2% A 51 THR HA 1.0 1.730 3.330 1882 1776 A 51 THR HG2% A 53 ASP HA 1.0 0.000 6.000 1883 1777 A 51 THR HG2% A 51 THR HB 1.0 1.478 2.434 1884 1778 A 51 THR HG2% A 49 ASN HD2x 1.0 0.000 6.000 1885 1779 A 51 THR HG2% A 54 ILE H 1.0 1.583 2.763 1886 1780 A 51 THR HG2% A 51 THR H 1.0 1.609 2.853 1887 1781 A 51 THR HG2% A 53 ASP H 1.0 0.000 6.000 1888 1782 A 51 THR HG2% A 52 CYS H 1.0 1.876 4.132 1889 1783 A 45 VAL HGx% A 43 THR HG2% 1.0 0.000 6.000 1890 1784 A 15 PRO HBy A 43 THR HG2% 1.0 1.836 3.870 1891 1785 A 43 THR HB A 43 THR HG2% 1.0 1.455 2.369 1892 1786 A 42 ASN HA A 43 THR HG2% 1.0 1.912 4.414 1893 1787 A 43 THR H A 43 THR HG2% 1.0 1.732 3.342 1894 1788 A 39 GLY H A 43 THR HG2% 1.0 1.939 4.655 1895 1789 A 43 THR HG2% A 40 GLU H 1.0 1.945 4.729 1896 1790 A 44 CYS H A 43 THR HG2% 1.0 1.734 3.352 1897 1791 A 42 ASN H A 43 THR HG2% 1.0 1.903 4.333 1898 1792 A 15 PRO HGx A 18 ALA HB% 1.0 1.786 3.598 1899 1793 A 18 ALA HB% A 15 PRO HBx 1.0 1.576 2.742 1900 1794 A 18 ALA HB% A 44 CYS HBx 1.0 1.729 3.325 1901 1795 A 18 ALA HB% A 15 PRO HDy 1.0 1.750 3.420 1902 1796 A 18 ALA HB% A 14 ILE HA 1.0 0.000 6.000 1903 1797 A 30 TRP HBy A 18 ALA HB% 1.0 1.693 3.171 1904 1798 A 18 ALA HB% A 17 ASN HA 1.0 1.952 4.810 1905 1799 A 18 ALA HB% A 18 ALA H 1.0 1.570 2.718 1906 1800 A 18 ALA HB% A 20 CYS HA 1.0 0.000 6.000 1907 1801 A 30 TRP HA A 18 ALA HB% 1.0 0.000 6.000 1908 1802 A 18 ALA HB% A 33 LEU H 1.0 0.000 6.000 1909 1803 A 18 ALA HB% A 19 GLY H 1.0 1.583 2.763 1910 1804 A 75 LYS HBy A 75 LYS HGx 1.0 1.711 3.249 1911 1805 A 75 LYS HA A 75 LYS HGx 1.0 1.740 3.378 1912 1806 A 93 VAL HGx% A 93 VAL HGy% 1.0 1.447 2.347 1913 1807 A 93 VAL HGy% A 34 LEU HDx% 1.0 1.639 2.961 1914 1808 A 93 VAL HB A 93 VAL HGy% 1.0 1.537 2.613 1915 1809 A 93 VAL HGy% A 34 LEU HG 1.0 1.506 2.520 1916 1810 A 93 VAL HGy% A 91 GLU HBy 1.0 1.882 4.176 1917 1811 A 90 TYR HBy A 93 VAL HGy% 1.0 1.749 3.417 1918 1812 A 90 TYR HBx A 93 VAL HGy% 1.0 1.763 3.487 1919 1813 A 93 VAL HGy% A 93 VAL HA 1.0 1.572 2.726 1920 1814 A 93 VAL HGy% A 33 LEU HA 1.0 1.556 2.674 1921 1815 A 93 VAL H A 93 VAL HGy% 1.0 1.542 2.628 1922 1816 A 93 VAL HGy% A 34 LEU H 1.0 1.627 2.919 1923 1817 A 16 LYS HA A 16 LYS HGy 1.0 1.773 3.535 1924 1818 A 17 ASN HD2x A 16 LYS HGy 1.0 1.957 4.877 1925 1819 A 17 ASN H A 16 LYS HGy 1.0 1.885 4.197 1926 1820 A 75 LYS HBy A 75 LYS HGy 1.0 1.702 3.210 1927 1821 A 75 LYS HGy A 75 LYS HBx 1.0 1.651 3.009 1928 1822 A 45 VAL HB A 45 VAL HGx% 1.0 1.443 2.335 1929 1823 A 45 VAL HGx% A 37 LYS HEx 1.0 1.919 4.467 1930 1824 A 43 THR HB A 45 VAL HGx% 1.0 1.713 3.255 1931 1825 A 45 VAL HA A 45 VAL HGx% 1.0 1.560 2.688 1932 1826 A 43 THR HA A 45 VAL HGx% 1.0 0.000 6.000 1933 1827 A 44 CYS HA A 45 VAL HGx% 1.0 1.834 3.860 1934 1828 A 45 VAL H A 45 VAL HGx% 1.0 1.683 3.131 1935 1829 A 46 GLU H A 45 VAL HGx% 1.0 0.000 6.000 1936 1830 A 45 VAL HGx% A 44 CYS H 1.0 1.916 4.446 1937 1831 A 45 VAL HGx% A 39 GLY H 1.0 1.841 3.901 1938 1832 A 45 VAL HGx% A 40 GLU H 1.0 1.868 4.076 1939 1833 A 85 THR HG2% A 62 THR HG2% 1.0 0.000 6.000 1940 1834 A 85 THR HG2% A 84 PRO HGx 1.0 1.724 3.306 1941 1835 A 85 THR HG2% A 84 PRO HBy 1.0 1.899 4.305 1942 1836 A 85 THR HG2% A 4 PRO HDx 1.0 1.926 4.540 1943 1837 A 85 THR HG2% A 95 CYS HBy 1.0 1.844 3.922 1944 1838 A 85 THR HG2% A 85 THR HB 1.0 1.544 2.634 1945 1839 A 85 THR HG2% A 97 SER HBx 1.0 1.716 3.270 1946 1840 A 85 THR HG2% A 96 SER HA 1.0 0.000 6.000 1947 1841 A 85 THR HG2% A 3 ASP HA 1.0 0.000 6.000 1948 1842 A 85 THR HG2% A 97 SER HA 1.0 1.774 3.538 1949 1843 A 85 THR HG2% A 96 SER H 1.0 1.928 4.556 1950 1844 A 85 THR HG2% A 97 SER H 1.0 1.783 3.583 1951 1845 A 85 THR HG2% A 85 THR H 1.0 1.777 3.551 1952 1846 A 3 ASP H A 2 VAL HGx% 1.0 1.801 3.679 1953 1847 A 2 VAL H A 2 VAL HGx% 1.0 1.778 3.554 1954 1848 A 87 ASN HD2x A 2 VAL HGx% 1.0 0.000 6.000 1955 1849 A 2 VAL HA A 2 VAL HGx% 1.0 0.000 6.000 1956 1850 A 2 VAL HGx% A 98 SER HBy 1.0 0.000 6.000 1957 1851 A 2 VAL HB A 2 VAL HGx% 1.0 1.527 2.585 1958 1852 A 4 PRO HGx A 2 VAL HGx% 1.0 0.000 6.000 1959 1853 A 24 ASP HBy A 2 VAL HGx% 1.0 1.822 3.792 1960 1854 A 7 VAL H A 7 VAL HGy% 1.0 1.794 3.634 1961 1855 A 99 SER HA A 2 VAL HGy% 1.0 1.790 3.620 1962 1856 A 7 VAL HA A 7 VAL HGy% 1.0 0.000 6.000 1963 1857 A 3 ASP H A 2 VAL HGy% 1.0 1.807 3.707 1964 1858 A 2 VAL H A 2 VAL HGy% 1.0 0.000 6.000 1965 1859 A 87 ASN HD2x A 2 VAL HGy% 1.0 0.000 6.000 1966 1860 A 3 ASP HBy A 2 VAL HGy% 1.0 1.885 4.199 1967 1861 A 2 VAL HB A 2 VAL HGy% 1.0 1.538 2.618 1968 1862 A 9 VAL HGx% A 7 VAL HGy% 1.0 0.000 6.000 1969 1863 A 22 ARG HGy A 9 VAL HGx% 1.0 0.000 6.000 1970 1864 A 9 VAL HGx% A 9 VAL HB 1.0 1.487 2.461 1971 1865 A 8 CYS HA A 9 VAL HGx% 1.0 1.888 4.222 1972 1866 A 10 ASP H A 9 VAL HGx% 1.0 1.887 4.209 1973 1867 A 9 VAL H A 9 VAL HGx% 1.0 1.840 3.898 1974 1868 A 90 TYR HBx A 33 LEU HDx% 1.0 0.000 6.000 1975 1869 A 33 LEU HG A 33 LEU HDx% 1.0 1.557 2.677 1976 1870 A 34 LEU HDy% A 34 LEU HDx% 1.0 1.445 2.339 1977 1871 A 93 VAL HGy% A 34 LEU HDy% 1.0 1.518 2.554 1978 1872 A 34 LEU HDy% A 34 LEU HBx 1.0 0.000 6.000 1979 1873 A 33 LEU HBx A 33 LEU HDx% 1.0 1.683 3.133 1980 1874 A 34 LEU HDy% A 34 LEU HG 1.0 1.486 2.456 1981 1875 A 91 GLU HGy A 33 LEU HDx% 1.0 1.686 3.142 1982 1876 A 34 LEU HDy% A 59 CYS HBy 1.0 1.939 4.669 1983 1877 A 90 TYR HBy A 33 LEU HDx% 1.0 0.000 6.000 1984 1878 A 34 LEU HDy% A 34 LEU HA 1.0 1.509 2.527 1985 1879 A 33 LEU HA A 33 LEU HDx% 1.0 0.000 6.000 1986 1880 A 18 ALA HA A 33 LEU HDx% 1.0 0.000 6.000 1987 1881 A 32 CYS HA A 33 LEU HDx% 1.0 0.000 6.000 1988 1882 A 34 LEU HDy% A 56 ASN HD2y 1.0 0.000 6.000 1989 1883 A 94 PHE HD1 A 34 LEU HDy% 1.0 0.000 6.000 1990 1883 A 94 PHE HD2 A 34 LEU HDy% 1.0 0.000 6.000 1991 1884 A 18 ALA H A 33 LEU HDx% 1.0 0.000 6.000 1992 1885 A 19 GLY H A 33 LEU HDx% 1.0 0.000 6.000 1993 1886 A 34 LEU HDy% A 35 GLY H 1.0 1.776 3.548 1994 1887 A 33 LEU H A 33 LEU HDx% 1.0 0.000 6.000 1995 1888 A 68 ALA HB% A 78 ILE HG1x 1.0 0.000 6.000 1996 1889 A 78 ILE HD11 A 68 ALA HB% 1.0 1.544 2.638 1997 1890 A 66 GLN HBy A 68 ALA HB% 1.0 1.942 4.702 1998 1891 A 68 ALA HB% A 67 ASN HBy 1.0 0.000 6.000 1999 1892 A 68 ALA HB% A 67 ASN HBx 1.0 0.000 6.000 2000 1893 A 68 ALA HB% A 76 LYS HGx 1.0 0.000 6.000 2001 1894 A 68 ALA HB% A 70 SER HBx 1.0 0.000 6.000 2002 1895 A 68 ALA HB% A 70 SER HBy 1.0 1.924 4.510 2003 1896 A 68 ALA HB% A 68 ALA HA 1.0 1.443 2.337 2004 1897 A 68 ALA HB% A 77 ILE HA 1.0 1.848 3.946 2005 1898 A 67 ASN HA A 68 ALA HB% 1.0 1.813 3.739 2006 1899 A 68 ALA HB% A 77 ILE H 1.0 1.951 4.801 2007 1900 A 68 ALA HB% A 69 GLU H 1.0 1.577 2.745 2008 1901 A 68 ALA HB% A 68 ALA H 1.0 1.572 2.728 2009 1902 A 23 ASP HBy A 27 THR HG2% 1.0 1.881 4.165 2010 1902 A 27 THR HG2% A 23 ASP HBx 1.0 1.881 4.165 2011 1903 A 27 THR HG2% A 25 ASP HBy 1.0 1.931 4.587 2012 1904 A 27 THR HG2% A 27 THR HA 1.0 1.527 2.581 2013 1905 A 13 ASP H A 11 THR HG2% 1.0 0.000 6.000 2014 1906 A 27 THR HG2% A 28 GLU H 1.0 1.654 3.022 2015 1907 A 62 THR H A 62 THR HG2% 1.0 1.629 2.925 2016 1908 A 80 THR HG2% A 81 CYS H 1.0 1.659 3.039 2017 1909 A 80 THR HA A 80 THR HG2% 1.0 1.534 2.604 2018 1910 A 80 THR HB A 80 THR HG2% 1.0 1.478 2.436 2019 1911 A 11 THR HG2% A 12 ARG HE 1.0 0.000 6.000 2020 1912 A 30 TRP HD1 A 11 THR HG2% 1.0 1.722 3.296 2021 1913 A 56 ASN HD2y A 62 THR HG2% 1.0 0.000 6.000 2022 1914 A 89 TYR H A 88 ALA HB% 1.0 1.703 3.215 2023 1915 A 88 ALA HB% A 88 ALA H 1.0 1.562 2.692 2024 1916 A 92 GLY H A 88 ALA HB% 1.0 1.675 3.103 2025 1917 A 90 TYR HBy A 88 ALA HB% 1.0 0.000 6.000 2026 1918 A 61 PRO HBx A 62 THR HG2% 1.0 1.754 3.438 2027 1919 A 34 LEU HG A 34 LEU HDx% 1.0 1.658 3.036 2028 1920 A 93 VAL HGx% A 34 LEU HG 1.0 1.949 4.781 2029 1921 A 34 LEU HG A 33 LEU HA 1.0 1.930 4.574 2030 1922 A 34 LEU HG A 34 LEU HA 1.0 1.875 4.125 2031 1923 A 34 LEU HG A 91 GLU HBy 1.0 1.946 4.736 2032 1924 A 76 LYS HGx A 70 SER HBx 1.0 1.899 4.303 2033 1925 A 76 LYS HEy A 76 LYS HGx 1.0 1.838 3.890 2034 1926 A 76 LYS HEy A 76 LYS HGy 1.0 1.855 3.987 2035 1927 A 70 SER HBx A 76 LYS HGy 1.0 1.833 3.855 2036 1928 A 76 LYS HA A 76 LYS HGy 1.0 1.810 3.722 2037 1929 A 73 ASN HA A 76 LYS HGy 1.0 1.834 3.858 2038 1930 A 76 LYS HGx A 76 LYS H 1.0 1.901 4.323 2039 1931 A 76 LYS HBy A 76 LYS HGy 1.0 1.785 3.595 2040 1932 A 76 LYS HGx A 76 LYS HGy 1.0 1.611 2.859 2041 1933 A 78 ILE H A 78 ILE HG1y 1.0 0.000 6.000 2042 1934 A 77 ILE HA A 78 ILE HG1y 1.0 0.000 6.000 2043 1935 A 78 ILE HB A 78 ILE HG1y 1.0 1.600 2.822 2044 1936 A 53 ASP HBx A 54 ILE HG1y 1.0 1.897 4.283 2045 1937 A 54 ILE HB A 54 ILE HG1y 1.0 1.621 2.899 2046 1938 A 51 THR HG2% A 54 ILE HG1y 1.0 1.691 3.165 2047 1939 A 12 ARG HA A 12 ARG HGy 1.0 0.000 6.000 2048 1940 A 12 ARG HA A 12 ARG HGx 1.0 0.000 6.000 2049 1941 A 12 ARG H A 12 ARG HGy 1.0 1.823 3.793 2050 1942 A 12 ARG H A 12 ARG HGx 1.0 1.823 3.801 2051 1943 A 13 ASP H A 12 ARG HGx 1.0 1.935 4.617 2052 1944 A 12 ARG HBy A 12 ARG HGx 1.0 1.501 2.503 2053 1945 A 57 GLY HA3 A 54 ILE HG1y 1.0 0.000 6.000 2054 1945 A 57 GLY HA2 A 54 ILE HG1y 1.0 0.000 6.000 2055 1946 A 3 ASP HBy A 86 PRO HGy 1.0 1.927 4.549 2056 1947 A 83 GLU H A 83 GLU HBy 1.0 0.000 6.000 2057 1948 A 85 THR H A 83 GLU HBx 1.0 1.948 4.756 2058 1949 A 84 PRO HA A 83 GLU HBy 1.0 0.000 6.000 2059 1950 A 84 PRO HA A 83 GLU HBx 1.0 0.000 6.000 2060 1951 A 82 LYS HA A 83 GLU HBx 1.0 0.000 6.000 2061 1952 A 84 PRO HBy A 83 GLU HBy 1.0 0.000 6.000 2062 1953 A 31 ARG H A 31 ARG HGy 1.0 1.933 4.607 2063 1954 A 31 ARG H A 31 ARG HGx 1.0 1.935 4.617 2064 1955 A 94 PHE HD2 A 31 ARG HGx 1.0 1.928 4.562 2065 1955 A 94 PHE HD1 A 31 ARG HGx 1.0 1.928 4.562 2066 1956 A 94 PHE HD2 A 31 ARG HGy 1.0 1.957 4.877 2067 1956 A 94 PHE HD1 A 31 ARG HGy 1.0 1.957 4.877 2068 1957 A 31 ARG HGx A 29 GLU HGx 1.0 1.867 4.073 2069 1958 A 31 ARG HGx A 31 ARG HBx 1.0 1.744 3.390 2070 1959 A 31 ARG HGy A 31 ARG HDx 1.0 1.732 3.338 2071 1960 A 18 ALA HA A 33 LEU HG 1.0 0.000 6.000 2072 1961 A 19 GLY H A 33 LEU HG 1.0 0.000 6.000 2073 1962 A 32 CYS HA A 33 LEU HG 1.0 0.000 6.000 2074 1963 A 33 LEU HBy A 33 LEU HG 1.0 1.782 3.578 2075 1964 A 33 LEU HBx A 33 LEU HG 1.0 1.734 3.350 2076 1965 A 22 ARG HGy A 23 ASP H 1.0 1.930 4.574 2077 1966 A 22 ARG HGy A 22 ARG HA 1.0 1.879 4.155 2078 1967 A 22 ARG HGx A 22 ARG HA 1.0 1.872 4.104 2079 1968 A 22 ARG HDy A 22 ARG HGy 1.0 1.818 3.768 2080 1969 A 28 GLU HGx A 22 ARG HGy 1.0 1.863 4.045 2081 1970 A 22 ARG HGy A 22 ARG HBy 1.0 1.830 3.842 2082 1971 A 22 ARG HBx A 22 ARG HGy 1.0 1.849 3.955 2083 1972 A 22 ARG HGx A 22 ARG HBy 1.0 1.843 3.919 2084 1973 A 75 LYS HBx A 75 LYS HGx 1.0 1.741 3.377 2085 1974 A 75 LYS HA A 75 LYS HBx 1.0 1.752 3.430 2086 1975 A 75 LYS HBy A 70 SER HBx 1.0 0.000 6.000 2087 1976 A 38 LYS HA A 38 LYS HBx 1.0 1.719 3.281 2088 1977 A 38 LYS HA A 38 LYS HBy 1.0 1.726 3.312 2089 1978 A 38 LYS H A 38 LYS HBy 1.0 1.662 3.048 2090 1979 A 39 GLY H A 38 LYS HBy 1.0 1.853 3.973 2091 1980 A 76 LYS H A 75 LYS HBx 1.0 1.945 4.725 2092 1981 A 29 GLU H A 28 GLU HBx 1.0 1.912 4.414 2093 1982 A 78 ILE HG2% A 75 LYS HDx 1.0 0.000 6.000 2094 1983 A 75 LYS HGx A 75 LYS HDy 1.0 1.696 3.182 2095 1984 A 75 LYS HDx A 75 LYS HGx 1.0 1.700 3.204 2096 1985 A 75 LYS HBy A 75 LYS HDx 1.0 1.761 3.475 2097 1986 A 75 LYS HDx A 75 LYS HBx 1.0 0.000 6.000 2098 1987 A 75 LYS HBy A 75 LYS HDy 1.0 1.758 3.460 2099 1988 A 82 LYS HA A 82 LYS HDy 1.0 1.876 4.130 2100 1989 A 64 SER H A 82 LYS HDy 1.0 1.937 4.645 2101 1990 A 30 TRP HH2 A 38 LYS HDy 1.0 1.896 4.276 2102 1991 A 38 LYS HDx A 39 GLY H 1.0 1.930 4.572 2103 1992 A 38 LYS HDy A 39 GLY H 1.0 1.899 4.303 2104 1993 A 38 LYS HDy A 38 LYS HA 1.0 1.860 4.020 2105 1994 A 38 LYS HDx A 38 LYS HA 1.0 1.875 4.129 2106 1995 A 69 GLU HBx A 70 SER H 1.0 1.885 4.193 2107 1996 A 69 GLU HA A 69 GLU HBy 1.0 1.633 2.941 2108 1997 A 68 ALA HB% A 69 GLU HBx 1.0 1.958 4.886 2109 1998 A 68 ALA HB% A 69 GLU HBy 1.0 0.000 6.000 2110 1999 A 72 GLU HBy A 72 GLU H 1.0 1.675 3.103 2111 2000 A 72 GLU HBy A 75 LYS H 1.0 1.891 4.243 2112 2001 A 72 GLU HBx A 75 LYS H 1.0 1.876 4.136 2113 2002 A 72 GLU HBy A 75 LYS HGy 1.0 1.835 3.865 2114 2003 A 72 GLU HBx A 75 LYS HGy 1.0 1.841 3.901 2115 2004 A 72 GLU HBy A 75 LYS HDx 1.0 0.000 6.000 2116 2005 A 72 GLU HBy A 73 ASN H 1.0 1.936 4.624 2117 2006 A 76 LYS HEy A 76 LYS HDy 1.0 1.748 3.410 2118 2007 A 50 PRO HDx A 76 LYS HDy 1.0 1.844 3.922 2119 2008 A 50 PRO HDy A 76 LYS HDy 1.0 1.945 4.733 2120 2009 A 76 LYS HDx A 76 LYS HBy 1.0 1.754 3.440 2121 2010 A 76 LYS HDx A 76 LYS HGx 1.0 1.678 3.110 2122 2011 A 76 LYS HGx A 76 LYS HDy 1.0 1.683 3.129 2123 2012 A 73 ASN HA A 76 LYS HDx 1.0 1.726 3.314 2124 2013 A 73 ASN HA A 76 LYS HDy 1.0 1.792 3.630 2125 2014 A 76 LYS HDy A 76 LYS HA 1.0 1.875 4.127 2126 2015 A 76 LYS HDx A 76 LYS HDy 1.0 1.472 2.418 2127 2016 A 7 VAL H A 7 VAL HB 1.0 0.000 6.000 2128 2017 A 8 CYS H A 7 VAL HB 1.0 1.827 3.821 2129 2018 A 3 ASP HBy A 3 ASP HBx 1.0 1.401 2.221 2130 2019 A 4 PRO HBx A 4 PRO HBy 1.0 1.489 2.467 2131 2020 A 5 LYS HBx A 5 LYS HBy 1.0 1.439 2.325 2132 2021 A 7 VAL HB A 7 VAL HGy% 1.0 1.456 2.372 2133 2022 A 8 CYS HBy A 8 CYS HBx 1.0 1.466 2.400 2134 2023 A 10 ASP HBy A 10 ASP HBx 1.0 1.367 2.131 2135 2024 A 15 PRO HBy A 15 PRO HBx 1.0 1.436 2.316 2136 2025 A 15 PRO HGx A 15 PRO HGy 1.0 1.584 2.768 2137 2026 A 17 ASN HBx A 17 ASN HBy 1.0 1.544 2.638 2138 2027 A 20 CYS HBx A 20 CYS HBy 1.0 1.493 2.481 2139 2028 A 22 ARG HBx A 22 ARG HBy 1.0 1.719 3.281 2140 2029 A 22 ARG HGy A 22 ARG HGx 1.0 1.638 2.958 2141 2030 A 25 ASP HBx A 25 ASP HBy 1.0 1.395 2.205 2142 2031 A 28 GLU HGx A 28 GLU HGy 1.0 1.584 2.768 2143 2032 A 31 ARG HBx A 31 ARG HBy 1.0 1.579 2.751 2144 2033 A 31 ARG HGx A 31 ARG HGy 1.0 1.597 2.811 2145 2034 A 32 CYS HBx A 32 CYS HBy 1.0 1.460 2.382 2146 2035 A 34 LEU HBx A 34 LEU HBy 1.0 1.521 2.563 2147 2036 A 36 TYR HBy A 36 TYR HBx 1.0 1.529 2.587 2148 2037 A 37 LYS HBx A 37 LYS HBy 1.0 1.463 2.393 2149 2038 A 37 LYS HDx A 37 LYS HDy 1.0 1.419 2.269 2150 2039 A 37 LYS HEx A 37 LYS HEy 1.0 1.265 1.887 2151 2040 A 38 LYS HDx A 38 LYS HDy 1.0 1.276 1.910 2152 2041 A 44 CYS HBx A 44 CYS HBy 1.0 1.516 2.546 2153 2042 A 47 ASN HBx A 47 ASN HBy 1.0 1.488 2.466 2154 2043 A 49 ASN HBy A 49 ASN HBx 1.0 1.272 1.902 2155 2044 A 50 PRO HBy A 50 PRO HBx 1.0 1.443 2.335 2156 2045 A 52 CYS HBy A 52 CYS HBx 1.0 1.447 2.347 2157 2046 A 53 ASP HBy A 53 ASP HBx 1.0 1.318 2.010 2158 2047 A 55 ASN HBy A 55 ASN HBx 1.0 1.330 2.038 2159 2048 A 56 ASN HBx A 56 ASN HBy 1.0 1.480 2.442 2160 2049 A 59 CYS HBy A 59 CYS HBx 1.0 1.535 2.609 2161 2050 A 61 PRO HBy A 61 PRO HGx 1.0 1.513 2.541 2162 2051 A 65 CYS HBx A 65 CYS HBy 1.0 1.457 2.375 2163 2052 A 66 GLN HBy A 66 GLN HBx 1.0 1.236 1.820 2164 2053 A 66 GLN HGy A 66 GLN HGx 1.0 1.388 2.188 2165 2054 A 69 GLU HBx A 69 GLU HGx 1.0 1.517 2.553 2166 2055 A 72 GLU HBy A 72 GLU HBx 1.0 1.362 2.120 2167 2056 A 75 LYS HBy A 75 LYS HBx 1.0 1.449 2.351 2168 2057 A 75 LYS HDx A 75 LYS HDy 1.0 1.276 1.910 2169 2058 A 76 LYS HBx A 76 LYS HBy 1.0 1.503 2.507 2170 2059 A 76 LYS HEy A 76 LYS HEx 1.0 1.346 2.080 2171 2060 A 81 CYS HBy A 81 CYS HBx 1.0 1.511 2.535 2172 2061 A 82 LYS HBy A 82 LYS HBx 1.0 1.325 2.029 2173 2062 A 83 GLU HBy A 83 GLU HBx 1.0 1.407 2.237 2174 2063 A 83 GLU HGx A 83 GLU HGy 1.0 1.274 1.906 2175 2064 A 84 PRO HBx A 84 PRO HBy 1.0 1.439 2.325 2176 2065 A 86 PRO HBx A 86 PRO HBy 1.0 1.333 2.045 2177 2066 A 87 ASN HBy A 87 ASN HBx 1.0 1.487 2.461 2178 2067 A 89 TYR HBy A 89 TYR HBx 1.0 1.592 2.794 2179 2068 A 91 GLU HGy A 91 GLU HGx 1.0 1.253 1.859 2180 2069 A 94 PHE HD2 A 90 TYR HBx 1.0 1.873 4.113 2181 2069 A 94 PHE HD1 A 90 TYR HBx 1.0 1.873 4.113 2182 2070 A 73 ASN HBy A 73 ASN H 1.0 1.836 3.868 2183 2071 A 73 ASN H A 73 ASN HBx 1.0 1.827 3.817 2184 2072 A 45 VAL HA A 46 GLU HGy 1.0 1.957 4.877 2185 2073 A 36 TYR HA A 46 GLU HBy 1.0 0.000 6.000 2186 2074 A 36 TYR HA A 46 GLU HBx 1.0 1.960 4.914 2187 2075 A 20 CYS HBx A 8 CYS HBx 1.0 0.000 6.000 2188 2076 A 99 SER HBy A 87 ASN HD2x 1.0 1.960 4.910 2189 2077 A 13 ASP HBy A 12 ARG HBx 1.0 1.960 4.900 2190 2078 A 69 GLU H A 69 GLU HBy 1.0 0.000 6.000 2191 2079 A 68 ALA HA A 69 GLU H 1.0 1.453 2.365 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 hbond _nef_distance_restraint_list.potential_type . save_ save_CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_3 save_