data_nef_c25974_2nbf save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 2NBF 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 7 CYS SG 1 36 CYS SG 1 7 CYS SG 1 43 CYS SG 1 14 CYS SG 1 43 CYS SG 1 28 CYS SG 1 54 CYS SG 1 36 CYS SG 1 54 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 ALA start . . 2 A 2 LYS middle . . 3 A 3 TYR middle . . 4 A 4 THR middle . . 5 A 5 GLY middle . false 6 A 6 LYS middle . . 7 A 7 CYS middle -HG . 8 A 8 THR middle . . 9 A 9 LYS middle . . 10 A 10 SER middle . . 11 A 11 LYS middle . . 12 A 12 ASN middle . . 13 A 13 GLU middle . . 14 A 14 CYS middle -HG . 15 A 15 LYS middle . . 16 A 16 TYR middle . . 17 A 17 LYS middle . . 18 A 18 ASN middle . . 19 A 19 ASP middle . . 20 A 20 ALA middle . . 21 A 21 GLY middle . false 22 A 22 LYS middle . . 23 A 23 ASP middle . . 24 A 24 THR middle . . 25 A 25 PHE middle . . 26 A 26 ILE middle . . 27 A 27 LYS middle . . 28 A 28 CYS middle -HG . 29 A 29 PRO middle . false 30 A 30 LYS middle . . 31 A 31 PHE middle . . 32 A 32 ASP middle . . 33 A 33 ASN middle . . 34 A 34 LYS middle . . 35 A 35 LYS middle . . 36 A 36 CYS middle -HG . 37 A 37 THR middle . . 38 A 38 LYS middle . . 39 A 39 ASP middle . . 40 A 40 ASN middle . . 41 A 41 ASN middle . . 42 A 42 LYS middle . . 43 A 43 CYS middle -HG . 44 A 44 THR middle . . 45 A 45 VAL middle . . 46 A 46 ASP middle . . 47 A 47 THR middle . . 48 A 48 TYR middle . . 49 A 49 ASN middle . . 50 A 50 ASN middle . . 51 A 51 ALA middle . . 52 A 52 VAL middle . . 53 A 53 ASP middle . . 54 A 54 CYS middle -HG . 55 A 55 ASP 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 2 LYS H H 1 8.167 0.003 A 2 LYS HA H 1 5.230 0.002 A 2 LYS HBx H 1 1.586 0.02 A 2 LYS HD2 H 1 0.406 0.002 A 2 LYS HE2 H 1 2.895 0.02 A 2 LYS N N 15 119.918 0.012 A 3 TYR H H 1 8.939 0.021 A 3 TYR HA H 1 4.809 0.002 A 3 TYR HBy H 1 2.790 0.02 A 3 TYR HBx H 1 1.802 0.02 A 3 TYR HD1 H 1 6.869 0.02 A 3 TYR HD2 H 1 6.869 0.02 A 3 TYR HE1 H 1 6.739 0.02 A 3 TYR HE2 H 1 6.739 0.02 A 3 TYR N N 15 122.493 0.125 A 4 THR H H 1 8.885 0.019 A 4 THR HA H 1 5.042 0.02 A 4 THR HB H 1 4.032 0.02 A 4 THR HG2% H 1 1.284 0.02 A 4 THR N N 15 117.297 0.153 A 5 GLY H H 1 9.135 0.016 A 5 GLY HAy H 1 4.633 0.02 A 5 GLY HAx H 1 3.972 0.02 A 5 GLY N N 15 115.452 0.128 A 6 LYS H H 1 8.422 0.019 A 6 LYS HA H 1 5.378 0.002 A 6 LYS HBy H 1 1.643 0.02 A 6 LYS HBx H 1 1.576 0.02 A 6 LYS HGy H 1 1.355 0.02 A 6 LYS HGx H 1 1.296 0.02 A 6 LYS N N 15 121.001 0.178 A 7 CYS H H 1 9.767 0.016 A 7 CYS HA H 1 6.297 0.02 A 7 CYS HBx H 1 2.849 0.02 A 7 CYS HBy H 1 3.375 0.02 A 7 CYS N N 15 122.647 0.103 A 8 THR H H 1 8.716 0.015 A 8 THR HA H 1 4.704 0.02 A 8 THR HB H 1 4.085 0.02 A 8 THR HG2% H 1 1.268 0.02 A 8 THR N N 15 113.493 0.080 A 9 LYS H H 1 8.947 0.012 A 9 LYS HA H 1 3.493 0.002 A 9 LYS HB2 H 1 1.743 0.02 A 9 LYS HGy H 1 1.262 0.02 A 9 LYS HGx H 1 1.108 0.02 A 9 LYS N N 15 127.640 0.087 A 10 SER H H 1 9.484 0.001 A 10 SER HA H 1 4.006 0.005 A 10 SER HBy H 1 3.885 0.02 A 10 SER HBx H 1 3.839 0.02 A 10 SER N N 15 116.726 0.016 A 11 LYS H H 1 7.051 0.003 A 11 LYS HA H 1 4.153 0.02 A 11 LYS HBx H 1 1.354 0.02 A 11 LYS HBy H 1 1.685 0.02 A 11 LYS N N 15 116.973 0.035 A 12 ASN H H 1 7.590 0.010 A 12 ASN HA H 1 4.566 0.02 A 12 ASN HBy H 1 3.190 0.02 A 12 ASN HBx H 1 2.263 0.02 A 12 ASN HD21 H 1 5.906 0.02 A 12 ASN HD22 H 1 6.960 0.02 A 12 ASN N N 15 120.652 0.083 A 13 GLU H H 1 7.290 0.013 A 13 GLU HA H 1 4.896 0.02 A 13 GLU HBx H 1 1.708 0.02 A 13 GLU HBy H 1 1.797 0.02 A 13 GLU HGy H 1 2.046 0.002 A 13 GLU HGx H 1 1.951 0.02 A 13 GLU N N 15 115.322 0.145 A 14 CYS H H 1 9.588 0.014 A 14 CYS HA H 1 4.639 0.02 A 14 CYS HBx H 1 2.654 0.02 A 14 CYS HBy H 1 2.894 0.02 A 14 CYS N N 15 123.345 0.131 A 15 LYS H H 1 8.636 0.003 A 15 LYS HA H 1 4.946 0.02 A 15 LYS HBy H 1 1.723 0.02 A 15 LYS HBx H 1 1.440 0.002 A 15 LYS HD2 H 1 0.555 0.02 A 15 LYS HEy H 1 2.678 0.02 A 15 LYS HEx H 1 2.574 0.02 A 15 LYS HG2 H 1 0.178 0.02 A 15 LYS N N 15 110.722 0.026 A 16 TYR H H 1 8.998 0.016 A 16 TYR HA H 1 4.899 0.02 A 16 TYR HBx H 1 2.300 0.02 A 16 TYR HBy H 1 2.649 0.02 A 16 TYR HD1 H 1 6.270 0.02 A 16 TYR HD2 H 1 6.270 0.02 A 16 TYR HE1 H 1 5.760 0.02 A 16 TYR HE2 H 1 5.760 0.02 A 16 TYR N N 15 126.630 0.102 A 17 LYS H H 1 8.421 0.018 A 17 LYS HA H 1 4.406 0.002 A 17 LYS HBy H 1 1.658 0.02 A 17 LYS HBx H 1 1.442 0.02 A 17 LYS HG2 H 1 1.227 0.02 A 17 LYS N N 15 120.977 0.178 A 18 ASN H H 1 7.735 0.013 A 18 ASN HA H 1 4.102 0.02 A 18 ASN HBy H 1 3.350 0.02 A 18 ASN HBx H 1 2.583 0.02 A 18 ASN HD21 H 1 6.740 0.02 A 18 ASN HD22 H 1 7.353 0.02 A 18 ASN N N 15 122.224 0.136 A 19 ASP H H 1 8.238 0.002 A 19 ASP HA H 1 4.384 0.02 A 19 ASP HBx H 1 2.681 0.02 A 19 ASP HBy H 1 2.829 0.02 A 19 ASP N N 15 117.436 0.018 A 20 ALA H H 1 7.419 0.015 A 20 ALA HA H 1 4.409 0.02 A 20 ALA HB% H 1 1.341 0.02 A 20 ALA N N 15 120.895 0.130 A 21 GLY H H 1 8.170 0.001 A 21 GLY HAy H 1 4.079 0.02 A 21 GLY HAx H 1 3.512 0.02 A 21 GLY N N 15 127.668 0.011 A 22 LYS H H 1 7.682 0.023 A 22 LYS HA H 1 4.309 0.02 A 22 LYS HBx H 1 1.468 0.02 A 22 LYS HBy H 1 1.581 0.02 A 22 LYS HE2 H 1 2.890 0.02 A 22 LYS HGy H 1 1.278 0.02 A 22 LYS HGx H 1 1.182 0.02 A 22 LYS N N 15 120.354 0.191 A 23 ASP H H 1 8.610 0.020 A 23 ASP HA H 1 4.256 0.02 A 23 ASP HBy H 1 2.391 0.02 A 23 ASP HBx H 1 1.851 0.02 A 23 ASP N N 15 126.398 0.246 A 24 THR H H 1 8.782 0.020 A 24 THR HA H 1 4.012 0.02 A 24 THR HB H 1 2.287 0.02 A 24 THR HG2% H 1 0.799 0.02 A 24 THR N N 15 122.770 0.155 A 25 PHE H H 1 8.328 0.021 A 25 PHE HA H 1 5.404 0.02 A 25 PHE HB2 H 1 2.684 0.02 A 25 PHE HD1 H 1 7.005 0.02 A 25 PHE HD2 H 1 7.005 0.02 A 25 PHE HE1 H 1 7.163 0.02 A 25 PHE HE2 H 1 7.163 0.02 A 25 PHE N N 15 122.423 0.161 A 26 ILE H H 1 9.138 0.016 A 26 ILE HA H 1 4.614 0.02 A 26 ILE HB H 1 1.800 0.02 A 26 ILE HD1% H 1 1.705 0.02 A 26 ILE HG12 H 1 1.351 0.017 A 26 ILE HG2% H 1 0.833 0.02 A 26 ILE N N 15 123.029 0.100 A 27 LYS H H 1 8.335 0.015 A 27 LYS HA H 1 4.163 0.002 A 27 LYS HBy H 1 1.897 0.02 A 27 LYS HBx H 1 1.731 0.02 A 27 LYS HD2 H 1 1.689 0.02 A 27 LYS HG2 H 1 1.577 0.02 A 27 LYS N N 15 127.077 0.112 A 28 CYS H H 1 8.618 0.015 A 28 CYS HA H 1 4.659 0.02 A 28 CYS HBy H 1 3.290 0.02 A 28 CYS HBx H 1 2.846 0.02 A 28 CYS N N 15 120.248 0.173 A 29 PRO HA H 1 4.426 0.02 A 29 PRO HBy H 1 2.546 0.02 A 29 PRO HBx H 1 1.532 0.02 A 29 PRO HD2 H 1 3.689 0.002 A 29 PRO HGy H 1 2.279 0.02 A 29 PRO HGx H 1 2.140 0.02 A 30 LYS H H 1 8.002 0.012 A 30 LYS HA H 1 3.949 0.02 A 30 LYS HBx H 1 1.414 0.02 A 30 LYS HBy H 1 1.560 0.02 A 30 LYS HG2 H 1 1.023 0.02 A 30 LYS N N 15 115.643 0.125 A 31 PHE H H 1 6.308 0.014 A 31 PHE HA H 1 4.504 0.02 A 31 PHE HBy H 1 3.460 0.003 A 31 PHE HBx H 1 2.514 0.005 A 31 PHE HE1 H 1 7.239 0.02 A 31 PHE HE2 H 1 7.239 0.02 A 31 PHE HZ H 1 7.430 0.02 A 31 PHE N N 15 116.470 0.114 A 32 ASP HA H 1 4.144 0.02 A 32 ASP HB2 H 1 2.599 0.02 A 33 ASN H H 1 8.564 0.002 A 33 ASN HA H 1 4.673 0.02 A 33 ASN HBy H 1 3.134 0.02 A 33 ASN HBx H 1 2.879 0.02 A 33 ASN HD21 H 1 6.798 0.02 A 33 ASN HD22 H 1 7.519 0.02 A 33 ASN N N 15 113.110 0.004 A 34 LYS H H 1 7.914 0.018 A 34 LYS HA H 1 4.984 0.02 A 34 LYS HBy H 1 2.289 0.02 A 34 LYS HBx H 1 1.600 0.02 A 34 LYS HD2 H 1 1.825 0.02 A 34 LYS HG2 H 1 1.410 0.02 A 34 LYS N N 15 120.347 0.186 A 35 LYS H H 1 7.005 0.012 A 35 LYS HA H 1 4.608 0.02 A 35 LYS HBy H 1 1.793 0.02 A 35 LYS HBx H 1 1.631 0.02 A 35 LYS HD2 H 1 1.314 0.02 A 35 LYS HG2 H 1 0.819 0.02 A 35 LYS N N 15 117.863 0.129 A 36 CYS H H 1 8.817 0.016 A 36 CYS HA H 1 4.857 0.02 A 36 CYS HBy H 1 3.209 0.02 A 36 CYS HBx H 1 2.959 0.02 A 36 CYS N N 15 118.915 0.131 A 37 THR H H 1 9.980 0.012 A 37 THR HA H 1 4.300 0.02 A 37 THR HG2% H 1 1.113 0.02 A 37 THR N N 15 121.008 0.120 A 38 LYS H H 1 7.287 0.012 A 38 LYS HA H 1 4.137 0.02 A 38 LYS HBy H 1 1.760 0.02 A 38 LYS HBx H 1 1.491 0.02 A 38 LYS HD2 H 1 1.346 0.005 A 38 LYS HE2 H 1 2.921 0.02 A 38 LYS HG2 H 1 1.264 0.02 A 38 LYS N N 15 122.326 0.134 A 39 ASP H H 1 8.817 0.014 A 39 ASP HA H 1 4.578 0.02 A 39 ASP HBy H 1 2.600 0.02 A 39 ASP HBx H 1 2.531 0.02 A 39 ASP N N 15 125.238 0.125 A 40 ASN H H 1 9.532 0.016 A 40 ASN HA H 1 4.272 0.02 A 40 ASN HBy H 1 3.175 0.02 A 40 ASN HBx H 1 3.070 0.02 A 40 ASN HD21 H 1 7.000 0.02 A 40 ASN HD22 H 1 7.557 0.02 A 40 ASN N N 15 114.713 0.142 A 41 ASN H H 1 7.742 0.013 A 41 ASN HA H 1 4.717 0.02 A 41 ASN HBx H 1 2.835 0.02 A 41 ASN HBy H 1 3.339 0.02 A 41 ASN HD21 H 1 7.572 0.02 A 41 ASN HD22 H 1 6.444 0.02 A 41 ASN N N 15 120.080 0.142 A 42 LYS H H 1 8.397 0.016 A 42 LYS HA H 1 4.346 0.005 A 42 LYS HB2 H 1 1.735 0.02 A 42 LYS HGy H 1 1.356 0.019 A 42 LYS HGx H 1 1.282 0.02 A 42 LYS N N 15 118.956 0.125 A 43 CYS H H 1 7.397 0.017 A 43 CYS HA H 1 5.335 0.02 A 43 CYS HBy H 1 3.703 0.02 A 43 CYS HBx H 1 2.664 0.02 A 43 CYS N N 15 112.235 0.209 A 44 THR H H 1 8.674 0.015 A 44 THR HA H 1 5.221 0.02 A 44 THR HB H 1 4.036 0.002 A 44 THR HG2% H 1 1.095 0.02 A 44 THR N N 15 112.586 0.092 A 45 VAL H H 1 8.555 0.016 A 45 VAL HA H 1 4.430 0.02 A 45 VAL HB H 1 1.202 0.002 A 45 VAL HGx% H 1 0.450 0.02 A 45 VAL HGy% H 1 0.419 0.02 A 45 VAL N N 15 121.814 0.171 A 46 ASP H H 1 8.519 0.017 A 46 ASP HA H 1 5.334 0.02 A 46 ASP HBx H 1 2.402 0.02 A 46 ASP HBy H 1 3.302 0.02 A 46 ASP N N 15 126.626 0.160 A 47 THR H H 1 9.116 0.015 A 47 THR HA H 1 4.187 0.02 A 47 THR HB H 1 4.589 0.002 A 47 THR HG2% H 1 1.296 0.02 A 47 THR N N 15 114.334 0.120 A 48 TYR H H 1 8.803 0.013 A 48 TYR HA H 1 4.374 0.02 A 48 TYR HBy H 1 3.106 0.02 A 48 TYR HBx H 1 2.872 0.02 A 48 TYR HD1 H 1 7.017 0.02 A 48 TYR HD2 H 1 7.017 0.02 A 48 TYR HE1 H 1 6.758 0.02 A 48 TYR HE2 H 1 6.758 0.02 A 48 TYR N N 15 124.010 0.151 A 49 ASN H H 1 7.433 0.011 A 49 ASN HA H 1 4.475 0.02 A 49 ASN HBx H 1 2.475 0.02 A 49 ASN HBy H 1 2.739 0.02 A 49 ASN HD21 H 1 6.695 0.02 A 49 ASN HD22 H 1 7.593 0.02 A 49 ASN N N 15 113.668 0.121 A 50 ASN H H 1 7.863 0.016 A 50 ASN HA H 1 4.199 0.02 A 50 ASN HBy H 1 2.925 0.02 A 50 ASN HBx H 1 2.690 0.02 A 50 ASN HD21 H 1 6.586 0.02 A 50 ASN HD22 H 1 7.387 0.02 A 50 ASN N N 15 117.403 0.152 A 51 ALA H H 1 7.853 0.014 A 51 ALA HA H 1 4.437 0.02 A 51 ALA HB% H 1 1.294 0.02 A 51 ALA N N 15 121.102 0.133 A 52 VAL H H 1 8.297 0.018 A 52 VAL HA H 1 4.875 0.02 A 52 VAL HB H 1 1.929 0.02 A 52 VAL HGx% H 1 0.998 0.02 A 52 VAL HGy% H 1 0.916 0.02 A 52 VAL N N 15 126.326 0.124 A 53 ASP H H 1 8.519 0.016 A 53 ASP HA H 1 4.795 0.02 A 53 ASP HBy H 1 2.816 0.02 A 53 ASP HBx H 1 2.310 0.02 A 53 ASP N N 15 125.100 0.161 A 54 CYS H H 1 8.609 0.019 A 54 CYS HA H 1 4.678 0.02 A 54 CYS HB2 H 1 3.496 0.001 A 54 CYS N N 15 126.377 0.247 A 55 ASP H H 1 7.579 0.015 A 55 ASP HA H 1 4.861 0.02 A 55 ASP HB2 H 1 2.688 0.02 A 55 ASP N N 15 128.711 0.095 stop_ save_ save_DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 36 CYS H A 37 THR H 1.0 . 4.88 2 2 A 37 THR H A 41 ASN HD22 1.0 . 3.87 3 3 A 37 THR H A 38 LYS H 1.0 . 3.00 4 4 A 37 THR H A 41 ASN HD21 1.0 . 4.54 5 5 A 6 LYS HGy A 7 CYS H 1.0 . 5.23 6 6 A 7 CYS H A 40 ASN H 1.0 . 4.79 7 7 A 7 CYS H A 41 ASN H 1.0 . 4.07 8 8 A 14 CYS H A 26 ILE H 1.0 . 3.59 9 9 A 14 CYS H A 27 LYS H 1.0 . 5.45 10 10 A 14 CYS H A 13 GLU H 1.0 . 4.76 11 11 A 14 CYS H A 13 GLU HBy 1.0 . 4.72 12 12 A 14 CYS H A 13 GLU HBx 1.0 . 4.70 13 13 A 40 ASN H A 39 ASP H 1.0 . 4.58 14 14 A 40 ASN H A 41 ASN H 1.0 . 3.10 15 15 A 40 ASN H A 9 LYS H 1.0 . 4.35 16 16 A 40 ASN H A 8 THR HG2% 1.0 . 4.74 17 17 A 4 THR HB A 5 GLY H 1.0 . 5.17 18 18 A 2 LYS HDy A 47 THR H 1.0 . 5.16 19 19 A 5 GLY H A 45 VAL H 1.0 . 5.50 20 20 A 5 GLY H A 43 CYS H 1.0 . 3.46 21 21 A 47 THR H A 3 TYR HD% 1.0 . 5.12 22 22 A 47 THR H A 50 ASN H 1.0 . 5.34 23 23 A 47 THR H A 48 TYR H 1.0 . 3.64 24 24 A 47 THR H A 48 TYR HBy 1.0 . 5.50 25 25 A 16 TYR H A 24 THR H 1.0 . 3.76 26 26 A 45 VAL H A 3 TYR H 1.0 . 3.60 27 27 A 3 TYR HD% A 3 TYR H 1.0 . 3.64 28 28 A 3 TYR H A 2 LYS HBx 1.0 . 4.89 29 29 A 3 TYR H A 3 TYR HE% 1.0 . 5.18 30 30 A 9 LYS H A 10 SER H 1.0 . 5.20 31 31 A 38 LYS H A 9 LYS H 1.0 . 5.20 32 32 A 9 LYS H A 36 CYS HBx 1.0 . 5.50 33 33 A 9 LYS H A 38 LYS HA 1.0 . 5.50 34 34 A 41 ASN HD22 A 39 ASP H 1.0 . 5.50 35 35 A 38 LYS H A 39 ASP H 1.0 . 4.32 36 36 A 36 CYS H A 36 CYS HBy 1.0 . 3.54 37 37 A 36 CYS H A 37 THR HG2% 1.0 . 5.50 38 38 A 39 ASP H A 9 LYS HGx 1.0 . 5.41 39 39 A 39 ASP H A 38 LYS HBy 1.0 . 3.86 40 40 A 39 ASP H A 38 LYS HGy 1.0 . 4.60 41 41 A 48 TYR H A 47 THR HG2% 1.0 . 5.20 42 42 A 48 TYR H A 48 TYR HD% 1.0 . 4.49 43 43 A 24 THR H A 25 PHE H 1.0 . 5.47 44 44 A 24 THR H A 18 ASN H 1.0 . 4.81 45 45 A 24 THR H A 15 LYS HDy 1.0 . 5.37 46 46 A 24 THR H A 25 PHE HE% 1.0 . 5.50 47 47 A 7 CYS H A 8 THR H 1.0 . 5.14 48 48 A 36 CYS HBx A 8 THR H 1.0 . 5.28 49 49 A 44 THR H A 53 ASP H 1.0 . 3.50 50 50 A 43 CYS H A 44 THR H 1.0 . 4.82 51 51 A 7 CYS H A 15 LYS H 1.0 . 5.50 52 52 A 15 LYS H A 7 CYS HA 1.0 . 3.61 53 53 A 12 ASN HBx A 28 CYS H 1.0 . 5.50 54 54 A 26 ILE H A 15 LYS H 1.0 . 5.26 55 55 A 13 GLU H A 28 CYS H 1.0 . 4.95 56 56 A 28 CYS H A 12 ASN HD21 1.0 . 5.28 57 57 A 54 CYS H A 55 ASP H 1.0 . 4.76 58 58 A 28 CYS H A 13 GLU HA 1.0 . 5.50 59 59 A 54 CYS H A 54 CYS HBy 1.0 . 3.44 60 60 A 45 VAL H A 3 TYR HD% 1.0 . 5.04 61 61 A 46 ASP H A 51 ALA H 1.0 . 3.82 62 62 A 47 THR H A 46 ASP H 1.0 . 4.76 63 63 A 5 GLY H A 6 LYS H 1.0 . 4.75 64 64 A 7 CYS H A 6 LYS H 1.0 . 4.83 65 65 A 16 TYR H A 17 LYS H 1.0 . 4.87 66 66 A 6 LYS H A 6 LYS HGx 1.0 . 4.57 67 67 A 41 ASN H A 42 LYS H 1.0 . 4.40 68 68 A 43 CYS H A 42 LYS H 1.0 . 4.72 69 69 A 42 LYS H A 55 ASP HBy 1.0 . 3.82 70 70 A 42 LYS H A 42 LYS HBy 1.0 . 2.94 71 71 A 26 ILE H A 27 LYS H 1.0 . 4.23 72 72 A 25 PHE H A 25 PHE HE% 1.0 . 4.60 73 73 A 25 PHE H A 25 PHE HD% 1.0 . 3.25 74 74 A 27 LYS H A 27 LYS HBx 1.0 . 3.62 75 75 A 25 PHE H A 24 THR HG2% 1.0 . 3.43 76 76 A 51 ALA H A 52 VAL H 1.0 . 4.70 77 77 A 52 VAL H A 51 ALA HB% 1.0 . 3.88 78 78 A 52 VAL H A 52 VAL HGy% 1.0 . 3.72 79 79 A 19 ASP H A 20 ALA H 1.0 . 4.16 80 80 A 19 ASP H A 18 ASN HD21 1.0 . 5.50 81 81 A 2 LYS H A 17 LYS HGy 1.0 . 5.01 82 82 A 21 GLY H A 22 LYS H 1.0 . 3.08 83 83 A 20 ALA H A 21 GLY H 1.0 . 3.00 84 84 A 21 GLY H A 20 ALA HB% 1.0 . 4.20 85 85 A 30 LYS H A 31 PHE H 1.0 . 3.21 86 86 A 30 LYS H A 29 PRO HGy 1.0 . 5.50 87 87 A 30 LYS H A 29 PRO HBx 1.0 . 3.58 88 88 A 33 ASN HBy A 34 LYS H 1.0 . 5.47 89 89 A 34 LYS H A 33 ASN H 1.0 . 4.31 90 90 A 34 LYS H A 35 LYS H 1.0 . 2.77 91 91 A 34 LYS H A 31 PHE HBx 1.0 . 5.20 92 92 A 34 LYS H A 34 LYS HDy 1.0 . 5.50 93 93 A 50 ASN H A 48 TYR H 1.0 . 4.16 94 94 A 50 ASN H A 49 ASN H 1.0 . 3.07 95 95 A 50 ASN H A 49 ASN HBy 1.0 . 4.75 96 96 A 50 ASN H A 49 ASN HBx 1.0 . 4.91 97 97 A 38 LYS H A 41 ASN H 1.0 . 5.42 98 98 A 41 ASN H A 9 LYS H 1.0 . 5.49 99 99 A 41 ASN H A 40 ASN HBy 1.0 . 5.21 100 100 A 41 ASN HD22 A 41 ASN H 1.0 . 4.16 101 101 A 41 ASN HD21 A 41 ASN H 1.0 . 5.31 102 102 A 18 ASN H A 16 TYR HD% 1.0 . 5.26 103 103 A 18 ASN HD21 A 22 LYS H 1.0 . 4.99 104 104 A 51 ALA HB% A 49 ASN HD21 1.0 . 5.01 105 105 A 8 THR H A 12 ASN H 1.0 . 5.01 106 106 A 9 LYS H A 12 ASN H 1.0 . 5.50 107 107 A 12 ASN H A 9 LYS HA 1.0 . 3.57 108 108 A 41 ASN HD22 A 38 LYS HBx 1.0 . 4.59 109 109 A 55 ASP H A 42 LYS H 1.0 . 4.56 110 110 A 48 TYR H A 49 ASN H 1.0 . 3.32 111 111 A 20 ALA H A 18 ASN HBx 1.0 . 5.10 112 112 A 43 CYS H A 42 LYS HGy 1.0 . 3.80 113 113 A 7 CYS H A 43 CYS H 1.0 . 5.02 114 114 A 43 CYS H A 6 LYS HA 1.0 . 4.68 115 115 A 43 CYS H A 44 THR HG2% 1.0 . 5.19 116 116 A 13 GLU H A 8 THR H 1.0 . 3.49 117 117 A 41 ASN HD22 A 38 LYS H 1.0 . 3.33 118 118 A 38 LYS H A 41 ASN HBx 1.0 . 4.35 119 119 A 38 LYS H A 36 CYS HBy 1.0 . 4.70 120 120 A 13 GLU H A 36 CYS HBx 1.0 . 5.19 121 121 A 13 GLU H A 13 GLU HBy 1.0 . 3.94 122 122 A 38 LYS H A 38 LYS HDy 1.0 . 5.17 123 123 A 30 LYS H A 31 PHE HE% 1.0 . 5.04 124 124 A 31 PHE H A 31 PHE HE% 1.0 . 3.88 125 125 A 31 PHE HE% A 30 LYS HGy 1.0 . 5.50 126 126 A 31 PHE HE% A 29 PRO HGx 1.0 . 5.50 127 127 A 48 TYR HD% A 49 ASN HBy 1.0 . 5.50 128 128 A 25 PHE HD% A 15 LYS HBx 1.0 . 4.27 129 129 A 26 ILE H A 25 PHE HD% 1.0 . 4.87 130 130 A 25 PHE HD% A 24 THR HA 1.0 . 4.73 131 131 A 25 PHE HD% A 13 GLU HGx 1.0 . 5.50 132 132 A 12 ASN HD21 A 30 LYS HA 1.0 . 4.61 133 133 A 12 ASN HD21 A 30 LYS H 1.0 . 5.50 134 134 A 3 TYR HD% A 17 LYS HGy 1.0 . 4.55 135 135 A 3 TYR HD% A 4 THR H 1.0 . 4.41 136 136 A 3 TYR HD% A 47 THR HG2% 1.0 . 4.17 137 137 A 20 ALA HB% A 18 ASN HD22 1.0 . 4.38 138 138 A 22 LYS H A 18 ASN HD22 1.0 . 5.17 139 139 A 18 ASN HD22 A 22 LYS HGx 1.0 . 5.50 140 140 A 47 THR H A 3 TYR HE% 1.0 . 5.29 141 141 A 19 ASP H A 18 ASN HD22 1.0 . 4.89 142 142 A 21 GLY H A 18 ASN HD22 1.0 . 5.50 143 143 A 3 TYR HE% A 17 LYS HGy 1.0 . 3.64 144 144 A 50 ASN H A 49 ASN HD22 1.0 . 5.50 145 145 A 41 ASN HD21 A 42 LYS H 1.0 . 5.50 146 146 A 38 LYS H A 41 ASN HD21 1.0 . 4.25 147 147 A 41 ASN HD21 A 7 CYS HA 1.0 . 5.26 148 148 A 13 GLU H A 7 CYS HA 1.0 . 4.91 149 149 A 8 THR H A 7 CYS HA 1.0 . 2.95 150 150 A 5 GLY H A 16 TYR HD% 1.0 . 5.33 151 151 A 16 TYR H A 16 TYR HD% 1.0 . 3.54 152 152 A 17 LYS H A 16 TYR HD% 1.0 . 3.97 153 153 A 3 TYR HE% A 16 TYR HD% 1.0 . 4.90 154 154 A 3 TYR HD% A 16 TYR HD% 1.0 . 4.08 155 155 A 36 CYS H A 12 ASN HD22 1.0 . 4.63 156 156 A 30 LYS H A 12 ASN HD22 1.0 . 5.50 157 157 A 30 LYS HA A 12 ASN HD22 1.0 . 4.34 158 158 A 12 ASN HD22 A 35 LYS HBy 1.0 . 4.56 159 159 A 16 TYR HE% A 26 ILE HG12 1.0 . 5.50 160 160 A 26 ILE H A 16 TYR HE% 1.0 . 5.20 161 161 A 3 TYR HE% A 16 TYR HE% 1.0 . 4.62 162 162 A 18 ASN HBx A 16 TYR HE% 1.0 . 5.06 163 163 A 16 TYR HE% A 26 ILE HG2% 1.0 . 3.77 164 164 A 16 TYR H A 16 TYR HE% 1.0 . 5.49 165 165 A 3 TYR HD% A 16 TYR HE% 1.0 . 4.45 166 166 A 16 TYR HE% A 14 CYS HBy 1.0 . 5.36 167 167 A 16 TYR HE% A 18 ASN HBy 1.0 . 4.51 168 168 A 16 TYR HE% A 3 TYR HBx 1.0 . 5.12 169 169 A 25 PHE HE% A 25 PHE HA 1.0 . 5.50 170 170 A 26 ILE HG2% A 25 PHE HA 1.0 . 4.76 171 171 A 14 CYS H A 25 PHE HA 1.0 . 4.89 172 172 A 26 ILE H A 25 PHE HA 1.0 . 2.79 173 173 A 16 TYR H A 25 PHE HA 1.0 . 4.11 174 174 A 25 PHE HD% A 25 PHE HA 1.0 . 3.67 175 175 A 25 PHE HA A 15 LYS HGy 1.0 . 5.50 176 176 A 25 PHE HA A 15 LYS HBy 1.0 . 5.27 177 177 A 7 CYS H A 6 LYS HA 1.0 . 2.79 178 178 A 41 ASN H A 6 LYS HA 1.0 . 5.23 179 179 A 7 CYS HA A 6 LYS HA 1.0 . 5.17 180 180 A 6 LYS HGx A 6 LYS HA 1.0 . 4.06 181 181 A 43 CYS HA A 53 ASP HBy 1.0 . 4.87 182 182 A 44 THR H A 43 CYS HA 1.0 . 2.95 183 183 A 55 ASP H A 43 CYS HA 1.0 . 3.98 184 184 A 44 THR HG2% A 43 CYS HA 1.0 . 4.92 185 185 A 47 THR H A 46 ASP HA 1.0 . 2.83 186 186 A 3 TYR H A 46 ASP HA 1.0 . 4.45 187 187 A 51 ALA H A 46 ASP HA 1.0 . 5.33 188 188 A 43 CYS HA A 44 THR HA 1.0 . 4.93 189 189 A 46 ASP HA A 45 VAL HGx% 1.0 . 5.37 190 189 A 46 ASP HA A 45 VAL HGy% 1.0 . 5.37 191 190 A 3 TYR H A 2 LYS HA 1.0 . 2.76 192 191 A 3 TYR HD% A 2 LYS HA 1.0 . 4.29 193 192 A 44 THR HA A 3 TYR HBy 1.0 . 4.93 194 193 A 47 THR H A 2 LYS HA 1.0 . 4.08 195 194 A 4 THR H A 44 THR HA 1.0 . 5.02 196 195 A 44 THR HA A 45 VAL HB 1.0 . 4.62 197 196 A 44 THR HA A 52 VAL HGx% 1.0 . 5.50 198 197 A 44 THR HA A 45 VAL HGx% 1.0 . 5.50 199 197 A 44 THR HA A 45 VAL HGy% 1.0 . 5.50 200 198 A 2 LYS HDy A 2 LYS HA 1.0 . 4.43 201 199 A 5 GLY H A 44 THR HA 1.0 . 3.96 202 200 A 45 VAL H A 44 THR HA 1.0 . 2.77 203 201 A 3 TYR HBx A 44 THR HA 1.0 . 5.04 204 202 A 44 THR HG2% A 44 THR HA 1.0 . 3.40 205 203 A 4 THR HA A 5 GLY HAy 1.0 . 4.77 206 204 A 5 GLY H A 4 THR HA 1.0 . 2.78 207 205 A 45 VAL H A 4 THR HA 1.0 . 4.15 208 206 A 43 CYS H A 4 THR HA 1.0 . 5.12 209 207 A 44 THR HG2% A 4 THR HA 1.0 . 3.89 210 208 A 2 LYS HDy A 4 THR HA 1.0 . 5.50 211 209 A 44 THR HA A 4 THR HA 1.0 . 4.22 212 210 A 3 TYR HBx A 4 THR HA 1.0 . 5.50 213 211 A 4 THR HA A 4 THR HG2% 1.0 . 3.56 214 212 A 44 THR H A 4 THR HA 1.0 . 5.39 215 213 A 34 LYS HDy A 34 LYS HA 1.0 . 3.83 216 214 A 16 TYR H A 15 LYS HA 1.0 . 2.75 217 215 A 25 PHE HA A 15 LYS HA 1.0 . 4.01 218 216 A 15 LYS HDy A 15 LYS HA 1.0 . 4.20 219 217 A 15 LYS HGy A 15 LYS HA 1.0 . 3.89 220 218 A 24 THR H A 15 LYS HA 1.0 . 4.62 221 219 A 17 LYS H A 16 TYR HA 1.0 . 2.92 222 220 A 16 TYR HD% A 16 TYR HA 1.0 . 4.26 223 221 A 16 TYR HA A 5 GLY HAx 1.0 . 4.42 224 222 A 14 CYS H A 13 GLU HA 1.0 . 2.79 225 223 A 13 GLU HA A 27 LYS HA 1.0 . 3.75 226 224 A 53 ASP HBy A 52 VAL HA 1.0 . 4.73 227 225 A 13 GLU HA A 14 CYS HBx 1.0 . 5.03 228 226 A 45 VAL HB A 52 VAL HA 1.0 . 5.50 229 227 A 52 VAL HA A 45 VAL HA 1.0 . 5.50 230 228 A 52 VAL HGx% A 52 VAL HA 1.0 . 3.74 231 229 A 13 GLU HA A 26 ILE HG2% 1.0 . 4.74 232 230 A 53 ASP H A 52 VAL HA 1.0 . 2.75 233 231 A 52 VAL HGy% A 52 VAL HA 1.0 . 3.72 234 232 A 52 VAL HA A 45 VAL HGx% 1.0 . 4.59 235 232 A 45 VAL HGy% A 52 VAL HA 1.0 . 4.59 236 233 A 37 THR HG2% A 36 CYS HA 1.0 . 4.88 237 234 A 37 THR H A 36 CYS HA 1.0 . 2.88 238 235 A 54 CYS HBy A 36 CYS HA 1.0 . 3.55 239 236 A 4 THR HB A 3 TYR HA 1.0 . 5.50 240 237 A 4 THR H A 3 TYR HA 1.0 . 2.84 241 238 A 3 TYR HD% A 3 TYR HA 1.0 . 3.48 242 239 A 54 CYS H A 53 ASP HA 1.0 . 2.81 243 240 A 53 ASP HA A 34 LYS HBx 1.0 . 3.32 244 241 A 8 THR HA A 39 ASP HBx 1.0 . 4.58 245 242 A 10 SER H A 8 THR HA 1.0 . 3.45 246 243 A 33 ASN HA A 33 ASN HD22 1.0 . 3.36 247 244 A 8 THR HA A 10 SER HBy 1.0 . 4.79 248 244 A 8 THR HA A 10 SER HBx 1.0 . 4.79 249 245 A 33 ASN HA A 33 ASN HD21 1.0 . 3.27 250 246 A 9 LYS H A 8 THR HA 1.0 . 2.96 251 247 A 8 THR HG2% A 8 THR HA 1.0 . 4.13 252 248 A 55 ASP H A 54 CYS HA 1.0 . 3.00 253 249 A 43 CYS HA A 54 CYS HA 1.0 . 3.83 254 250 A 28 CYS HA A 29 PRO HDy 1.0 . 3.17 255 251 A 29 PRO HGy A 28 CYS HA 1.0 . 5.50 256 252 A 52 VAL HGx% A 28 CYS HA 1.0 . 3.56 257 253 A 28 CYS HA A 52 VAL HB 1.0 . 3.98 258 254 A 15 LYS H A 14 CYS HA 1.0 . 2.81 259 255 A 7 CYS HA A 14 CYS HA 1.0 . 3.04 260 256 A 5 GLY HAy A 16 TYR HBy 1.0 . 4.54 261 257 A 33 ASN H A 35 LYS HA 1.0 . 5.35 262 258 A 54 CYS HBy A 35 LYS HA 1.0 . 4.05 263 259 A 35 LYS HA A 28 CYS HBx 1.0 . 3.89 264 260 A 27 LYS H A 26 ILE HA 1.0 . 2.68 265 261 A 12 ASN HD22 A 35 LYS HA 1.0 . 4.45 266 262 A 35 LYS HA A 28 CYS HBy 1.0 . 3.09 267 263 A 26 ILE HA A 26 ILE HD1% 1.0 . 3.46 268 264 A 26 ILE HG12 A 26 ILE HA 1.0 . 3.83 269 265 A 26 ILE HG2% A 26 ILE HA 1.0 . 3.66 270 266 A 36 CYS H A 35 LYS HA 1.0 . 2.86 271 267 A 12 ASN HD21 A 35 LYS HA 1.0 . 4.85 272 268 A 47 THR HB A 45 VAL HGx% 1.0 . 4.61 273 268 A 45 VAL HGy% A 47 THR HB 1.0 . 4.61 274 269 A 40 ASN H A 39 ASP HA 1.0 . 2.64 275 270 A 41 ASN H A 39 ASP HA 1.0 . 3.96 276 271 A 9 LYS H A 39 ASP HA 1.0 . 3.38 277 272 A 8 THR H A 12 ASN HA 1.0 . 4.84 278 273 A 12 ASN H A 12 ASN HA 1.0 . 2.81 279 274 A 13 GLU H A 12 ASN HA 1.0 . 3.09 280 275 A 36 CYS HBx A 12 ASN HA 1.0 . 3.72 281 276 A 30 LYS H A 31 PHE HA 1.0 . 5.50 282 277 A 31 PHE HA A 30 LYS HBy 1.0 . 4.90 283 278 A 49 ASN HD21 A 49 ASN HA 1.0 . 5.50 284 279 A 49 ASN HD22 A 49 ASN HA 1.0 . 5.50 285 280 A 52 VAL H A 51 ALA HA 1.0 . 2.66 286 281 A 45 VAL HA A 46 ASP HBx 1.0 . 4.71 287 282 A 52 VAL HGy% A 45 VAL HA 1.0 . 4.51 288 283 A 45 VAL HA A 45 VAL HGx% 1.0 . 3.57 289 283 A 45 VAL HGy% A 45 VAL HA 1.0 . 3.57 290 284 A 46 ASP H A 45 VAL HA 1.0 . 2.72 291 285 A 30 LYS HA A 29 PRO HA 1.0 . 5.50 292 286 A 30 LYS H A 29 PRO HA 1.0 . 2.75 293 287 A 31 PHE H A 29 PRO HA 1.0 . 4.44 294 288 A 28 CYS HA A 29 PRO HA 1.0 . 4.38 295 289 A 18 ASN H A 17 LYS HA 1.0 . 2.69 296 290 A 17 LYS HA A 21 GLY HAx 1.0 . 5.50 297 291 A 16 TYR HD% A 17 LYS HA 1.0 . 5.19 298 292 A 3 TYR HD% A 17 LYS HA 1.0 . 5.50 299 293 A 48 TYR HD% A 48 TYR HA 1.0 . 3.56 300 294 A 7 CYS H A 42 LYS HA 1.0 . 5.00 301 295 A 43 CYS H A 42 LYS HA 1.0 . 2.63 302 296 A 6 LYS HA A 42 LYS HA 1.0 . 4.12 303 297 A 42 LYS HA A 42 LYS HGx 1.0 . 4.24 304 298 A 22 LYS HA A 23 ASP H 1.0 . 2.68 305 299 A 22 LYS HGx A 22 LYS HA 1.0 . 4.18 306 300 A 9 LYS HA A 37 THR HA 1.0 . 5.50 307 301 A 37 THR HG2% A 37 THR HA 1.0 . 3.25 308 302 A 6 LYS HBy A 40 ASN HA 1.0 . 3.18 309 303 A 40 ASN H A 40 ASN HA 1.0 . 2.75 310 304 A 40 ASN HA A 6 LYS HBx 1.0 . 3.60 311 305 A 7 CYS H A 40 ASN HA 1.0 . 4.22 312 306 A 41 ASN H A 40 ASN HA 1.0 . 3.45 313 307 A 40 ASN HA A 40 ASN HD21 1.0 . 5.50 314 308 A 16 TYR H A 23 ASP HA 1.0 . 4.51 315 309 A 17 LYS HA A 23 ASP HA 1.0 . 5.50 316 310 A 15 LYS HDy A 23 ASP HA 1.0 . 5.50 317 311 A 24 THR H A 23 ASP HA 1.0 . 2.70 318 312 A 25 PHE HE% A 23 ASP HA 1.0 . 5.09 319 313 A 23 ASP HA A 24 THR HB 1.0 . 4.80 320 314 A 15 LYS HGy A 23 ASP HA 1.0 . 5.50 321 315 A 52 VAL HGy% A 50 ASN HA 1.0 . 5.41 322 316 A 46 ASP H A 50 ASN HA 1.0 . 4.98 323 317 A 51 ALA H A 50 ASN HA 1.0 . 2.57 324 318 A 3 TYR HD% A 47 THR HA 1.0 . 5.50 325 319 A 50 ASN HA A 50 ASN HD22 1.0 . 5.50 326 320 A 50 ASN HA A 45 VAL HGx% 1.0 . 4.24 327 320 A 45 VAL HGy% A 50 ASN HA 1.0 . 4.24 328 321 A 47 THR HG2% A 47 THR HA 1.0 . 3.38 329 322 A 27 LYS HA A 28 CYS HBx 1.0 . 5.42 330 323 A 14 CYS H A 27 LYS HA 1.0 . 3.78 331 324 A 28 CYS H A 27 LYS HA 1.0 . 2.72 332 325 A 27 LYS HA A 13 GLU HGy 1.0 . 4.36 333 326 A 27 LYS HA A 27 LYS HGy 1.0 . 4.02 334 327 A 13 GLU HGx A 27 LYS HA 1.0 . 4.69 335 328 A 35 LYS HBy A 32 ASP HA 1.0 . 4.19 336 329 A 32 ASP HA A 35 LYS HGy 1.0 . 4.95 337 330 A 34 LYS H A 32 ASP HA 1.0 . 4.63 338 331 A 35 LYS H A 32 ASP HA 1.0 . 4.55 339 332 A 37 THR H A 38 LYS HA 1.0 . 5.50 340 333 A 39 ASP H A 38 LYS HA 1.0 . 2.65 341 334 A 41 ASN HD21 A 38 LYS HA 1.0 . 5.50 342 335 A 38 LYS HA A 39 ASP HBy 1.0 . 4.64 343 336 A 38 LYS HA A 38 LYS HBx 1.0 . 2.98 344 337 A 18 ASN HD21 A 18 ASN HA 1.0 . 5.20 345 338 A 3 TYR HD% A 18 ASN HA 1.0 . 4.51 346 339 A 3 TYR HE% A 18 ASN HA 1.0 . 3.93 347 340 A 16 TYR HD% A 18 ASN HA 1.0 . 4.06 348 341 A 16 TYR HE% A 18 ASN HA 1.0 . 4.32 349 342 A 9 LYS H A 8 THR HB 1.0 . 3.70 350 343 A 8 THR H A 8 THR HB 1.0 . 3.72 351 344 A 53 ASP HBy A 44 THR HB 1.0 . 4.70 352 345 A 44 THR H A 44 THR HB 1.0 . 4.14 353 346 A 45 VAL H A 44 THR HB 1.0 . 3.46 354 347 A 4 THR HB A 4 THR H 1.0 . 3.37 355 348 A 24 THR HA A 25 PHE HA 1.0 . 5.50 356 349 A 25 PHE H A 24 THR HA 1.0 . 2.74 357 350 A 24 THR HG2% A 24 THR HA 1.0 . 3.44 358 351 A 25 PHE HE% A 24 THR HA 1.0 . 4.91 359 352 A 12 ASN H A 10 SER HA 1.0 . 5.09 360 353 A 5 GLY HAx A 16 TYR HBy 1.0 . 3.60 361 354 A 16 TYR HD% A 5 GLY HAx 1.0 . 5.31 362 355 A 5 GLY HAx A 16 TYR HBx 1.0 . 4.12 363 356 A 6 LYS H A 5 GLY HAx 1.0 . 2.98 364 357 A 15 LYS H A 5 GLY HAx 1.0 . 5.03 365 358 A 30 LYS HGy A 30 LYS HA 1.0 . 3.95 366 359 A 8 THR HG2% A 10 SER HBy 1.0 . 3.36 367 359 A 8 THR HG2% A 10 SER HBx 1.0 . 3.36 368 360 A 29 PRO HDy A 52 VAL HB 1.0 . 3.38 369 361 A 52 VAL HGx% A 29 PRO HDy 1.0 . 3.79 370 362 A 52 VAL HGy% A 29 PRO HDy 1.0 . 4.67 371 363 A 55 ASP H A 43 CYS HBx 1.0 . 4.44 372 364 A 7 CYS HA A 43 CYS HBx 1.0 . 5.21 373 365 A 20 ALA HB% A 21 GLY HAx 1.0 . 5.50 374 366 A 21 GLY HAx A 17 LYS HBx 1.0 . 5.26 375 367 A 21 GLY HAx A 17 LYS HBy 1.0 . 3.81 376 368 A 54 CYS HBy A 43 CYS HBy 1.0 . 4.60 377 369 A 36 CYS H A 54 CYS HBy 1.0 . 3.68 378 370 A 38 LYS H A 9 LYS HA 1.0 . 4.56 379 371 A 36 CYS HBx A 9 LYS HA 1.0 . 3.90 380 372 A 8 THR H A 9 LYS HA 1.0 . 5.50 381 373 A 29 PRO HBx A 31 PHE HBx 1.0 . 5.20 382 374 A 31 PHE H A 31 PHE HBx 1.0 . 3.92 383 375 A 8 THR H A 7 CYS HBx 1.0 . 3.35 384 376 A 18 ASN HD21 A 18 ASN HBx 1.0 . 3.76 385 377 A 18 ASN HBx A 18 ASN HD22 1.0 . 4.04 386 378 A 19 ASP H A 18 ASN HBx 1.0 . 3.73 387 379 A 40 ASN H A 41 ASN HBx 1.0 . 5.17 388 380 A 55 ASP HBy A 41 ASN HBx 1.0 . 4.13 389 381 A 42 LYS H A 41 ASN HBx 1.0 . 3.91 390 382 A 41 ASN H A 41 ASN HBx 1.0 . 2.92 391 383 A 41 ASN HD22 A 41 ASN HBx 1.0 . 3.51 392 384 A 41 ASN HD21 A 41 ASN HBx 1.0 . 4.04 393 385 A 37 THR H A 41 ASN HBx 1.0 . 5.50 394 386 A 46 ASP H A 46 ASP HBx 1.0 . 3.36 395 387 A 47 THR H A 46 ASP HBx 1.0 . 4.88 396 388 A 51 ALA HB% A 46 ASP HBx 1.0 . 3.57 397 389 A 49 ASN HD22 A 46 ASP HBx 1.0 . 5.50 398 390 A 12 ASN HD22 A 28 CYS HBx 1.0 . 4.62 399 391 A 52 VAL HGx% A 28 CYS HBx 1.0 . 4.98 400 392 A 36 CYS H A 28 CYS HBx 1.0 . 4.45 401 393 A 28 CYS H A 28 CYS HBx 1.0 . 3.96 402 394 A 12 ASN HD21 A 28 CYS HBx 1.0 . 4.83 403 395 A 37 THR H A 36 CYS HBy 1.0 . 5.07 404 396 A 36 CYS HBy A 8 THR H 1.0 . 4.76 405 397 A 36 CYS HBy A 7 CYS HA 1.0 . 5.06 406 398 A 36 CYS HBy A 7 CYS HBx 1.0 . 4.45 407 399 A 36 CYS HBy A 9 LYS HA 1.0 . 3.97 408 400 A 12 ASN HBx A 12 ASN HD22 1.0 . 3.95 409 401 A 39 ASP HBy A 40 ASN HBx 1.0 . 4.58 410 402 A 12 ASN HBx A 12 ASN HD21 1.0 . 3.33 411 403 A 41 ASN H A 40 ASN HBx 1.0 . 5.35 412 404 A 40 ASN HD21 A 40 ASN HBx 1.0 . 3.46 413 405 A 33 ASN HBy A 33 ASN HD21 1.0 . 4.00 414 406 A 48 TYR H A 48 TYR HBy 1.0 . 3.41 415 407 A 48 TYR HBy A 49 ASN H 1.0 . 4.00 416 408 A 40 ASN HBy A 6 LYS HBx 1.0 . 4.56 417 409 A 36 CYS H A 36 CYS HBx 1.0 . 3.46 418 410 A 2 LYS HBy A 2 LYS HEy 1.0 . 3.59 419 411 A 26 ILE HG2% A 14 CYS HBx 1.0 . 3.59 420 412 A 14 CYS H A 14 CYS HBx 1.0 . 3.22 421 413 A 34 LYS HDy A 33 ASN HBx 1.0 . 3.93 422 414 A 33 ASN HBx A 34 LYS HGy 1.0 . 3.73 423 415 A 26 ILE HG12 A 14 CYS HBx 1.0 . 4.84 424 416 A 48 TYR H A 48 TYR HBx 1.0 . 3.33 425 417 A 49 ASN H A 48 TYR HBx 1.0 . 3.67 426 418 A 43 CYS HBx A 7 CYS HBy 1.0 . 3.89 427 419 A 7 CYS H A 7 CYS HBy 1.0 . 3.84 428 420 A 8 THR H A 7 CYS HBy 1.0 . 4.02 429 421 A 28 CYS H A 28 CYS HBy 1.0 . 3.23 430 422 A 12 ASN HD22 A 28 CYS HBy 1.0 . 4.02 431 423 A 38 LYS HDy A 41 ASN HBy 1.0 . 5.36 432 424 A 44 THR HG2% A 53 ASP HBy 1.0 . 3.85 433 425 A 12 ASN HD21 A 28 CYS HBy 1.0 . 4.20 434 426 A 38 LYS H A 41 ASN HBy 1.0 . 5.50 435 427 A 41 ASN H A 41 ASN HBy 1.0 . 3.51 436 428 A 41 ASN HD21 A 41 ASN HBy 1.0 . 4.08 437 429 A 52 VAL HGx% A 28 CYS HBy 1.0 . 4.51 438 430 A 42 LYS H A 41 ASN HBy 1.0 . 3.28 439 431 A 53 ASP H A 53 ASP HBy 1.0 . 3.74 440 432 A 3 TYR H A 3 TYR HBx 1.0 . 4.10 441 433 A 4 THR H A 3 TYR HBx 1.0 . 3.53 442 434 A 16 TYR HD% A 3 TYR HBx 1.0 . 3.89 443 435 A 3 TYR HBx A 45 VAL HB 1.0 . 3.94 444 436 A 2 LYS HDy A 3 TYR HBx 1.0 . 5.22 445 437 A 51 ALA HB% A 49 ASN HBy 1.0 . 4.80 446 438 A 49 ASN HBy A 49 ASN HD21 1.0 . 3.63 447 439 A 50 ASN H A 50 ASN HBx 1.0 . 4.13 448 440 A 41 ASN HD21 A 55 ASP HBy 1.0 . 4.78 449 441 A 50 ASN HBx A 50 ASN HD21 1.0 . 3.82 450 442 A 19 ASP H A 19 ASP HBy 1.0 . 4.10 451 443 A 55 ASP H A 55 ASP HBy 1.0 . 3.05 452 444 A 26 ILE HA A 25 PHE HBy 1.0 . 5.18 453 445 A 25 PHE H A 25 PHE HBy 1.0 . 3.06 454 446 A 26 ILE H A 25 PHE HBy 1.0 . 3.93 455 447 A 44 THR H A 43 CYS HBy 1.0 . 3.51 456 448 A 15 LYS H A 14 CYS HBy 1.0 . 4.21 457 449 A 14 CYS H A 14 CYS HBy 1.0 . 3.37 458 450 A 17 LYS H A 16 TYR HBx 1.0 . 3.25 459 451 A 3 TYR HD% A 16 TYR HBx 1.0 . 5.21 460 452 A 40 ASN H A 39 ASP HBx 1.0 . 3.78 461 453 A 39 ASP H A 39 ASP HBx 1.0 . 3.53 462 454 A 15 LYS HBx A 15 LYS HEy 1.0 . 4.99 463 455 A 8 THR HG2% A 39 ASP HBx 1.0 . 4.64 464 456 A 9 LYS H A 39 ASP HBx 1.0 . 4.45 465 457 A 25 PHE HE% A 15 LYS HEy 1.0 . 4.26 466 458 A 33 ASN H A 32 ASP HBy 1.0 . 4.92 467 459 A 19 ASP H A 18 ASN HBy 1.0 . 4.22 468 460 A 18 ASN H A 18 ASN HBy 1.0 . 3.59 469 461 A 18 ASN HD21 A 18 ASN HBy 1.0 . 3.56 470 462 A 18 ASN HD22 A 18 ASN HBy 1.0 . 3.97 471 463 A 30 LYS H A 29 PRO HBy 1.0 . 4.07 472 464 A 8 THR HG2% A 39 ASP HBy 1.0 . 5.16 473 465 A 40 ASN H A 39 ASP HBy 1.0 . 4.30 474 466 A 9 LYS H A 39 ASP HBy 1.0 . 5.01 475 467 A 39 ASP H A 39 ASP HBy 1.0 . 3.13 476 468 A 34 LYS H A 31 PHE HBy 1.0 . 4.16 477 469 A 48 TYR HD% A 49 ASN HBx 1.0 . 4.64 478 470 A 49 ASN HBx A 49 ASN HD21 1.0 . 3.85 479 471 A 49 ASN HBx A 48 TYR HE% 1.0 . 5.50 480 472 A 47 THR H A 46 ASP HBy 1.0 . 4.53 481 473 A 50 ASN H A 46 ASP HBy 1.0 . 4.20 482 474 A 46 ASP H A 46 ASP HBy 1.0 . 3.54 483 475 A 25 PHE HE% A 23 ASP HBy 1.0 . 4.23 484 476 A 24 THR H A 23 ASP HBy 1.0 . 4.60 485 477 A 23 ASP H A 23 ASP HBy 1.0 . 3.19 486 478 A 44 THR H A 53 ASP HBx 1.0 . 5.08 487 479 A 53 ASP H A 53 ASP HBx 1.0 . 3.70 488 480 A 17 LYS H A 16 TYR HBy 1.0 . 3.67 489 481 A 3 TYR HD% A 16 TYR HBy 1.0 . 5.50 490 482 A 5 GLY H A 16 TYR HBy 1.0 . 5.18 491 483 A 54 CYS H A 34 LYS HBx 1.0 . 3.82 492 484 A 34 LYS H A 34 LYS HBx 1.0 . 4.01 493 485 A 35 LYS H A 34 LYS HBx 1.0 . 4.79 494 486 A 16 TYR H A 16 TYR HBy 1.0 . 3.89 495 487 A 30 LYS H A 29 PRO HGx 1.0 . 5.40 496 488 A 25 PHE H A 24 THR HB 1.0 . 4.92 497 489 A 18 ASN H A 24 THR HB 1.0 . 5.36 498 490 A 16 TYR HE% A 24 THR HB 1.0 . 5.08 499 491 A 24 THR H A 24 THR HB 1.0 . 3.36 500 492 A 13 GLU H A 12 ASN HBy 1.0 . 4.77 501 493 A 12 ASN H A 12 ASN HBy 1.0 . 3.67 502 494 A 12 ASN HD21 A 12 ASN HBy 1.0 . 3.75 503 495 A 29 PRO HGy A 28 CYS HBy 1.0 . 5.48 504 496 A 52 VAL H A 29 PRO HGy 1.0 . 5.30 505 497 A 14 CYS H A 13 GLU HGx 1.0 . 4.62 506 498 A 26 ILE H A 13 GLU HGx 1.0 . 5.42 507 499 A 13 GLU H A 13 GLU HGx 1.0 . 4.95 508 500 A 26 ILE H A 13 GLU HGy 1.0 . 5.40 509 501 A 13 GLU H A 13 GLU HGy 1.0 . 4.74 510 502 A 14 CYS H A 13 GLU HGy 1.0 . 4.61 511 503 A 25 PHE HD% A 13 GLU HGy 1.0 . 4.82 512 504 A 53 ASP H A 52 VAL HB 1.0 . 4.73 513 505 A 52 VAL H A 52 VAL HB 1.0 . 3.30 514 506 A 29 PRO HGx A 52 VAL HB 1.0 . 5.46 515 507 A 27 LYS H A 27 LYS HBy 1.0 . 3.50 516 508 A 23 ASP H A 23 ASP HBx 1.0 . 3.66 517 509 A 15 LYS HDy A 23 ASP HBx 1.0 . 5.09 518 510 A 25 PHE HE% A 23 ASP HBx 1.0 . 3.90 519 511 A 15 LYS HGy A 23 ASP HBx 1.0 . 4.62 520 512 A 24 THR H A 23 ASP HBx 1.0 . 3.97 521 513 A 15 LYS HEy A 23 ASP HBx 1.0 . 4.98 522 514 A 45 VAL H A 3 TYR HBy 1.0 . 4.53 523 515 A 16 TYR HE% A 3 TYR HBy 1.0 . 4.26 524 516 A 2 LYS HDy A 3 TYR HBy 1.0 . 4.20 525 517 A 26 ILE H A 26 ILE HB 1.0 . 3.78 526 518 A 4 THR H A 3 TYR HBy 1.0 . 4.22 527 519 A 16 TYR HD% A 3 TYR HBy 1.0 . 4.09 528 520 A 3 TYR HBy A 16 TYR HBx 1.0 . 4.29 529 521 A 38 LYS H A 38 LYS HBy 1.0 . 3.52 530 522 A 41 ASN HD21 A 38 LYS HBy 1.0 . 4.00 531 523 A 41 ASN HD22 A 38 LYS HBy 1.0 . 4.30 532 524 A 12 ASN HD21 A 27 LYS HBx 1.0 . 4.90 533 525 A 9 LYS H A 9 LYS HBy 1.0 . 3.10 534 526 A 43 CYS H A 42 LYS HBy 1.0 . 4.08 535 527 A 9 LYS HBy A 9 LYS HGy 1.0 . 2.94 536 528 A 38 LYS HBy A 41 ASN HBy 1.0 . 4.23 537 529 A 15 LYS HBx A 15 LYS HEx 1.0 . 3.74 538 530 A 15 LYS HDy A 15 LYS HBx 1.0 . 3.80 539 531 A 16 TYR H A 15 LYS HBx 1.0 . 5.03 540 532 A 15 LYS H A 15 LYS HBx 1.0 . 3.21 541 533 A 13 GLU H A 13 GLU HBx 1.0 . 3.58 542 534 A 25 PHE HE% A 15 LYS HBx 1.0 . 4.33 543 535 A 15 LYS HBx A 14 CYS HA 1.0 . 4.92 544 536 A 26 ILE H A 26 ILE HD1% 1.0 . 5.08 545 537 A 26 ILE HG2% A 26 ILE HD1% 1.0 . 3.76 546 538 A 3 TYR HA A 17 LYS HBx 1.0 . 4.90 547 539 A 17 LYS H A 17 LYS HBx 1.0 . 3.21 548 540 A 18 ASN H A 17 LYS HBx 1.0 . 4.96 549 541 A 7 CYS H A 6 LYS HBx 1.0 . 4.06 550 542 A 40 ASN H A 6 LYS HBx 1.0 . 4.81 551 543 A 6 LYS HBx A 40 ASN HBx 1.0 . 5.50 552 544 A 6 LYS HBx A 40 ASN HD21 1.0 . 5.29 553 545 A 36 CYS H A 35 LYS HBy 1.0 . 3.76 554 546 A 12 ASN HD21 A 35 LYS HBy 1.0 . 5.41 555 547 A 35 LYS H A 35 LYS HBy 1.0 . 3.50 556 548 A 3 TYR H A 2 LYS HBy 1.0 . 4.33 557 549 A 53 ASP HA A 34 LYS HBy 1.0 . 4.39 558 550 A 34 LYS H A 34 LYS HBy 1.0 . 3.41 559 551 A 7 CYS H A 6 LYS HBy 1.0 . 3.77 560 552 A 40 ASN H A 6 LYS HBy 1.0 . 4.31 561 553 A 41 ASN H A 6 LYS HBy 1.0 . 5.14 562 554 A 18 ASN HD21 A 22 LYS HBy 1.0 . 4.67 563 555 A 18 ASN HD22 A 22 LYS HBy 1.0 . 4.17 564 556 A 23 ASP H A 22 LYS HBy 1.0 . 3.78 565 557 A 22 LYS H A 22 LYS HBy 1.0 . 3.63 566 558 A 43 CYS H A 6 LYS HBy 1.0 . 4.86 567 559 A 27 LYS H A 27 LYS HGy 1.0 . 3.68 568 560 A 29 PRO HBx A 31 PHE HZ 1.0 . 5.20 569 561 A 29 PRO HBx A 31 PHE HE% 1.0 . 3.70 570 562 A 31 PHE H A 29 PRO HBx 1.0 . 3.44 571 563 A 38 LYS HBx A 41 ASN HBy 1.0 . 3.45 572 564 A 41 ASN HD21 A 38 LYS HBx 1.0 . 3.63 573 565 A 38 LYS H A 38 LYS HBx 1.0 . 3.67 574 566 A 38 LYS HBx A 41 ASN HBx 1.0 . 5.50 575 567 A 37 THR H A 38 LYS HBx 1.0 . 5.34 576 568 A 39 ASP H A 38 LYS HBx 1.0 . 3.31 577 569 A 18 ASN HD21 A 22 LYS HBx 1.0 . 4.37 578 570 A 18 ASN HD22 A 22 LYS HBx 1.0 . 3.78 579 571 A 22 LYS H A 22 LYS HBx 1.0 . 3.21 580 572 A 15 LYS H A 15 LYS HBy 1.0 . 3.49 581 573 A 25 PHE HD% A 15 LYS HBy 1.0 . 3.84 582 574 A 18 ASN H A 17 LYS HBy 1.0 . 4.06 583 575 A 16 TYR H A 15 LYS HBy 1.0 . 4.23 584 576 A 17 LYS H A 17 LYS HBy 1.0 . 3.64 585 577 A 15 LYS HBy A 15 LYS HEy 1.0 . 3.68 586 578 A 15 LYS HBy A 15 LYS HEx 1.0 . 3.70 587 579 A 34 LYS H A 34 LYS HGy 1.0 . 4.21 588 580 A 31 PHE HE% A 30 LYS HBy 1.0 . 4.95 589 581 A 31 PHE H A 30 LYS HBy 1.0 . 4.36 590 582 A 30 LYS H A 30 LYS HBy 1.0 . 3.29 591 583 A 6 LYS HGy A 6 LYS HBx 1.0 . 2.98 592 584 A 41 ASN HD21 A 38 LYS HDy 1.0 . 5.47 593 585 A 42 LYS H A 42 LYS HGx 1.0 . 4.76 594 586 A 39 ASP H A 38 LYS HDy 1.0 . 3.91 595 587 A 6 LYS HGy A 6 LYS H 1.0 . 5.03 596 588 A 12 ASN H A 11 LYS HBx 1.0 . 4.62 597 589 A 27 LYS H A 26 ILE HG12 1.0 . 3.52 598 590 A 22 LYS H A 20 ALA HB% 1.0 . 4.13 599 591 A 20 ALA H A 20 ALA HB% 1.0 . 3.14 600 592 A 20 ALA HB% A 21 GLY HAy 1.0 . 5.50 601 593 A 12 ASN HD22 A 35 LYS HDy 1.0 . 5.50 602 594 A 47 THR H A 47 THR HG2% 1.0 . 3.35 603 595 A 46 ASP H A 51 ALA HB% 1.0 . 4.30 604 596 A 51 ALA H A 51 ALA HB% 1.0 . 3.18 605 597 A 51 ALA HB% A 49 ASN HD22 1.0 . 4.53 606 598 A 51 ALA HB% A 46 ASP HBy 1.0 . 4.27 607 599 A 7 CYS H A 6 LYS HGx 1.0 . 4.98 608 600 A 42 LYS H A 42 LYS HGy 1.0 . 4.48 609 601 A 51 ALA HB% A 49 ASN HBx 1.0 . 5.42 610 602 A 4 THR HG2% A 3 TYR HA 1.0 . 5.50 611 603 A 4 THR H A 4 THR HG2% 1.0 . 4.83 612 604 A 47 THR HG2% A 2 LYS HA 1.0 . 5.50 613 605 A 22 LYS H A 22 LYS HGy 1.0 . 4.39 614 606 A 8 THR HG2% A 7 CYS HA 1.0 . 5.50 615 607 A 8 THR HG2% A 8 THR H 1.0 . 4.62 616 608 A 9 LYS H A 9 LYS HGy 1.0 . 3.09 617 609 A 38 LYS HBy A 38 LYS HGy 1.0 . 2.95 618 610 A 17 LYS HGy A 2 LYS HA 1.0 . 5.50 619 611 A 17 LYS HGy A 3 TYR HBx 1.0 . 5.14 620 612 A 45 VAL H A 45 VAL HB 1.0 . 3.41 621 613 A 3 TYR HD% A 45 VAL HB 1.0 . 3.72 622 614 A 3 TYR HBy A 45 VAL HB 1.0 . 3.83 623 615 A 52 VAL HGy% A 45 VAL HB 1.0 . 4.62 624 616 A 22 LYS H A 22 LYS HGx 1.0 . 4.11 625 617 A 21 GLY H A 22 LYS HGx 1.0 . 5.41 626 618 A 37 THR H A 37 THR HG2% 1.0 . 3.69 627 619 A 38 LYS H A 37 THR HG2% 1.0 . 4.67 628 620 A 37 THR HG2% A 35 LYS HGy 1.0 . 4.35 629 621 A 9 LYS H A 9 LYS HGx 1.0 . 4.36 630 622 A 9 LYS HGx A 9 LYS HA 1.0 . 4.08 631 623 A 45 VAL H A 44 THR HG2% 1.0 . 4.17 632 624 A 5 GLY H A 44 THR HG2% 1.0 . 5.29 633 625 A 44 THR H A 44 THR HG2% 1.0 . 4.07 634 626 A 44 THR HG2% A 5 GLY HAy 1.0 . 5.50 635 627 A 30 LYS H A 30 LYS HGy 1.0 . 3.50 636 628 A 14 CYS H A 52 VAL HGx% 1.0 . 5.26 637 629 A 44 THR H A 52 VAL HGx% 1.0 . 5.20 638 630 A 54 CYS H A 52 VAL HGx% 1.0 . 4.71 639 631 A 53 ASP H A 52 VAL HGx% 1.0 . 3.63 640 632 A 52 VAL H A 52 VAL HGx% 1.0 . 4.47 641 633 A 54 CYS HBy A 52 VAL HGx% 1.0 . 5.50 642 634 A 14 CYS HBy A 52 VAL HGx% 1.0 . 3.94 643 635 A 29 PRO HGx A 52 VAL HGx% 1.0 . 5.50 644 636 A 29 PRO HGy A 52 VAL HGx% 1.0 . 5.50 645 637 A 52 VAL HGx% A 14 CYS HBx 1.0 . 4.49 646 638 A 53 ASP H A 52 VAL HGy% 1.0 . 4.13 647 639 A 51 ALA H A 52 VAL HGy% 1.0 . 5.18 648 640 A 52 VAL HGy% A 14 CYS HBx 1.0 . 5.18 649 641 A 14 CYS H A 26 ILE HG2% 1.0 . 4.23 650 642 A 26 ILE H A 26 ILE HG2% 1.0 . 3.41 651 643 A 34 LYS H A 35 LYS HGy 1.0 . 5.49 652 644 A 26 ILE HG2% A 14 CYS HBy 1.0 . 3.89 653 645 A 52 VAL HGy% A 26 ILE HG2% 1.0 . 3.49 654 646 A 16 TYR HD% A 26 ILE HG2% 1.0 . 4.13 655 647 A 26 ILE HG2% A 52 VAL HGx% 1.0 . 4.24 656 648 A 36 CYS H A 35 LYS HGy 1.0 . 4.75 657 649 A 35 LYS H A 35 LYS HGy 1.0 . 3.73 658 650 A 26 ILE HG2% A 52 VAL HB 1.0 . 5.41 659 651 A 26 ILE HG12 A 26 ILE HG2% 1.0 . 3.07 660 652 A 16 TYR H A 24 THR HG2% 1.0 . 5.42 661 653 A 24 THR H A 24 THR HG2% 1.0 . 4.41 662 654 A 24 THR HG2% A 18 ASN HD21 1.0 . 5.07 663 655 A 24 THR HG2% A 18 ASN HD22 1.0 . 5.33 664 656 A 16 TYR H A 15 LYS HDy 1.0 . 4.05 665 657 A 15 LYS HDy A 15 LYS H 1.0 . 5.01 666 658 A 15 LYS HDy A 25 PHE HE% 1.0 . 4.72 667 659 A 15 LYS HDy A 15 LYS HBy 1.0 . 3.35 668 660 A 15 LYS HDy A 25 PHE HD% 1.0 . 5.50 669 661 A 47 THR H A 45 VAL HGx% 1.0 . 4.82 670 661 A 47 THR H A 45 VAL HGy% 1.0 . 4.82 671 662 A 3 TYR H A 45 VAL HGx% 1.0 . 4.94 672 662 A 3 TYR H A 45 VAL HGy% 1.0 . 4.94 673 663 A 51 ALA H A 45 VAL HGx% 1.0 . 5.17 674 663 A 51 ALA H A 45 VAL HGy% 1.0 . 5.17 675 664 A 3 TYR HD% A 45 VAL HGx% 1.0 . 4.05 676 664 A 3 TYR HD% A 45 VAL HGy% 1.0 . 4.05 677 665 A 3 TYR HE% A 45 VAL HGx% 1.0 . 5.31 678 665 A 3 TYR HE% A 45 VAL HGy% 1.0 . 5.31 679 666 A 3 TYR HA A 45 VAL HGx% 1.0 . 5.21 680 666 A 45 VAL HGy% A 3 TYR HA 1.0 . 5.21 681 667 A 3 TYR HBx A 45 VAL HGx% 1.0 . 5.24 682 667 A 3 TYR HBx A 45 VAL HGy% 1.0 . 5.24 683 668 A 52 VAL HB A 45 VAL HGx% 1.0 . 5.50 684 668 A 45 VAL HGy% A 52 VAL HB 1.0 . 5.50 685 669 A 51 ALA HB% A 45 VAL HGx% 1.0 . 3.91 686 669 A 51 ALA HB% A 45 VAL HGy% 1.0 . 3.91 687 670 A 46 ASP H A 45 VAL HGx% 1.0 . 3.74 688 670 A 46 ASP H A 45 VAL HGy% 1.0 . 3.74 689 671 A 3 TYR HBy A 45 VAL HGx% 1.0 . 4.33 690 671 A 45 VAL HGy% A 3 TYR HBy 1.0 . 4.33 691 672 A 52 VAL HGy% A 45 VAL HGx% 1.0 . 3.75 692 672 A 52 VAL HGy% A 45 VAL HGy% 1.0 . 3.75 693 673 A 2 LYS HDy A 45 VAL H 1.0 . 3.67 694 674 A 16 TYR H A 15 LYS HGy 1.0 . 4.12 695 675 A 24 THR H A 15 LYS HGy 1.0 . 4.89 696 676 A 25 PHE HE% A 15 LYS HGy 1.0 . 4.04 697 677 A 25 PHE HD% A 15 LYS HGy 1.0 . 4.92 698 678 A 15 LYS HGy A 23 ASP HBy 1.0 . 5.50 699 679 A 15 LYS HDy A 15 LYS HGy 1.0 . 2.98 700 680 A 15 LYS H A 15 LYS HGy 1.0 . 5.15 701 681 A 55 ASP H A 54 CYS HBy 1.0 . 3.58 702 682 A 55 ASP H A 41 ASN HBy 1.0 . 4.33 703 683 A 37 THR H A 55 ASP H 1.0 . 5.48 704 684 A 41 ASN HD21 A 55 ASP H 1.0 . 5.25 705 685 A 9 LYS H A 38 LYS HBx 1.0 . 5.30 706 686 A 27 LYS H A 26 ILE HD1% 1.0 . 3.24 707 687 A 27 LYS H A 26 ILE HG2% 1.0 . 4.51 708 688 A 16 TYR H A 25 PHE HE% 1.0 . 5.50 709 689 A 46 ASP H A 52 VAL HA 1.0 . 4.51 710 690 A 46 ASP H A 52 VAL HGy% 1.0 . 5.50 711 691 A 46 ASP H A 45 VAL HGx% 1.0 . 4.05 712 692 A 24 THR H A 23 ASP H 1.0 . 3.90 713 693 A 22 LYS H A 23 ASP H 1.0 . 4.88 714 694 A 54 CYS H A 52 VAL H 1.0 . 5.50 715 695 A 52 VAL H A 29 PRO HDy 1.0 . 5.11 716 696 A 54 CYS H A 34 LYS HA 1.0 . 4.19 717 697 A 52 VAL H A 45 VAL HGx% 1.0 . 5.50 718 698 A 54 CYS H A 53 ASP HBy 1.0 . 4.71 719 699 A 54 CYS H A 28 CYS HBx 1.0 . 5.50 720 700 A 39 ASP H A 9 LYS HBy 1.0 . 4.33 721 701 A 53 ASP H A 44 THR HB 1.0 . 5.50 722 702 A 53 ASP H A 52 VAL H 1.0 . 4.38 723 703 A 53 ASP H A 45 VAL HA 1.0 . 4.45 724 704 A 53 ASP H A 45 VAL HGx% 1.0 . 5.50 725 705 A 48 TYR H A 46 ASP HA 1.0 . 4.50 726 706 A 14 CYS H A 15 LYS H 1.0 . 4.37 727 707 A 14 CYS H A 7 CYS HA 1.0 . 5.50 728 708 A 26 ILE H A 25 PHE H 1.0 . 5.13 729 709 A 26 ILE H A 16 TYR HD% 1.0 . 5.25 730 710 A 26 ILE H A 15 LYS HA 1.0 . 4.84 731 711 A 26 ILE H A 14 CYS HBx 1.0 . 4.35 732 712 A 24 THR H A 17 LYS HA 1.0 . 4.23 733 713 A 24 THR H A 16 TYR HD% 1.0 . 5.50 734 714 A 7 CYS H A 43 CYS HBx 1.0 . 5.29 735 715 A 47 THR H A 3 TYR H 1.0 . 4.47 736 716 A 3 TYR H A 3 TYR HBy 1.0 . 3.72 737 717 A 3 TYR H A 45 VAL HB 1.0 . 4.13 738 718 A 2 LYS HDy A 3 TYR H 1.0 . 4.73 739 719 A 18 ASN H A 21 GLY HAx 1.0 . 5.12 740 720 A 38 LYS H A 36 CYS HA 1.0 . 4.34 741 721 A 38 LYS H A 9 LYS HBy 1.0 . 4.08 742 722 A 18 ASN H A 17 LYS HGy 1.0 . 5.30 743 723 A 18 ASN H A 18 ASN HD21 1.0 . 4.34 744 724 A 45 VAL H A 3 TYR HBx 1.0 . 5.08 745 725 A 43 CYS H A 6 LYS H 1.0 . 5.38 746 726 A 6 LYS H A 5 GLY HAy 1.0 . 3.42 747 727 A 51 ALA H A 49 ASN HD21 1.0 . 5.06 748 728 A 51 ALA H A 50 ASN HBy 1.0 . 5.29 749 729 A 37 THR H A 54 CYS HBy 1.0 . 5.02 750 730 A 51 ALA H A 46 ASP HBx 1.0 . 3.70 751 731 A 51 ALA H A 50 ASN HBx 1.0 . 5.36 752 732 A 51 ALA H A 46 ASP HBy 1.0 . 4.82 753 733 A 51 ALA H A 45 VAL HGx% 1.0 . 5.46 754 734 A 17 LYS H A 17 LYS HGy 1.0 . 4.94 755 735 A 18 ASN H A 17 LYS H 1.0 . 5.15 756 736 A 24 THR H A 17 LYS H 1.0 . 5.50 757 737 A 20 ALA H A 22 LYS HBx 1.0 . 5.49 758 738 A 20 ALA H A 18 ASN HD22 1.0 . 4.73 759 739 A 20 ALA H A 21 GLY HAy 1.0 . 5.30 760 740 A 20 ALA H A 21 GLY HAx 1.0 . 4.98 761 741 A 20 ALA H A 19 ASP HBx 1.0 . 4.71 762 742 A 20 ALA H A 19 ASP HBy 1.0 . 4.37 763 743 A 3 TYR HD% A 17 LYS H 1.0 . 5.50 764 744 A 12 ASN HBx A 12 ASN H 1.0 . 4.15 765 745 A 12 ASN H A 11 LYS HBy 1.0 . 4.63 766 746 A 20 ALA H A 22 LYS H 1.0 . 3.65 767 747 A 14 CYS H A 28 CYS H 1.0 . 4.41 768 748 A 28 CYS H A 12 ASN HD22 1.0 . 5.50 769 749 A 28 CYS H A 27 LYS HBy 1.0 . 4.03 770 750 A 28 CYS H A 27 LYS HBx 1.0 . 4.25 771 751 A 34 LYS H A 35 LYS HA 1.0 . 4.48 772 752 A 34 LYS H A 33 ASN HBx 1.0 . 5.11 773 753 A 22 LYS H A 22 LYS HEy 1.0 . 5.50 774 754 A 34 LYS H A 33 ASN HD21 1.0 . 5.29 775 755 A 2 LYS H A 47 THR HB 1.0 . 5.23 776 756 A 42 LYS H A 55 ASP HA 1.0 . 5.31 777 757 A 42 LYS H A 41 ASN HA 1.0 . 3.12 778 758 A 36 CYS H A 12 ASN HD21 1.0 . 4.87 779 759 A 33 ASN H A 35 LYS H 1.0 . 5.50 780 760 A 54 CYS HBy A 35 LYS H 1.0 . 5.49 781 761 A 36 CYS H A 35 LYS H 1.0 . 5.32 782 762 A 44 THR HG2% A 4 THR H 1.0 . 5.50 783 763 A 50 ASN H A 49 ASN HD21 1.0 . 4.30 784 764 A 50 ASN H A 50 ASN HA 1.0 . 2.80 785 765 A 50 ASN H A 51 ALA HB% 1.0 . 5.18 786 766 A 12 ASN HA A 11 LYS H 1.0 . 5.39 787 767 A 12 ASN H A 11 LYS H 1.0 . 5.25 788 768 A 10 SER H A 9 LYS HBy 1.0 . 5.36 789 769 A 31 PHE H A 31 PHE HBy 1.0 . 3.26 790 770 A 31 PHE H A 29 PRO HGx 1.0 . 5.01 791 771 A 31 PHE H A 30 LYS HBx 1.0 . 3.99 792 772 A 31 PHE H A 30 LYS HGy 1.0 . 4.44 793 773 A 31 PHE H A 31 PHE HZ 1.0 . 4.93 794 774 A 5 GLY H A 4 THR H 1.0 . 4.00 795 775 A 30 LYS H A 30 LYS HBx 1.0 . 3.62 796 776 A 5 GLY H A 16 TYR HBx 1.0 . 5.46 797 777 A 5 GLY H A 4 THR HG2% 1.0 . 3.98 798 778 A 13 GLU H A 12 ASN H 1.0 . 4.02 799 779 A 13 GLU H A 8 THR HA 1.0 . 5.30 800 780 A 13 GLU H A 8 THR HB 1.0 . 4.53 801 781 A 13 GLU H A 12 ASN HBx 1.0 . 5.04 802 782 A 47 THR H A 49 ASN H 1.0 . 5.50 803 783 A 47 THR H A 45 VAL HGx% 1.0 . 5.12 804 784 A 49 ASN H A 49 ASN HD21 1.0 . 4.34 805 785 A 49 ASN H A 49 ASN HD22 1.0 . 5.50 806 786 A 51 ALA HB% A 49 ASN H 1.0 . 5.32 807 787 A 49 ASN H A 50 ASN HA 1.0 . 4.33 808 788 A 49 ASN H A 46 ASP HBx 1.0 . 4.98 809 789 A 49 ASN H A 49 ASN HBy 1.0 . 4.11 810 790 A 8 THR H A 14 CYS HA 1.0 . 3.93 811 791 A 48 TYR HD% A 49 ASN H 1.0 . 4.51 812 792 A 46 ASP H A 49 ASN H 1.0 . 5.50 813 793 A 33 ASN H A 34 LYS HA 1.0 . 4.78 814 794 A 44 THR H A 43 CYS HBx 1.0 . 4.32 815 795 A 44 THR H A 54 CYS HA 1.0 . 4.40 816 796 A 44 THR H A 4 THR HG2% 1.0 . 5.50 817 797 A 44 THR H A 53 ASP HBy 1.0 . 4.51 818 798 A 44 THR H A 55 ASP H 1.0 . 5.46 819 799 A 44 THR H A 52 VAL HA 1.0 . 5.10 820 800 A 43 CYS H A 55 ASP H 1.0 . 5.13 821 801 A 43 CYS H A 5 GLY HAx 1.0 . 4.86 822 802 A 43 CYS H A 54 CYS HA 1.0 . 5.26 823 803 A 43 CYS H A 7 CYS HBy 1.0 . 5.50 824 804 A 43 CYS H A 6 LYS HGx 1.0 . 4.09 825 805 A 15 LYS H A 6 LYS H 1.0 . 3.80 826 806 A 15 LYS H A 14 CYS HBx 1.0 . 4.58 827 807 A 15 LYS H A 25 PHE HA 1.0 . 5.31 828 808 A 16 TYR H A 15 LYS H 1.0 . 4.94 stop_ save_