data_nef_c25789_2n71 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 2N71 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 4 CYS SG 1 38 CYS SG 1 10 CYS SG 1 29 CYS SG 1 18 CYS SG 1 50 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 GLU middle . . 3 A 3 ASP middle . . 4 A 4 CYS middle -HG . 5 A 5 VAL middle . . 6 A 6 GLY middle . false 7 A 7 ARG middle . . 8 A 8 LYS middle . . 9 A 9 ALA middle . . 10 A 10 CYS middle -HG . 11 A 11 THR middle . . 12 A 12 ARG middle . . 13 A 13 GLU middle . . 14 A 14 TRP middle . . 15 A 15 TYR middle . . 16 A 16 PRO middle . false 17 A 17 VAL middle . . 18 A 18 CYS middle -HG . 19 A 19 GLY middle . false 20 A 20 SER middle . . 21 A 21 ASP middle . . 22 A 22 GLY middle . false 23 A 23 VAL middle . . 24 A 24 THR middle . . 25 A 25 TYR middle . . 26 A 26 SER middle . . 27 A 27 ASN middle . . 28 A 28 PRO middle . false 29 A 29 CYS middle -HG . 30 A 30 ASN middle . . 31 A 31 PHE middle . . 32 A 32 SER middle . . 33 A 33 ALA middle . . 34 A 34 GLN middle . . 35 A 35 GLN middle . . 36 A 36 GLU middle . . 37 A 37 GLN middle . . 38 A 38 CYS middle -HG . 39 A 39 ASP middle . . 40 A 40 PRO middle . false 41 A 41 ASN middle . . 42 A 42 ILE middle . . 43 A 43 THR middle . . 44 A 44 ILE middle . . 45 A 45 ALA middle . . 46 A 46 HIS middle . . 47 A 47 MET middle . . 48 A 48 GLY middle . false 49 A 49 GLU middle . . 50 A 50 CYS end -HG . 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 ALA HA H 1 4.133 0.04 A 1 ALA HB% H 1 1.579 0.04 A 1 ALA CA C 13 51.927 0.5 A 1 ALA CB C 13 19.432 0.5 A 2 GLU H H 1 8.777 0.04 A 2 GLU HA H 1 4.778 0.04 A 2 GLU CA C 13 56.919 0.5 A 2 GLU CB C 13 30.334 0.5 A 2 GLU N N 15 120.587 0.5 A 3 ASP H H 1 8.491 0.04 A 3 ASP HA H 1 4.543 0.04 A 3 ASP HBy H 1 3.511 0.04 A 3 ASP HBx H 1 2.635 0.04 A 3 ASP N N 15 121.555 0.5 A 4 CYS H H 1 8.347 0.04 A 4 CYS HA H 1 4.587 0.04 A 4 CYS HB2 H 1 3.001 0.04 A 4 CYS C C 13 173.506 0.5 A 4 CYS CA C 13 57.905 0.5 A 4 CYS CB C 13 38.220 0.5 A 4 CYS N N 15 122.792 0.5 A 5 VAL H H 1 8.597 0.04 A 5 VAL HA H 1 4.591 0.04 A 5 VAL HB H 1 1.989 0.04 A 5 VAL HG1% H 1 0.965 0.04 A 5 VAL C C 13 175.872 0.5 A 5 VAL CA C 13 61.756 0.5 A 5 VAL CB C 13 34.641 0.5 A 5 VAL CG1 C 13 20.898 0.5 A 5 VAL N N 15 130.233 0.5 A 6 GLY H H 1 8.836 0.04 A 6 GLY HAx H 1 3.047 0.04 A 6 GLY HAy H 1 3.991 0.04 A 6 GLY C C 13 173.454 0.5 A 6 GLY CA C 13 45.527 0.5 A 6 GLY N N 15 115.595 0.5 A 7 ARG H H 1 8.760 0.04 A 7 ARG HA H 1 4.637 0.04 A 7 ARG HBx H 1 1.756 0.04 A 7 ARG HBy H 1 1.806 0.04 A 7 ARG HD2 H 1 3.201 0.04 A 7 ARG HE H 1 7.197 0.04 A 7 ARG HGx H 1 1.554 0.04 A 7 ARG HGy H 1 1.645 0.04 A 7 ARG C C 13 175.190 0.5 A 7 ARG CA C 13 55.528 0.5 A 7 ARG CB C 13 32.434 0.5 A 7 ARG N N 15 124.372 0.5 A 7 ARG NE N 15 85.485 0.5 A 8 LYS H H 1 8.497 0.04 A 8 LYS HA H 1 4.435 0.04 A 8 LYS HB2 H 1 1.597 0.04 A 8 LYS HD2 H 1 1.732 0.04 A 8 LYS HE2 H 1 2.914 0.04 A 8 LYS HG2 H 1 1.337 0.04 A 8 LYS C C 13 174.455 0.5 A 8 LYS CA C 13 55.630 0.5 A 8 LYS CB C 13 36.088 0.5 A 8 LYS N N 15 126.364 0.5 A 9 ALA H H 1 8.339 0.04 A 9 ALA HA H 1 4.462 0.04 A 9 ALA HB% H 1 1.327 0.04 A 9 ALA C C 13 176.690 0.5 A 9 ALA CA C 13 52.255 0.5 A 9 ALA CB C 13 17.072 0.5 A 9 ALA N N 15 126.059 0.5 A 10 CYS H H 1 8.103 0.04 A 10 CYS HA H 1 5.070 0.04 A 10 CYS HBx H 1 2.807 0.04 A 10 CYS HBy H 1 3.334 0.04 A 10 CYS C C 13 175.913 0.5 A 10 CYS CA C 13 52.909 0.5 A 10 CYS CB C 13 41.080 0.5 A 10 CYS N N 15 123.013 0.5 A 11 THR H H 1 8.272 0.04 A 11 THR HA H 1 4.510 0.04 A 11 THR HB H 1 4.583 0.04 A 11 THR HG2% H 1 1.332 0.04 A 11 THR C C 13 174.887 0.5 A 11 THR CA C 13 61.918 0.5 A 11 THR CB C 13 69.543 0.5 A 11 THR CG2 C 13 21.660 0.5 A 11 THR N N 15 113.789 0.5 A 12 ARG H H 1 8.585 0.04 A 12 ARG HA H 1 4.451 0.04 A 12 ARG HB2 H 1 1.831 0.04 A 12 ARG HD2 H 1 3.257 0.04 A 12 ARG HE H 1 7.273 0.04 A 12 ARG HG2 H 1 1.698 0.04 A 12 ARG C C 13 176.188 0.5 A 12 ARG CA C 13 55.853 0.5 A 12 ARG CB C 13 29.473 0.5 A 12 ARG N N 15 120.274 0.5 A 12 ARG NE N 15 84.987 0.5 A 13 GLU H H 1 8.069 0.04 A 13 GLU HA H 1 4.206 0.04 A 13 GLU HB2 H 1 2.008 0.04 A 13 GLU HG2 H 1 2.276 0.04 A 13 GLU C C 13 175.542 0.5 A 13 GLU CA C 13 57.303 0.5 A 13 GLU CB C 13 30.201 0.5 A 13 GLU N N 15 122.312 0.5 A 14 TRP H H 1 8.823 0.04 A 14 TRP HA H 1 5.125 0.04 A 14 TRP HBx H 1 3.197 0.04 A 14 TRP HBy H 1 3.391 0.04 A 14 TRP HD1 H 1 7.233 0.04 A 14 TRP HE1 H 1 10.309 0.04 A 14 TRP HE3 H 1 7.773 0.04 A 14 TRP HH2 H 1 7.154 0.04 A 14 TRP HZ2 H 1 7.451 0.04 A 14 TRP HZ3 H 1 7.059 0.04 A 14 TRP C C 13 174.853 0.5 A 14 TRP CA C 13 56.388 0.5 A 14 TRP CB C 13 29.804 0.5 A 14 TRP CD1 C 13 128.274 0.5 A 14 TRP CE3 C 13 121.766 0.5 A 14 TRP CH2 C 13 124.677 0.5 A 14 TRP CZ2 C 13 114.477 0.5 A 14 TRP CZ3 C 13 121.819 0.5 A 14 TRP N N 15 126.929 0.5 A 14 TRP NE1 N 15 129.929 0.5 A 15 TYR H H 1 8.949 0.04 A 15 TYR HA H 1 4.522 0.04 A 15 TYR HBx H 1 2.819 0.04 A 15 TYR HBy H 1 2.970 0.04 A 15 TYR HDx H 1 7.092 0.04 A 15 TYR HEx H 1 6.782 0.04 A 15 TYR CB C 13 38.301 0.5 A 15 TYR CDx C 13 133.137 0.5 A 15 TYR CEx C 13 118.104 0.5 A 15 TYR N N 15 129.982 0.5 A 16 PRO HA H 1 4.094 0.04 A 16 PRO HBx H 1 0.755 0.04 A 16 PRO HBy H 1 0.977 0.04 A 16 PRO HDx H 1 1.107 0.04 A 16 PRO HDy H 1 3.044 0.04 A 16 PRO HG2 H 1 1.400 0.04 A 16 PRO C C 13 177.191 0.5 A 16 PRO CA C 13 62.523 0.5 A 16 PRO CB C 13 32.836 0.5 A 16 PRO CD C 13 48.467 0.5 A 17 VAL H H 1 8.355 0.04 A 17 VAL HA H 1 4.184 0.04 A 17 VAL HB H 1 1.783 0.04 A 17 VAL HGx% H 1 0.631 0.04 A 17 VAL HGy% H 1 0.594 0.04 A 17 VAL C C 13 172.678 0.5 A 17 VAL CA C 13 60.249 0.5 A 17 VAL CB C 13 36.086 0.5 A 17 VAL CGy C 13 22.709 0.5 A 17 VAL CGx C 13 20.036 0.5 A 17 VAL N N 15 114.809 0.5 A 18 CYS H H 1 8.245 0.04 A 18 CYS HA H 1 5.217 0.04 A 18 CYS HBx H 1 1.394 0.04 A 18 CYS HBy H 1 2.357 0.04 A 18 CYS C C 13 175.720 0.5 A 18 CYS CA C 13 53.874 0.5 A 18 CYS CB C 13 38.042 0.5 A 18 CYS N N 15 123.493 0.5 A 19 GLY H H 1 9.676 0.04 A 19 GLY HA2 H 1 4.726 0.04 A 19 GLY C C 13 176.356 0.5 A 19 GLY CA C 13 45.350 0.5 A 19 GLY N N 15 116.182 0.5 A 20 SER H H 1 9.783 0.04 A 20 SER HA H 1 4.147 0.04 A 20 SER HB2 H 1 3.954 0.04 A 20 SER C C 13 173.922 0.5 A 20 SER CA C 13 61.110 0.5 A 20 SER CB C 13 62.104 0.5 A 20 SER N N 15 119.167 0.5 A 21 ASP H H 1 8.823 0.04 A 21 ASP HA H 1 4.512 0.04 A 21 ASP HBx H 1 2.709 0.04 A 21 ASP HBy H 1 3.051 0.04 A 21 ASP C C 13 177.137 0.5 A 21 ASP CA C 13 53.514 0.5 A 21 ASP CB C 13 39.784 0.5 A 21 ASP N N 15 120.973 0.5 A 22 GLY H H 1 8.448 0.04 A 22 GLY HAx H 1 3.731 0.04 A 22 GLY HAy H 1 4.114 0.04 A 22 GLY C C 13 173.782 0.5 A 22 GLY CA C 13 45.916 0.5 A 22 GLY N N 15 109.625 0.5 A 23 VAL H H 1 7.755 0.04 A 23 VAL HA H 1 3.850 0.04 A 23 VAL HB H 1 2.225 0.04 A 23 VAL HGx% H 1 0.711 0.04 A 23 VAL HGy% H 1 0.168 0.04 A 23 VAL CA C 13 61.747 0.5 A 23 VAL CB C 13 33.045 0.5 A 23 VAL CGy C 13 22.077 0.5 A 23 VAL CGx C 13 20.095 0.5 A 23 VAL N N 15 124.643 0.5 A 24 THR H H 1 8.204 0.04 A 24 THR HA H 1 4.751 0.04 A 24 THR HB H 1 4.113 0.04 A 24 THR HG2% H 1 1.101 0.04 A 24 THR C C 13 174.674 0.5 A 24 THR CA C 13 62.517 0.5 A 24 THR CB C 13 69.332 0.5 A 24 THR CG2 C 13 23.741 0.5 A 24 THR N N 15 124.128 0.5 A 25 TYR H H 1 9.528 0.04 A 25 TYR HA H 1 4.580 0.04 A 25 TYR HBx H 1 2.820 0.04 A 25 TYR HBy H 1 2.868 0.04 A 25 TYR HDy H 1 7.057 0.04 A 25 TYR HEy H 1 6.780 0.04 A 25 TYR C C 13 176.958 0.5 A 25 TYR CA C 13 58.112 0.5 A 25 TYR CB C 13 40.957 0.5 A 25 TYR CDy C 13 133.123 0.5 A 25 TYR CEy C 13 117.603 0.5 A 25 TYR N N 15 130.525 0.5 A 26 SER H H 1 9.300 0.04 A 26 SER HA H 1 3.688 0.04 A 26 SER HB2 H 1 4.276 0.04 A 26 SER C C 13 172.371 0.5 A 26 SER CA C 13 61.334 0.5 A 26 SER CB C 13 63.624 0.5 A 26 SER N N 15 118.275 0.5 A 27 ASN H H 1 7.341 0.04 A 27 ASN HA H 1 5.456 0.04 A 27 ASN HBx H 1 3.160 0.04 A 27 ASN HBy H 1 3.566 0.04 A 27 ASN HD2x H 1 6.301 0.04 A 27 ASN HD2y H 1 8.111 0.04 A 27 ASN CA C 13 51.882 0.5 A 27 ASN CB C 13 36.669 0.5 A 27 ASN N N 15 109.467 0.5 A 27 ASN ND2 N 15 115.323 0.5 A 28 PRO HA H 1 4.225 0.04 A 28 PRO HB2 H 1 2.519 0.04 A 28 PRO HD2 H 1 3.987 0.04 A 28 PRO C C 13 177.600 0.5 A 28 PRO CA C 13 65.794 0.5 A 28 PRO CB C 13 32.317 0.5 A 28 PRO CD C 13 51.201 0.5 A 29 CYS H H 1 8.275 0.04 A 29 CYS HA H 1 4.371 0.04 A 29 CYS HBx H 1 3.068 0.04 A 29 CYS HBy H 1 3.398 0.04 A 29 CYS C C 13 177.390 0.5 A 29 CYS CA C 13 60.240 0.5 A 29 CYS CB C 13 36.524 0.5 A 29 CYS N N 15 120.684 0.5 A 30 ASN H H 1 8.653 0.04 A 30 ASN HA H 1 4.515 0.04 A 30 ASN HBx H 1 2.805 0.04 A 30 ASN HBy H 1 3.057 0.04 A 30 ASN HD2x H 1 7.227 0.04 A 30 ASN HD2y H 1 7.466 0.04 A 30 ASN C C 13 178.484 0.5 A 30 ASN CA C 13 57.010 0.5 A 30 ASN CB C 13 39.559 0.5 A 30 ASN N N 15 122.591 0.5 A 30 ASN ND2 N 15 114.137 0.5 A 31 PHE H H 1 7.848 0.04 A 31 PHE HA H 1 3.222 0.04 A 31 PHE HBx H 1 2.576 0.04 A 31 PHE HBy H 1 3.004 0.04 A 31 PHE HDx H 1 6.739 0.04 A 31 PHE HEx H 1 6.905 0.04 A 31 PHE HZ H 1 6.674 0.04 A 31 PHE C C 13 175.893 0.5 A 31 PHE CA C 13 61.887 0.5 A 31 PHE CB C 13 38.828 0.5 A 31 PHE CDx C 13 130.870 0.5 A 31 PHE CEx C 13 131.358 0.5 A 31 PHE CZ C 13 129.780 0.5 A 31 PHE N N 15 121.793 0.5 A 32 SER H H 1 8.661 0.04 A 32 SER HA H 1 3.785 0.04 A 32 SER HB2 H 1 4.042 0.04 A 32 SER C C 13 175.874 0.5 A 32 SER CA C 13 61.991 0.5 A 32 SER CB C 13 62.697 0.5 A 32 SER N N 15 116.875 0.5 A 33 ALA H H 1 7.977 0.04 A 33 ALA HA H 1 3.877 0.04 A 33 ALA HB% H 1 1.323 0.04 A 33 ALA C C 13 178.824 0.5 A 33 ALA CA C 13 55.115 0.5 A 33 ALA CB C 13 18.889 0.5 A 33 ALA N N 15 122.924 0.5 A 34 GLN H H 1 7.177 0.04 A 34 GLN HA H 1 3.595 0.04 A 34 GLN HBx H 1 1.657 0.04 A 34 GLN HBy H 1 2.179 0.04 A 34 GLN HE2x H 1 6.915 0.04 A 34 GLN HE2y H 1 7.962 0.04 A 34 GLN HGx H 1 2.042 0.04 A 34 GLN HGy H 1 3.099 0.04 A 34 GLN C C 13 178.745 0.5 A 34 GLN CA C 13 58.880 0.5 A 34 GLN CB C 13 27.349 0.5 A 34 GLN CG C 13 31.092 0.5 A 34 GLN N N 15 119.261 0.5 A 34 GLN NE2 N 15 111.618 0.5 A 35 GLN H H 1 7.716 0.04 A 35 GLN HA H 1 4.008 0.04 A 35 GLN HBx H 1 1.112 0.04 A 35 GLN HBy H 1 1.878 0.04 A 35 GLN HE2x H 1 7.035 0.04 A 35 GLN HE2y H 1 7.695 0.04 A 35 GLN HGx H 1 2.008 0.04 A 35 GLN HGy H 1 2.160 0.04 A 35 GLN C C 13 176.948 0.5 A 35 GLN CA C 13 57.174 0.5 A 35 GLN CB C 13 29.865 0.5 A 35 GLN N N 15 122.346 0.5 A 35 GLN NE2 N 15 113.592 0.5 A 36 GLU H H 1 8.239 0.04 A 36 GLU HA H 1 3.891 0.04 A 36 GLU HBx H 1 1.963 0.04 A 36 GLU HBy H 1 2.052 0.04 A 36 GLU HGx H 1 2.245 0.04 A 36 GLU HGy H 1 2.476 0.04 A 36 GLU C C 13 179.191 0.5 A 36 GLU CA C 13 58.444 0.5 A 36 GLU CB C 13 30.860 0.5 A 36 GLU CG C 13 36.758 0.5 A 36 GLU N N 15 114.288 0.5 A 37 GLN H H 1 7.644 0.04 A 37 GLN HA H 1 4.382 0.04 A 37 GLN HB2 H 1 2.068 0.04 A 37 GLN HE2x H 1 6.920 0.04 A 37 GLN HE2y H 1 7.986 0.04 A 37 GLN HGx H 1 2.307 0.04 A 37 GLN HGy H 1 3.377 0.04 A 37 GLN C C 13 177.125 0.5 A 37 GLN CA C 13 56.848 0.5 A 37 GLN CB C 13 30.442 0.5 A 37 GLN CG C 13 34.028 0.5 A 37 GLN N N 15 112.767 0.5 A 37 GLN NE2 N 15 111.726 0.5 A 38 CYS H H 1 7.704 0.04 A 38 CYS HA H 1 5.033 0.04 A 38 CYS HBx H 1 2.873 0.04 A 38 CYS HBy H 1 3.051 0.04 A 38 CYS C C 13 174.561 0.5 A 38 CYS CA C 13 54.813 0.5 A 38 CYS CB C 13 41.981 0.5 A 38 CYS N N 15 115.172 0.5 A 39 ASP H H 1 7.824 0.04 A 39 ASP HA H 1 5.035 0.04 A 39 ASP HBx H 1 2.462 0.04 A 39 ASP HBy H 1 2.806 0.04 A 39 ASP CA C 13 51.652 0.5 A 39 ASP CB C 13 41.995 0.5 A 39 ASP N N 15 118.112 0.5 A 40 PRO HA H 1 4.682 0.04 A 40 PRO HBx H 1 2.003 0.04 A 40 PRO HBy H 1 2.377 0.04 A 40 PRO HDx H 1 3.589 0.04 A 40 PRO HDy H 1 3.839 0.04 A 40 PRO HG2 H 1 1.883 0.04 A 40 PRO C C 13 177.751 0.5 A 40 PRO CA C 13 63.531 0.5 A 40 PRO CB C 13 32.479 0.5 A 40 PRO CD C 13 50.390 0.5 A 41 ASN H H 1 8.183 0.04 A 41 ASN HA H 1 4.710 0.04 A 41 ASN HB2 H 1 2.882 0.04 A 41 ASN HD21 H 1 7.450 0.04 A 41 ASN C C 13 175.877 0.5 A 41 ASN CA C 13 53.533 0.5 A 41 ASN CB C 13 39.317 0.5 A 41 ASN N N 15 114.538 0.5 A 41 ASN ND2 N 15 115.432 0.5 A 42 ILE H H 1 7.260 0.04 A 42 ILE HA H 1 4.188 0.04 A 42 ILE HB H 1 1.940 0.04 A 42 ILE HD1% H 1 0.633 0.04 A 42 ILE HG1x H 1 1.338 0.04 A 42 ILE HG1y H 1 1.636 0.04 A 42 ILE HG2% H 1 0.911 0.04 A 42 ILE C C 13 174.947 0.5 A 42 ILE CA C 13 62.863 0.5 A 42 ILE CB C 13 39.653 0.5 A 42 ILE CD1 C 13 14.048 0.5 A 42 ILE CG1 C 13 25.383 0.5 A 42 ILE CG2 C 13 17.314 0.5 A 42 ILE N N 15 117.609 0.5 A 43 THR H H 1 8.828 0.04 A 43 THR HA H 1 4.814 0.04 A 43 THR HB H 1 4.203 0.04 A 43 THR HG2% H 1 1.178 0.04 A 43 THR C C 13 173.737 0.5 A 43 THR CA C 13 60.118 0.5 A 43 THR CB C 13 72.559 0.5 A 43 THR CG2 C 13 22.174 0.5 A 43 THR N N 15 114.448 0.5 A 44 ILE H H 1 8.487 0.04 A 44 ILE HA H 1 3.475 0.04 A 44 ILE HB H 1 1.441 0.04 A 44 ILE HD1% H 1 0.380 0.04 A 44 ILE HG1x H 1 -0.595 0.04 A 44 ILE HG1y H 1 0.022 0.04 A 44 ILE HG2% H 1 0.356 0.04 A 44 ILE C C 13 176.400 0.5 A 44 ILE CA C 13 62.849 0.5 A 44 ILE CB C 13 37.712 0.5 A 44 ILE CD1 C 13 12.865 0.5 A 44 ILE CG1 C 13 27.287 0.5 A 44 ILE CG2 C 13 16.857 0.5 A 44 ILE N N 15 121.256 0.5 A 45 ALA H H 1 9.195 0.04 A 45 ALA HA H 1 4.210 0.04 A 45 ALA HB% H 1 1.168 0.04 A 45 ALA C C 13 178.725 0.5 A 45 ALA CA C 13 54.537 0.5 A 45 ALA CB C 13 19.216 0.5 A 45 ALA N N 15 135.414 0.5 A 46 HIS H H 1 7.240 0.04 A 46 HIS HA H 1 4.608 0.04 A 46 HIS HBx H 1 3.204 0.04 A 46 HIS HBy H 1 3.820 0.04 A 46 HIS HD2 H 1 7.212 0.04 A 46 HIS HE1 H 1 8.735 0.04 A 46 HIS C C 13 173.062 0.5 A 46 HIS CA C 13 54.573 0.5 A 46 HIS CB C 13 29.351 0.5 A 46 HIS CD2 C 13 121.406 0.5 A 46 HIS CE1 C 13 137.116 0.5 A 46 HIS N N 15 106.909 0.5 A 47 MET H H 1 9.092 0.04 A 47 MET HA H 1 4.655 0.04 A 47 MET HBx H 1 2.048 0.04 A 47 MET HBy H 1 2.894 0.04 A 47 MET HE% H 1 1.872 0.04 A 47 MET C C 13 179.036 0.5 A 47 MET CA C 13 54.965 0.5 A 47 MET CB C 13 31.458 0.5 A 47 MET CE C 13 16.877 0.5 A 47 MET N N 15 119.326 0.5 A 48 GLY H H 1 8.162 0.04 A 48 GLY HAx H 1 3.379 0.04 A 48 GLY HAy H 1 4.519 0.04 A 48 GLY C C 13 170.539 0.5 A 48 GLY CA C 13 44.288 0.5 A 48 GLY N N 15 114.963 0.5 A 49 GLU H H 1 8.225 0.04 A 49 GLU HA H 1 3.971 0.04 A 49 GLU HBx H 1 1.975 0.04 A 49 GLU HBy H 1 2.208 0.04 A 49 GLU C C 13 178.243 0.5 A 49 GLU CA C 13 56.770 0.5 A 49 GLU CB C 13 30.475 0.5 A 49 GLU N N 15 113.303 0.5 A 50 CYS H H 1 8.373 0.04 A 50 CYS HA H 1 4.396 0.04 A 50 CYS HBx H 1 2.593 0.04 A 50 CYS HBy H 1 3.164 0.04 A 50 CYS CA C 13 56.403 0.5 A 50 CYS CB C 13 38.074 0.5 A 50 CYS N N 15 124.377 0.5 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 45 ALA H A 19 GLY H 1.0 2.0 6.0 2 2 A 27 ASN H A 17 VAL H 1.0 2.0 6.0 3 3 A 27 ASN HA A 15 TYR H 1.0 1.9 4.7 4 4 A 38 CYS HBx A 39 ASP H 1.0 1.7 3.1 5 5 A 14 TRP HZ2 A 14 TRP HE1 1.0 1.8 4.0 6 6 A 14 TRP HE1 A 14 TRP HH2 1.0 2.0 6.0 7 7 A 15 TYR HA A 16 PRO HDx 1.0 1.8 3.6 8 8 A 5 VAL HA A 34 GLN HE2y 1.0 1.9 4.5 9 9 A 5 VAL HA A 34 GLN HE2x 1.0 1.8 3.6 10 10 A 9 ALA H A 10 CYS H 1.0 2.0 6.0 11 11 A 27 ASN HA A 27 ASN HBy 1.0 1.8 4.0 12 12 A 27 ASN HA A 27 ASN HBx 1.0 1.8 3.6 13 13 A 27 ASN HA A 15 TYR HBy 1.0 2.0 5.0 14 14 A 15 TYR H A 14 TRP HE3 1.0 2.0 6.0 15 15 A 25 TYR H A 26 SER H 1.0 2.0 6.0 16 16 A 19 GLY H A 22 GLY H 1.0 2.0 6.0 17 17 A 27 ASN H A 25 TYR H 1.0 2.0 6.0 18 18 A 45 ALA H A 18 CYS H 1.0 2.0 6.0 19 19 A 26 SER H A 30 ASN H 1.0 1.6 6.0 20 20 A 26 SER H A 31 PHE H 1.0 1.9 6.0 21 21 A 26 SER H A 30 ASN HD2x 1.0 1.8 6.0 22 22 A 50 CYS H A 46 HIS HE1 1.0 2.0 6.0 23 23 A 15 TYR H A 27 ASN HD2x 1.0 2.0 6.0 24 24 A 13 GLU H A 14 TRP H 1.0 2.0 6.0 25 25 A 34 GLN HE2x A 6 GLY H 1.0 2.0 6.0 26 26 A 27 ASN H A 15 TYR H 1.0 1.9 6.0 27 27 A 34 GLN HE2y A 7 ARG H 1.0 2.0 4.6 28 28 A 15 TYR H A 27 ASN HD2y 1.0 1.9 6.0 29 29 A 27 ASN H A 31 PHE H 1.0 2.0 6.0 30 30 A 14 TRP HE3 A 14 TRP HD1 1.0 2.0 6.0 31 31 A 14 TRP HH2 A 14 TRP HE3 1.0 2.0 5.4 32 32 A 30 ASN H A 27 ASN HD2y 1.0 1.9 6.0 33 33 A 27 ASN HD2x A 27 ASN HD2y 1.0 1.5 2.5 34 34 A 27 ASN HD2y A 12 ARG H 1.0 2.0 6.0 35 35 A 4 CYS H A 5 VAL H 1.0 2.0 5.0 36 36 A 12 ARG H A 11 THR H 1.0 1.8 4.2 37 37 A 10 CYS H A 8 LYS H 1.0 2.0 6.0 38 38 A 27 ASN HD2x A 12 ARG H 1.0 2.0 6.0 39 39 A 35 GLN H A 32 SER H 1.0 1.9 6.0 40 40 A 30 ASN H A 30 ASN HD2x 1.0 2.0 6.0 41 41 A 31 PHE H A 29 CYS H 1.0 1.9 6.0 42 42 A 23 VAL H A 24 THR H 1.0 2.0 6.0 43 43 A 10 CYS H A 30 ASN HD2x 1.0 2.0 5.8 44 44 A 31 PHE H A 30 ASN HD2x 1.0 1.8 6.0 45 45 A 14 TRP HZ2 A 14 TRP HE3 1.0 2.0 6.0 46 46 A 37 GLN H A 37 GLN HE2x 1.0 1.9 4.9 47 47 A 39 ASP H A 38 CYS H 1.0 1.8 3.4 48 48 A 27 ASN HD2y A 12 ARG HE 1.0 2.0 6.0 49 49 A 14 TRP HZ2 A 14 TRP HH2 1.0 1.7 3.3 50 50 A 14 TRP HZ2 A 14 TRP HZ3 1.0 2.0 5.2 51 51 A 37 GLN H A 37 GLN HE2y 1.0 1.9 5.1 52 52 A 31 PHE HZ A 35 GLN HE2y 1.0 2.0 5.2 53 53 A 27 ASN HA A 30 ASN H 1.0 1.9 6.0 54 54 A 17 VAL H A 27 ASN HA 1.0 2.0 6.0 55 55 A 46 HIS HE1 A 18 CYS HA 1.0 1.7 6.0 56 56 A 18 CYS HA A 46 HIS H 1.0 1.9 6.0 57 57 A 14 TRP HE3 A 14 TRP HA 1.0 1.9 3.9 58 58 A 14 TRP HD1 A 14 TRP HA 1.0 2.0 6.0 59 59 A 22 GLY H A 19 GLY HAy 1.0 2.0 6.0 60 60 A 31 PHE HZ A 19 GLY HAy 1.0 2.0 6.0 61 61 A 47 MET HA A 48 GLY H 1.0 1.8 3.4 62 62 A 19 GLY H A 25 TYR HA 1.0 2.0 6.0 63 63 A 45 ALA H A 46 HIS HA 1.0 2.0 6.0 64 64 A 11 THR H A 11 THR HB 1.0 2.0 4.8 65 65 A 25 TYR H A 25 TYR HA 1.0 1.9 4.3 66 66 A 27 ASN H A 25 TYR HA 1.0 2.0 6.0 67 67 A 12 ARG H A 11 THR HA 1.0 1.6 2.8 68 68 A 11 THR H A 11 THR HA 1.0 1.9 3.7 69 69 A 13 GLU H A 11 THR HA 1.0 2.0 5.6 70 70 A 30 ASN HA A 30 ASN HD2y 1.0 1.8 6.0 71 71 A 46 HIS HE1 A 48 GLY HAx 1.0 1.9 6.0 72 72 A 48 GLY H A 48 GLY HAx 1.0 1.9 3.7 73 73 A 27 ASN H A 30 ASN HA 1.0 2.0 6.0 74 74 A 27 ASN HD2y A 12 ARG HA 1.0 2.0 6.0 75 75 A 12 ARG H A 12 ARG HA 1.0 1.9 4.3 76 76 A 8 LYS H A 8 LYS HA 1.0 1.9 4.3 77 77 A 34 GLN HE2x A 8 LYS HA 1.0 1.9 6.0 78 78 A 34 GLN HE2y A 8 LYS HA 1.0 1.7 6.0 79 79 A 46 HIS HE1 A 50 CYS HA 1.0 1.8 3.6 80 80 A 50 CYS H A 50 CYS HA 1.0 1.8 4.0 81 81 A 29 CYS H A 29 CYS HA 1.0 1.9 4.1 82 82 A 38 CYS H A 37 GLN HA 1.0 1.8 4.0 83 83 A 14 TRP HE1 A 14 TRP HBy 1.0 1.9 6.0 84 84 A 14 TRP HE1 A 15 TYR HA 1.0 1.7 6.0 85 85 A 20 SER HBy A 20 SER H 1.0 1.8 4.0 86 86 A 26 SER H A 26 SER HB2 1.0 1.9 4.5 87 87 A 30 ASN H A 26 SER HB2 1.0 2.0 6.0 88 88 A 14 TRP HE3 A 26 SER HB2 1.0 0.0 6.0 89 89 A 27 ASN H A 26 SER HB2 1.0 2.0 6.0 90 90 A 30 ASN HD2y A 26 SER HB2 1.0 1.9 5.1 91 91 A 14 TRP HH2 A 26 SER HB2 1.0 1.8 6.0 92 92 A 14 TRP HZ3 A 26 SER HB2 1.0 2.0 5.2 93 93 A 30 ASN HD2x A 26 SER HB2 1.0 2.0 6.0 94 94 A 15 TYR H A 13 GLU HA 1.0 1.9 6.0 95 95 A 13 GLU H A 13 GLU HA 1.0 1.9 4.1 96 96 A 17 VAL H A 17 VAL HA 1.0 1.9 4.3 97 97 A 48 GLY H A 17 VAL HA 1.0 1.8 3.6 98 98 A 45 ALA H A 20 SER HA 1.0 1.9 6.0 99 99 A 24 THR H A 24 THR HB 1.0 1.8 3.6 100 100 A 14 TRP HZ2 A 16 PRO HA 1.0 1.9 6.0 101 101 A 15 TYR H A 16 PRO HA 1.0 2.0 5.6 102 102 A 27 ASN H A 16 PRO HA 1.0 2.0 6.0 103 103 A 32 SER HBy A 33 ALA H 1.0 1.9 4.3 104 104 A 37 GLN H A 35 GLN HA 1.0 0.0 6.0 105 105 A 15 TYR H A 28 PRO HD2 1.0 2.0 6.0 106 106 A 45 ALA H A 20 SER HBy 1.0 1.9 6.0 107 107 A 37 GLN HE2y A 33 ALA HA 1.0 2.0 5.4 108 108 A 32 SER H A 33 ALA HA 1.0 1.8 6.0 109 109 A 22 GLY H A 23 VAL HA 1.0 2.0 6.0 110 110 A 23 VAL H A 23 VAL HA 1.0 1.9 4.5 111 111 A 39 ASP H A 40 PRO HDy 1.0 1.7 6.0 112 112 A 46 HIS HE1 A 46 HIS HBy 1.0 1.7 6.0 113 113 A 46 HIS H A 46 HIS HBy 1.0 1.9 4.3 114 113 A 46 HIS HBy A 46 HIS HD2 1.0 1.9 4.3 115 114 A 35 GLN H A 32 SER HA 1.0 2.0 5.4 116 115 A 14 TRP HH2 A 26 SER HA 1.0 2.0 5.6 117 116 A 14 TRP HZ3 A 26 SER HA 1.0 1.9 4.3 118 117 A 45 ALA H A 44 ILE HA 1.0 1.7 3.1 119 118 A 19 GLY H A 44 ILE HA 1.0 1.9 6.0 120 119 A 25 TYR H A 26 SER HA 1.0 2.0 6.0 121 120 A 15 TYR H A 26 SER HA 1.0 1.9 6.0 122 121 A 44 ILE HA A 43 THR H 1.0 2.0 6.0 123 122 A 31 PHE HZ A 44 ILE HA 1.0 2.0 6.0 124 123 A 15 TYR H A 14 TRP HBy 1.0 2.0 6.0 125 124 A 30 ASN H A 29 CYS HBy 1.0 1.8 4.0 126 125 A 29 CYS H A 29 CYS HBy 1.0 1.5 2.7 127 126 A 14 TRP HE3 A 14 TRP HBy 1.0 2.0 6.0 128 127 A 12 ARG H A 10 CYS HBy 1.0 1.8 6.0 129 128 A 11 THR H A 10 CYS HBy 1.0 1.9 4.1 130 129 A 12 ARG H A 12 ARG HDy 1.0 2.0 6.0 131 130 A 12 ARG HE A 12 ARG HDy 1.0 2.0 6.0 132 131 A 31 PHE H A 31 PHE HA 1.0 2.0 4.6 133 132 A 33 ALA H A 31 PHE HA 1.0 2.0 6.0 134 133 A 14 TRP H A 14 TRP HBx 1.0 1.9 4.1 135 134 A 14 TRP HE3 A 14 TRP HBx 1.0 1.9 4.3 136 135 A 27 ASN H A 27 ASN HBx 1.0 2.0 6.0 137 136 A 46 HIS HE1 A 50 CYS HBy 1.0 2.0 6.0 138 137 A 34 GLN HE2x A 34 GLN HGy 1.0 1.8 3.6 139 138 A 30 ASN H A 30 ASN HBy 1.0 1.7 3.1 140 139 A 26 SER H A 30 ASN HBy 1.0 2.0 5.4 141 140 A 22 GLY H A 21 ASP HBy 1.0 2.0 6.0 142 141 A 38 CYS H A 38 CYS HBy 1.0 1.9 4.5 143 142 A 30 ASN HD2x A 30 ASN HBy 1.0 2.0 5.2 144 143 A 4 CYS H A 4 CYS HBy 1.0 1.8 3.6 145 144 A 32 SER H A 31 PHE HBy 1.0 1.8 3.6 146 145 A 15 TYR H A 15 TYR HBy 1.0 2.0 6.0 147 146 A 25 TYR HBy A 26 SER H 1.0 0.0 6.0 148 147 A 27 ASN H A 25 TYR HBy 1.0 0.0 6.0 149 148 A 25 TYR HBy A 25 TYR H 1.0 1.5 2.5 150 149 A 25 TYR HBx A 25 TYR H 1.0 1.7 3.3 151 150 A 23 VAL H A 21 ASP HBx 1.0 1.9 6.0 152 151 A 21 ASP HBx A 21 ASP H 1.0 1.9 4.1 153 152 A 4 CYS H A 3 ASP HBy 1.0 1.9 5.3 154 153 A 23 VAL H A 50 CYS HBx 1.0 1.6 6.0 155 154 A 27 ASN H A 31 PHE HBx 1.0 2.0 6.0 156 155 A 25 TYR H A 50 CYS HBx 1.0 1.9 6.0 157 156 A 32 SER H A 31 PHE HBx 1.0 2.0 6.0 158 157 A 31 PHE H A 31 PHE HBx 1.0 1.9 3.9 159 158 A 27 ASN HBy A 14 TRP H 1.0 2.0 4.8 160 159 A 37 GLN HE2x A 34 GLN HA 1.0 2.0 6.0 161 160 A 37 GLN H A 34 GLN HA 1.0 0.0 6.0 162 161 A 27 ASN HBy A 29 CYS H 1.0 2.0 6.0 163 162 A 15 TYR H A 27 ASN HBy 1.0 1.8 4.0 164 163 A 27 ASN H A 27 ASN HBy 1.0 2.0 6.0 165 164 A 27 ASN HD2y A 29 CYS HBy 1.0 1.9 5.3 166 165 A 27 ASN HD2y A 10 CYS HBy 1.0 2.0 5.2 167 166 A 27 ASN HD2y A 12 ARG HDy 1.0 2.0 6.0 168 167 A 27 ASN HD2y A 29 CYS HBx 1.0 1.8 6.0 169 168 A 39 ASP H A 39 ASP HBx 1.0 1.9 4.5 170 169 A 37 GLN H A 36 GLU HGy 1.0 1.8 3.6 171 170 A 40 PRO HBy A 41 ASN HD2y 1.0 2.0 4.6 172 171 A 50 CYS H A 18 CYS HBy 1.0 2.0 5.0 173 172 A 25 TYR H A 18 CYS HBy 1.0 1.9 4.5 174 173 A 19 GLY H A 18 CYS HBy 1.0 2.0 6.0 175 174 A 46 HIS HE1 A 18 CYS HBy 1.0 2.0 4.6 176 175 A 15 TYR H A 13 GLU HG2 1.0 2.0 6.0 177 176 A 37 GLN H A 36 GLU HGx 1.0 1.9 6.0 178 177 A 19 GLY H A 23 VAL HB 1.0 2.0 6.0 179 178 A 49 GLU HBy A 49 GLU H 1.0 1.9 4.1 180 179 A 35 GLN HE2y A 35 GLN HGy 1.0 1.8 3.6 181 180 A 31 PHE HZ A 35 GLN HGy 1.0 1.9 6.0 182 181 A 36 GLU HBy A 36 GLU H 1.0 2.0 6.0 183 182 A 13 GLU H A 13 GLU HBy 1.0 1.8 3.4 184 183 A 27 ASN HD2y A 13 GLU HBy 1.0 1.9 6.0 185 184 A 35 GLN HE2x A 35 GLN HGx 1.0 1.9 4.5 186 185 A 50 CYS H A 49 GLU HBx 1.0 1.9 4.7 187 186 A 43 THR H A 42 ILE HB 1.0 1.7 3.1 188 187 A 37 GLN H A 36 GLU HBx 1.0 0.0 6.0 189 188 A 20 SER H A 42 ILE HB 1.0 2.0 5.8 190 189 A 31 PHE HZ A 42 ILE HB 1.0 2.0 6.0 191 190 A 35 GLN HE2y A 35 GLN HBy 1.0 1.9 6.0 192 191 A 37 GLN H A 35 GLN HBy 1.0 2.0 5.8 193 192 A 35 GLN HBy A 34 GLN H 1.0 1.7 6.0 194 193 A 8 LYS H A 7 ARG HBy 1.0 0.5 6.0 195 194 A 25 TYR H A 17 VAL HB 1.0 2.0 6.0 196 195 A 48 GLY H A 17 VAL HB 1.0 0.6 6.0 197 196 A 17 VAL H A 17 VAL HB 1.0 1.9 4.5 198 197 A 7 ARG H A 7 ARG HGy 1.0 2.0 5.4 199 198 A 31 PHE HZ A 42 ILE HG1y 1.0 2.0 5.4 200 199 A 9 ALA H A 8 LYS HBy 1.0 1.9 4.9 201 200 A 8 LYS H A 8 LYS HBy 1.0 1.9 4.5 202 201 A 31 PHE HZ A 44 ILE HB 1.0 1.9 6.0 203 202 A 15 TYR H A 16 PRO HGy 1.0 2.0 6.0 204 203 A 14 TRP HZ2 A 16 PRO HGy 1.0 1.8 4.2 205 204 A 14 TRP HH2 A 16 PRO HGy 1.0 2.0 6.0 206 205 A 18 CYS H A 18 CYS HBx 1.0 1.8 3.6 207 206 A 19 GLY H A 18 CYS HBx 1.0 2.0 6.0 208 207 A 46 HIS HE1 A 18 CYS HBx 1.0 2.0 6.0 209 208 A 20 SER H A 42 ILE HG1x 1.0 1.9 6.0 210 209 A 42 ILE HG1x A 42 ILE H 1.0 1.9 4.5 211 210 A 31 PHE HZ A 42 ILE HG1x 1.0 2.0 5.4 212 211 A 16 PRO HDx A 14 TRP HD1 1.0 1.9 4.3 213 212 A 14 TRP HE1 A 16 PRO HDx 1.0 2.0 5.8 214 213 A 35 GLN H A 35 GLN HBx 1.0 1.8 3.4 215 214 A 31 PHE HZ A 35 GLN HBx 1.0 2.0 6.0 216 215 A 14 TRP HE1 A 16 PRO HBy 1.0 2.0 6.0 217 216 A 14 TRP HZ2 A 16 PRO HBy 1.0 2.0 5.6 218 217 A 14 TRP HH2 A 16 PRO HBy 1.0 2.0 6.0 219 218 A 15 TYR H A 16 PRO HBy 1.0 1.9 6.0 220 219 A 49 GLU H A 16 PRO HBy 1.0 2.0 6.0 221 220 A 48 GLY H A 16 PRO HBy 1.0 1.5 6.0 222 221 A 14 TRP HZ3 A 16 PRO HBy 1.0 2.0 6.0 223 222 A 17 VAL H A 16 PRO HBx 1.0 1.9 4.7 224 223 A 14 TRP HH2 A 16 PRO HBx 1.0 2.0 6.0 225 224 A 14 TRP HE1 A 16 PRO HBx 1.0 1.9 6.0 226 225 A 14 TRP HZ2 A 16 PRO HBx 1.0 2.0 5.8 227 226 A 35 GLN HE2x A 31 PHE HZ 1.0 2.0 4.8 228 227 A 27 ASN HA A 13 GLU HBy 1.0 1.9 6.0 229 228 A 27 ASN HA A 16 PRO HA 1.0 1.9 6.0 230 229 A 18 CYS HA A 18 CYS HBy 1.0 1.9 4.1 231 230 A 44 ILE HB A 43 THR HA 1.0 1.8 6.0 232 231 A 43 THR HA A 43 THR HB 1.0 2.0 6.0 233 232 A 20 SER HBy A 43 THR HA 1.0 2.0 6.0 234 233 A 42 ILE HG1x A 43 THR HA 1.0 0.0 6.0 235 234 A 50 CYS HBy A 24 THR HA 1.0 0.0 6.0 236 235 A 24 THR HB A 24 THR HA 1.0 2.0 6.0 237 236 A 25 TYR HBy A 24 THR HA 1.0 1.9 6.0 238 237 A 25 TYR HBx A 24 THR HA 1.0 2.0 6.0 239 238 A 50 CYS HBx A 24 THR HA 1.0 2.0 6.0 240 239 A 18 CYS HBy A 24 THR HA 1.0 2.0 6.0 241 240 A 41 ASN HA A 41 ASN HBy 1.0 1.8 3.4 242 241 A 19 GLY HAy A 31 PHE HA 1.0 0.0 6.0 243 242 A 35 GLN HA A 40 PRO HA 1.0 2.0 6.0 244 243 A 40 PRO HA A 36 GLU HA 1.0 1.8 4.0 245 244 A 40 PRO HDy A 40 PRO HA 1.0 1.8 6.0 246 245 A 40 PRO HBy A 40 PRO HA 1.0 1.7 3.3 247 246 A 35 GLN HGy A 40 PRO HA 1.0 1.9 4.5 248 247 A 40 PRO HA A 40 PRO HBx 1.0 1.9 4.3 249 248 A 35 GLN HBx A 40 PRO HA 1.0 1.4 6.0 250 249 A 7 ARG HA A 6 GLY HAy 1.0 2.0 6.0 251 250 A 7 ARG HBy A 7 ARG HA 1.0 1.7 3.3 252 250 A 7 ARG HA A 7 ARG HBx 1.0 1.7 3.3 253 251 A 7 ARG HGy A 7 ARG HA 1.0 1.9 4.9 254 252 A 7 ARG HA A 7 ARG HGx 1.0 1.9 4.5 255 253 A 47 MET HA A 17 VAL HA 1.0 2.0 5.8 256 254 A 47 MET HA A 48 GLY HAy 1.0 2.0 6.0 257 255 A 46 HIS HA A 46 HIS HBx 1.0 1.7 3.5 258 256 A 5 VAL HA A 5 VAL HB 1.0 1.8 3.8 259 257 A 46 HIS HA A 18 CYS HBy 1.0 1.8 6.0 260 258 A 25 TYR HBy A 25 TYR HA 1.0 1.8 3.6 261 259 A 25 TYR HA A 31 PHE HBx 1.0 2.0 5.6 262 260 A 3 ASP HBy A 3 ASP HA 1.0 1.9 4.3 263 261 A 15 TYR HA A 15 TYR HBy 1.0 0.0 6.0 264 262 A 21 ASP HBx A 21 ASP HA 1.0 1.6 3.0 265 263 A 48 GLY HAx A 48 GLY HAy 1.0 1.6 2.6 266 264 A 23 VAL HB A 21 ASP HA 1.0 0.0 6.0 267 265 A 12 ARG HA A 12 ARG HBy 1.0 1.9 6.0 268 266 A 12 ARG HA A 12 ARG HDy 1.0 1.9 6.0 269 267 A 8 LYS HA A 8 LYS HDy 1.0 1.6 3.0 270 268 A 8 LYS HA A 8 LYS HBy 1.0 1.9 4.3 271 269 A 18 CYS HA A 18 CYS HBx 1.0 1.9 4.1 272 270 A 14 TRP HA A 16 PRO HDy 1.0 2.0 6.0 273 271 A 15 TYR HBy A 14 TRP HA 1.0 1.7 6.0 274 272 A 27 ASN HBy A 14 TRP HA 1.0 2.0 5.8 275 273 A 14 TRP HA A 14 TRP HBy 1.0 2.0 5.0 276 274 A 14 TRP HA A 14 TRP HBx 1.0 1.8 3.8 277 275 A 16 PRO HDx A 14 TRP HA 1.0 1.9 6.0 278 276 A 14 TRP HA A 13 GLU HBy 1.0 2.0 6.0 279 277 A 10 CYS HBy A 10 CYS HA 1.0 1.9 4.1 280 278 A 39 ASP HBx A 39 ASP HA 1.0 1.8 3.8 281 279 A 38 CYS HBy A 38 CYS HA 1.0 1.8 3.6 282 280 A 50 CYS HA A 50 CYS HBy 1.0 1.8 4.0 283 281 A 50 CYS HA A 50 CYS HBx 1.0 1.9 4.5 284 282 A 50 CYS HA A 18 CYS HBy 1.0 2.0 5.2 285 283 A 29 CYS HA A 29 CYS HBx 1.0 1.8 3.8 286 284 A 37 GLN HA A 36 GLU HGx 1.0 1.3 6.0 287 285 A 37 GLN HA A 36 GLU HGy 1.0 0.0 6.0 288 286 A 37 GLN HA A 37 GLN HGx 1.0 2.0 6.0 289 287 A 37 GLN HA A 36 GLU HBx 1.0 0.0 6.0 290 288 A 26 SER HB2 A 30 ASN HBx 1.0 1.7 6.0 291 289 A 28 PRO HA A 31 PHE HBy 1.0 1.9 3.9 292 290 A 28 PRO HA A 31 PHE HBx 1.0 1.9 4.3 293 291 A 28 PRO HA A 28 PRO HBy 1.0 1.8 3.6 294 292 A 13 GLU HA A 13 GLU HBy 1.0 1.7 3.1 295 293 A 42 ILE HG1y A 42 ILE HA 1.0 1.9 4.5 296 294 A 42 ILE HG1x A 42 ILE HA 1.0 2.0 5.4 297 295 A 17 VAL HA A 17 VAL HB 1.0 1.9 3.9 298 296 A 17 VAL HA A 16 PRO HBx 1.0 1.6 6.0 299 297 A 37 GLN HGx A 1 ALA HA 1.0 0.0 6.0 300 298 A 1 ALA HA A 37 GLN HBy 1.0 2.0 6.0 301 299 A 20 SER HA A 42 ILE HB 1.0 1.9 5.3 302 300 A 16 PRO HA A 16 PRO HGy 1.0 2.0 6.0 303 301 A 16 PRO HA A 16 PRO HBy 1.0 1.8 4.0 304 302 A 16 PRO HA A 16 PRO HBx 1.0 1.8 3.8 305 303 A 35 GLN HA A 39 ASP HBx 1.0 1.9 4.9 306 304 A 35 GLN HA A 35 GLN HGy 1.0 1.7 3.3 307 305 A 35 GLN HA A 35 GLN HBy 1.0 1.8 3.4 308 306 A 6 GLY HAy A 6 GLY HAx 1.0 1.6 2.6 309 307 A 49 GLU HBx A 49 GLU HA 1.0 1.7 3.1 310 308 A 27 ASN HBx A 28 PRO HD2 1.0 1.9 4.1 311 309 A 49 GLU HBy A 49 GLU HA 1.0 1.7 3.1 312 310 A 18 CYS HBx A 49 GLU HA 1.0 2.0 6.0 313 311 A 18 CYS HBy A 49 GLU HA 1.0 2.0 4.4 314 312 A 50 CYS HBx A 49 GLU HA 1.0 0.7 6.0 315 313 A 16 PRO HBx A 49 GLU HA 1.0 1.9 6.0 316 314 A 40 PRO HDx A 40 PRO HGy 1.0 1.9 4.1 317 315 A 34 GLN HA A 34 GLN HBy 1.0 1.9 4.7 318 316 A 34 GLN HA A 34 GLN HBx 1.0 1.8 4.0 319 317 A 44 ILE HA A 42 ILE HB 1.0 2.0 5.8 320 318 A 44 ILE HA A 44 ILE HB 1.0 2.0 4.6 321 319 A 44 ILE HA A 44 ILE HG1x 1.0 1.9 4.1 322 320 A 16 PRO HBx A 48 GLY HAy 1.0 1.9 6.0 323 321 A 31 PHE HA A 34 GLN HBy 1.0 2.0 5.2 324 322 A 7 ARG HBy A 7 ARG HDy 1.0 1.8 3.8 325 322 A 7 ARG HBx A 7 ARG HDy 1.0 1.8 3.8 326 323 A 7 ARG HGy A 7 ARG HDy 1.0 1.9 4.1 327 324 A 34 GLN HGy A 35 GLN HBy 1.0 1.6 6.0 328 325 A 34 GLN HGy A 34 GLN HBx 1.0 1.9 3.9 329 326 A 34 GLN HGy A 34 GLN HBy 1.0 1.8 3.8 330 327 A 34 GLN HGy A 34 GLN HGx 1.0 1.5 2.7 331 328 A 16 PRO HGy A 16 PRO HDy 1.0 1.7 3.5 332 329 A 16 PRO HDx A 16 PRO HDy 1.0 1.5 2.7 333 330 A 16 PRO HBy A 16 PRO HDy 1.0 1.9 4.1 334 331 A 15 TYR HBy A 13 GLU HG2 1.0 2.0 6.0 335 332 A 8 LYS HEy A 8 LYS HGy 1.0 1.8 3.6 336 333 A 8 LYS HDy A 8 LYS HEy 1.0 2.0 5.8 337 334 A 8 LYS HBy A 8 LYS HEy 1.0 0.0 6.0 338 335 A 21 ASP HBx A 42 ILE HB 1.0 2.0 6.0 339 336 A 17 VAL HB A 44 ILE HG1x 1.0 2.0 5.8 340 337 A 44 ILE HB A 44 ILE HG1x 1.0 1.8 4.2 341 338 A 35 GLN HGy A 35 GLN HBx 1.0 1.8 4.0 342 339 A 35 GLN HBy A 35 GLN HBx 1.0 1.6 2.6 343 340 A 16 PRO HDx A 16 PRO HGy 1.0 1.8 3.8 344 341 A 16 PRO HGy A 16 PRO HBy 1.0 1.8 3.8 345 342 A 16 PRO HGy A 16 PRO HBx 1.0 1.9 4.3 346 343 A 18 CYS HBy A 18 CYS HBx 1.0 1.5 2.5 347 344 A 34 GLN HBy A 34 GLN HBx 1.0 1.0 2.2 348 345 A 42 ILE HB A 42 ILE HG1x 1.0 1.8 3.6 349 346 A 8 LYS HDy A 8 LYS HGy 1.0 1.9 4.7 350 347 A 8 LYS HBy A 8 LYS HGy 1.0 0.0 6.0 351 348 A 31 PHE HA A 31 PHE HBx 1.0 0.0 6.0 352 349 A 50 CYS HBy A 50 CYS HBx 1.0 1.5 2.5 353 350 A 31 PHE HBy A 31 PHE HBx 1.0 1.6 2.8 354 351 A 25 TYR HBy A 31 PHE HBx 1.0 1.9 3.9 355 352 A 39 ASP HBx A 39 ASP HBy 1.0 1.7 2.9 356 353 A 10 CYS HBy A 10 CYS HBx 1.0 1.5 2.5 357 354 A 27 ASN HBy A 27 ASN HBx 1.0 1.6 2.8 358 355 A 14 TRP HBy A 14 TRP HBx 1.0 1.5 2.5 359 356 A 29 CYS HBy A 29 CYS HBx 1.0 1.5 2.5 360 357 A 36 GLU HBy A 36 GLU HA 1.0 1.8 3.6 361 358 A 36 GLU HBx A 36 GLU HA 1.0 1.7 3.3 362 359 A 40 PRO HDy A 40 PRO HBx 1.0 1.9 4.5 363 360 A 40 PRO HDy A 40 PRO HGy 1.0 1.7 3.3 364 361 A 32 SER HA A 35 GLN HBy 1.0 1.9 4.3 365 362 A 32 SER HA A 35 GLN HBx 1.0 0.0 6.0 366 363 A 36 GLU HGy A 36 GLU HGx 1.0 1.5 2.7 367 364 A 42 ILE HB A 42 ILE HG1y 1.0 0.0 6.0 368 365 A 46 HIS H A 44 ILE HG1x 1.0 1.8 6.0 369 366 A 14 TRP HE3 A 14 TRP HZ3 1.0 1.7 3.1 370 367 A 31 PHE HZ A 20 SER H 1.0 2.0 6.0 371 368 A 15 TYR H A 14 TRP HD1 1.0 2.0 6.0 372 369 A 31 PHE HZ A 43 THR H 1.0 2.0 6.0 373 370 A 34 GLN HE2y A 5 VAL H 1.0 1.9 6.0 374 371 A 31 PHE H A 34 GLN H 1.0 1.9 6.0 375 372 A 7 ARG H A 6 GLY HAx 1.0 1.8 3.6 376 373 A 7 ARG H A 6 GLY HAy 1.0 1.5 2.7 377 374 A 11 THR H A 10 CYS HA 1.0 1.7 3.5 378 375 A 12 ARG H A 11 THR HB 1.0 2.0 4.6 379 376 A 14 TRP H A 13 GLU HA 1.0 1.5 2.7 380 377 A 15 TYR H A 14 TRP HA 1.0 1.7 3.1 381 378 A 17 VAL HA A 47 MET H 1.0 1.6 6.0 382 379 A 19 GLY H A 18 CYS HA 1.0 1.7 3.1 383 380 A 25 TYR H A 18 CYS HA 1.0 2.0 4.8 384 381 A 19 GLY HAy A 44 ILE HA 1.0 2.0 5.6 385 382 A 20 SER HA A 21 ASP H 1.0 1.8 3.6 386 383 A 25 TYR H A 24 THR HB 1.0 2.0 6.0 387 384 A 26 SER H A 25 TYR HA 1.0 1.7 3.1 388 385 A 19 GLY H A 25 TYR H 1.0 2.0 5.8 389 386 A 27 ASN H A 26 SER HA 1.0 2.0 5.6 390 387 A 27 ASN HA A 27 ASN HD2x 1.0 2.0 6.0 391 388 A 27 ASN HA A 28 PRO HD2 1.0 1.9 5.1 392 389 A 27 ASN HBx A 27 ASN HD2y 1.0 2.0 6.0 393 390 A 27 ASN HBy A 27 ASN HD2x 1.0 1.8 3.6 394 391 A 27 ASN HBy A 27 ASN HD2y 1.0 2.0 5.0 395 392 A 31 PHE H A 30 ASN HA 1.0 2.0 5.4 396 393 A 32 SER H A 31 PHE HA 1.0 2.0 5.6 397 394 A 33 ALA H A 32 SER HA 1.0 2.0 5.8 398 395 A 33 ALA HA A 34 GLN H 1.0 1.9 5.1 399 396 A 35 GLN H A 34 GLN HA 1.0 2.0 4.8 400 397 A 35 GLN HA A 36 GLU H 1.0 0.0 6.0 401 398 A 39 ASP HA A 40 PRO HDx 1.0 1.8 3.6 402 399 A 40 PRO HDy A 39 ASP HA 1.0 1.8 3.8 403 400 A 42 ILE H A 41 ASN HA 1.0 1.9 4.7 404 401 A 31 PHE HZ A 44 ILE HG1x 1.0 2.0 4.4 405 402 A 18 CYS H A 46 HIS HA 1.0 0.0 6.0 406 403 A 45 ALA H A 46 HIS H 1.0 1.7 3.3 407 404 A 46 HIS H A 46 HIS HA 1.0 1.8 3.8 408 405 A 46 HIS H A 45 ALA HA 1.0 1.9 4.5 409 406 A 46 HIS H A 46 HIS HBy 1.0 2.0 5.2 410 407 A 46 HIS H A 44 ILE HA 1.0 2.0 6.0 411 408 A 46 HIS H A 46 HIS HBx 1.0 0.8 6.0 412 409 A 46 HIS H A 18 CYS HBy 1.0 1.9 4.5 413 410 A 46 HIS H A 17 VAL HB 1.0 1.9 6.0 414 411 A 14 TRP HE1 A 49 GLU H 1.0 0.6 6.0 415 412 A 14 TRP HE1 A 14 TRP HE3 1.0 1.5 6.0 416 413 A 14 TRP HE1 A 14 TRP HD1 1.0 1.6 3.0 417 414 A 19 GLY H A 23 VAL H 1.0 1.9 4.3 418 415 A 6 GLY H A 5 VAL H 1.0 2.0 5.2 419 416 A 5 VAL H A 3 ASP HA 1.0 0.0 6.0 420 417 A 14 TRP HE3 A 14 TRP H 1.0 0.4 6.0 421 418 A 14 TRP H A 14 TRP HD1 1.0 2.0 6.0 422 419 A 14 TRP H A 14 TRP HA 1.0 1.9 3.9 423 420 A 7 ARG H A 8 LYS H 1.0 1.9 4.9 424 421 A 8 LYS H A 7 ARG HA 1.0 1.6 2.8 425 422 A 9 ALA H A 8 LYS HA 1.0 1.6 3.0 426 423 A 23 VAL H A 35 GLN HE2y 1.0 2.0 6.0 427 424 A 23 VAL H A 19 GLY HAy 1.0 1.9 3.9 428 425 A 34 GLN HE2x A 7 ARG H 1.0 2.0 5.4 429 426 A 7 ARG H A 7 ARG HE 1.0 0.0 6.0 430 427 A 19 GLY H A 50 CYS H 1.0 2.0 5.8 431 428 A 50 CYS H A 18 CYS HA 1.0 2.0 5.8 432 429 A 50 CYS H A 24 THR HA 1.0 1.9 4.3 433 430 A 18 CYS H A 46 HIS HE1 1.0 0.1 6.0 434 431 A 24 THR H A 24 THR HA 1.0 1.8 3.6 435 432 A 24 THR H A 50 CYS HA 1.0 0.0 6.0 436 433 A 18 CYS H A 18 CYS HA 1.0 1.8 3.6 437 434 A 32 SER H A 33 ALA H 1.0 1.9 3.9 438 435 A 29 CYS H A 33 ALA H 1.0 2.0 6.0 439 436 A 30 ASN HA A 33 ALA H 1.0 1.9 4.5 440 437 A 34 GLN HE2y A 4 CYS H 1.0 1.8 6.0 441 438 A 4 CYS H A 38 CYS HA 1.0 1.7 6.0 442 439 A 4 CYS H A 3 ASP HA 1.0 1.6 3.0 443 440 A 10 CYS H A 27 ASN HD2y 1.0 1.6 6.0 444 441 A 10 CYS H A 10 CYS HA 1.0 1.8 3.6 445 442 A 10 CYS H A 9 ALA HA 1.0 1.6 2.8 446 443 A 30 ASN H A 31 PHE H 1.0 1.8 3.8 447 444 A 30 ASN H A 12 ARG HE 1.0 0.0 6.0 448 445 A 30 ASN H A 29 CYS H 1.0 1.8 3.6 449 446 A 13 GLU H A 12 ARG H 1.0 1.9 3.9 450 447 A 35 GLN H A 37 GLN HE2x 1.0 2.0 6.0 451 448 A 35 GLN H A 40 PRO HA 1.0 1.7 6.0 452 449 A 35 GLN H A 35 GLN HA 1.0 1.7 3.3 453 450 A 27 ASN HA A 31 PHE H 1.0 0.2 6.0 454 451 A 25 TYR H A 24 THR H 1.0 2.0 6.0 455 452 A 31 PHE H A 28 PRO HA 1.0 1.8 4.0 456 453 A 20 SER H A 44 ILE H 1.0 1.4 6.0 457 454 A 45 ALA H A 21 ASP H 1.0 2.0 6.0 458 455 A 22 GLY H A 21 ASP H 1.0 1.8 3.4 459 456 A 29 CYS H A 12 ARG HE 1.0 2.0 6.0 460 457 A 27 ASN HD2y A 29 CYS H 1.0 0.3 6.0 461 458 A 27 ASN HA A 29 CYS H 1.0 2.0 6.0 462 459 A 46 HIS HE1 A 47 MET H 1.0 0.0 6.0 463 460 A 48 GLY H A 47 MET H 1.0 2.0 6.0 464 461 A 46 HIS H A 47 MET H 1.0 2.0 5.8 465 462 A 32 SER H A 34 GLN H 1.0 2.0 6.0 466 463 A 33 ALA H A 34 GLN H 1.0 1.8 3.4 467 464 A 35 GLN H A 34 GLN H 1.0 1.7 3.3 468 465 A 30 ASN HA A 34 GLN H 1.0 2.0 6.0 469 466 A 34 GLN HA A 34 GLN H 1.0 1.9 4.1 470 467 A 27 ASN HA A 26 SER H 1.0 0.0 6.0 471 468 A 39 ASP H A 4 CYS H 1.0 1.8 6.0 472 469 A 39 ASP H A 40 PRO HA 1.0 2.0 5.2 473 470 A 39 ASP H A 37 GLN HA 1.0 1.5 6.0 474 471 A 39 ASP H A 35 GLN HA 1.0 1.9 4.1 475 472 A 43 THR H A 42 ILE H 1.0 1.8 6.0 476 473 A 42 ILE H A 41 ASN H 1.0 1.7 3.3 477 474 A 39 ASP H A 42 ILE H 1.0 2.0 6.0 478 475 A 31 PHE HZ A 42 ILE H 1.0 1.1 6.0 479 476 A 42 ILE H A 39 ASP HA 1.0 1.6 6.0 480 477 A 42 ILE H A 42 ILE HA 1.0 1.9 3.9 481 478 A 32 SER H A 29 CYS H 1.0 1.9 6.0 482 479 A 19 GLY H A 21 ASP H 1.0 2.0 6.0 483 480 A 19 GLY H A 18 CYS H 1.0 2.0 6.0 484 481 A 34 GLN HE2y A 6 GLY H 1.0 2.0 5.6 485 482 A 38 CYS H A 38 CYS HA 1.0 1.7 3.3 486 483 A 14 TRP HE3 A 27 ASN HD2x 1.0 2.0 5.8 487 484 A 27 ASN H A 27 ASN HD2x 1.0 1.8 6.0 488 485 A 27 ASN HD2x A 12 ARG HE 1.0 1.4 6.0 489 486 A 27 ASN HD2x A 14 TRP HA 1.0 1.2 6.0 490 487 A 27 ASN HD2x A 11 THR HA 1.0 2.0 4.8 491 488 A 27 ASN HD2x A 12 ARG HA 1.0 0.0 6.0 492 489 A 6 GLY H A 8 LYS H 1.0 0.0 6.0 493 490 A 17 VAL H A 18 CYS HA 1.0 0.0 6.0 494 491 A 17 VAL H A 25 TYR HA 1.0 2.0 6.0 495 492 A 20 SER H A 43 THR H 1.0 1.8 3.6 496 493 A 45 ALA H A 43 THR H 1.0 1.5 6.0 497 494 A 43 THR H A 44 ILE H 1.0 2.0 5.4 498 495 A 39 ASP H A 41 ASN H 1.0 2.0 5.2 499 496 A 39 ASP HA A 41 ASN H 1.0 1.8 6.0 500 497 A 14 TRP HZ2 A 49 GLU H 1.0 1.1 6.0 501 498 A 27 ASN HD2y A 11 THR H 1.0 2.0 6.0 502 499 A 48 GLY HAx A 49 GLU H 1.0 1.7 3.1 503 500 A 30 ASN HD2x A 30 ASN HD2y 1.0 1.3 2.2 504 501 A 30 ASN HD2x A 30 ASN HA 1.0 2.0 5.4 505 502 A 26 SER H A 30 ASN HD2y 1.0 2.0 6.0 506 503 A 30 ASN H A 30 ASN HD2y 1.0 2.0 6.0 507 504 A 10 CYS H A 30 ASN HD2y 1.0 0.0 6.0 508 505 A 30 ASN HD2y A 34 GLN HA 1.0 1.8 6.0 509 506 A 30 ASN HD2y A 10 CYS HBy 1.0 2.0 6.0 510 507 A 35 GLN HE2x A 19 GLY HAy 1.0 1.9 5.1 511 508 A 37 GLN H A 38 CYS HA 1.0 1.8 6.0 512 509 A 37 GLN H A 37 GLN HA 1.0 1.9 3.9 513 510 A 34 GLN HE2x A 5 VAL H 1.0 0.5 6.0 514 511 A 34 GLN HE2x A 30 ASN HD2y 1.0 2.0 6.0 515 512 A 34 GLN HE2y A 30 ASN HD2y 1.0 1.9 6.0 516 513 A 37 GLN HE2y A 34 GLN HA 1.0 1.8 6.0 517 514 A 22 GLY H A 20 SER H 1.0 2.0 5.2 518 515 A 45 ALA H A 22 GLY H 1.0 1.6 6.0 519 516 A 22 GLY H A 23 VAL H 1.0 1.7 3.1 520 517 A 22 GLY H A 21 ASP HA 1.0 1.9 4.7 521 518 A 27 ASN H A 26 SER H 1.0 1.9 3.9 522 519 A 27 ASN H A 30 ASN H 1.0 1.9 5.1 523 520 A 27 ASN H A 29 CYS H 1.0 1.8 6.0 524 521 A 27 ASN H A 27 ASN HA 1.0 1.9 3.9 525 522 A 27 ASN H A 14 TRP HA 1.0 0.0 6.0 526 523 A 27 ASN H A 28 PRO HA 1.0 2.0 5.0 527 524 A 45 ALA H A 44 ILE H 1.0 2.0 6.0 528 525 A 31 PHE HZ A 44 ILE H 1.0 2.0 5.0 529 526 A 44 ILE H A 43 THR HA 1.0 1.8 3.6 530 527 A 45 ALA H A 20 SER H 1.0 1.9 4.9 531 528 A 45 ALA H A 45 ALA HA 1.0 1.8 3.8 532 529 A 45 ALA H A 46 HIS HBy 1.0 1.8 6.0 533 530 A 45 ALA H A 18 CYS HBy 1.0 1.9 6.0 534 531 A 45 ALA H A 17 VAL HB 1.0 0.0 6.0 535 532 A 45 ALA H A 44 ILE HG1x 1.0 1.9 5.1 536 533 A 20 SER H A 21 ASP H 1.0 1.9 3.7 537 534 A 25 TYR H A 50 CYS HBy 1.0 0.0 6.0 538 535 A 25 TYR HBx A 25 TYR H 1.0 1.7 2.9 539 535 A 25 TYR HBy A 25 TYR H 1.0 1.7 2.9 540 536 A 25 TYR H A 24 THR HA 1.0 1.6 3.0 541 537 A 14 TRP HE1 A 16 PRO HA 1.0 0.0 6.0 542 538 A 14 TRP HE1 A 16 PRO HDy 1.0 2.0 5.4 543 539 A 14 TRP HE1 A 49 GLU HBx 1.0 1.9 6.0 544 540 A 14 TRP HE1 A 16 PRO HGy 1.0 1.8 3.6 545 541 A 15 TYR H A 15 TYR HA 1.0 1.9 4.1 546 542 A 15 TYR H A 16 PRO HDy 1.0 1.9 4.1 547 543 A 15 TYR H A 13 GLU HBy 1.0 0.9 6.0 548 544 A 15 TYR H A 16 PRO HDx 1.0 1.9 4.9 549 545 A 15 TYR H A 16 PRO HBx 1.0 1.8 6.0 550 546 A 5 VAL H A 6 GLY HAx 1.0 1.6 6.0 551 547 A 5 VAL H A 4 CYS HBy 1.0 2.0 5.0 552 548 A 5 VAL H A 5 VAL HB 1.0 1.8 3.4 553 549 A 15 TYR HA A 14 TRP H 1.0 2.0 6.0 554 550 A 14 TRP H A 14 TRP HBy 1.0 1.6 3.0 555 551 A 14 TRP H A 15 TYR HBx 1.0 0.0 6.0 556 552 A 14 TRP H A 13 GLU HG2 1.0 2.0 5.0 557 553 A 14 TRP H A 13 GLU HBy 1.0 1.8 3.8 558 554 A 8 LYS H A 34 GLN HGx 1.0 1.7 6.0 559 555 A 8 LYS H A 8 LYS HGy 1.0 2.0 4.6 560 556 A 23 VAL H A 21 ASP HBy 1.0 2.0 6.0 561 557 A 23 VAL H A 23 VAL HB 1.0 1.6 3.0 562 558 A 7 ARG H A 7 ARG HA 1.0 1.8 3.6 563 559 A 7 ARG H A 7 ARG HBx 1.0 1.7 3.5 564 560 A 50 CYS H A 49 GLU HA 1.0 1.7 2.9 565 561 A 50 CYS H A 50 CYS HBy 1.0 2.0 5.0 566 562 A 50 CYS H A 50 CYS HBx 1.0 1.7 3.3 567 563 A 50 CYS H A 49 GLU HBy 1.0 1.9 4.7 568 564 A 50 CYS H A 18 CYS HBx 1.0 1.9 6.0 569 565 A 24 THR H A 23 VAL HA 1.0 1.5 2.7 570 566 A 24 THR H A 50 CYS HBy 1.0 0.7 6.0 571 567 A 24 THR H A 50 CYS HBx 1.0 2.0 6.0 572 568 A 24 THR H A 23 VAL HB 1.0 2.0 5.4 573 569 A 18 CYS H A 17 VAL HA 1.0 1.7 3.1 574 570 A 18 CYS H A 46 HIS HBy 1.0 1.8 6.0 575 571 A 18 CYS H A 18 CYS HBy 1.0 1.8 3.4 576 572 A 18 CYS H A 17 VAL HB 1.0 1.8 3.6 577 573 A 33 ALA H A 33 ALA HA 1.0 1.7 3.3 578 574 A 33 ALA H A 36 GLU HGy 1.0 1.9 6.0 579 575 A 33 ALA H A 34 GLN HBx 1.0 2.0 6.0 580 576 A 4 CYS H A 5 VAL HB 1.0 2.0 6.0 581 577 A 10 CYS H A 10 CYS HBy 1.0 1.8 3.8 582 578 A 30 ASN H A 30 ASN HA 1.0 1.8 3.6 583 579 A 30 ASN H A 28 PRO HD2 1.0 2.0 6.0 584 580 A 30 ASN H A 30 ASN HBx 1.0 1.7 3.1 585 581 A 30 ASN H A 28 PRO HBy 1.0 1.8 6.0 586 582 A 27 ASN HBx A 13 GLU H 1.0 1.6 6.0 587 583 A 13 GLU H A 13 GLU HG2 1.0 2.0 5.8 588 584 A 13 GLU H A 12 ARG HGy 1.0 1.9 6.0 589 585 A 35 GLN H A 34 GLN HGy 1.0 2.0 5.0 590 586 A 35 GLN H A 35 GLN HBy 1.0 1.9 4.1 591 587 A 35 GLN H A 34 GLN HBx 1.0 2.0 5.0 592 588 A 31 PHE H A 31 PHE HBy 1.0 1.6 3.0 593 589 A 31 PHE H A 34 GLN HBy 1.0 0.0 6.0 594 590 A 31 PHE H A 34 GLN HBx 1.0 0.0 6.0 595 591 A 4 CYS HBy A 3 ASP H 1.0 1.5 6.0 596 592 A 3 ASP HBy A 3 ASP H 1.0 1.7 3.5 597 593 A 44 ILE H A 44 ILE HG1x 1.0 1.9 4.7 598 594 A 19 GLY HAy A 21 ASP H 1.0 1.9 3.9 599 595 A 21 ASP H A 21 ASP HA 1.0 1.8 3.6 600 596 A 21 ASP H A 22 GLY HAy 1.0 1.9 6.0 601 597 A 21 ASP HBy A 21 ASP H 1.0 2.0 5.2 602 598 A 21 ASP H A 42 ILE HB 1.0 1.9 6.0 603 599 A 21 ASP H A 42 ILE HG1y 1.0 0.0 6.0 604 600 A 23 VAL H A 18 CYS HA 1.0 1.9 6.0 605 601 A 29 CYS H A 29 CYS HBx 1.0 1.8 3.8 606 602 A 29 CYS H A 28 PRO HBy 1.0 1.9 6.0 607 603 A 29 CYS H A 13 GLU HBy 1.0 0.0 6.0 608 604 A 29 CYS H A 12 ARG HGy 1.0 1.9 6.0 609 605 A 12 ARG H A 12 ARG HGy 1.0 1.8 3.4 610 606 A 19 GLY HAy A 20 SER H 1.0 1.7 3.3 611 607 A 20 SER H A 20 SER HA 1.0 1.7 3.1 612 608 A 20 SER H A 42 ILE HG1y 1.0 2.0 6.0 613 609 A 46 HIS HA A 47 MET H 1.0 1.6 3.0 614 610 A 46 HIS HBy A 47 MET H 1.0 2.0 5.0 615 611 A 47 MET H A 46 HIS HBx 1.0 1.8 3.6 616 612 A 47 MET H A 47 MET HBx 1.0 1.7 3.1 617 613 A 47 MET H A 18 CYS HBx 1.0 0.0 6.0 618 614 A 34 GLN HGy A 34 GLN H 1.0 1.9 4.5 619 615 A 36 GLU HGy A 34 GLN H 1.0 1.9 6.0 620 616 A 34 GLN H A 34 GLN HBy 1.0 1.8 3.4 621 617 A 34 GLN H A 34 GLN HBx 1.0 1.9 3.9 622 618 A 26 SER H A 26 SER HA 1.0 1.8 3.8 623 619 A 39 ASP H A 40 PRO HDx 1.0 2.0 6.0 624 620 A 42 ILE H A 39 ASP HBy 1.0 0.0 6.0 625 621 A 39 ASP HBx A 42 ILE H 1.0 2.0 6.0 626 622 A 42 ILE HB A 42 ILE H 1.0 1.9 4.3 627 623 A 42 ILE HG1y A 42 ILE H 1.0 1.9 4.3 628 624 A 32 SER H A 29 CYS HA 1.0 2.0 6.0 629 625 A 32 SER H A 32 SER HBy 1.0 1.7 3.1 630 626 A 32 SER H A 32 SER HA 1.0 1.8 3.6 631 627 A 19 GLY H A 19 GLY HAy 1.0 1.6 3.0 632 628 A 19 GLY H A 23 VAL HA 1.0 1.7 6.0 633 629 A 19 GLY H A 25 TYR HBx 1.0 0.0 6.0 634 629 A 19 GLY H A 25 TYR HBy 1.0 0.0 6.0 635 630 A 19 GLY H A 25 TYR HBy 1.0 1.3 6.0 636 631 A 5 VAL HA A 6 GLY H 1.0 1.6 2.8 637 632 A 6 GLY H A 6 GLY HAx 1.0 1.8 4.0 638 633 A 6 GLY H A 6 GLY HAy 1.0 1.7 3.3 639 634 A 6 GLY H A 5 VAL HB 1.0 1.9 4.9 640 635 A 38 CYS HBx A 38 CYS H 1.0 1.7 2.9 641 636 A 48 GLY H A 48 GLY HAy 1.0 1.8 3.6 642 637 A 27 ASN HBx A 27 ASN HD2x 1.0 1.8 3.8 643 638 A 27 ASN HD2x A 13 GLU HG2 1.0 1.9 6.0 644 639 A 17 VAL H A 16 PRO HA 1.0 1.6 2.8 645 640 A 23 VAL H A 22 GLY HAx 1.0 2.0 5.4 646 641 A 17 VAL H A 25 TYR HBy 1.0 1.9 4.9 647 641 A 17 VAL H A 25 TYR HBx 1.0 1.9 4.9 648 642 A 17 VAL H A 16 PRO HBy 1.0 2.0 5.0 649 643 A 19 GLY HAy A 43 THR H 1.0 0.0 6.0 650 644 A 43 THR H A 42 ILE HA 1.0 1.7 2.9 651 645 A 40 PRO HDy A 41 ASN H 1.0 2.0 5.2 652 646 A 40 PRO HDx A 41 ASN H 1.0 2.0 5.2 653 647 A 41 ASN HBy A 41 ASN H 1.0 1.8 3.4 654 648 A 39 ASP HBx A 41 ASN H 1.0 1.7 6.0 655 649 A 36 GLU H A 36 GLU HBx 1.0 2.0 5.0 656 650 A 40 PRO HGy A 41 ASN H 1.0 1.9 4.7 657 651 A 42 ILE HG1y A 41 ASN H 1.0 2.0 6.0 658 652 A 42 ILE HG1x A 41 ASN H 1.0 1.8 6.0 659 653 A 49 GLU H A 49 GLU HA 1.0 1.8 3.8 660 654 A 49 GLU H A 48 GLY HAy 1.0 1.8 3.6 661 655 A 11 THR H A 10 CYS HBx 1.0 1.9 6.0 662 656 A 18 CYS HBy A 49 GLU H 1.0 0.0 6.0 663 657 A 49 GLU H A 49 GLU HBx 1.0 1.9 4.3 664 658 A 49 GLU H A 16 PRO HGy 1.0 2.0 4.6 665 659 A 30 ASN HD2x A 10 CYS HBy 1.0 2.0 5.2 666 660 A 30 ASN HD2x A 30 ASN HBx 1.0 1.9 4.1 667 661 A 30 ASN HD2x A 34 GLN HGx 1.0 0.0 6.0 668 662 A 30 ASN HD2x A 34 GLN HBx 1.0 1.9 6.0 669 663 A 30 ASN HD2y A 30 ASN HBy 1.0 1.9 5.1 670 664 A 30 ASN HD2y A 30 ASN HBx 1.0 1.9 4.1 671 665 A 30 ASN HD2y A 34 GLN HBy 1.0 0.0 6.0 672 666 A 30 ASN HD2y A 34 GLN HBx 1.0 1.3 6.0 673 667 A 35 GLN HE2x A 44 ILE HA 1.0 1.4 6.0 674 668 A 35 GLN HE2x A 39 ASP HBx 1.0 0.0 6.0 675 669 A 35 GLN HE2x A 42 ILE HG1y 1.0 2.0 6.0 676 670 A 37 GLN H A 38 CYS HBy 1.0 2.0 6.0 677 671 A 37 GLN HE2x A 36 GLU HGy 1.0 2.0 5.2 678 672 A 34 GLN HE2x A 34 GLN HBx 1.0 1.9 5.1 679 673 A 37 GLN HE2y A 36 GLU HGy 1.0 2.0 6.0 680 674 A 38 CYS HBx A 34 GLN HE2x 1.0 2.0 6.0 681 675 A 34 GLN HE2x A 34 GLN HGx 1.0 2.0 6.0 682 676 A 22 GLY H A 22 GLY HAx 1.0 1.8 3.4 683 677 A 22 GLY H A 22 GLY HAy 1.0 1.8 3.4 684 678 A 22 GLY H A 21 ASP HBx 1.0 2.0 6.0 685 679 A 22 GLY H A 23 VAL HB 1.0 2.0 6.0 686 680 A 27 ASN H A 30 ASN HBx 1.0 1.7 3.5 687 681 A 27 ASN H A 30 ASN HBy 1.0 1.9 4.3 688 682 A 44 ILE H A 43 THR HB 1.0 1.7 3.1 689 683 A 44 ILE HA A 44 ILE H 1.0 1.8 3.4 690 684 A 44 ILE HB A 44 ILE H 1.0 1.7 3.1 691 685 A 43 THR H A 42 ILE HG1y 1.0 1.8 3.8 692 686 A 45 ALA H A 19 GLY HAy 1.0 1.9 4.9 693 687 A 23 VAL H A 21 ASP H 1.0 1.9 4.7 694 688 A 17 VAL H A 25 TYR H 1.0 1.8 4.0 695 689 A 17 VAL H A 26 SER HA 1.0 2.0 6.0 696 690 A 20 SER H A 44 ILE HA 1.0 2.0 5.2 697 691 A 18 CYS H A 46 HIS H 1.0 1.9 4.3 stop_ save_ save_CNS/XPLOR_distance_constraints_5 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_5 _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 20 SER H A 42 ILE H 1.0 2.0 6.0 2 1 A 46 HIS H A 20 SER H 1.0 2.0 6.0 3 2 A 20 SER H A 44 ILE H 1.0 2.0 6.0 4 2 A 22 GLY H A 20 SER H 1.0 2.0 6.0 5 3 A 30 ASN HA A 30 ASN HBy 1.0 1.6 2.6 6 3 A 21 ASP HBy A 21 ASP HA 1.0 1.6 2.6 7 3 A 15 TYR HA A 16 PRO HDy 1.0 1.6 2.6 8 4 A 50 CYS H A 24 THR H 1.0 2.0 5.2 9 4 A 17 VAL H A 18 CYS H 1.0 2.0 5.2 10 4 A 50 CYS H A 49 GLU H 1.0 2.0 5.2 11 5 A 46 HIS HE1 A 49 GLU H 1.0 1.9 6.0 12 5 A 18 CYS H A 46 HIS HE1 1.0 1.9 6.0 13 6 A 19 GLY H A 17 VAL H 1.0 1.9 6.0 14 6 A 19 GLY H A 50 CYS H 1.0 1.9 6.0 15 7 A 25 TYR H A 50 CYS H 1.0 2.0 4.6 16 7 A 17 VAL H A 25 TYR H 1.0 2.0 4.6 17 8 A 19 GLY H A 24 THR H 1.0 2.0 6.0 18 8 A 19 GLY H A 18 CYS H 1.0 2.0 6.0 19 9 A 25 TYR H A 18 CYS H 1.0 2.0 6.0 20 9 A 25 TYR H A 24 THR H 1.0 2.0 6.0 21 10 A 45 ALA H A 21 ASP H 1.0 1.9 6.0 22 10 A 45 ALA H A 43 THR H 1.0 1.9 6.0 23 11 A 14 TRP HH2 A 26 SER H 1.0 2.0 6.0 24 11 A 26 SER H A 30 ASN HD2y 1.0 2.0 6.0 25 12 A 2 GLU H A 3 ASP H 1.0 1.8 3.8 26 12 A 22 GLY H A 21 ASP H 1.0 1.8 3.8 27 13 A 43 THR H A 44 ILE H 1.0 1.9 4.1 28 13 A 6 GLY H A 5 VAL H 1.0 1.9 4.1 29 14 A 6 GLY H A 4 CYS H 1.0 1.9 6.0 30 14 A 4 CYS H A 2 GLU H 1.0 1.9 6.0 31 15 A 27 ASN H A 10 CYS H 1.0 1.1 6.0 32 15 A 27 ASN H A 27 ASN HD2x 1.0 1.1 6.0 33 16 A 39 ASP H A 42 ILE H 1.0 2.0 6.0 34 16 A 31 PHE H A 30 ASN HD2y 1.0 2.0 6.0 35 17 A 23 VAL H A 46 HIS H 1.0 2.0 6.0 36 17 A 35 GLN H A 30 ASN HD2y 1.0 2.0 6.0 37 17 A 35 GLN HE2x A 42 ILE H 1.0 2.0 6.0 38 18 A 4 CYS H A 34 GLN H 1.0 1.9 6.0 39 18 A 9 ALA H A 34 GLN H 1.0 1.9 6.0 40 18 A 14 TRP HH2 A 11 THR H 1.0 1.9 6.0 41 18 A 29 CYS H A 34 GLN H 1.0 1.9 6.0 42 18 A 9 ALA H A 7 ARG HE 1.0 1.9 6.0 43 19 A 37 GLN HE2x A 37 GLN HE2y 1.0 1.4 2.2 44 19 A 34 GLN HE2y A 34 GLN HE2x 1.0 1.4 2.2 45 20 A 27 ASN HD2y A 29 CYS H 1.0 2.0 6.0 46 20 A 27 ASN HD2y A 11 THR H 1.0 2.0 6.0 47 21 A 9 ALA H A 8 LYS H 1.0 1.9 4.5 48 21 A 4 CYS H A 3 ASP H 1.0 1.9 4.5 49 21 A 4 CYS H A 5 VAL H 1.0 1.9 4.5 50 22 A 10 CYS H A 30 ASN H 1.0 1.9 6.0 51 22 A 30 ASN H A 27 ASN HD2x 1.0 1.9 6.0 52 23 A 4 CYS H A 37 GLN HE2x 1.0 2.0 5.8 53 23 A 34 GLN HE2x A 4 CYS H 1.0 2.0 5.8 54 23 A 29 CYS H A 33 ALA H 1.0 2.0 5.8 55 24 A 22 GLY H A 35 GLN HE2x 1.0 2.0 6.0 56 24 A 38 CYS H A 3 ASP H 1.0 2.0 6.0 57 24 A 35 GLN HE2x A 44 ILE H 1.0 2.0 6.0 58 25 A 30 ASN HD2x A 29 CYS H 1.0 1.9 6.0 59 25 A 14 TRP HZ2 A 49 GLU H 1.0 1.9 6.0 60 26 A 35 GLN H A 37 GLN HE2x 1.0 2.0 5.8 61 26 A 35 GLN H A 33 ALA H 1.0 2.0 5.8 62 26 A 37 GLN HE2x A 38 CYS H 1.0 2.0 5.8 63 27 A 30 ASN HD2x A 37 GLN HE2y 1.0 2.0 6.0 64 27 A 34 GLN HE2y A 30 ASN HD2x 1.0 2.0 6.0 65 28 A 17 VAL H A 18 CYS HA 1.0 2.0 6.0 66 28 A 50 CYS H A 18 CYS HA 1.0 2.0 6.0 67 29 A 40 PRO HA A 41 ASN H 1.0 2.0 5.8 68 29 A 41 ASN HA A 41 ASN H 1.0 2.0 5.8 69 30 A 35 GLN HE2x A 40 PRO HA 1.0 2.0 4.8 70 30 A 38 CYS H A 40 PRO HA 1.0 2.0 4.8 71 30 A 35 GLN H A 40 PRO HA 1.0 2.0 4.8 72 31 A 30 ASN HD2y A 7 ARG HA 1.0 1.8 4.2 73 31 A 46 HIS H A 46 HIS HA 1.0 1.8 4.2 74 32 A 10 CYS H A 11 THR HB 1.0 2.0 5.4 75 32 A 13 GLU H A 11 THR HB 1.0 2.0 5.4 76 33 A 22 GLY H A 21 ASP HA 1.0 1.9 4.5 77 33 A 3 ASP HA A 3 ASP H 1.0 1.9 4.5 78 34 A 48 GLY HAx A 49 GLU H 1.0 1.7 3.5 79 34 A 11 THR H A 11 THR HA 1.0 1.7 3.5 80 35 A 23 VAL H A 21 ASP HA 1.0 1.9 6.0 81 35 A 14 TRP HE3 A 11 THR HA 1.0 1.9 6.0 82 36 A 7 ARG H A 9 ALA HA 1.0 2.0 6.0 83 36 A 46 HIS HE1 A 48 GLY HAx 1.0 2.0 6.0 84 37 A 30 ASN HD2x A 9 ALA HA 1.0 1.9 6.0 85 37 A 30 ASN HD2x A 8 LYS HA 1.0 1.9 6.0 86 38 A 30 ASN HD2y A 29 CYS HA 1.0 1.7 6.0 87 38 A 46 HIS H A 50 CYS HA 1.0 1.7 6.0 88 38 A 50 CYS HA A 46 HIS HD2 1.0 1.7 6.0 89 39 A 39 ASP H A 37 GLN HA 1.0 2.0 6.0 90 39 A 31 PHE H A 29 CYS HA 1.0 2.0 6.0 91 40 A 37 GLN HE2x A 37 GLN HA 1.0 2.0 6.0 92 40 A 29 CYS HA A 33 ALA H 1.0 2.0 6.0 93 41 A 37 GLN HA A 34 GLN H 1.0 1.7 6.0 94 41 A 29 CYS HA A 34 GLN H 1.0 1.7 6.0 95 42 A 29 CYS H A 26 SER HB2 1.0 0.0 6.0 96 42 A 11 THR H A 26 SER HB2 1.0 0.0 6.0 97 43 A 30 ASN H A 28 PRO HA 1.0 2.0 5.4 98 43 A 32 SER H A 28 PRO HA 1.0 2.0 5.4 99 44 A 23 VAL H A 45 ALA HA 1.0 0.0 6.0 100 44 A 14 TRP HE3 A 13 GLU HA 1.0 0.0 6.0 101 45 A 46 HIS H A 45 ALA HA 1.0 1.9 3.9 102 45 A 42 ILE H A 42 ILE HA 1.0 1.9 3.9 103 46 A 46 HIS H A 22 GLY HAx 1.0 1.5 6.0 104 46 A 46 HIS H A 20 SER HA 1.0 1.5 6.0 105 47 A 14 TRP HH2 A 24 THR HB 1.0 1.9 6.0 106 47 A 14 TRP HH2 A 16 PRO HA 1.0 1.9 6.0 107 48 A 32 SER HBy A 34 GLN H 1.0 0.0 6.0 108 48 A 35 GLN HA A 34 GLN H 1.0 0.0 6.0 109 49 A 38 CYS H A 35 GLN HA 1.0 1.8 4.0 110 49 A 35 GLN H A 35 GLN HA 1.0 1.8 4.0 111 50 A 35 GLN HA A 42 ILE H 1.0 2.0 6.0 112 50 A 12 ARG HE A 28 PRO HD2 1.0 2.0 6.0 113 51 A 14 TRP HH2 A 49 GLU HA 1.0 2.0 6.0 114 51 A 35 GLN HA A 34 GLN H 1.0 2.0 6.0 115 52 A 8 LYS H A 6 GLY HAx 1.0 1.9 6.0 116 52 A 5 VAL H A 6 GLY HAx 1.0 1.9 6.0 117 53 A 6 GLY H A 6 GLY HAx 1.0 1.9 3.9 118 53 A 20 SER HBy A 43 THR H 1.0 1.9 3.9 119 54 A 31 PHE HZ A 42 ILE HA 1.0 2.0 5.6 120 54 A 31 PHE HZ A 43 THR HB 1.0 2.0 5.6 121 55 A 44 ILE HA A 44 ILE H 1.0 2.0 4.6 122 55 A 3 ASP HBx A 3 ASP H 1.0 2.0 4.6 123 56 A 30 ASN HD2x A 29 CYS HBy 1.0 2.0 6.0 124 56 A 14 TRP HZ2 A 14 TRP HBy 1.0 2.0 6.0 125 57 A 29 CYS H A 29 CYS HBy 1.0 1.7 2.9 126 57 A 49 GLU H A 48 GLY HAy 1.0 1.7 2.9 127 58 A 14 TRP HD1 A 14 TRP HBy 1.0 1.8 4.0 128 58 A 12 ARG HE A 29 CYS HBy 1.0 1.8 4.0 129 59 A 12 ARG HE A 10 CYS HBy 1.0 0.0 6.0 130 59 A 30 ASN HD2y A 10 CYS HBy 1.0 0.0 6.0 131 60 A 26 SER H A 14 TRP HBx 1.0 1.9 6.0 132 60 A 26 SER H A 31 PHE HA 1.0 1.9 6.0 133 61 A 46 HIS HD2 A 46 HIS HBx 1.0 1.8 3.8 134 61 A 14 TRP HD1 A 14 TRP HBx 1.0 1.8 3.8 135 61 A 7 ARG HDy A 7 ARG HE 1.0 1.8 3.8 136 62 A 15 TYR H A 14 TRP HBx 1.0 2.0 4.8 137 62 A 15 TYR H A 27 ASN HBx 1.0 2.0 4.8 138 63 A 30 ASN HBy A 34 GLN H 1.0 2.0 6.0 139 63 A 34 GLN HGy A 34 GLN H 1.0 2.0 6.0 140 64 A 14 TRP HD1 A 16 PRO HDy 1.0 2.0 4.4 141 64 A 12 ARG HE A 29 CYS HBx 1.0 2.0 4.4 142 65 A 6 GLY H A 6 GLY HAy 1.0 1.7 3.3 143 65 A 21 ASP HBy A 21 ASP H 1.0 1.7 3.3 144 66 A 29 CYS HBx A 34 GLN H 1.0 2.0 5.6 145 66 A 6 GLY HAy A 7 ARG HE 1.0 2.0 5.6 146 66 A 14 TRP HH2 A 16 PRO HDy 1.0 2.0 5.6 147 66 A 30 ASN HBy A 34 GLN H 1.0 2.0 5.6 148 67 A 5 VAL H A 6 GLY HAy 1.0 0.0 6.0 149 67 A 5 VAL H A 4 CYS HBy 1.0 0.0 6.0 150 68 A 27 ASN H A 15 TYR HBy 1.0 0.0 6.0 151 68 A 27 ASN H A 31 PHE HBy 1.0 0.0 6.0 152 69 A 48 GLY H A 47 MET HBy 1.0 1.8 3.8 153 69 A 41 ASN HBy A 41 ASN H 1.0 1.8 3.8 154 70 A 17 VAL H A 25 TYR HBy 1.0 1.9 3.9 155 70 A 38 CYS HBx A 4 CYS H 1.0 1.9 3.9 156 71 A 38 CYS HBx A 37 GLN HE2x 1.0 1.9 4.1 157 71 A 38 CYS HBx A 34 GLN HE2x 1.0 1.9 4.1 158 72 A 9 ALA H A 10 CYS HBx 1.0 2.0 5.8 159 72 A 17 VAL H A 25 TYR HBx 1.0 2.0 5.8 160 73 A 25 TYR HBx A 26 SER H 1.0 1.8 3.6 161 73 A 26 SER H A 30 ASN HBx 1.0 1.8 3.6 162 74 A 25 TYR HBx A 18 CYS H 1.0 1.9 6.0 163 74 A 29 CYS H A 30 ASN HBx 1.0 1.9 6.0 164 74 A 11 THR H A 10 CYS HBx 1.0 1.9 6.0 165 75 A 42 ILE H A 39 ASP HBy 1.0 1.9 3.9 166 75 A 30 ASN HD2y A 30 ASN HBx 1.0 1.9 3.9 167 76 A 39 ASP H A 34 GLN HA 1.0 1.9 5.5 168 76 A 39 ASP H A 40 PRO HDx 1.0 1.9 5.5 169 77 A 27 ASN HD2y A 30 ASN HBx 1.0 1.9 6.0 170 77 A 27 ASN HD2y A 10 CYS HBx 1.0 1.9 6.0 171 78 A 38 CYS H A 39 ASP HBx 1.0 0.0 6.0 172 78 A 35 GLN H A 36 GLU HGy 1.0 0.0 6.0 173 78 A 38 CYS H A 36 GLU HGy 1.0 0.0 6.0 174 79 A 35 GLN HE2y A 34 GLN HBy 1.0 0.0 6.0 175 79 A 35 GLN HE2y A 23 VAL HB 1.0 0.0 6.0 176 80 A 14 TRP HZ2 A 49 GLU HBy 1.0 2.0 6.0 177 80 A 30 ASN HD2x A 34 GLN HBy 1.0 2.0 6.0 178 81 A 6 GLY H A 34 GLN HBy 1.0 0.0 6.0 179 81 A 21 ASP H A 35 GLN HGy 1.0 0.0 6.0 180 81 A 43 THR H A 35 GLN HGy 1.0 0.0 6.0 181 82 A 33 ALA H A 34 GLN HBy 1.0 2.0 6.0 182 82 A 34 GLN HE2x A 34 GLN HBy 1.0 2.0 6.0 183 83 A 35 GLN H A 34 GLN HBy 1.0 1.7 3.3 184 83 A 35 GLN HE2x A 35 GLN HGy 1.0 1.7 3.3 185 84 A 35 GLN HGy A 42 ILE H 1.0 2.0 6.0 186 84 A 30 ASN HD2y A 34 GLN HBy 1.0 2.0 6.0 187 85 A 37 GLN H A 36 GLU HBy 1.0 1.9 4.3 188 85 A 37 GLN H A 37 GLN HBy 1.0 1.9 4.3 189 86 A 35 GLN HGx A 34 GLN H 1.0 2.0 6.0 190 86 A 34 GLN H A 34 GLN HGx 1.0 2.0 6.0 191 87 A 37 GLN HE2x A 37 GLN HBy 1.0 1.8 3.8 192 87 A 34 GLN HE2x A 34 GLN HGx 1.0 1.8 3.8 193 88 A 39 ASP H A 35 GLN HGx 1.0 2.0 6.0 194 88 A 39 ASP H A 36 GLU HBy 1.0 2.0 6.0 195 88 A 39 ASP H A 34 GLN HGx 1.0 2.0 6.0 196 88 A 39 ASP H A 40 PRO HBx 1.0 2.0 6.0 197 89 A 30 ASN H A 13 GLU HBy 1.0 2.0 6.0 198 89 A 32 SER H A 34 GLN HGx 1.0 2.0 6.0 199 89 A 32 SER H A 35 GLN HGx 1.0 2.0 6.0 200 90 A 40 PRO HBx A 41 ASN H 1.0 1.9 3.9 201 90 A 48 GLY H A 47 MET HBx 1.0 1.9 3.9 202 91 A 6 GLY H A 5 VAL HB 1.0 0.0 6.0 203 91 A 14 TRP H A 13 GLU HBy 1.0 0.0 6.0 204 92 A 41 ASN HD2y A 40 PRO HBx 1.0 1.8 6.0 205 92 A 14 TRP HZ2 A 49 GLU HBx 1.0 1.8 6.0 206 93 A 49 GLU H A 49 GLU HBx 1.0 1.9 4.7 207 93 A 36 GLU H A 36 GLU HBx 1.0 1.9 4.7 208 94 A 37 GLN HE2x A 36 GLU HBx 1.0 2.0 5.4 209 94 A 34 GLN HE2x A 5 VAL HB 1.0 2.0 5.4 210 95 A 42 ILE H A 40 PRO HGy 1.0 1.9 6.0 211 95 A 35 GLN HBy A 42 ILE H 1.0 1.9 6.0 212 96 A 39 ASP H A 40 PRO HGy 1.0 1.9 6.0 213 96 A 39 ASP H A 35 GLN HBy 1.0 1.9 6.0 214 97 A 8 LYS H A 8 LYS HDy 1.0 2.0 5.2 215 97 A 8 LYS H A 7 ARG HBx 1.0 2.0 5.2 216 98 A 34 GLN HE2x A 8 LYS HDy 1.0 2.0 6.0 217 98 A 34 GLN HE2x A 7 ARG HBx 1.0 2.0 6.0 218 99 A 34 GLN HE2y A 8 LYS HDy 1.0 2.0 5.8 219 99 A 34 GLN HE2y A 7 ARG HBx 1.0 2.0 5.8 220 100 A 39 ASP H A 42 ILE HG1y 1.0 2.0 6.0 221 100 A 39 ASP H A 34 GLN HBx 1.0 2.0 6.0 222 100 A 31 PHE H A 34 GLN HBx 1.0 2.0 6.0 223 101 A 30 ASN HD2y A 34 GLN HBx 1.0 1.8 4.2 224 101 A 42 ILE HG1y A 42 ILE H 1.0 1.8 4.2 225 102 A 35 GLN HE2x A 42 ILE HG1y 1.0 1.9 3.9 226 102 A 35 GLN H A 34 GLN HBx 1.0 1.9 3.9 227 103 A 7 ARG HGy A 7 ARG HE 1.0 1.8 4.0 228 103 A 34 GLN H A 34 GLN HBx 1.0 1.8 4.0 229 104 A 30 ASN HD2y A 8 LYS HBy 1.0 2.0 6.0 230 104 A 7 ARG HGx A 7 ARG HE 1.0 2.0 6.0 231 105 A 45 ALA H A 44 ILE HB 1.0 2.0 6.0 232 105 A 45 ALA H A 18 CYS HBx 1.0 2.0 6.0 233 106 A 24 THR H A 18 CYS HBx 1.0 1.6 6.0 234 106 A 48 GLY H A 18 CYS HBx 1.0 1.6 6.0 235 106 A 48 GLY H A 16 PRO HGy 1.0 1.6 6.0 236 107 A 14 TRP HD1 A 16 PRO HGy 1.0 1.9 4.7 237 107 A 46 HIS H A 18 CYS HBx 1.0 1.9 4.7 238 108 A 21 ASP H A 42 ILE HG1x 1.0 1.8 4.0 239 108 A 43 THR H A 42 ILE HG1x 1.0 1.8 4.0 240 109 A 27 ASN HA A 29 CYS HBx 1.0 0.0 6.0 241 109 A 27 ASN HA A 30 ASN HBy 1.0 0.0 6.0 242 110 A 18 CYS HA A 49 GLU HBy 1.0 1.7 6.0 243 110 A 18 CYS HA A 23 VAL HB 1.0 1.7 6.0 244 111 A 23 VAL HB A 24 THR HA 1.0 2.0 6.0 245 111 A 49 GLU HBy A 24 THR HA 1.0 2.0 6.0 246 112 A 21 ASP HBy A 24 THR HA 1.0 2.0 5.8 247 112 A 30 ASN HBy A 24 THR HA 1.0 2.0 5.8 248 112 A 38 CYS HBy A 2 GLU HA 1.0 2.0 5.8 249 113 A 30 ASN HBy A 24 THR HA 1.0 0.0 6.0 250 113 A 38 CYS HBy A 2 GLU HA 1.0 0.0 6.0 251 114 A 19 GLY HAy A 31 PHE HBy 1.0 2.0 6.0 252 114 A 4 CYS HBy A 2 GLU HA 1.0 2.0 6.0 253 114 A 19 GLY HAy A 21 ASP HBy 1.0 2.0 6.0 254 115 A 31 PHE HA A 24 THR HA 1.0 0.0 6.0 255 115 A 19 GLY HAy A 31 PHE HA 1.0 0.0 6.0 256 116 A 49 GLU HBy A 24 THR HA 1.0 2.0 6.0 257 116 A 19 GLY HAy A 23 VAL HB 1.0 2.0 6.0 258 117 A 41 ASN HA A 40 PRO HDx 1.0 2.0 6.0 259 117 A 40 PRO HA A 40 PRO HDx 1.0 2.0 6.0 260 118 A 35 GLN HBy A 40 PRO HA 1.0 1.8 4.0 261 118 A 40 PRO HA A 40 PRO HGy 1.0 1.8 4.0 262 119 A 47 MET HA A 47 MET HBx 1.0 1.7 3.3 263 119 A 5 VAL HA A 5 VAL HB 1.0 1.7 3.3 264 120 A 46 HIS HA A 44 ILE HB 1.0 2.0 6.0 265 120 A 47 MET HA A 16 PRO HGy 1.0 2.0 6.0 266 120 A 47 MET HA A 18 CYS HBx 1.0 2.0 6.0 267 120 A 46 HIS HA A 18 CYS HBx 1.0 2.0 6.0 268 121 A 5 VAL HA A 23 VAL HB 1.0 1.8 6.0 269 121 A 25 TYR HA A 49 GLU HBy 1.0 1.8 6.0 270 121 A 25 TYR HA A 23 VAL HB 1.0 1.8 6.0 271 122 A 25 TYR HA A 49 GLU HBy 1.0 0.0 6.0 272 122 A 25 TYR HA A 35 GLN HGy 1.0 0.0 6.0 273 122 A 25 TYR HA A 34 GLN HBy 1.0 0.0 6.0 274 122 A 5 VAL HA A 34 GLN HBy 1.0 0.0 6.0 275 123 A 5 VAL HA A 34 GLN HBx 1.0 2.0 6.0 276 123 A 34 GLN HBx A 4 CYS HA 1.0 2.0 6.0 277 123 A 25 TYR HA A 34 GLN HBx 1.0 2.0 6.0 278 123 A 11 THR HB A 12 ARG HGy 1.0 2.0 6.0 279 124 A 48 GLY HAx A 50 CYS HBx 1.0 2.0 6.0 280 124 A 30 ASN HA A 31 PHE HBx 1.0 2.0 6.0 281 125 A 48 GLY HAx A 16 PRO HGy 1.0 1.9 5.5 282 125 A 15 TYR HA A 16 PRO HGy 1.0 1.9 5.5 283 126 A 48 GLY HAx A 16 PRO HBy 1.0 0.0 6.0 284 126 A 15 TYR HA A 16 PRO HBy 1.0 0.0 6.0 285 127 A 11 THR HA A 14 TRP HBx 1.0 1.9 6.0 286 127 A 30 ASN HA A 31 PHE HA 1.0 1.9 6.0 287 128 A 18 CYS HBy A 21 ASP HA 1.0 1.9 6.0 288 128 A 48 GLY HAx A 18 CYS HBy 1.0 1.9 6.0 289 129 A 5 VAL HB A 3 ASP HA 1.0 1.4 6.0 290 129 A 11 THR HA A 13 GLU HBy 1.0 1.4 6.0 291 129 A 48 GLY HAx A 49 GLU HBx 1.0 1.4 6.0 292 130 A 48 GLY HAx A 17 VAL HB 1.0 0.0 6.0 293 130 A 30 ASN HA A 8 LYS HDy 1.0 0.0 6.0 294 130 A 15 TYR HA A 17 VAL HB 1.0 0.0 6.0 295 131 A 15 TYR HA A 15 TYR HBx 1.0 1.8 3.6 296 131 A 30 ASN HA A 30 ASN HBx 1.0 1.8 3.6 297 132 A 8 LYS HBy A 9 ALA HA 1.0 1.9 6.0 298 132 A 30 ASN HA A 8 LYS HBy 1.0 1.9 6.0 299 133 A 30 ASN HA A 34 GLN HA 1.0 2.0 5.8 300 133 A 27 ASN HBy A 11 THR HA 1.0 2.0 5.8 301 134 A 27 ASN HBx A 12 ARG HA 1.0 0.0 6.0 302 134 A 27 ASN HBx A 11 THR HA 1.0 0.0 6.0 303 135 A 9 ALA HA A 10 CYS HBx 1.0 2.0 5.6 304 135 A 9 ALA HA A 30 ASN HBx 1.0 2.0 5.6 305 136 A 9 ALA HA A 34 GLN HBy 1.0 0.0 6.0 306 136 A 8 LYS HA A 34 GLN HBy 1.0 0.0 6.0 307 137 A 10 CYS HA A 10 CYS HBx 1.0 1.7 3.3 308 137 A 39 ASP HA A 39 ASP HBy 1.0 1.7 3.3 309 138 A 5 VAL HB A 38 CYS HA 1.0 1.9 6.0 310 138 A 40 PRO HBx A 38 CYS HA 1.0 1.9 6.0 311 138 A 40 PRO HBx A 39 ASP HA 1.0 1.9 6.0 312 138 A 35 GLN HGx A 39 ASP HA 1.0 1.9 6.0 313 139 A 35 GLN HBy A 39 ASP HA 1.0 2.0 6.0 314 139 A 39 ASP HA A 40 PRO HGy 1.0 2.0 6.0 315 140 A 50 CYS HA A 49 GLU HBx 1.0 0.0 6.0 316 140 A 37 GLN HA A 36 GLU HBx 1.0 0.0 6.0 317 141 A 29 CYS HA A 30 ASN HBx 1.0 2.0 6.0 318 141 A 29 CYS HA A 10 CYS HBx 1.0 2.0 6.0 319 142 A 44 ILE HB A 45 ALA HA 1.0 2.0 6.0 320 142 A 44 ILE HB A 43 THR HB 1.0 2.0 6.0 321 142 A 17 VAL HA A 18 CYS HBx 1.0 2.0 6.0 322 143 A 28 PRO HA A 31 PHE HA 1.0 1.7 6.0 323 143 A 13 GLU HA A 14 TRP HBx 1.0 1.7 6.0 324 144 A 18 CYS HBy A 45 ALA HA 1.0 0.0 6.0 325 144 A 17 VAL HA A 18 CYS HBy 1.0 0.0 6.0 326 145 A 17 VAL HA A 44 ILE HG1x 1.0 2.0 6.0 327 145 A 43 THR HB A 44 ILE HG1x 1.0 2.0 6.0 328 145 A 28 PRO HA A 44 ILE HG1x 1.0 2.0 6.0 329 146 A 28 PRO HA A 30 ASN HBx 1.0 1.9 6.0 330 146 A 42 ILE HA A 39 ASP HBy 1.0 1.9 6.0 331 146 A 28 PRO HA A 15 TYR HBx 1.0 1.9 6.0 332 146 A 25 TYR HBx A 28 PRO HA 1.0 1.9 6.0 333 146 A 25 TYR HBx A 17 VAL HA 1.0 1.9 6.0 334 147 A 28 PRO HA A 34 GLN HBy 1.0 1.9 6.0 335 147 A 35 GLN HGy A 42 ILE HA 1.0 1.9 6.0 336 148 A 1 ALA HA A 37 GLN HBy 1.0 2.0 6.0 337 148 A 17 VAL HA A 47 MET HBx 1.0 2.0 6.0 338 149 A 20 SER HA A 18 CYS HBy 1.0 2.0 5.2 339 149 A 18 CYS HBy A 22 GLY HAx 1.0 2.0 5.2 340 150 A 20 SER HA A 35 GLN HGx 1.0 2.0 6.0 341 150 A 1 ALA HA A 37 GLN HBy 1.0 2.0 6.0 342 151 A 24 THR HB A 7 ARG HBy 1.0 2.0 6.0 343 151 A 24 THR HB A 7 ARG HBx 1.0 2.0 6.0 344 151 A 20 SER HA A 17 VAL HB 1.0 2.0 6.0 345 152 A 50 CYS HBx A 22 GLY HAx 1.0 2.0 5.4 346 152 A 24 THR HB A 50 CYS HBx 1.0 2.0 5.4 347 153 A 16 PRO HA A 49 GLU HBy 1.0 1.9 4.3 348 153 A 24 THR HB A 49 GLU HBy 1.0 1.9 4.3 349 154 A 24 THR HB A 18 CYS HBy 1.0 0.0 6.0 350 154 A 18 CYS HBy A 22 GLY HAx 1.0 0.0 6.0 351 155 A 16 PRO HA A 49 GLU HBy 1.0 1.9 4.1 352 155 A 23 VAL HB A 22 GLY HAx 1.0 1.9 4.1 353 155 A 24 THR HB A 49 GLU HBy 1.0 1.9 4.1 354 156 A 24 THR HB A 7 ARG HBx 1.0 2.0 6.0 355 156 A 16 PRO HA A 17 VAL HB 1.0 2.0 6.0 356 157 A 24 THR HB A 49 GLU HBx 1.0 2.0 5.4 357 157 A 16 PRO HA A 49 GLU HBx 1.0 2.0 5.4 358 158 A 42 ILE HB A 22 GLY HAx 1.0 0.0 6.0 359 158 A 32 SER HBy A 36 GLU HBx 1.0 0.0 6.0 360 159 A 35 GLN HA A 39 ASP HBx 1.0 2.0 5.4 361 159 A 28 PRO HD2 A 28 PRO HBy 1.0 2.0 5.4 362 160 A 17 VAL HB A 49 GLU HA 1.0 0.0 6.0 363 160 A 7 ARG HBx A 6 GLY HAx 1.0 0.0 6.0 364 161 A 20 SER HBy A 42 ILE HG1x 1.0 1.9 4.5 365 161 A 35 GLN HA A 42 ILE HG1x 1.0 1.9 4.5 366 162 A 20 SER HBy A 42 ILE HG1y 1.0 1.8 4.0 367 162 A 35 GLN HA A 42 ILE HG1y 1.0 1.8 4.0 368 162 A 35 GLN HA A 34 GLN HBx 1.0 1.8 4.0 369 163 A 33 ALA HA A 34 GLN HBx 1.0 2.0 6.0 370 163 A 20 SER HBy A 42 ILE HG1y 1.0 2.0 6.0 371 164 A 40 PRO HBx A 40 PRO HDx 1.0 1.9 3.9 372 164 A 34 GLN HA A 34 GLN HGx 1.0 1.9 3.9 373 165 A 16 PRO HDx A 27 ASN HBy 1.0 2.0 6.0 374 165 A 34 GLN HA A 35 GLN HBx 1.0 2.0 6.0 375 166 A 18 CYS HBx A 48 GLY HAy 1.0 1.9 4.3 376 166 A 16 PRO HGy A 48 GLY HAy 1.0 1.9 4.3 377 167 A 14 TRP HBy A 16 PRO HBy 1.0 2.0 6.0 378 167 A 16 PRO HBy A 48 GLY HAy 1.0 2.0 6.0 379 168 A 27 ASN HBx A 16 PRO HBy 1.0 2.0 6.0 380 168 A 14 TRP HBx A 16 PRO HBy 1.0 2.0 6.0 381 169 A 50 CYS HBy A 23 VAL HB 1.0 2.0 5.4 382 169 A 50 CYS HBy A 49 GLU HBy 1.0 2.0 5.4 383 170 A 38 CYS HBy A 5 VAL HB 1.0 1.9 6.0 384 170 A 6 GLY HAy A 5 VAL HB 1.0 1.9 6.0 385 170 A 21 ASP HBy A 42 ILE HB 1.0 1.9 6.0 386 171 A 17 VAL HB A 47 MET HBy 1.0 1.8 6.0 387 171 A 25 TYR HBy A 17 VAL HB 1.0 1.8 6.0 388 172 A 30 ASN HBx A 34 GLN HBx 1.0 2.0 6.0 389 172 A 42 ILE HG1y A 39 ASP HBy 1.0 2.0 6.0 390 173 A 34 GLN HGx A 10 CYS HBx 1.0 0.0 6.0 391 173 A 30 ASN HBx A 34 GLN HGx 1.0 0.0 6.0 392 173 A 34 GLN HGx A 39 ASP HBy 1.0 0.0 6.0 393 174 A 12 ARG HBy A 10 CYS HBx 1.0 0.0 6.0 394 174 A 35 GLN HBy A 39 ASP HBy 1.0 0.0 6.0 395 175 A 23 VAL HB A 42 ILE HG1y 1.0 0.0 6.0 396 175 A 23 VAL HB A 34 GLN HBx 1.0 0.0 6.0 397 175 A 36 GLU HGx A 34 GLN HBx 1.0 0.0 6.0 398 176 A 7 ARG HBx A 34 GLN HBy 1.0 0.0 6.0 399 176 A 8 LYS HDy A 34 GLN HBy 1.0 0.0 6.0 400 177 A 31 PHE HA A 30 ASN HBx 1.0 0.0 6.0 401 177 A 25 TYR HBx A 31 PHE HA 1.0 0.0 6.0 402 178 A 25 TYR HBx A 31 PHE HA 1.0 1.9 4.3 403 178 A 25 TYR HBy A 31 PHE HA 1.0 1.9 4.3 404 178 A 31 PHE HA A 30 ASN HBx 1.0 1.9 4.3 405 179 A 27 ASN HBy A 29 CYS HBx 1.0 2.0 5.4 406 179 A 27 ASN HBy A 30 ASN HBy 1.0 2.0 5.4 407 179 A 38 CYS HBy A 34 GLN HA 1.0 2.0 5.4 408 180 A 23 VAL HA A 23 VAL HB 1.0 1.8 3.8 409 180 A 33 ALA HA A 36 GLU HGx 1.0 1.8 3.8 410 181 A 36 GLU HGy A 36 GLU HA 1.0 1.9 4.7 411 181 A 33 ALA HA A 36 GLU HGy 1.0 1.9 4.7 412 182 A 40 PRO HBy A 35 GLN HGy 1.0 0.0 6.0 413 182 A 18 CYS HBy A 49 GLU HBy 1.0 0.0 6.0 414 183 A 35 GLN HGx A 42 ILE HG1y 1.0 1.9 4.3 415 183 A 34 GLN HBx A 34 GLN HGx 1.0 1.9 4.3 416 184 A 35 GLN H A 42 ILE H 1.0 1.9 6.0 417 184 A 38 CYS H A 42 ILE H 1.0 1.9 6.0 418 184 A 35 GLN H A 30 ASN HD2y 1.0 1.9 6.0 419 184 A 35 GLN HE2x A 42 ILE H 1.0 1.9 6.0 420 185 A 14 TRP H A 14 TRP HD1 1.0 2.0 5.8 421 185 A 43 THR H A 42 ILE H 1.0 2.0 5.8 422 186 A 7 ARG H A 7 ARG HE 1.0 2.0 6.0 423 186 A 46 HIS HE1 A 46 HIS HD2 1.0 2.0 6.0 424 187 A 30 ASN H A 30 ASN HD2y 1.0 2.0 5.8 425 187 A 30 ASN H A 12 ARG HE 1.0 2.0 5.8 426 188 A 4 CYS H A 37 GLN HE2y 1.0 1.9 6.0 427 188 A 34 GLN HE2y A 9 ALA H 1.0 1.9 6.0 428 188 A 34 GLN HE2y A 4 CYS H 1.0 1.9 6.0 429 189 A 9 ALA H A 34 GLN H 1.0 2.0 6.0 430 189 A 29 CYS H A 34 GLN H 1.0 2.0 6.0 431 189 A 9 ALA H A 7 ARG HE 1.0 2.0 6.0 432 190 A 29 CYS H A 12 ARG HE 1.0 1.6 2.8 433 190 A 18 CYS H A 46 HIS H 1.0 1.6 2.8 434 191 A 10 CYS H A 30 ASN HD2y 1.0 2.0 6.0 435 191 A 27 ASN HD2x A 12 ARG HE 1.0 2.0 6.0 436 192 A 15 TYR H A 13 GLU H 1.0 2.0 6.0 437 192 A 15 TYR H A 27 ASN HD2x 1.0 2.0 6.0 438 193 A 27 ASN HD2x A 14 TRP H 1.0 1.9 6.0 439 193 A 13 GLU H A 14 TRP H 1.0 1.9 6.0 440 194 A 4 CYS H A 37 GLN HE2x 1.0 2.0 6.0 441 194 A 34 GLN HE2x A 4 CYS H 1.0 2.0 6.0 442 195 A 31 PHE H A 32 SER H 1.0 1.7 3.3 443 195 A 30 ASN H A 31 PHE H 1.0 1.7 3.3 444 196 A 46 HIS H A 21 ASP H 1.0 0.0 6.0 445 196 A 21 ASP H A 42 ILE H 1.0 0.0 6.0 446 197 A 27 ASN HD2x A 12 ARG H 1.0 1.9 3.9 447 197 A 13 GLU H A 12 ARG H 1.0 1.9 3.9 448 198 A 26 SER H A 29 CYS H 1.0 0.0 6.0 449 198 A 17 VAL H A 26 SER H 1.0 0.0 6.0 450 199 A 39 ASP H A 38 CYS HA 1.0 1.8 3.4 451 199 A 39 ASP H A 39 ASP HA 1.0 1.8 3.4 452 200 A 42 ILE H A 40 PRO HA 1.0 1.9 4.1 453 200 A 42 ILE H A 41 ASN HA 1.0 1.9 4.1 454 201 A 20 SER H A 21 ASP H 1.0 1.8 3.6 455 201 A 20 SER H A 43 THR H 1.0 1.8 3.6 456 202 A 14 TRP HD1 A 49 GLU H 1.0 1.0 6.0 457 202 A 11 THR H A 12 ARG HE 1.0 1.0 6.0 458 203 A 35 GLN HE2x A 43 THR H 1.0 1.7 6.0 459 203 A 35 GLN HE2x A 21 ASP H 1.0 1.7 6.0 460 204 A 22 GLY H A 35 GLN HE2x 1.0 1.9 6.0 461 204 A 35 GLN HE2x A 44 ILE H 1.0 1.9 6.0 462 205 A 35 GLN HE2x A 43 THR HB 1.0 1.5 6.0 463 205 A 35 GLN HE2x A 42 ILE HA 1.0 1.5 6.0 464 206 A 34 GLN HE2x A 37 GLN H 1.0 0.0 6.0 465 206 A 37 GLN H A 33 ALA H 1.0 0.0 6.0 466 207 A 37 GLN H A 33 ALA HA 1.0 1.9 4.5 467 207 A 37 GLN H A 36 GLU HA 1.0 1.9 4.5 468 208 A 34 GLN HE2x A 38 CYS HA 1.0 0.3 6.0 469 208 A 37 GLN HE2x A 38 CYS HA 1.0 0.3 6.0 470 209 A 34 GLN HE2y A 9 ALA H 1.0 1.9 6.0 471 209 A 34 GLN HE2y A 4 CYS H 1.0 1.9 6.0 472 210 A 34 GLN HE2y A 7 ARG HE 1.0 0.0 6.0 473 210 A 34 GLN HE2y A 30 ASN HD2y 1.0 0.0 6.0 474 211 A 37 GLN HE2y A 38 CYS HA 1.0 0.1 6.0 475 211 A 34 GLN HE2y A 38 CYS HA 1.0 0.1 6.0 476 212 A 34 GLN HE2y A 38 CYS HBy 1.0 0.0 6.0 477 212 A 34 GLN HE2y A 6 GLY HAy 1.0 0.0 6.0 478 213 A 25 TYR H A 16 PRO HA 1.0 1.9 4.9 479 213 A 25 TYR H A 24 THR HB 1.0 1.9 4.9 480 214 A 14 TRP HE1 A 48 GLY HAx 1.0 1.9 6.0 481 214 A 14 TRP HE1 A 15 TYR HA 1.0 1.9 6.0 482 215 A 8 LYS H A 34 GLN HBx 1.0 0.0 6.0 483 215 A 8 LYS H A 7 ARG HGy 1.0 0.0 6.0 484 216 A 9 ALA H A 34 GLN HBx 1.0 1.9 4.5 485 216 A 9 ALA H A 7 ARG HGy 1.0 1.9 4.5 486 217 A 24 THR H A 31 PHE HA 1.0 0.0 6.0 487 217 A 24 THR H A 7 ARG HDy 1.0 0.0 6.0 488 218 A 18 CYS H A 50 CYS HBy 1.0 0.6 6.0 489 218 A 18 CYS H A 46 HIS HBx 1.0 0.6 6.0 490 219 A 4 CYS H A 34 GLN HGx 1.0 1.9 6.0 491 219 A 4 CYS H A 37 GLN HBy 1.0 1.9 6.0 492 220 A 10 CYS H A 30 ASN HBx 1.0 1.7 3.3 493 220 A 10 CYS H A 10 CYS HBx 1.0 1.7 3.3 494 221 A 10 CYS H A 34 GLN HBx 1.0 0.0 6.0 495 221 A 10 CYS H A 12 ARG HGy 1.0 0.0 6.0 496 221 A 10 CYS H A 7 ARG HGy 1.0 0.0 6.0 497 222 A 30 ASN H A 34 GLN HBx 1.0 1.8 6.0 498 222 A 30 ASN H A 12 ARG HGy 1.0 1.8 6.0 499 223 A 30 ASN H A 8 LYS HBy 1.0 1.5 6.0 500 223 A 30 ASN H A 34 GLN HBx 1.0 1.5 6.0 501 224 A 35 GLN H A 39 ASP HBx 1.0 1.4 6.0 502 224 A 35 GLN H A 36 GLU HGy 1.0 1.4 6.0 503 225 A 31 PHE H A 34 GLN HGx 1.0 0.0 6.0 504 225 A 31 PHE H A 35 GLN HGx 1.0 0.0 6.0 505 226 A 44 ILE H A 47 MET HBx 1.0 0.0 6.0 506 226 A 37 GLN HBy A 3 ASP H 1.0 0.0 6.0 507 227 A 21 ASP H A 22 GLY HAx 1.0 1.9 4.3 508 227 A 20 SER HA A 21 ASP H 1.0 1.9 4.3 509 228 A 25 TYR HBy A 26 SER H 1.0 1.9 4.1 510 228 A 25 TYR HBx A 26 SER H 1.0 1.9 4.1 511 228 A 26 SER H A 30 ASN HBx 1.0 1.9 4.1 512 229 A 39 ASP H A 39 ASP HBy 1.0 1.7 3.3 513 229 A 38 CYS HBx A 39 ASP H 1.0 1.7 3.3 514 230 A 39 ASP H A 35 GLN HGx 1.0 0.0 6.0 515 230 A 39 ASP H A 34 GLN HGx 1.0 0.0 6.0 516 230 A 39 ASP H A 40 PRO HBx 1.0 0.0 6.0 517 231 A 39 ASP H A 42 ILE HG1y 1.0 2.0 6.0 518 231 A 39 ASP H A 34 GLN HBx 1.0 2.0 6.0 519 232 A 32 SER H A 42 ILE HG1y 1.0 0.0 6.0 520 232 A 32 SER H A 34 GLN HBx 1.0 0.0 6.0 521 233 A 19 GLY H A 24 THR HB 1.0 1.8 6.0 522 233 A 19 GLY H A 20 SER HA 1.0 1.8 6.0 523 233 A 19 GLY H A 22 GLY HAx 1.0 1.8 6.0 524 234 A 6 GLY H A 34 GLN HBx 1.0 1.2 6.0 525 234 A 6 GLY H A 8 LYS HBy 1.0 1.2 6.0 526 234 A 6 GLY H A 7 ARG HGy 1.0 1.2 6.0 527 235 A 38 CYS H A 40 PRO HDx 1.0 1.9 4.5 528 235 A 38 CYS H A 34 GLN HA 1.0 1.9 4.5 529 236 A 38 CYS H A 39 ASP HBx 1.0 1.9 6.0 530 236 A 38 CYS H A 36 GLU HGy 1.0 1.9 6.0 531 237 A 38 CYS H A 35 GLN HGx 1.0 0.0 6.0 532 237 A 38 CYS H A 34 GLN HGx 1.0 0.0 6.0 533 237 A 38 CYS H A 40 PRO HBx 1.0 0.0 6.0 534 238 A 38 CYS H A 42 ILE HG1y 1.0 1.8 6.0 535 238 A 38 CYS H A 34 GLN HBx 1.0 1.8 6.0 536 239 A 27 ASN HD2x A 15 TYR HBx 1.0 1.9 6.0 537 239 A 27 ASN HD2x A 30 ASN HBx 1.0 1.9 6.0 538 239 A 27 ASN HD2x A 10 CYS HBx 1.0 1.9 6.0 539 240 A 48 GLY H A 18 CYS HBx 1.0 1.9 5.5 540 240 A 48 GLY H A 16 PRO HGy 1.0 1.9 5.5 541 241 A 17 VAL H A 18 CYS HBx 1.0 2.0 6.0 542 241 A 17 VAL H A 16 PRO HGy 1.0 2.0 6.0 543 242 A 25 TYR HBx A 35 GLN HE2x 1.0 0.1 6.0 544 242 A 35 GLN HE2x A 39 ASP HBy 1.0 0.1 6.0 545 243 A 37 GLN H A 35 GLN HGx 1.0 0.0 6.0 546 243 A 37 GLN H A 34 GLN HGx 1.0 0.0 6.0 547 243 A 37 GLN H A 40 PRO HBx 1.0 0.0 6.0 548 244 A 37 GLN HE2y A 37 GLN HBy 1.0 2.0 5.2 549 244 A 34 GLN HE2y A 34 GLN HGx 1.0 2.0 5.2 550 245 A 37 GLN HE2y A 34 GLN HBx 1.0 2.0 6.0 551 245 A 34 GLN HE2y A 34 GLN HBx 1.0 2.0 6.0 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 17 VAL H A 25 TYR O 1.0 1.5 2.1 2 2 A 25 TYR O A 17 VAL N 1.0 2.5 3.1 3 3 A 25 TYR H A 17 VAL O 1.0 1.5 2.1 4 4 A 17 VAL O A 25 TYR N 1.0 2.5 3.1 5 5 A 19 GLY H A 23 VAL O 1.0 1.5 2.1 6 6 A 23 VAL O A 19 GLY N 1.0 2.5 3.1 7 7 A 23 VAL H A 19 GLY O 1.0 1.5 2.1 8 8 A 19 GLY O A 23 VAL N 1.0 2.5 3.1 9 9 A 20 SER H A 43 THR O 1.0 1.5 2.1 10 10 A 43 THR O A 20 SER N 1.0 2.5 3.1 11 11 A 43 THR H A 20 SER O 1.0 1.5 2.1 12 12 A 20 SER O A 43 THR N 1.0 2.5 3.1 13 13 A 32 SER H A 28 PRO O 1.0 1.5 2.1 14 14 A 28 PRO O A 32 SER N 1.0 2.5 3.1 15 15 A 33 ALA H A 29 CYS O 1.0 1.5 2.1 16 16 A 29 CYS O A 33 ALA N 1.0 2.5 3.1 17 17 A 34 GLN H A 30 ASN O 1.0 1.5 2.1 18 18 A 30 ASN O A 34 GLN N 1.0 2.5 3.1 19 19 A 35 GLN H A 31 PHE O 1.0 1.5 2.1 20 20 A 31 PHE O A 35 GLN N 1.0 2.5 3.1 21 21 A 36 GLU H A 32 SER O 1.0 1.5 2.1 22 22 A 32 SER O A 36 GLU N 1.0 2.5 3.1 23 23 A 37 GLN H A 33 ALA O 1.0 1.5 2.1 24 24 A 33 ALA O A 37 GLN N 1.0 2.5 3.1 25 25 A 38 CYS H A 34 GLN O 1.0 1.5 2.1 26 26 A 34 GLN O A 38 CYS N 1.0 2.5 3.1 27 27 A 45 ALA H A 18 CYS O 1.0 1.5 2.1 28 28 A 18 CYS O A 45 ALA N 1.0 2.5 3.1 stop_ save_ save_CNS/XPLOR_dihedral_4 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_4 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 2 GLU C A 3 ASP N A 3 ASP CA A 3 ASP C 1.0 -124.0 -84.0 PHI 2 2 A 3 ASP C A 4 CYS N A 4 CYS CA A 4 CYS C 1.0 -150.0 -100.0 PHI 3 3 A 4 CYS C A 5 VAL N A 5 VAL CA A 5 VAL C 1.0 -128.0 -104.0 PHI 4 4 A 6 GLY C A 7 ARG N A 7 ARG CA A 7 ARG C 1.0 -130.0 -72.0 PHI 5 5 A 7 ARG C A 8 LYS N A 8 LYS CA A 8 LYS C 1.0 -143.0 -103.0 PHI 6 6 A 8 LYS C A 9 ALA N A 9 ALA CA A 9 ALA C 1.0 -108.0 -78.0 PHI 7 7 A 9 ALA C A 10 CYS N A 10 CYS CA A 10 CYS C 1.0 -137.0 -97.0 PHI 8 8 A 11 THR C A 12 ARG N A 12 ARG CA A 12 ARG C 1.0 -115.0 -81.0 PHI 9 9 A 13 GLU C A 14 TRP N A 14 TRP CA A 14 TRP C 1.0 -128.0 -92.0 PHI 10 10 A 14 TRP C A 15 TYR N A 15 TYR CA A 15 TYR C 1.0 -113.0 -69.0 PHI 11 11 A 15 TYR C A 16 PRO N A 16 PRO CA A 16 PRO C 1.0 -80.0 -58.0 PHI 12 12 A 17 VAL C A 18 CYS N A 18 CYS CA A 18 CYS C 1.0 -135.0 -113.0 PHI 13 13 A 19 GLY C A 20 SER N A 20 SER CA A 20 SER C 1.0 -68.0 -58.0 PHI 14 14 A 20 SER C A 21 ASP N A 21 ASP CA A 21 ASP C 1.0 -92.0 -74.0 PHI 15 15 A 21 ASP C A 22 GLY N A 22 GLY CA A 22 GLY C 1.0 81.0 95.0 PHI 16 16 A 22 GLY C A 23 VAL N A 23 VAL CA A 23 VAL C 1.0 -105.0 -57.0 PHI 17 17 A 23 VAL C A 24 THR N A 24 THR CA A 24 THR C 1.0 -117.0 -89.0 PHI 18 18 A 25 TYR C A 26 SER N A 26 SER CA A 26 SER C 1.0 -70.0 -46.0 PHI 19 19 A 27 ASN C A 28 PRO N A 28 PRO CA A 28 PRO C 1.0 -72.0 -48.0 PHI 20 20 A 28 PRO C A 29 CYS N A 29 CYS CA A 29 CYS C 1.0 -87.0 -55.0 PHI 21 21 A 29 CYS C A 30 ASN N A 30 ASN CA A 30 ASN C 1.0 -66.0 -58.0 PHI 22 22 A 30 ASN C A 31 PHE N A 31 PHE CA A 31 PHE C 1.0 -65.0 -61.0 PHI 23 23 A 31 PHE C A 32 SER N A 32 SER CA A 32 SER C 1.0 -63.0 -57.0 PHI 24 24 A 32 SER C A 33 ALA N A 33 ALA CA A 33 ALA C 1.0 -68.0 -60.0 PHI 25 25 A 33 ALA C A 34 GLN N A 34 GLN CA A 34 GLN C 1.0 -76.0 -64.0 PHI 26 26 A 34 GLN C A 35 GLN N A 35 GLN CA A 35 GLN C 1.0 -77.0 -59.0 PHI 27 27 A 35 GLN C A 36 GLU N A 36 GLU CA A 36 GLU C 1.0 -92.0 -62.0 PHI 28 28 A 36 GLU C A 37 GLN N A 37 GLN CA A 37 GLN C 1.0 -111.0 -81.0 PHI 29 29 A 39 ASP C A 40 PRO N A 40 PRO CA A 40 PRO C 1.0 -72.0 -56.0 PHI 30 30 A 40 PRO C A 41 ASN N A 41 ASN CA A 41 ASN C 1.0 -102.0 -72.0 PHI 31 31 A 42 ILE C A 43 THR N A 43 THR CA A 43 THR C 1.0 -142.0 -108.0 PHI 32 32 A 43 THR C A 44 ILE N A 44 ILE CA A 44 ILE C 1.0 -84.0 -66.0 PHI 33 33 A 44 ILE C A 45 ALA N A 45 ALA CA A 45 ALA C 1.0 -94.0 -68.0 PHI 34 34 A 45 ALA C A 46 HIS N A 46 HIS CA A 46 HIS C 1.0 -168.0 -158.0 PHI 35 35 A 46 HIS C A 47 MET N A 47 MET CA A 47 MET C 1.0 -93.0 -65.0 PHI 36 36 A 48 GLY C A 49 GLU N A 49 GLU CA A 49 GLU C 1.0 -108.0 -50.0 PHI 37 37 A 3 ASP N A 3 ASP CA A 3 ASP C A 4 CYS N 1.0 117.0 155.0 PSI 38 38 A 4 CYS N A 4 CYS CA A 4 CYS C A 5 VAL N 1.0 117.0 145.0 PSI 39 39 A 5 VAL N A 5 VAL CA A 5 VAL C A 6 GLY N 1.0 118.0 132.0 PSI 40 40 A 7 ARG N A 7 ARG CA A 7 ARG C A 8 LYS N 1.0 116.0 140.0 PSI 41 41 A 8 LYS N A 8 LYS CA A 8 LYS C A 9 ALA N 1.0 124.0 152.0 PSI 42 42 A 9 ALA N A 9 ALA CA A 9 ALA C A 10 CYS N 1.0 121.0 135.0 PSI 43 43 A 10 CYS N A 10 CYS CA A 10 CYS C A 11 THR N 1.0 151.0 171.0 PSI 44 44 A 12 ARG N A 12 ARG CA A 12 ARG C A 13 GLU N 1.0 -29.0 19.0 PSI 45 45 A 14 TRP N A 14 TRP CA A 14 TRP C A 15 TYR N 1.0 98.0 126.0 PSI 46 46 A 15 TYR N A 15 TYR CA A 15 TYR C A 16 PRO N 1.0 108.0 140.0 PSI 47 47 A 16 PRO N A 16 PRO CA A 16 PRO C A 17 VAL N 1.0 140.0 164.0 PSI 48 48 A 18 CYS N A 18 CYS CA A 18 CYS C A 19 GLY N 1.0 119.0 157.0 PSI 49 49 A 20 SER N A 20 SER CA A 20 SER C A 21 ASP N 1.0 -37.0 -13.0 PSI 50 50 A 21 ASP N A 21 ASP CA A 21 ASP C A 22 GLY N 1.0 -8.0 10.0 PSI 51 51 A 22 GLY N A 22 GLY CA A 22 GLY C A 23 VAL N 1.0 -10.0 28.0 PSI 52 52 A 23 VAL N A 23 VAL CA A 23 VAL C A 24 THR N 1.0 120.0 140.0 PSI 53 53 A 24 THR N A 24 THR CA A 24 THR C A 25 TYR N 1.0 117.0 129.0 PSI 54 54 A 26 SER N A 26 SER CA A 26 SER C A 27 ASN N 1.0 -40.0 -26.0 PSI 55 55 A 28 PRO N A 28 PRO CA A 28 PRO C A 29 CYS N 1.0 -49.0 -3.0 PSI 56 56 A 29 CYS N A 29 CYS CA A 29 CYS C A 30 ASN N 1.0 -55.0 -3.0 PSI 57 57 A 30 ASN N A 30 ASN CA A 30 ASN C A 31 PHE N 1.0 -44.0 -30.0 PSI 58 58 A 31 PHE N A 31 PHE CA A 31 PHE C A 32 SER N 1.0 -46.0 -40.0 PSI 59 59 A 32 SER N A 32 SER CA A 32 SER C A 33 ALA N 1.0 -49.0 -33.0 PSI 60 60 A 33 ALA N A 33 ALA CA A 33 ALA C A 34 GLN N 1.0 -43.0 -35.0 PSI 61 61 A 34 GLN N A 34 GLN CA A 34 GLN C A 35 GLN N 1.0 -40.0 -32.0 PSI 62 62 A 35 GLN N A 35 GLN CA A 35 GLN C A 36 GLU N 1.0 -50.0 -38.0 PSI 63 63 A 36 GLU N A 36 GLU CA A 36 GLU C A 37 GLN N 1.0 -43.0 -27.0 PSI 64 64 A 37 GLN N A 37 GLN CA A 37 GLN C A 38 CYS N 1.0 -34.0 6.0 PSI 65 65 A 40 PRO N A 40 PRO CA A 40 PRO C A 41 ASN N 1.0 -23.0 -15.0 PSI 66 66 A 41 ASN N A 41 ASN CA A 41 ASN C A 42 ILE N 1.0 -21.0 19.0 PSI 67 67 A 43 THR N A 43 THR CA A 43 THR C A 44 ILE N 1.0 148.0 166.0 PSI 68 68 A 44 ILE N A 44 ILE CA A 44 ILE C A 45 ALA N 1.0 121.0 139.0 PSI 69 69 A 45 ALA N A 45 ALA CA A 45 ALA C A 46 HIS N 1.0 -51.0 -35.0 PSI 70 70 A 46 HIS N A 46 HIS CA A 46 HIS C A 47 MET N 1.0 149.0 163.0 PSI 71 71 A 47 MET N A 47 MET CA A 47 MET C A 48 GLY N 1.0 127.0 157.0 PSI 72 72 A 49 GLU N A 49 GLU CA A 49 GLU C A 50 CYS N 1.0 125.0 149.0 PSI stop_ save_