data_nef_c19959_4cyk 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 4cyk 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 2 1 ZN ZN 1 14 CYS SG 2 1 ZN ZN 1 23 CYS SG 2 1 ZN ZN 1 30 CYS SG 2 1 ZN ZN 1 34 HIS NE2 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 MET start . . 2 A 2 ASP middle . . 3 A 3 LYS middle . . 4 A 4 ILE middle . . 5 A 5 ASN middle . . 6 A 6 PRO middle . false 7 A 7 ASP middle . . 8 A 8 TRP middle . . 9 A 9 ALA middle . . 10 A 10 LYS middle . . 11 A 11 ASP middle . . 12 A 12 ILE middle . . 13 A 13 PRO middle . false 14 A 14 CYS middle -HG . 15 A 15 ARG middle . . 16 A 16 ASN middle . . 17 A 17 ILE middle . . 18 A 18 THR middle . . 19 A 19 ILE middle . . 20 A 20 TYR middle . . 21 A 21 GLY middle . false 22 A 22 TYR middle . . 23 A 23 CYS middle -HG . 24 A 24 LYS middle . . 25 A 25 LYS middle . . 26 A 26 GLU middle . . 27 A 27 LYS middle . . 28 A 28 GLU middle . . 29 A 29 GLY middle . false 30 A 30 CYS middle -HG . 31 A 31 PRO middle . false 32 A 32 PHE middle . . 33 A 33 LYS middle . . 34 A 34 HIS middle -HE2 . 35 A 35 SER middle . . 36 A 36 ASP middle . . 37 A 37 ASN middle . . 38 A 38 THR middle . . 39 A 39 THR middle . . 40 A 40 ALA middle . . 41 A 41 THR end . . 42 B 1 ZN . . . stop_ save_ save_assigned_chem_shift_list _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list 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 MET H1 H 1 8.527 0.01 A 1 MET HA H 1 4.466 0.01 A 1 MET HBx H 1 1.960 0.01 A 1 MET HBy H 1 2.081 0.01 A 1 MET HE% H 1 1.819 0.01 A 1 MET HGy H 1 2.579 0.01 A 1 MET HGx H 1 2.478 0.01 A 1 MET C C 13 175.190 0.10 A 1 MET CA C 13 55.540 0.10 A 1 MET CB C 13 32.200 0.10 A 2 ASP H H 1 8.132 0.01 A 2 ASP HA H 1 4.486 0.01 A 2 ASP HBy H 1 2.621 0.01 A 2 ASP HBx H 1 2.546 0.01 A 2 ASP C C 13 175.100 0.10 A 2 ASP CA C 13 54.490 0.10 A 2 ASP CB C 13 40.860 0.10 A 2 ASP N N 15 120.620 0.10 A 3 LYS H H 1 8.066 0.01 A 3 LYS HA H 1 4.262 0.01 A 3 LYS HBy H 1 1.766 0.01 A 3 LYS HBx H 1 1.675 0.01 A 3 LYS HDx H 1 1.360 0.01 A 3 LYS HDy H 1 1.596 0.01 A 3 LYS HEx H 1 2.921 0.01 A 3 LYS HEy H 1 2.921 0.01 A 3 LYS HGx H 1 1.287 0.01 A 3 LYS HGy H 1 1.360 0.01 A 3 LYS C C 13 175.380 0.10 A 3 LYS CA C 13 55.860 0.10 A 3 LYS CB C 13 32.730 0.10 A 3 LYS N N 15 120.480 0.10 A 4 ILE H H 1 8.056 0.01 A 4 ILE HA H 1 4.034 0.01 A 4 ILE HB H 1 1.781 0.01 A 4 ILE HD1% H 1 0.854 0.01 A 4 ILE HG1x H 1 1.179 0.01 A 4 ILE HG1y H 1 1.474 0.01 A 4 ILE HG2% H 1 0.794 0.01 A 4 ILE C C 13 174.700 0.10 A 4 ILE CA C 13 60.550 0.10 A 4 ILE CB C 13 38.690 0.10 A 4 ILE N N 15 121.910 0.10 A 5 ASN H H 1 8.422 0.01 A 5 ASN HA H 1 4.891 0.01 A 5 ASN HBy H 1 2.795 0.01 A 5 ASN HBx H 1 2.693 0.01 A 5 ASN HD21 H 1 7.108 0.01 A 5 ASN HD22 H 1 7.566 0.01 A 5 ASN C C 13 173.460 0.10 A 5 ASN CA C 13 50.580 0.10 A 5 ASN CB C 13 38.680 0.10 A 5 ASN N N 15 124.830 0.10 A 6 PRO HA H 1 4.224 0.01 A 6 PRO HBx H 1 1.852 0.01 A 6 PRO HBy H 1 2.238 0.01 A 6 PRO HDy H 1 3.939 0.01 A 6 PRO HDx H 1 3.798 0.01 A 6 PRO HGx H 1 1.953 0.01 A 6 PRO HGy H 1 1.953 0.01 A 6 PRO C C 13 176.670 0.10 A 6 PRO CA C 13 64.480 0.10 A 6 PRO CB C 13 31.920 0.10 A 7 ASP H H 1 8.082 0.01 A 7 ASP HA H 1 4.440 0.01 A 7 ASP HBx H 1 2.573 0.01 A 7 ASP HBy H 1 2.651 0.01 A 7 ASP C C 13 176.020 0.10 A 7 ASP CA C 13 55.590 0.10 A 7 ASP CB C 13 40.460 0.10 A 7 ASP N N 15 118.190 0.10 A 8 TRP H H 1 7.480 0.01 A 8 TRP HA H 1 4.429 0.01 A 8 TRP HBx H 1 3.342 0.01 A 8 TRP HBy H 1 3.342 0.01 A 8 TRP HD1 H 1 7.341 0.01 A 8 TRP HE1 H 1 10.226 0.01 A 8 TRP HE3 H 1 7.429 0.01 A 8 TRP HH2 H 1 7.256 0.01 A 8 TRP HZ2 H 1 7.451 0.01 A 8 TRP HZ3 H 1 7.130 0.01 A 8 TRP C C 13 176.340 0.10 A 8 TRP CA C 13 58.330 0.10 A 8 TRP CB C 13 28.620 0.10 A 8 TRP N N 15 119.460 0.10 A 9 ALA H H 1 7.517 0.01 A 9 ALA HA H 1 3.435 0.01 A 9 ALA HB% H 1 0.183 0.01 A 9 ALA C C 13 176.990 0.10 A 9 ALA CA C 13 53.750 0.10 A 9 ALA CB C 13 17.830 0.10 A 9 ALA N N 15 121.420 0.10 A 10 LYS H H 1 7.061 0.01 A 10 LYS HA H 1 4.048 0.01 A 10 LYS HBx H 1 1.775 0.01 A 10 LYS HBy H 1 1.775 0.01 A 10 LYS HDx H 1 1.571 0.01 A 10 LYS HDy H 1 1.631 0.01 A 10 LYS HEx H 1 2.974 0.01 A 10 LYS HEy H 1 2.974 0.01 A 10 LYS HGx H 1 1.202 0.01 A 10 LYS HGy H 1 1.357 0.01 A 10 LYS C C 13 175.380 0.10 A 10 LYS CA C 13 57.900 0.10 A 10 LYS CB C 13 31.800 0.10 A 10 LYS N N 15 113.110 0.10 A 11 ASP H H 1 7.341 0.01 A 11 ASP HA H 1 4.873 0.01 A 11 ASP HBx H 1 2.403 0.01 A 11 ASP HBy H 1 2.828 0.01 A 11 ASP C C 13 174.770 0.10 A 11 ASP CA C 13 53.700 0.10 A 11 ASP CB C 13 42.070 0.10 A 11 ASP N N 15 115.800 0.10 A 12 ILE H H 1 8.009 0.01 A 12 ILE HA H 1 4.402 0.01 A 12 ILE HB H 1 2.139 0.01 A 12 ILE HD1% H 1 0.650 0.01 A 12 ILE HG1y H 1 1.088 0.01 A 12 ILE HG1x H 1 1.009 0.01 A 12 ILE HG2% H 1 0.858 0.01 A 12 ILE C C 13 172.580 0.10 A 12 ILE CA C 13 57.610 0.10 A 12 ILE CB C 13 38.660 0.10 A 12 ILE N N 15 125.190 0.10 A 13 PRO HA H 1 4.189 0.01 A 13 PRO HBx H 1 1.682 0.01 A 13 PRO HBy H 1 2.156 0.01 A 13 PRO HDy H 1 3.954 0.01 A 13 PRO HDx H 1 3.590 0.01 A 13 PRO HGx H 1 1.776 0.01 A 13 PRO HGy H 1 2.018 0.01 A 13 PRO C C 13 175.320 0.10 A 13 PRO CA C 13 63.010 0.10 A 13 PRO CB C 13 32.060 0.10 A 14 CYS H H 1 8.304 0.01 A 14 CYS HA H 1 3.355 0.01 A 14 CYS HB2 H 1 2.564 0.01 A 14 CYS HB3 H 1 1.763 0.01 A 14 CYS C C 13 176.740 0.10 A 14 CYS CA C 13 61.010 0.10 A 14 CYS CB C 13 29.650 0.10 A 14 CYS N N 15 125.300 0.10 A 15 ARG H H 1 8.279 0.01 A 15 ARG HA H 1 3.945 0.01 A 15 ARG HBx H 1 1.609 0.01 A 15 ARG HBy H 1 1.609 0.01 A 15 ARG HDx H 1 3.012 0.01 A 15 ARG HDy H 1 3.012 0.01 A 15 ARG HGx H 1 1.488 0.01 A 15 ARG HGy H 1 1.488 0.01 A 15 ARG C C 13 176.450 0.10 A 15 ARG CA C 13 58.350 0.10 A 15 ARG CB C 13 29.640 0.10 A 15 ARG N N 15 132.160 0.10 A 16 ASN H H 1 8.533 0.01 A 16 ASN HA H 1 4.610 0.01 A 16 ASN HBx H 1 3.243 0.01 A 16 ASN HBy H 1 3.243 0.01 A 16 ASN HD21 H 1 7.149 0.01 A 16 ASN HD22 H 1 8.431 0.01 A 16 ASN C C 13 177.080 0.10 A 16 ASN CA C 13 56.270 0.10 A 16 ASN CB C 13 37.560 0.10 A 16 ASN N N 15 118.420 0.10 A 17 ILE H H 1 7.173 0.01 A 17 ILE HA H 1 3.305 0.01 A 17 ILE HB H 1 2.096 0.01 A 17 ILE HD1% H 1 1.041 0.01 A 17 ILE HG1x H 1 1.276 0.01 A 17 ILE HG1y H 1 1.696 0.01 A 17 ILE HG2% H 1 0.823 0.01 A 17 ILE C C 13 177.530 0.10 A 17 ILE CA C 13 64.480 0.10 A 17 ILE CB C 13 36.310 0.10 A 17 ILE N N 15 118.580 0.10 A 18 THR H H 1 7.244 0.01 A 18 THR HA H 1 3.800 0.01 A 18 THR HB H 1 4.111 0.01 A 18 THR HG2% H 1 1.113 0.01 A 18 THR C C 13 174.330 0.10 A 18 THR CA C 13 65.820 0.10 A 18 THR CB C 13 68.620 0.10 A 18 THR N N 15 115.090 0.10 A 19 ILE H H 1 7.766 0.01 A 19 ILE HA H 1 3.696 0.01 A 19 ILE HB H 1 1.180 0.01 A 19 ILE HD1% H 1 0.589 0.01 A 19 ILE HG1y H 1 1.251 0.01 A 19 ILE HG1x H 1 0.916 0.01 A 19 ILE HG2% H 1 0.027 0.01 A 19 ILE C C 13 176.460 0.10 A 19 ILE CA C 13 63.540 0.10 A 19 ILE CB C 13 39.020 0.10 A 19 ILE N N 15 117.760 0.10 A 20 TYR H H 1 8.220 0.01 A 20 TYR HA H 1 4.689 0.01 A 20 TYR HB2 H 1 3.020 0.01 A 20 TYR HB3 H 1 2.898 0.01 A 20 TYR HDx H 1 7.183 0.01 A 20 TYR HDy H 1 7.183 0.01 A 20 TYR HEx H 1 6.779 0.01 A 20 TYR HEy H 1 6.779 0.01 A 20 TYR C C 13 175.800 0.10 A 20 TYR CA C 13 58.130 0.10 A 20 TYR CB C 13 39.610 0.10 A 20 TYR N N 15 115.040 0.10 A 21 GLY H H 1 7.811 0.01 A 21 GLY HAy H 1 4.455 0.01 A 21 GLY HAx H 1 3.882 0.01 A 21 GLY C C 13 171.940 0.10 A 21 GLY CA C 13 45.350 0.10 A 21 GLY N N 15 107.880 0.10 A 22 TYR H H 1 7.314 0.01 A 22 TYR HA H 1 4.553 0.01 A 22 TYR HB2 H 1 3.039 0.01 A 22 TYR HB3 H 1 2.897 0.01 A 22 TYR HDx H 1 6.807 0.01 A 22 TYR HDy H 1 6.807 0.01 A 22 TYR HEx H 1 6.672 0.01 A 22 TYR HEy H 1 6.672 0.01 A 22 TYR C C 13 170.340 0.10 A 22 TYR CA C 13 55.990 0.10 A 22 TYR CB C 13 39.350 0.10 A 22 TYR N N 15 115.990 0.10 A 23 CYS H H 1 9.232 0.01 A 23 CYS HA H 1 4.528 0.01 A 23 CYS HBx H 1 2.986 0.01 A 23 CYS HBy H 1 2.986 0.01 A 23 CYS C C 13 175.900 0.10 A 23 CYS CA C 13 57.850 0.10 A 23 CYS CB C 13 31.800 0.10 A 23 CYS N N 15 123.440 0.10 A 24 LYS H H 1 8.430 0.01 A 24 LYS HA H 1 4.210 0.01 A 24 LYS HBy H 1 1.769 0.01 A 24 LYS HBx H 1 1.692 0.01 A 24 LYS HDx H 1 1.614 0.01 A 24 LYS HDy H 1 1.614 0.01 A 24 LYS HEx H 1 2.924 0.01 A 24 LYS HEy H 1 2.924 0.01 A 24 LYS HGy H 1 1.380 0.01 A 24 LYS HGx H 1 1.285 0.01 A 24 LYS C C 13 176.000 0.10 A 24 LYS CA C 13 58.360 0.10 A 24 LYS CB C 13 32.390 0.10 A 25 LYS H H 1 8.176 0.01 A 25 LYS HA H 1 4.397 0.01 A 25 LYS HB2 H 1 1.995 0.01 A 25 LYS HB3 H 1 1.559 0.01 A 25 LYS HDx H 1 1.598 0.01 A 25 LYS HDy H 1 1.825 0.01 A 25 LYS HEx H 1 2.849 0.01 A 25 LYS HEy H 1 2.849 0.01 A 25 LYS HGy H 1 1.436 0.01 A 25 LYS HGx H 1 1.295 0.01 A 25 LYS C C 13 176.430 0.10 A 25 LYS CA C 13 54.810 0.10 A 25 LYS CB C 13 32.130 0.10 A 25 LYS N N 15 117.830 0.10 A 26 GLU H H 1 7.588 0.01 A 26 GLU HA H 1 3.278 0.01 A 26 GLU HBy H 1 2.127 0.01 A 26 GLU HBx H 1 1.767 0.01 A 26 GLU HGx H 1 1.418 0.01 A 26 GLU HGy H 1 1.418 0.01 A 26 GLU C C 13 176.900 0.10 A 26 GLU CA C 13 60.770 0.10 A 26 GLU CB C 13 29.560 0.10 A 26 GLU N N 15 127.220 0.10 A 27 LYS H H 1 8.603 0.01 A 27 LYS HA H 1 4.406 0.01 A 27 LYS HB2 H 1 2.031 0.01 A 27 LYS HB3 H 1 1.704 0.01 A 27 LYS HDx H 1 1.596 0.01 A 27 LYS HDy H 1 1.596 0.01 A 27 LYS HEx H 1 2.932 0.01 A 27 LYS HEy H 1 2.932 0.01 A 27 LYS HGx H 1 1.357 0.01 A 27 LYS HGy H 1 1.357 0.01 A 27 LYS C C 13 175.420 0.10 A 27 LYS CA C 13 55.910 0.10 A 27 LYS CB C 13 31.480 0.10 A 27 LYS N N 15 115.670 0.10 A 28 GLU H H 1 7.570 0.01 A 28 GLU HA H 1 4.521 0.01 A 28 GLU HB2 H 1 2.261 0.01 A 28 GLU HB3 H 1 1.577 0.01 A 28 GLU HGx H 1 2.125 0.01 A 28 GLU HGy H 1 2.125 0.01 A 28 GLU C C 13 175.570 0.10 A 28 GLU CA C 13 54.670 0.10 A 28 GLU CB C 13 30.770 0.10 A 28 GLU N N 15 118.630 0.10 A 29 GLY H H 1 8.081 0.01 A 29 GLY HAy H 1 4.266 0.01 A 29 GLY HAx H 1 3.578 0.01 A 29 GLY C C 13 173.680 0.10 A 29 GLY CA C 13 45.330 0.10 A 29 GLY N N 15 107.020 0.10 A 30 CYS H H 1 7.674 0.01 A 30 CYS HA H 1 4.489 0.01 A 30 CYS HB2 H 1 2.609 0.01 A 30 CYS HB3 H 1 2.680 0.01 A 30 CYS C C 13 175.530 0.10 A 30 CYS CA C 13 57.860 0.10 A 30 CYS CB C 13 30.280 0.10 A 30 CYS N N 15 124.160 0.10 A 31 PRO HA H 1 4.478 0.01 A 31 PRO HBx H 1 1.571 0.01 A 31 PRO HBy H 1 1.891 0.01 A 31 PRO HDx H 1 3.827 0.01 A 31 PRO HDy H 1 3.991 0.01 A 31 PRO HGx H 1 1.719 0.01 A 31 PRO HGy H 1 1.719 0.01 A 31 PRO C C 13 174.850 0.10 A 31 PRO CA C 13 63.830 0.10 A 31 PRO CB C 13 32.110 0.10 A 32 PHE H H 1 7.556 0.01 A 32 PHE HA H 1 4.615 0.01 A 32 PHE HBx H 1 2.421 0.01 A 32 PHE HBy H 1 3.205 0.01 A 32 PHE HDx H 1 7.646 0.01 A 32 PHE HDy H 1 7.646 0.01 A 32 PHE HEx H 1 7.311 0.01 A 32 PHE HEy H 1 7.311 0.01 A 32 PHE HZ H 1 7.423 0.01 A 32 PHE C C 13 172.190 0.10 A 32 PHE CA C 13 58.280 0.10 A 32 PHE CB C 13 39.310 0.10 A 32 PHE N N 15 119.600 0.10 A 33 LYS H H 1 8.325 0.01 A 33 LYS HA H 1 4.227 0.01 A 33 LYS HBy H 1 1.765 0.01 A 33 LYS HBx H 1 1.639 0.01 A 33 LYS HDx H 1 1.490 0.01 A 33 LYS HDy H 1 1.599 0.01 A 33 LYS HEy H 1 2.903 0.01 A 33 LYS HEx H 1 2.862 0.01 A 33 LYS HGx H 1 1.266 0.01 A 33 LYS HGy H 1 1.430 0.01 A 33 LYS C C 13 176.790 0.10 A 33 LYS CA C 13 57.000 0.10 A 33 LYS CB C 13 33.130 0.10 A 33 LYS N N 15 118.700 0.10 A 34 HIS H H 1 9.096 0.01 A 34 HIS HA H 1 4.697 0.01 A 34 HIS HB2 H 1 3.412 0.01 A 34 HIS HB3 H 1 2.944 0.01 A 34 HIS HD2 H 1 6.718 0.01 A 34 HIS HE1 H 1 7.875 0.01 A 34 HIS C C 13 172.680 0.10 A 34 HIS CA C 13 56.860 0.10 A 34 HIS CB C 13 29.150 0.10 A 34 HIS N N 15 125.610 0.10 A 35 SER H H 1 7.859 0.01 A 35 SER HA H 1 4.510 0.01 A 35 SER HBx H 1 3.847 0.01 A 35 SER HBy H 1 3.876 0.01 A 35 SER C C 13 172.730 0.10 A 35 SER CA C 13 57.940 0.10 A 35 SER CB C 13 64.110 0.10 A 35 SER N N 15 115.050 0.10 A 36 ASP H H 1 8.546 0.01 A 36 ASP HA H 1 4.625 0.01 A 36 ASP HBy H 1 2.697 0.01 A 36 ASP HBx H 1 2.612 0.01 A 36 ASP C C 13 175.110 0.10 A 36 ASP CA C 13 54.110 0.10 A 36 ASP CB C 13 41.200 0.10 A 36 ASP N N 15 121.530 0.10 A 37 ASN H H 1 8.476 0.01 A 37 ASN HA H 1 4.752 0.01 A 37 ASN HBy H 1 2.826 0.01 A 37 ASN HBx H 1 2.742 0.01 A 37 ASN HD21 H 1 6.896 0.01 A 37 ASN HD22 H 1 7.599 0.01 A 37 ASN C C 13 174.790 0.10 A 37 ASN CA C 13 53.310 0.10 A 37 ASN CB C 13 38.620 0.10 A 37 ASN N N 15 119.270 0.10 A 38 THR H H 1 8.305 0.01 A 38 THR HA H 1 4.343 0.01 A 38 THR HB H 1 4.231 0.01 A 38 THR HG2% H 1 1.179 0.01 A 38 THR C C 13 173.980 0.10 A 38 THR CA C 13 62.280 0.10 A 38 THR CB C 13 69.630 0.10 A 38 THR N N 15 114.420 0.10 A 39 THR H H 1 8.141 0.01 A 39 THR HA H 1 4.313 0.01 A 39 THR HB H 1 4.180 0.01 A 39 THR HG2% H 1 1.173 0.01 A 39 THR C C 13 173.140 0.10 A 39 THR CA C 13 61.860 0.10 A 39 THR CB C 13 69.630 0.10 A 39 THR N N 15 116.530 0.10 A 40 ALA H H 1 8.318 0.01 A 40 ALA HA H 1 4.296 0.01 A 40 ALA HB% H 1 1.382 0.01 A 40 ALA C C 13 176.090 0.10 A 40 ALA CA C 13 52.490 0.10 A 40 ALA CB C 13 19.160 0.10 A 40 ALA N N 15 127.440 0.10 A 41 THR H H 1 7.759 0.01 A 41 THR HA H 1 4.092 0.01 A 41 THR HB H 1 4.195 0.01 A 41 THR HG2% H 1 1.118 0.01 A 41 THR C C 13 178.440 0.10 A 41 THR CA C 13 62.850 0.10 A 41 THR CB C 13 70.710 0.10 A 41 THR N N 15 118.740 0.10 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 1 MET HA A 1 MET HE% 1.0 1.8 6.00 2 2 A 1 MET HA A 1 MET HBx 1.0 1.8 4.75 3 2 A 1 MET HA A 1 MET HBy 1.0 1.8 4.75 4 3 A 1 MET HA A 1 MET HGy 1.0 1.8 3.50 5 3 A 1 MET HA A 1 MET HGx 1.0 1.8 3.50 6 4 A 1 MET HE% A 1 MET HBx 1.0 1.8 4.75 7 4 A 1 MET HBy A 1 MET HE% 1.0 1.8 4.75 8 5 A 1 MET HE% A 1 MET HGy 1.0 1.8 6.00 9 5 A 1 MET HGx A 1 MET HE% 1.0 1.8 6.00 10 6 A 1 MET HBx A 1 MET HGy 1.0 1.8 3.50 11 6 A 1 MET HGx A 1 MET HBx 1.0 1.8 3.50 12 6 A 1 MET HBy A 1 MET HGx 1.0 1.8 3.50 13 6 A 1 MET HBy A 1 MET HGy 1.0 1.8 3.50 14 7 A 2 ASP H A 2 ASP HA 1.0 1.8 4.75 15 8 A 2 ASP H A 2 ASP HBy 1.0 1.8 3.50 16 8 A 2 ASP H A 2 ASP HBx 1.0 1.8 3.50 17 9 A 2 ASP HA A 2 ASP HBy 1.0 1.8 3.50 18 9 A 2 ASP HA A 2 ASP HBx 1.0 1.8 3.50 19 10 A 3 LYS H A 3 LYS HA 1.0 1.8 3.50 20 11 A 3 LYS H A 3 LYS HBy 1.0 1.8 3.50 21 11 A 3 LYS H A 3 LYS HBx 1.0 1.8 3.50 22 12 A 3 LYS H A 3 LYS HGx 1.0 1.8 4.75 23 12 A 3 LYS H A 3 LYS HGy 1.0 1.8 4.75 24 13 A 3 LYS H A 3 LYS HDx 1.0 1.8 4.75 25 13 A 3 LYS H A 3 LYS HDy 1.0 1.8 4.75 26 14 A 3 LYS H A 3 LYS HEx 1.0 1.8 6.00 27 14 A 3 LYS H A 3 LYS HEy 1.0 1.8 6.00 28 15 A 3 LYS HA A 3 LYS HBy 1.0 1.8 3.50 29 15 A 3 LYS HA A 3 LYS HBx 1.0 1.8 3.50 30 16 A 3 LYS HA A 3 LYS HGx 1.0 1.8 4.75 31 16 A 3 LYS HA A 3 LYS HGy 1.0 1.8 4.75 32 17 A 3 LYS HA A 3 LYS HDx 1.0 1.8 4.75 33 17 A 3 LYS HA A 3 LYS HDy 1.0 1.8 4.75 34 18 A 3 LYS HBx A 3 LYS HGx 1.0 1.8 3.50 35 18 A 3 LYS HGy A 3 LYS HBy 1.0 1.8 3.50 36 18 A 3 LYS HBx A 3 LYS HGy 1.0 1.8 3.50 37 18 A 3 LYS HBy A 3 LYS HGx 1.0 1.8 3.50 38 19 A 3 LYS HBx A 3 LYS HDx 1.0 1.8 3.50 39 19 A 3 LYS HBy A 3 LYS HDx 1.0 1.8 3.50 40 19 A 3 LYS HDy A 3 LYS HBy 1.0 1.8 3.50 41 19 A 3 LYS HBx A 3 LYS HDy 1.0 1.8 3.50 42 20 A 3 LYS HBy A 3 LYS HEx 1.0 1.8 4.75 43 20 A 3 LYS HBx A 3 LYS HEx 1.0 1.8 4.75 44 20 A 3 LYS HEy A 3 LYS HBy 1.0 1.8 4.75 45 20 A 3 LYS HBx A 3 LYS HEy 1.0 1.8 4.75 46 21 A 3 LYS HDy A 3 LYS HGx 1.0 1.8 3.50 47 21 A 3 LYS HDx A 3 LYS HGx 1.0 1.8 3.50 48 21 A 3 LYS HGy A 3 LYS HDx 1.0 1.8 3.50 49 21 A 3 LYS HGy A 3 LYS HDy 1.0 1.8 3.50 50 22 A 3 LYS HEx A 3 LYS HGx 1.0 1.8 3.50 51 22 A 3 LYS HEy A 3 LYS HGx 1.0 1.8 3.50 52 22 A 3 LYS HGy A 3 LYS HEx 1.0 1.8 3.50 53 22 A 3 LYS HGy A 3 LYS HEy 1.0 1.8 3.50 54 23 A 3 LYS HDy A 3 LYS HEx 1.0 1.8 3.50 55 23 A 3 LYS HDx A 3 LYS HEx 1.0 1.8 3.50 56 23 A 3 LYS HEy A 3 LYS HDx 1.0 1.8 3.50 57 23 A 3 LYS HDy A 3 LYS HEy 1.0 1.8 3.50 58 24 A 4 ILE H A 4 ILE HA 1.0 1.8 4.75 59 25 A 4 ILE H A 4 ILE HB 1.0 1.8 3.50 60 26 A 4 ILE H A 4 ILE HG2% 1.0 1.8 4.75 61 27 A 4 ILE H A 4 ILE HD1% 1.0 1.8 6.00 62 28 A 4 ILE H A 4 ILE HG1x 1.0 1.8 4.75 63 28 A 4 ILE H A 4 ILE HG1y 1.0 1.8 4.75 64 29 A 4 ILE HA A 4 ILE HB 1.0 1.8 3.50 65 30 A 4 ILE HA A 4 ILE HG2% 1.0 1.8 4.75 66 31 A 4 ILE HA A 4 ILE HD1% 1.0 1.8 6.00 67 32 A 4 ILE HA A 4 ILE HG1x 1.0 1.8 4.75 68 32 A 4 ILE HA A 4 ILE HG1y 1.0 1.8 4.75 69 33 A 4 ILE HB A 4 ILE HG2% 1.0 1.8 3.50 70 34 A 4 ILE HB A 4 ILE HD1% 1.0 1.8 4.75 71 35 A 4 ILE HB A 4 ILE HG1x 1.0 1.8 3.50 72 35 A 4 ILE HB A 4 ILE HG1y 1.0 1.8 3.50 73 36 A 4 ILE HG2% A 4 ILE HD1% 1.0 1.8 3.50 74 37 A 4 ILE HG2% A 4 ILE HG1x 1.0 1.8 4.75 75 37 A 4 ILE HG2% A 4 ILE HG1y 1.0 1.8 4.75 76 38 A 4 ILE HD1% A 4 ILE HG1x 1.0 1.8 4.75 77 38 A 4 ILE HD1% A 4 ILE HG1y 1.0 1.8 4.75 78 39 A 5 ASN H A 5 ASN HA 1.0 1.8 4.75 79 40 A 5 ASN H A 5 ASN HD22 1.0 1.8 6.00 80 41 A 5 ASN H A 5 ASN HBy 1.0 1.8 4.75 81 41 A 5 ASN H A 5 ASN HBx 1.0 1.8 4.75 82 42 A 5 ASN HA A 5 ASN HD21 1.0 1.8 6.00 83 43 A 5 ASN HA A 5 ASN HD22 1.0 1.8 6.00 84 44 A 5 ASN HA A 5 ASN HBy 1.0 1.8 3.50 85 44 A 5 ASN HA A 5 ASN HBx 1.0 1.8 3.50 86 45 A 5 ASN HD21 A 5 ASN HBy 1.0 1.8 4.75 87 45 A 5 ASN HBx A 5 ASN HD21 1.0 1.8 4.75 88 46 A 5 ASN HD22 A 5 ASN HBy 1.0 1.8 3.50 89 46 A 5 ASN HD22 A 5 ASN HBx 1.0 1.8 3.50 90 47 A 7 ASP H A 7 ASP HA 1.0 1.8 4.75 91 48 A 7 ASP H A 7 ASP HBx 1.0 1.8 3.50 92 48 A 7 ASP H A 7 ASP HBy 1.0 1.8 3.50 93 49 A 7 ASP HA A 7 ASP HBx 1.0 1.8 3.50 94 49 A 7 ASP HA A 7 ASP HBy 1.0 1.8 3.50 95 50 A 8 TRP H A 8 TRP HA 1.0 1.8 3.50 96 51 A 8 TRP H A 8 TRP HD1 1.0 1.8 3.50 97 52 A 8 TRP H A 8 TRP HBx 1.0 1.8 3.50 98 52 A 8 TRP H A 8 TRP HBy 1.0 1.8 3.50 99 53 A 8 TRP HA A 8 TRP HD1 1.0 1.8 4.75 100 54 A 8 TRP HA A 8 TRP HE3 1.0 1.8 4.75 101 55 A 8 TRP HA A 8 TRP HBx 1.0 1.8 3.50 102 55 A 8 TRP HA A 8 TRP HBy 1.0 1.8 3.50 103 56 A 8 TRP HD1 A 8 TRP HBx 1.0 1.8 3.50 104 56 A 8 TRP HD1 A 8 TRP HBy 1.0 1.8 3.50 105 57 A 8 TRP HE1 A 8 TRP HBx 1.0 1.8 6.00 106 57 A 8 TRP HBy A 8 TRP HE1 1.0 1.8 6.00 107 58 A 8 TRP HE3 A 8 TRP HBx 1.0 1.8 3.50 108 58 A 8 TRP HBy A 8 TRP HE3 1.0 1.8 3.50 109 59 A 8 TRP HZ3 A 8 TRP HBx 1.0 1.8 4.75 110 59 A 8 TRP HBy A 8 TRP HZ3 1.0 1.8 4.75 111 60 A 9 ALA H A 9 ALA HA 1.0 1.8 3.50 112 61 A 9 ALA H A 9 ALA HB% 1.0 1.8 4.75 113 62 A 9 ALA HA A 9 ALA HB% 1.0 1.8 3.50 114 63 A 10 LYS H A 10 LYS HA 1.0 1.8 3.50 115 64 A 10 LYS H A 10 LYS HBx 1.0 1.8 3.50 116 64 A 10 LYS H A 10 LYS HBy 1.0 1.8 3.50 117 65 A 10 LYS H A 10 LYS HGx 1.0 1.8 4.75 118 65 A 10 LYS H A 10 LYS HGy 1.0 1.8 4.75 119 66 A 10 LYS H A 10 LYS HDx 1.0 1.8 4.75 120 66 A 10 LYS H A 10 LYS HDy 1.0 1.8 4.75 121 67 A 10 LYS HA A 10 LYS HBx 1.0 1.8 3.50 122 67 A 10 LYS HA A 10 LYS HBy 1.0 1.8 3.50 123 68 A 10 LYS HA A 10 LYS HGx 1.0 1.8 4.75 124 68 A 10 LYS HA A 10 LYS HGy 1.0 1.8 4.75 125 69 A 10 LYS HA A 10 LYS HDx 1.0 1.8 4.75 126 69 A 10 LYS HA A 10 LYS HDy 1.0 1.8 4.75 127 70 A 10 LYS HA A 10 LYS HEx 1.0 1.8 6.00 128 70 A 10 LYS HA A 10 LYS HEy 1.0 1.8 6.00 129 71 A 10 LYS HBy A 10 LYS HGx 1.0 1.8 3.50 130 71 A 10 LYS HBx A 10 LYS HGx 1.0 1.8 3.50 131 71 A 10 LYS HGy A 10 LYS HBx 1.0 1.8 3.50 132 71 A 10 LYS HBy A 10 LYS HGy 1.0 1.8 3.50 133 72 A 10 LYS HBx A 10 LYS HDx 1.0 1.8 3.50 134 72 A 10 LYS HBy A 10 LYS HDx 1.0 1.8 3.50 135 72 A 10 LYS HDy A 10 LYS HBx 1.0 1.8 3.50 136 72 A 10 LYS HBy A 10 LYS HDy 1.0 1.8 3.50 137 73 A 10 LYS HBy A 10 LYS HEx 1.0 1.8 4.75 138 73 A 10 LYS HBx A 10 LYS HEx 1.0 1.8 4.75 139 73 A 10 LYS HEy A 10 LYS HBx 1.0 1.8 4.75 140 73 A 10 LYS HBy A 10 LYS HEy 1.0 1.8 4.75 141 74 A 10 LYS HDy A 10 LYS HGx 1.0 1.8 3.50 142 74 A 10 LYS HDx A 10 LYS HGx 1.0 1.8 3.50 143 74 A 10 LYS HGy A 10 LYS HDx 1.0 1.8 3.50 144 74 A 10 LYS HGy A 10 LYS HDy 1.0 1.8 3.50 145 75 A 10 LYS HEx A 10 LYS HGx 1.0 1.8 3.50 146 75 A 10 LYS HEy A 10 LYS HGx 1.0 1.8 3.50 147 75 A 10 LYS HGy A 10 LYS HEx 1.0 1.8 3.50 148 75 A 10 LYS HGy A 10 LYS HEy 1.0 1.8 3.50 149 76 A 10 LYS HDx A 10 LYS HEx 1.0 1.8 3.50 150 76 A 10 LYS HDy A 10 LYS HEx 1.0 1.8 3.50 151 76 A 10 LYS HEy A 10 LYS HDx 1.0 1.8 3.50 152 76 A 10 LYS HDy A 10 LYS HEy 1.0 1.8 3.50 153 77 A 11 ASP H A 11 ASP HA 1.0 1.8 4.75 154 78 A 11 ASP H A 11 ASP HBx 1.0 1.8 3.50 155 78 A 11 ASP H A 11 ASP HBy 1.0 1.8 3.50 156 79 A 11 ASP HA A 11 ASP HBx 1.0 1.8 3.50 157 79 A 11 ASP HA A 11 ASP HBy 1.0 1.8 3.50 158 80 A 12 ILE H A 12 ILE HA 1.0 1.8 4.75 159 81 A 12 ILE H A 12 ILE HB 1.0 1.8 3.50 160 82 A 12 ILE H A 12 ILE HG2% 1.0 1.8 4.75 161 83 A 12 ILE H A 12 ILE HD1% 1.0 1.8 6.00 162 84 A 12 ILE H A 12 ILE HG1y 1.0 1.8 4.75 163 84 A 12 ILE H A 12 ILE HG1x 1.0 1.8 4.75 164 85 A 12 ILE HA A 12 ILE HB 1.0 1.8 4.75 165 86 A 12 ILE HA A 12 ILE HG2% 1.0 1.8 4.75 166 87 A 12 ILE HA A 12 ILE HD1% 1.0 1.8 4.75 167 88 A 12 ILE HA A 12 ILE HG1y 1.0 1.8 4.75 168 88 A 12 ILE HA A 12 ILE HG1x 1.0 1.8 4.75 169 89 A 12 ILE HB A 12 ILE HG2% 1.0 1.8 4.75 170 90 A 12 ILE HB A 12 ILE HD1% 1.0 1.8 4.75 171 91 A 12 ILE HB A 12 ILE HG1y 1.0 1.8 4.75 172 91 A 12 ILE HB A 12 ILE HG1x 1.0 1.8 4.75 173 92 A 12 ILE HG2% A 12 ILE HD1% 1.0 1.8 4.75 174 93 A 12 ILE HG2% A 12 ILE HG1y 1.0 1.8 4.75 175 93 A 12 ILE HG2% A 12 ILE HG1x 1.0 1.8 4.75 176 94 A 12 ILE HD1% A 12 ILE HG1y 1.0 1.8 4.75 177 94 A 12 ILE HD1% A 12 ILE HG1x 1.0 1.8 4.75 178 95 A 14 CYS H A 14 CYS HA 1.0 1.8 3.50 179 96 A 14 CYS H A 14 CYS HB3 1.0 1.8 3.50 180 97 A 14 CYS H A 14 CYS HB2 1.0 1.8 3.50 181 98 A 14 CYS HA A 14 CYS HB3 1.0 1.8 4.75 182 99 A 14 CYS HA A 14 CYS HB2 1.0 1.8 3.50 183 100 A 15 ARG H A 15 ARG HA 1.0 1.8 4.75 184 101 A 15 ARG H A 15 ARG HBx 1.0 1.8 3.50 185 101 A 15 ARG H A 15 ARG HBy 1.0 1.8 3.50 186 102 A 15 ARG H A 15 ARG HGx 1.0 1.8 4.75 187 102 A 15 ARG H A 15 ARG HGy 1.0 1.8 4.75 188 103 A 15 ARG H A 15 ARG HDx 1.0 1.8 6.00 189 103 A 15 ARG H A 15 ARG HDy 1.0 1.8 6.00 190 104 A 15 ARG HA A 15 ARG HBx 1.0 1.8 3.50 191 104 A 15 ARG HA A 15 ARG HBy 1.0 1.8 3.50 192 105 A 15 ARG HA A 15 ARG HGx 1.0 1.8 3.50 193 105 A 15 ARG HA A 15 ARG HGy 1.0 1.8 3.50 194 106 A 15 ARG HA A 15 ARG HDx 1.0 1.8 4.75 195 106 A 15 ARG HA A 15 ARG HDy 1.0 1.8 4.75 196 107 A 15 ARG HBx A 15 ARG HGx 1.0 1.8 3.50 197 107 A 15 ARG HBy A 15 ARG HGx 1.0 1.8 3.50 198 107 A 15 ARG HGy A 15 ARG HBx 1.0 1.8 3.50 199 107 A 15 ARG HBy A 15 ARG HGy 1.0 1.8 3.50 200 108 A 15 ARG HBx A 15 ARG HDx 1.0 1.8 3.50 201 108 A 15 ARG HBy A 15 ARG HDx 1.0 1.8 3.50 202 108 A 15 ARG HDy A 15 ARG HBx 1.0 1.8 3.50 203 108 A 15 ARG HBy A 15 ARG HDy 1.0 1.8 3.50 204 109 A 15 ARG HDx A 15 ARG HGx 1.0 1.8 3.50 205 109 A 15 ARG HDy A 15 ARG HGx 1.0 1.8 3.50 206 109 A 15 ARG HGy A 15 ARG HDx 1.0 1.8 3.50 207 109 A 15 ARG HGy A 15 ARG HDy 1.0 1.8 3.50 208 110 A 16 ASN H A 16 ASN HA 1.0 1.8 4.75 209 111 A 16 ASN H A 16 ASN HD22 1.0 1.8 4.75 210 112 A 16 ASN H A 16 ASN HBx 1.0 1.8 3.50 211 112 A 16 ASN H A 16 ASN HBy 1.0 1.8 3.50 212 113 A 16 ASN HA A 16 ASN HD22 1.0 1.8 6.00 213 114 A 16 ASN HA A 16 ASN HBx 1.0 1.8 4.75 214 114 A 16 ASN HA A 16 ASN HBy 1.0 1.8 4.75 215 115 A 16 ASN HD21 A 16 ASN HBx 1.0 1.8 3.50 216 115 A 16 ASN HBy A 16 ASN HD21 1.0 1.8 3.50 217 116 A 16 ASN HD22 A 16 ASN HBx 1.0 1.8 3.50 218 116 A 16 ASN HD22 A 16 ASN HBy 1.0 1.8 3.50 219 117 A 17 ILE H A 17 ILE HA 1.0 1.8 3.50 220 118 A 17 ILE H A 17 ILE HB 1.0 1.8 3.50 221 119 A 17 ILE H A 17 ILE HG2% 1.0 1.8 4.75 222 120 A 17 ILE H A 17 ILE HD1% 1.0 1.8 6.00 223 121 A 17 ILE H A 17 ILE HG1x 1.0 1.8 3.50 224 121 A 17 ILE H A 17 ILE HG1y 1.0 1.8 3.50 225 122 A 17 ILE HA A 17 ILE HB 1.0 1.8 3.50 226 123 A 17 ILE HA A 17 ILE HG2% 1.0 1.8 4.75 227 124 A 17 ILE HA A 17 ILE HD1% 1.0 1.8 4.75 228 125 A 17 ILE HA A 17 ILE HG1x 1.0 1.8 4.75 229 125 A 17 ILE HA A 17 ILE HG1y 1.0 1.8 4.75 230 126 A 17 ILE HB A 17 ILE HG2% 1.0 1.8 3.50 231 127 A 17 ILE HB A 17 ILE HD1% 1.0 1.8 4.75 232 128 A 17 ILE HB A 17 ILE HG1x 1.0 1.8 3.50 233 128 A 17 ILE HB A 17 ILE HG1y 1.0 1.8 3.50 234 129 A 17 ILE HG2% A 17 ILE HD1% 1.0 1.8 4.75 235 130 A 17 ILE HG2% A 17 ILE HG1x 1.0 1.8 4.75 236 130 A 17 ILE HG2% A 17 ILE HG1y 1.0 1.8 4.75 237 131 A 17 ILE HD1% A 17 ILE HG1x 1.0 1.8 4.75 238 131 A 17 ILE HD1% A 17 ILE HG1y 1.0 1.8 4.75 239 132 A 18 THR H A 18 THR HA 1.0 1.8 3.50 240 133 A 18 THR H A 18 THR HB 1.0 1.8 3.50 241 134 A 18 THR H A 18 THR HG2% 1.0 1.8 4.75 242 135 A 18 THR HA A 18 THR HB 1.0 1.8 3.50 243 136 A 18 THR HA A 18 THR HG2% 1.0 1.8 3.50 244 137 A 18 THR HB A 18 THR HG2% 1.0 1.8 4.75 245 138 A 19 ILE H A 19 ILE HA 1.0 1.8 3.50 246 139 A 19 ILE H A 19 ILE HB 1.0 1.8 3.50 247 140 A 19 ILE H A 19 ILE HG2% 1.0 1.8 4.75 248 141 A 19 ILE H A 19 ILE HD1% 1.0 1.8 6.00 249 142 A 19 ILE H A 19 ILE HG1y 1.0 1.8 3.50 250 142 A 19 ILE H A 19 ILE HG1x 1.0 1.8 3.50 251 143 A 19 ILE HA A 19 ILE HB 1.0 1.8 3.50 252 144 A 19 ILE HA A 19 ILE HG2% 1.0 1.8 3.50 253 145 A 19 ILE HA A 19 ILE HD1% 1.0 1.8 4.75 254 146 A 19 ILE HA A 19 ILE HG1y 1.0 1.8 3.50 255 146 A 19 ILE HA A 19 ILE HG1x 1.0 1.8 3.50 256 147 A 19 ILE HB A 19 ILE HG2% 1.0 1.8 3.50 257 148 A 19 ILE HB A 19 ILE HD1% 1.0 1.8 4.75 258 149 A 19 ILE HB A 19 ILE HG1y 1.0 1.8 3.50 259 149 A 19 ILE HB A 19 ILE HG1x 1.0 1.8 3.50 260 150 A 19 ILE HG2% A 19 ILE HD1% 1.0 1.8 4.75 261 151 A 19 ILE HG2% A 19 ILE HG1y 1.0 1.8 4.75 262 151 A 19 ILE HG2% A 19 ILE HG1x 1.0 1.8 4.75 263 152 A 19 ILE HD1% A 19 ILE HG1y 1.0 1.8 3.50 264 152 A 19 ILE HD1% A 19 ILE HG1x 1.0 1.8 3.50 265 153 A 20 TYR H A 20 TYR HA 1.0 1.8 4.75 266 154 A 20 TYR H A 20 TYR HB3 1.0 1.8 4.75 267 155 A 20 TYR H A 20 TYR HB2 1.0 1.8 4.75 268 156 A 20 TYR H A 20 TYR HD% 1.0 1.8 3.50 269 157 A 20 TYR H A 20 TYR HE% 1.0 1.8 6.00 270 158 A 20 TYR HA A 20 TYR HB3 1.0 1.8 4.75 271 159 A 20 TYR HA A 20 TYR HB2 1.0 1.8 4.75 272 160 A 20 TYR HA A 20 TYR HD% 1.0 1.8 3.50 273 161 A 20 TYR HA A 20 TYR HE% 1.0 1.8 6.00 274 162 A 20 TYR HB3 A 20 TYR HD% 1.0 1.8 3.50 275 163 A 20 TYR HB3 A 20 TYR HE% 1.0 1.8 6.00 276 164 A 20 TYR HB2 A 20 TYR HD% 1.0 1.8 3.50 277 165 A 20 TYR HB2 A 20 TYR HE% 1.0 1.8 6.00 278 166 A 21 GLY H A 21 GLY HAy 1.0 1.8 3.50 279 166 A 21 GLY H A 21 GLY HAx 1.0 1.8 3.50 280 167 A 22 TYR H A 22 TYR HA 1.0 1.8 4.75 281 168 A 22 TYR H A 22 TYR HB3 1.0 1.8 3.50 282 169 A 22 TYR H A 22 TYR HB2 1.0 1.8 4.75 283 170 A 22 TYR H A 22 TYR HD% 1.0 1.8 4.75 284 171 A 22 TYR H A 22 TYR HE% 1.0 1.8 6.00 285 172 A 22 TYR HA A 22 TYR HB3 1.0 1.8 3.50 286 173 A 22 TYR HA A 22 TYR HB2 1.0 1.8 3.50 287 174 A 22 TYR HA A 22 TYR HD% 1.0 1.8 4.75 288 175 A 22 TYR HA A 22 TYR HE% 1.0 1.8 6.00 289 176 A 22 TYR HB3 A 22 TYR HD% 1.0 1.8 3.50 290 177 A 22 TYR HB3 A 22 TYR HE% 1.0 1.8 6.00 291 178 A 22 TYR HB2 A 22 TYR HD% 1.0 1.8 3.50 292 179 A 22 TYR HB2 A 22 TYR HE% 1.0 1.8 6.00 293 180 A 23 CYS H A 23 CYS HA 1.0 1.8 3.50 294 181 A 23 CYS H A 23 CYS HBx 1.0 1.8 3.50 295 181 A 23 CYS H A 23 CYS HBy 1.0 1.8 3.50 296 182 A 23 CYS HA A 23 CYS HBx 1.0 1.8 3.50 297 182 A 23 CYS HA A 23 CYS HBy 1.0 1.8 3.50 298 183 A 24 LYS H A 24 LYS HA 1.0 1.8 4.75 299 184 A 24 LYS H A 24 LYS HBy 1.0 1.8 6.00 300 184 A 24 LYS H A 24 LYS HBx 1.0 1.8 6.00 301 185 A 24 LYS H A 24 LYS HGy 1.0 1.8 6.00 302 185 A 24 LYS H A 24 LYS HGx 1.0 1.8 6.00 303 186 A 24 LYS HA A 24 LYS HBy 1.0 1.8 3.50 304 186 A 24 LYS HA A 24 LYS HBx 1.0 1.8 3.50 305 187 A 24 LYS HA A 24 LYS HGy 1.0 1.8 4.75 306 187 A 24 LYS HA A 24 LYS HGx 1.0 1.8 4.75 307 188 A 24 LYS HBy A 24 LYS HGy 1.0 1.8 3.50 308 188 A 24 LYS HBx A 24 LYS HGy 1.0 1.8 3.50 309 188 A 24 LYS HGx A 24 LYS HBy 1.0 1.8 3.50 310 188 A 24 LYS HBx A 24 LYS HGx 1.0 1.8 3.50 311 189 A 24 LYS HBy A 24 LYS HDx 1.0 1.8 3.50 312 189 A 24 LYS HBx A 24 LYS HDx 1.0 1.8 3.50 313 189 A 24 LYS HDy A 24 LYS HBy 1.0 1.8 3.50 314 189 A 24 LYS HBx A 24 LYS HDy 1.0 1.8 3.50 315 190 A 24 LYS HBx A 24 LYS HEx 1.0 1.8 4.75 316 190 A 24 LYS HBy A 24 LYS HEx 1.0 1.8 4.75 317 190 A 24 LYS HEy A 24 LYS HBy 1.0 1.8 4.75 318 190 A 24 LYS HBx A 24 LYS HEy 1.0 1.8 4.75 319 191 A 24 LYS HDy A 24 LYS HGy 1.0 1.8 3.50 320 191 A 24 LYS HGx A 24 LYS HDx 1.0 1.8 3.50 321 191 A 24 LYS HGx A 24 LYS HDy 1.0 1.8 3.50 322 191 A 24 LYS HDx A 24 LYS HGy 1.0 1.8 3.50 323 192 A 24 LYS HEy A 24 LYS HGy 1.0 1.8 3.50 324 192 A 24 LYS HEx A 24 LYS HGy 1.0 1.8 3.50 325 192 A 24 LYS HGx A 24 LYS HEx 1.0 1.8 3.50 326 192 A 24 LYS HGx A 24 LYS HEy 1.0 1.8 3.50 327 193 A 24 LYS HDy A 24 LYS HEx 1.0 1.8 3.50 328 193 A 24 LYS HDx A 24 LYS HEx 1.0 1.8 3.50 329 193 A 24 LYS HEy A 24 LYS HDx 1.0 1.8 3.50 330 193 A 24 LYS HDy A 24 LYS HEy 1.0 1.8 3.50 331 194 A 25 LYS H A 25 LYS HA 1.0 1.8 4.75 332 195 A 25 LYS H A 25 LYS HB3 1.0 1.8 4.75 333 196 A 25 LYS H A 25 LYS HB2 1.0 1.8 3.50 334 197 A 25 LYS H A 25 LYS HGy 1.0 1.8 4.75 335 197 A 25 LYS H A 25 LYS HGx 1.0 1.8 4.75 336 198 A 25 LYS H A 25 LYS HDx 1.0 1.8 4.75 337 198 A 25 LYS H A 25 LYS HDy 1.0 1.8 4.75 338 199 A 25 LYS HA A 25 LYS HB3 1.0 1.8 3.50 339 200 A 25 LYS HA A 25 LYS HB2 1.0 1.8 4.75 340 201 A 25 LYS HA A 25 LYS HGy 1.0 1.8 4.75 341 201 A 25 LYS HA A 25 LYS HGx 1.0 1.8 4.75 342 202 A 25 LYS HA A 25 LYS HDx 1.0 1.8 4.75 343 202 A 25 LYS HA A 25 LYS HDy 1.0 1.8 4.75 344 203 A 25 LYS HB3 A 25 LYS HGy 1.0 1.8 3.50 345 203 A 25 LYS HB3 A 25 LYS HGx 1.0 1.8 3.50 346 204 A 25 LYS HB3 A 25 LYS HDx 1.0 1.8 3.50 347 204 A 25 LYS HB3 A 25 LYS HDy 1.0 1.8 3.50 348 205 A 25 LYS HB3 A 25 LYS HEx 1.0 1.8 6.00 349 205 A 25 LYS HB3 A 25 LYS HEy 1.0 1.8 6.00 350 206 A 25 LYS HB2 A 25 LYS HGy 1.0 1.8 3.50 351 206 A 25 LYS HB2 A 25 LYS HGx 1.0 1.8 3.50 352 207 A 25 LYS HB2 A 25 LYS HDx 1.0 1.8 3.50 353 207 A 25 LYS HB2 A 25 LYS HDy 1.0 1.8 3.50 354 208 A 25 LYS HB2 A 25 LYS HEx 1.0 1.8 4.75 355 208 A 25 LYS HB2 A 25 LYS HEy 1.0 1.8 4.75 356 209 A 25 LYS HDx A 25 LYS HGy 1.0 1.8 3.50 357 209 A 25 LYS HGx A 25 LYS HDx 1.0 1.8 3.50 358 209 A 25 LYS HGx A 25 LYS HDy 1.0 1.8 3.50 359 209 A 25 LYS HDy A 25 LYS HGy 1.0 1.8 3.50 360 210 A 25 LYS HEy A 25 LYS HGy 1.0 1.8 3.50 361 210 A 25 LYS HEx A 25 LYS HGy 1.0 1.8 3.50 362 210 A 25 LYS HGx A 25 LYS HEx 1.0 1.8 3.50 363 210 A 25 LYS HGx A 25 LYS HEy 1.0 1.8 3.50 364 211 A 25 LYS HDy A 25 LYS HEx 1.0 1.8 3.50 365 211 A 25 LYS HEy A 25 LYS HDx 1.0 1.8 3.50 366 211 A 25 LYS HDy A 25 LYS HEy 1.0 1.8 3.50 367 211 A 25 LYS HDx A 25 LYS HEx 1.0 1.8 3.50 368 212 A 26 GLU H A 26 GLU HA 1.0 1.8 4.75 369 213 A 26 GLU H A 26 GLU HBy 1.0 1.8 3.50 370 213 A 26 GLU H A 26 GLU HBx 1.0 1.8 3.50 371 214 A 26 GLU H A 26 GLU HGx 1.0 1.8 4.75 372 214 A 26 GLU H A 26 GLU HGy 1.0 1.8 4.75 373 215 A 26 GLU HA A 26 GLU HBy 1.0 1.8 3.50 374 215 A 26 GLU HA A 26 GLU HBx 1.0 1.8 3.50 375 216 A 26 GLU HA A 26 GLU HGx 1.0 1.8 4.75 376 216 A 26 GLU HA A 26 GLU HGy 1.0 1.8 4.75 377 217 A 26 GLU HBy A 26 GLU HGx 1.0 1.8 3.50 378 217 A 26 GLU HBx A 26 GLU HGx 1.0 1.8 3.50 379 217 A 26 GLU HGy A 26 GLU HBy 1.0 1.8 3.50 380 217 A 26 GLU HBx A 26 GLU HGy 1.0 1.8 3.50 381 218 A 27 LYS H A 27 LYS HA 1.0 1.8 4.75 382 219 A 27 LYS H A 27 LYS HB3 1.0 1.8 4.75 383 220 A 27 LYS H A 27 LYS HB2 1.0 1.8 4.75 384 221 A 27 LYS H A 27 LYS HGx 1.0 1.8 4.75 385 221 A 27 LYS H A 27 LYS HGy 1.0 1.8 4.75 386 222 A 27 LYS H A 27 LYS HDx 1.0 1.8 6.00 387 222 A 27 LYS H A 27 LYS HDy 1.0 1.8 6.00 388 223 A 27 LYS HA A 27 LYS HB3 1.0 1.8 3.50 389 224 A 27 LYS HA A 27 LYS HB2 1.0 1.8 4.75 390 225 A 27 LYS HA A 27 LYS HGx 1.0 1.8 3.50 391 225 A 27 LYS HA A 27 LYS HGy 1.0 1.8 3.50 392 226 A 27 LYS HB3 A 27 LYS HGx 1.0 1.8 3.50 393 226 A 27 LYS HB3 A 27 LYS HGy 1.0 1.8 3.50 394 227 A 27 LYS HB3 A 27 LYS HDx 1.0 1.8 3.50 395 227 A 27 LYS HB3 A 27 LYS HDy 1.0 1.8 3.50 396 228 A 27 LYS HB3 A 27 LYS HEx 1.0 1.8 6.00 397 228 A 27 LYS HB3 A 27 LYS HEy 1.0 1.8 6.00 398 229 A 27 LYS HB2 A 27 LYS HGx 1.0 1.8 3.50 399 229 A 27 LYS HB2 A 27 LYS HGy 1.0 1.8 3.50 400 230 A 27 LYS HB2 A 27 LYS HDx 1.0 1.8 3.50 401 230 A 27 LYS HB2 A 27 LYS HDy 1.0 1.8 3.50 402 231 A 27 LYS HB2 A 27 LYS HEx 1.0 1.8 4.75 403 231 A 27 LYS HB2 A 27 LYS HEy 1.0 1.8 4.75 404 232 A 27 LYS HDx A 27 LYS HGx 1.0 1.8 3.50 405 232 A 27 LYS HDy A 27 LYS HGx 1.0 1.8 3.50 406 232 A 27 LYS HGy A 27 LYS HDx 1.0 1.8 3.50 407 232 A 27 LYS HGy A 27 LYS HDy 1.0 1.8 3.50 408 233 A 27 LYS HEx A 27 LYS HGx 1.0 1.8 3.50 409 233 A 27 LYS HEy A 27 LYS HGx 1.0 1.8 3.50 410 233 A 27 LYS HGy A 27 LYS HEx 1.0 1.8 3.50 411 233 A 27 LYS HGy A 27 LYS HEy 1.0 1.8 3.50 412 234 A 27 LYS HDx A 27 LYS HEx 1.0 1.8 3.50 413 234 A 27 LYS HDy A 27 LYS HEx 1.0 1.8 3.50 414 234 A 27 LYS HEy A 27 LYS HDx 1.0 1.8 3.50 415 234 A 27 LYS HDy A 27 LYS HEy 1.0 1.8 3.50 416 235 A 28 GLU H A 28 GLU HA 1.0 1.8 4.75 417 236 A 28 GLU H A 28 GLU HB3 1.0 1.8 4.75 418 237 A 28 GLU H A 28 GLU HB2 1.0 1.8 3.50 419 238 A 28 GLU H A 28 GLU HGx 1.0 1.8 4.75 420 238 A 28 GLU H A 28 GLU HGy 1.0 1.8 4.75 421 239 A 28 GLU HA A 28 GLU HB3 1.0 1.8 4.75 422 240 A 28 GLU HA A 28 GLU HB2 1.0 1.8 4.75 423 241 A 28 GLU HA A 28 GLU HGx 1.0 1.8 3.50 424 241 A 28 GLU HA A 28 GLU HGy 1.0 1.8 3.50 425 242 A 28 GLU HB3 A 28 GLU HGx 1.0 1.8 3.50 426 242 A 28 GLU HB3 A 28 GLU HGy 1.0 1.8 3.50 427 243 A 28 GLU HB2 A 28 GLU HGx 1.0 1.8 3.50 428 243 A 28 GLU HB2 A 28 GLU HGy 1.0 1.8 3.50 429 244 A 29 GLY H A 29 GLY HAy 1.0 1.8 3.50 430 244 A 29 GLY H A 29 GLY HAx 1.0 1.8 3.50 431 245 A 30 CYS H A 30 CYS HA 1.0 1.8 3.50 432 246 A 30 CYS H A 30 CYS HB3 1.0 1.8 3.50 433 247 A 30 CYS H A 30 CYS HB2 1.0 1.8 3.50 434 248 A 30 CYS HA A 30 CYS HB3 1.0 1.8 4.75 435 249 A 30 CYS HA A 30 CYS HB2 1.0 1.8 4.75 436 250 A 32 PHE H A 32 PHE HA 1.0 1.8 4.75 437 251 A 32 PHE H A 32 PHE HBx 1.0 1.8 3.50 438 251 A 32 PHE H A 32 PHE HBy 1.0 1.8 3.50 439 252 A 32 PHE H A 32 PHE HD% 1.0 1.8 4.75 440 253 A 32 PHE H A 32 PHE HE% 1.0 1.8 6.00 441 254 A 32 PHE HA A 32 PHE HBx 1.0 1.8 4.75 442 254 A 32 PHE HA A 32 PHE HBy 1.0 1.8 4.75 443 255 A 32 PHE HA A 32 PHE HD% 1.0 1.8 3.50 444 256 A 32 PHE HA A 32 PHE HE% 1.0 1.8 6.00 445 257 A 32 PHE HD% A 32 PHE HBx 1.0 1.8 3.50 446 257 A 32 PHE HBy A 32 PHE HD% 1.0 1.8 3.50 447 258 A 32 PHE HE% A 32 PHE HBx 1.0 1.8 6.00 448 258 A 32 PHE HBy A 32 PHE HE% 1.0 1.8 6.00 449 259 A 33 LYS H A 33 LYS HA 1.0 1.8 3.50 450 260 A 33 LYS H A 33 LYS HBy 1.0 1.8 3.50 451 260 A 33 LYS H A 33 LYS HBx 1.0 1.8 3.50 452 261 A 33 LYS H A 33 LYS HGx 1.0 1.8 4.75 453 261 A 33 LYS H A 33 LYS HGy 1.0 1.8 4.75 454 262 A 33 LYS H A 33 LYS HDx 1.0 1.8 4.75 455 262 A 33 LYS H A 33 LYS HDy 1.0 1.8 4.75 456 263 A 33 LYS HA A 33 LYS HBy 1.0 1.8 3.50 457 263 A 33 LYS HA A 33 LYS HBx 1.0 1.8 3.50 458 264 A 33 LYS HA A 33 LYS HGx 1.0 1.8 4.75 459 264 A 33 LYS HA A 33 LYS HGy 1.0 1.8 4.75 460 265 A 33 LYS HA A 33 LYS HDx 1.0 1.8 3.50 461 265 A 33 LYS HA A 33 LYS HDy 1.0 1.8 3.50 462 266 A 33 LYS HBx A 33 LYS HGx 1.0 1.8 3.50 463 266 A 33 LYS HGy A 33 LYS HBy 1.0 1.8 3.50 464 266 A 33 LYS HBx A 33 LYS HGy 1.0 1.8 3.50 465 266 A 33 LYS HBy A 33 LYS HGx 1.0 1.8 3.50 466 267 A 33 LYS HBy A 33 LYS HDx 1.0 1.8 3.50 467 267 A 33 LYS HBx A 33 LYS HDx 1.0 1.8 3.50 468 267 A 33 LYS HDy A 33 LYS HBy 1.0 1.8 3.50 469 267 A 33 LYS HBx A 33 LYS HDy 1.0 1.8 3.50 470 268 A 33 LYS HBx A 33 LYS HEy 1.0 1.8 4.75 471 268 A 33 LYS HBy A 33 LYS HEy 1.0 1.8 4.75 472 268 A 33 LYS HEx A 33 LYS HBy 1.0 1.8 4.75 473 268 A 33 LYS HBx A 33 LYS HEx 1.0 1.8 4.75 474 269 A 33 LYS HDx A 33 LYS HGx 1.0 1.8 3.50 475 269 A 33 LYS HDy A 33 LYS HGx 1.0 1.8 3.50 476 269 A 33 LYS HGy A 33 LYS HDx 1.0 1.8 3.50 477 269 A 33 LYS HGy A 33 LYS HDy 1.0 1.8 3.50 478 270 A 33 LYS HEy A 33 LYS HGx 1.0 1.8 3.50 479 270 A 33 LYS HEx A 33 LYS HGx 1.0 1.8 3.50 480 270 A 33 LYS HGy A 33 LYS HEy 1.0 1.8 3.50 481 270 A 33 LYS HGy A 33 LYS HEx 1.0 1.8 3.50 482 271 A 33 LYS HDx A 33 LYS HEy 1.0 1.8 3.50 483 271 A 33 LYS HDy A 33 LYS HEy 1.0 1.8 3.50 484 271 A 33 LYS HEx A 33 LYS HDx 1.0 1.8 3.50 485 271 A 33 LYS HDy A 33 LYS HEx 1.0 1.8 3.50 486 272 A 34 HIS H A 34 HIS HA 1.0 1.8 6.00 487 273 A 34 HIS H A 34 HIS HB3 1.0 1.8 6.00 488 274 A 34 HIS H A 34 HIS HB2 1.0 1.8 6.00 489 275 A 34 HIS H A 34 HIS HD2 1.0 1.8 6.00 490 276 A 34 HIS HA A 34 HIS HB3 1.0 1.8 4.75 491 277 A 34 HIS HA A 34 HIS HB2 1.0 1.8 4.75 492 278 A 34 HIS HA A 34 HIS HD2 1.0 1.8 4.75 493 279 A 34 HIS HB3 A 34 HIS HD2 1.0 1.8 4.75 494 280 A 34 HIS HB3 A 34 HIS HE1 1.0 1.8 6.00 495 281 A 34 HIS HB2 A 34 HIS HD2 1.0 1.8 4.75 496 282 A 35 SER H A 35 SER HA 1.0 1.8 4.75 497 283 A 35 SER H A 35 SER HBx 1.0 1.8 4.75 498 283 A 35 SER H A 35 SER HBy 1.0 1.8 4.75 499 284 A 35 SER HA A 35 SER HBx 1.0 1.8 3.50 500 284 A 35 SER HA A 35 SER HBy 1.0 1.8 3.50 501 285 A 36 ASP H A 36 ASP HA 1.0 1.8 4.75 502 286 A 36 ASP H A 36 ASP HBy 1.0 1.8 6.00 503 286 A 36 ASP H A 36 ASP HBx 1.0 1.8 6.00 504 287 A 36 ASP HA A 36 ASP HBy 1.0 1.8 4.75 505 287 A 36 ASP HA A 36 ASP HBx 1.0 1.8 4.75 506 288 A 37 ASN H A 37 ASN HA 1.0 1.8 6.00 507 289 A 37 ASN H A 37 ASN HBy 1.0 1.8 6.00 508 289 A 37 ASN H A 37 ASN HBx 1.0 1.8 6.00 509 290 A 37 ASN HA A 37 ASN HBy 1.0 1.8 4.75 510 290 A 37 ASN HA A 37 ASN HBx 1.0 1.8 4.75 511 291 A 37 ASN HD21 A 37 ASN HBy 1.0 1.8 6.00 512 291 A 37 ASN HBx A 37 ASN HD21 1.0 1.8 6.00 513 292 A 37 ASN HD22 A 37 ASN HBy 1.0 1.8 4.75 514 292 A 37 ASN HBx A 37 ASN HD22 1.0 1.8 4.75 515 293 A 38 THR H A 38 THR HA 1.0 1.8 4.75 516 294 A 38 THR H A 38 THR HB 1.0 1.8 3.50 517 295 A 38 THR H A 38 THR HG2% 1.0 1.8 6.00 518 296 A 38 THR HA A 38 THR HB 1.0 1.8 4.75 519 297 A 38 THR HA A 38 THR HG2% 1.0 1.8 4.75 520 298 A 38 THR HB A 38 THR HG2% 1.0 1.8 4.75 521 299 A 39 THR H A 39 THR HA 1.0 1.8 4.75 522 300 A 39 THR H A 39 THR HB 1.0 1.8 4.75 523 301 A 39 THR H A 39 THR HG2% 1.0 1.8 6.00 524 302 A 39 THR HA A 39 THR HB 1.0 1.8 4.75 525 303 A 39 THR HA A 39 THR HG2% 1.0 1.8 4.75 526 304 A 39 THR HB A 39 THR HG2% 1.0 1.8 6.00 527 305 A 40 ALA H A 40 ALA HA 1.0 1.8 4.75 528 306 A 40 ALA H A 40 ALA HB% 1.0 1.8 6.00 529 307 A 40 ALA HA A 40 ALA HB% 1.0 1.8 4.75 530 308 A 41 THR H A 41 THR HA 1.0 1.8 3.50 531 309 A 41 THR H A 41 THR HB 1.0 1.8 6.00 532 310 A 41 THR H A 41 THR HG2% 1.0 1.8 6.00 533 311 A 41 THR HA A 41 THR HB 1.0 1.8 4.75 534 312 A 41 THR HA A 41 THR HG2% 1.0 1.8 4.75 535 313 A 41 THR HB A 41 THR HG2% 1.0 1.8 6.00 536 314 A 1 MET HA A 2 ASP H 1.0 1.8 3.50 537 315 A 2 ASP H A 1 MET HBx 1.0 1.8 6.00 538 315 A 1 MET HBy A 2 ASP H 1.0 1.8 6.00 539 316 A 2 ASP H A 1 MET HGy 1.0 1.8 6.00 540 316 A 1 MET HGx A 2 ASP H 1.0 1.8 6.00 541 317 A 2 ASP H A 3 LYS H 1.0 1.8 4.75 542 318 A 2 ASP H A 3 LYS HBy 1.0 1.8 4.75 543 318 A 2 ASP H A 3 LYS HBx 1.0 1.8 4.75 544 319 A 2 ASP HA A 3 LYS H 1.0 1.8 3.50 545 320 A 3 LYS H A 2 ASP HBy 1.0 1.8 4.75 546 320 A 2 ASP HBx A 3 LYS H 1.0 1.8 4.75 547 321 A 3 LYS HA A 4 ILE H 1.0 1.8 3.50 548 322 A 4 ILE H A 5 ASN H 1.0 1.8 6.00 549 323 A 4 ILE H A 5 ASN HA 1.0 1.8 6.00 550 324 A 4 ILE H A 5 ASN HBy 1.0 1.8 6.00 551 324 A 4 ILE H A 5 ASN HBx 1.0 1.8 6.00 552 325 A 4 ILE HA A 5 ASN H 1.0 1.8 3.50 553 326 A 4 ILE HB A 5 ASN H 1.0 1.8 4.75 554 327 A 4 ILE HG2% A 5 ASN H 1.0 1.8 6.00 555 328 A 4 ILE HG2% A 5 ASN HA 1.0 1.8 6.00 556 329 A 4 ILE HD1% A 5 ASN H 1.0 1.8 6.00 557 330 A 5 ASN H A 4 ILE HG1x 1.0 1.8 6.00 558 330 A 4 ILE HG1y A 5 ASN H 1.0 1.8 6.00 559 331 A 5 ASN H A 6 PRO HDy 1.0 1.8 6.00 560 331 A 5 ASN H A 6 PRO HDx 1.0 1.8 6.00 561 332 A 5 ASN HA A 6 PRO HBx 1.0 1.8 6.00 562 332 A 5 ASN HA A 6 PRO HBy 1.0 1.8 6.00 563 333 A 5 ASN HA A 6 PRO HGx 1.0 1.8 4.75 564 333 A 5 ASN HA A 6 PRO HGy 1.0 1.8 4.75 565 334 A 5 ASN HA A 6 PRO HDy 1.0 1.8 3.50 566 334 A 5 ASN HA A 6 PRO HDx 1.0 1.8 3.50 567 335 A 5 ASN HD21 A 6 PRO HDy 1.0 1.8 6.00 568 335 A 5 ASN HD21 A 6 PRO HDx 1.0 1.8 6.00 569 336 A 5 ASN HBx A 6 PRO HDy 1.0 1.8 4.75 570 336 A 5 ASN HBy A 6 PRO HDy 1.0 1.8 4.75 571 336 A 6 PRO HDx A 5 ASN HBy 1.0 1.8 4.75 572 336 A 5 ASN HBx A 6 PRO HDx 1.0 1.8 4.75 573 337 A 7 ASP H A 6 PRO HA 1.0 1.8 3.50 574 338 A 7 ASP H A 6 PRO HBx 1.0 1.8 4.75 575 338 A 7 ASP H A 6 PRO HBy 1.0 1.8 4.75 576 339 A 7 ASP H A 6 PRO HGx 1.0 1.8 4.75 577 339 A 7 ASP H A 6 PRO HGy 1.0 1.8 4.75 578 340 A 7 ASP H A 6 PRO HDy 1.0 1.8 4.75 579 340 A 7 ASP H A 6 PRO HDx 1.0 1.8 4.75 580 341 A 7 ASP H A 8 TRP H 1.0 1.8 3.50 581 342 A 7 ASP H A 8 TRP HD1 1.0 1.8 6.00 582 343 A 7 ASP H A 8 TRP HBx 1.0 1.8 6.00 583 343 A 7 ASP H A 8 TRP HBy 1.0 1.8 6.00 584 344 A 7 ASP HA A 8 TRP H 1.0 1.8 3.50 585 345 A 8 TRP H A 7 ASP HBx 1.0 1.8 4.75 586 345 A 7 ASP HBy A 8 TRP H 1.0 1.8 4.75 587 346 A 8 TRP HD1 A 7 ASP HBx 1.0 1.8 6.00 588 346 A 7 ASP HBy A 8 TRP HD1 1.0 1.8 6.00 589 347 A 8 TRP H A 9 ALA HA 1.0 1.8 6.00 590 348 A 8 TRP H A 9 ALA HB% 1.0 1.8 4.75 591 349 A 8 TRP HA A 9 ALA H 1.0 1.8 4.75 592 350 A 8 TRP HA A 9 ALA HB% 1.0 1.8 6.00 593 351 A 8 TRP HD1 A 9 ALA HB% 1.0 1.8 6.00 594 352 A 8 TRP HE1 A 9 ALA HB% 1.0 1.8 6.00 595 353 A 8 TRP HE3 A 9 ALA HA 1.0 1.8 4.75 596 354 A 8 TRP HE3 A 9 ALA HB% 1.0 1.8 4.75 597 355 A 9 ALA HB% A 8 TRP HZ2 1.0 1.8 4.75 598 356 A 8 TRP HZ3 A 9 ALA HA 1.0 1.8 4.75 599 357 A 8 TRP HZ3 A 9 ALA HB% 1.0 1.8 6.00 600 358 A 9 ALA HA A 8 TRP HH2 1.0 1.8 6.00 601 359 A 9 ALA HB% A 8 TRP HH2 1.0 1.8 6.00 602 360 A 9 ALA H A 8 TRP HBx 1.0 1.8 4.75 603 360 A 8 TRP HBy A 9 ALA H 1.0 1.8 4.75 604 361 A 9 ALA HB% A 8 TRP HBx 1.0 1.8 6.00 605 361 A 8 TRP HBy A 9 ALA HB% 1.0 1.8 6.00 606 362 A 9 ALA H A 10 LYS H 1.0 1.8 3.50 607 363 A 9 ALA HA A 10 LYS H 1.0 1.8 4.75 608 364 A 9 ALA HB% A 10 LYS H 1.0 1.8 4.75 609 365 A 9 ALA HB% A 10 LYS HA 1.0 1.8 6.00 610 366 A 9 ALA HB% A 10 LYS HBx 1.0 1.8 6.00 611 366 A 9 ALA HB% A 10 LYS HBy 1.0 1.8 6.00 612 367 A 9 ALA HB% A 10 LYS HGx 1.0 1.8 6.00 613 367 A 9 ALA HB% A 10 LYS HGy 1.0 1.8 6.00 614 368 A 10 LYS H A 11 ASP H 1.0 1.8 3.50 615 369 A 10 LYS H A 11 ASP HA 1.0 1.8 6.00 616 370 A 10 LYS H A 11 ASP HBx 1.0 1.8 6.00 617 370 A 10 LYS H A 11 ASP HBy 1.0 1.8 6.00 618 371 A 10 LYS HA A 11 ASP H 1.0 1.8 4.75 619 372 A 11 ASP H A 10 LYS HBx 1.0 1.8 4.75 620 372 A 10 LYS HBy A 11 ASP H 1.0 1.8 4.75 621 373 A 11 ASP H A 10 LYS HGx 1.0 1.8 4.75 622 373 A 10 LYS HGy A 11 ASP H 1.0 1.8 4.75 623 374 A 11 ASP H A 10 LYS HDx 1.0 1.8 6.00 624 374 A 10 LYS HDy A 11 ASP H 1.0 1.8 6.00 625 375 A 11 ASP HA A 10 LYS HDx 1.0 1.8 4.75 626 375 A 10 LYS HDy A 11 ASP HA 1.0 1.8 4.75 627 376 A 11 ASP H A 12 ILE H 1.0 1.8 3.50 628 377 A 11 ASP H A 12 ILE HB 1.0 1.8 4.75 629 378 A 11 ASP H A 12 ILE HG1y 1.0 1.8 6.00 630 378 A 11 ASP H A 12 ILE HG1x 1.0 1.8 6.00 631 379 A 11 ASP HA A 12 ILE H 1.0 1.8 4.75 632 380 A 12 ILE H A 11 ASP HBx 1.0 1.8 4.75 633 380 A 11 ASP HBy A 12 ILE H 1.0 1.8 4.75 634 381 A 12 ILE HD1% A 11 ASP HBx 1.0 1.8 6.00 635 381 A 11 ASP HBy A 12 ILE HD1% 1.0 1.8 6.00 636 382 A 11 ASP HBy A 12 ILE HG1y 1.0 1.8 6.00 637 382 A 11 ASP HBx A 12 ILE HG1y 1.0 1.8 6.00 638 382 A 12 ILE HG1x A 11 ASP HBx 1.0 1.8 6.00 639 382 A 11 ASP HBy A 12 ILE HG1x 1.0 1.8 6.00 640 383 A 12 ILE H A 13 PRO HDy 1.0 1.8 6.00 641 383 A 12 ILE H A 13 PRO HDx 1.0 1.8 6.00 642 384 A 12 ILE HA A 13 PRO HDy 1.0 1.8 3.50 643 384 A 12 ILE HA A 13 PRO HDx 1.0 1.8 3.50 644 385 A 12 ILE HG2% A 13 PRO HA 1.0 1.8 6.00 645 386 A 12 ILE HG2% A 13 PRO HBx 1.0 1.8 6.00 646 386 A 12 ILE HG2% A 13 PRO HBy 1.0 1.8 6.00 647 387 A 12 ILE HG2% A 13 PRO HGx 1.0 1.8 6.00 648 387 A 12 ILE HG2% A 13 PRO HGy 1.0 1.8 6.00 649 388 A 12 ILE HG2% A 13 PRO HDy 1.0 1.8 4.75 650 388 A 12 ILE HG2% A 13 PRO HDx 1.0 1.8 4.75 651 389 A 12 ILE HD1% A 13 PRO HDy 1.0 1.8 6.00 652 389 A 12 ILE HD1% A 13 PRO HDx 1.0 1.8 6.00 653 390 A 12 ILE HG1x A 13 PRO HDy 1.0 1.8 6.00 654 390 A 12 ILE HG1y A 13 PRO HDy 1.0 1.8 6.00 655 390 A 13 PRO HDx A 12 ILE HG1y 1.0 1.8 6.00 656 390 A 12 ILE HG1x A 13 PRO HDx 1.0 1.8 6.00 657 391 A 14 CYS H A 13 PRO HA 1.0 1.8 3.50 658 392 A 14 CYS HA A 13 PRO HA 1.0 1.8 6.00 659 393 A 14 CYS H A 13 PRO HBx 1.0 1.8 3.50 660 393 A 14 CYS H A 13 PRO HBy 1.0 1.8 3.50 661 394 A 14 CYS H A 13 PRO HGx 1.0 1.8 6.00 662 394 A 14 CYS H A 13 PRO HGy 1.0 1.8 6.00 663 395 A 14 CYS H A 13 PRO HDy 1.0 1.8 6.00 664 395 A 14 CYS H A 13 PRO HDx 1.0 1.8 6.00 665 396 A 14 CYS HA A 15 ARG H 1.0 1.8 3.50 666 397 A 14 CYS HA A 15 ARG HBx 1.0 1.8 4.75 667 397 A 14 CYS HA A 15 ARG HBy 1.0 1.8 4.75 668 398 A 14 CYS HA A 15 ARG HGx 1.0 1.8 6.00 669 398 A 14 CYS HA A 15 ARG HGy 1.0 1.8 6.00 670 399 A 14 CYS HB3 A 15 ARG H 1.0 1.8 4.75 671 400 A 14 CYS HB2 A 15 ARG H 1.0 1.8 4.75 672 401 A 15 ARG H A 16 ASN H 1.0 1.8 4.75 673 402 A 15 ARG H A 16 ASN HA 1.0 1.8 6.00 674 403 A 15 ARG HA A 16 ASN H 1.0 1.8 4.75 675 404 A 15 ARG HA A 16 ASN HA 1.0 1.8 6.00 676 405 A 16 ASN H A 15 ARG HBx 1.0 1.8 4.75 677 405 A 15 ARG HBy A 16 ASN H 1.0 1.8 4.75 678 406 A 16 ASN HA A 15 ARG HBx 1.0 1.8 6.00 679 406 A 15 ARG HBy A 16 ASN HA 1.0 1.8 6.00 680 407 A 16 ASN HD21 A 15 ARG HBx 1.0 1.8 6.00 681 407 A 15 ARG HBy A 16 ASN HD21 1.0 1.8 6.00 682 408 A 16 ASN HD22 A 15 ARG HBx 1.0 1.8 6.00 683 408 A 15 ARG HBy A 16 ASN HD22 1.0 1.8 6.00 684 409 A 16 ASN H A 15 ARG HGx 1.0 1.8 4.75 685 409 A 15 ARG HGy A 16 ASN H 1.0 1.8 4.75 686 410 A 16 ASN HA A 15 ARG HGx 1.0 1.8 6.00 687 410 A 15 ARG HGy A 16 ASN HA 1.0 1.8 6.00 688 411 A 16 ASN H A 17 ILE H 1.0 1.8 3.50 689 412 A 16 ASN H A 17 ILE HB 1.0 1.8 6.00 690 413 A 16 ASN H A 17 ILE HG2% 1.0 1.8 6.00 691 414 A 16 ASN H A 17 ILE HD1% 1.0 1.8 6.00 692 415 A 16 ASN H A 17 ILE HG1x 1.0 1.8 6.00 693 415 A 16 ASN H A 17 ILE HG1y 1.0 1.8 6.00 694 416 A 16 ASN HA A 17 ILE H 1.0 1.8 3.50 695 417 A 17 ILE H A 16 ASN HBx 1.0 1.8 3.50 696 417 A 16 ASN HBy A 17 ILE H 1.0 1.8 3.50 697 418 A 17 ILE H A 18 THR H 1.0 1.8 3.50 698 419 A 17 ILE H A 18 THR HA 1.0 1.8 6.00 699 420 A 17 ILE H A 18 THR HB 1.0 1.8 6.00 700 421 A 17 ILE H A 18 THR HG2% 1.0 1.8 6.00 701 422 A 17 ILE HA A 18 THR H 1.0 1.8 3.50 702 423 A 17 ILE HB A 18 THR H 1.0 1.8 3.50 703 424 A 17 ILE HG2% A 18 THR H 1.0 1.8 6.00 704 425 A 17 ILE HG2% A 18 THR HA 1.0 1.8 6.00 705 426 A 17 ILE HG2% A 18 THR HB 1.0 1.8 6.00 706 427 A 17 ILE HD1% A 18 THR H 1.0 1.8 6.00 707 428 A 18 THR H A 17 ILE HG1x 1.0 1.8 4.75 708 428 A 17 ILE HG1y A 18 THR H 1.0 1.8 4.75 709 429 A 18 THR H A 19 ILE H 1.0 1.8 3.50 710 430 A 18 THR H A 19 ILE HA 1.0 1.8 6.00 711 431 A 18 THR H A 19 ILE HB 1.0 1.8 6.00 712 432 A 18 THR H A 19 ILE HG2% 1.0 1.8 6.00 713 433 A 18 THR H A 19 ILE HD1% 1.0 1.8 6.00 714 434 A 18 THR H A 19 ILE HG1y 1.0 1.8 6.00 715 434 A 18 THR H A 19 ILE HG1x 1.0 1.8 6.00 716 435 A 18 THR HA A 19 ILE H 1.0 1.8 4.75 717 436 A 18 THR HA A 19 ILE HD1% 1.0 1.8 6.00 718 437 A 18 THR HB A 19 ILE H 1.0 1.8 3.50 719 438 A 18 THR HB A 19 ILE HG2% 1.0 1.8 6.00 720 439 A 18 THR HB A 19 ILE HD1% 1.0 1.8 6.00 721 440 A 18 THR HB A 19 ILE HG1y 1.0 1.8 4.75 722 440 A 18 THR HB A 19 ILE HG1x 1.0 1.8 4.75 723 441 A 18 THR HG2% A 19 ILE H 1.0 1.8 6.00 724 442 A 18 THR HG2% A 19 ILE HA 1.0 1.8 6.00 725 443 A 18 THR HG2% A 19 ILE HG2% 1.0 1.8 6.00 726 444 A 18 THR HG2% A 19 ILE HD1% 1.0 1.8 6.00 727 445 A 19 ILE H A 20 TYR H 1.0 1.8 3.50 728 446 A 19 ILE H A 20 TYR HA 1.0 1.8 6.00 729 447 A 19 ILE H A 20 TYR HB3 1.0 1.8 6.00 730 448 A 19 ILE H A 20 TYR HB2 1.0 1.8 6.00 731 449 A 19 ILE H A 20 TYR HD% 1.0 1.8 4.75 732 450 A 19 ILE H A 20 TYR HE% 1.0 1.8 6.00 733 451 A 19 ILE HA A 20 TYR H 1.0 1.8 4.75 734 452 A 19 ILE HA A 20 TYR HA 1.0 1.8 4.75 735 453 A 19 ILE HA A 20 TYR HD% 1.0 1.8 6.00 736 454 A 19 ILE HA A 20 TYR HE% 1.0 1.8 6.00 737 455 A 19 ILE HB A 20 TYR H 1.0 1.8 3.50 738 456 A 19 ILE HB A 20 TYR HD% 1.0 1.8 4.75 739 457 A 19 ILE HB A 20 TYR HE% 1.0 1.8 4.75 740 458 A 19 ILE HG2% A 20 TYR H 1.0 1.8 6.00 741 459 A 19 ILE HG2% A 20 TYR HA 1.0 1.8 6.00 742 460 A 19 ILE HG2% A 20 TYR HB3 1.0 1.8 6.00 743 461 A 19 ILE HG2% A 20 TYR HB2 1.0 1.8 6.00 744 462 A 19 ILE HG2% A 20 TYR HD% 1.0 1.8 4.75 745 463 A 19 ILE HG2% A 20 TYR HE% 1.0 1.8 4.75 746 464 A 19 ILE HD1% A 20 TYR H 1.0 1.8 6.00 747 465 A 19 ILE HD1% A 20 TYR HD% 1.0 1.8 6.00 748 466 A 19 ILE HD1% A 20 TYR HE% 1.0 1.8 6.00 749 467 A 20 TYR H A 19 ILE HG1y 1.0 1.8 4.75 750 467 A 19 ILE HG1x A 20 TYR H 1.0 1.8 4.75 751 468 A 20 TYR HD% A 19 ILE HG1y 1.0 1.8 4.75 752 468 A 19 ILE HG1x A 20 TYR HD% 1.0 1.8 4.75 753 469 A 20 TYR HE% A 19 ILE HG1y 1.0 1.8 6.00 754 469 A 19 ILE HG1x A 20 TYR HE% 1.0 1.8 6.00 755 470 A 20 TYR H A 21 GLY H 1.0 1.8 3.50 756 471 A 20 TYR H A 21 GLY HAy 1.0 1.8 4.75 757 471 A 20 TYR H A 21 GLY HAx 1.0 1.8 4.75 758 472 A 20 TYR HA A 21 GLY H 1.0 1.8 4.75 759 473 A 20 TYR HB3 A 21 GLY H 1.0 1.8 4.75 760 474 A 20 TYR HB2 A 21 GLY H 1.0 1.8 4.75 761 475 A 20 TYR HD% A 21 GLY H 1.0 1.8 4.75 762 476 A 21 GLY H A 22 TYR H 1.0 1.8 3.50 763 477 A 21 GLY H A 22 TYR HA 1.0 1.8 6.00 764 478 A 22 TYR H A 21 GLY HAy 1.0 1.8 4.75 765 478 A 21 GLY HAx A 22 TYR H 1.0 1.8 4.75 766 479 A 22 TYR HD% A 21 GLY HAy 1.0 1.8 6.00 767 479 A 21 GLY HAx A 22 TYR HD% 1.0 1.8 6.00 768 480 A 22 TYR HE% A 21 GLY HAy 1.0 1.8 6.00 769 480 A 21 GLY HAx A 22 TYR HE% 1.0 1.8 6.00 770 481 A 22 TYR H A 23 CYS H 1.0 1.8 6.00 771 482 A 22 TYR HA A 23 CYS H 1.0 1.8 3.50 772 483 A 22 TYR HB3 A 23 CYS H 1.0 1.8 4.75 773 484 A 22 TYR HB2 A 23 CYS H 1.0 1.8 3.50 774 485 A 22 TYR HD% A 23 CYS H 1.0 1.8 4.75 775 486 A 22 TYR HE% A 23 CYS H 1.0 1.8 6.00 776 487 A 23 CYS HA A 24 LYS H 1.0 1.8 6.00 777 488 A 24 LYS H A 23 CYS HBx 1.0 1.8 4.75 778 488 A 23 CYS HBy A 24 LYS H 1.0 1.8 4.75 779 489 A 24 LYS H A 25 LYS H 1.0 1.8 6.00 780 490 A 24 LYS HA A 25 LYS H 1.0 1.8 6.00 781 491 A 25 LYS H A 24 LYS HBy 1.0 1.8 4.75 782 491 A 24 LYS HBx A 25 LYS H 1.0 1.8 4.75 783 492 A 25 LYS H A 26 GLU H 1.0 1.8 3.50 784 493 A 25 LYS HA A 26 GLU H 1.0 1.8 4.75 785 494 A 25 LYS HB3 A 26 GLU H 1.0 1.8 4.75 786 495 A 26 GLU H A 25 LYS HGy 1.0 1.8 6.00 787 495 A 25 LYS HGx A 26 GLU H 1.0 1.8 6.00 788 496 A 26 GLU H A 27 LYS H 1.0 1.8 4.75 789 497 A 26 GLU HA A 27 LYS H 1.0 1.8 6.00 790 498 A 27 LYS H A 26 GLU HBy 1.0 1.8 6.00 791 498 A 26 GLU HBx A 27 LYS H 1.0 1.8 6.00 792 499 A 27 LYS H A 28 GLU H 1.0 1.8 4.75 793 500 A 27 LYS HA A 28 GLU H 1.0 1.8 4.75 794 501 A 27 LYS HB3 A 28 GLU H 1.0 1.8 4.75 795 502 A 27 LYS HB2 A 28 GLU H 1.0 1.8 4.75 796 503 A 28 GLU H A 27 LYS HGx 1.0 1.8 6.00 797 503 A 27 LYS HGy A 28 GLU H 1.0 1.8 6.00 798 504 A 28 GLU H A 29 GLY H 1.0 1.8 4.75 799 505 A 28 GLU H A 29 GLY HAy 1.0 1.8 6.00 800 505 A 28 GLU H A 29 GLY HAx 1.0 1.8 6.00 801 506 A 28 GLU HA A 29 GLY H 1.0 1.8 4.75 802 507 A 28 GLU HB2 A 29 GLY H 1.0 1.8 4.75 803 508 A 29 GLY H A 28 GLU HGx 1.0 1.8 6.00 804 508 A 28 GLU HGy A 29 GLY H 1.0 1.8 6.00 805 509 A 29 GLY H A 30 CYS H 1.0 1.8 4.75 806 510 A 30 CYS H A 29 GLY HAy 1.0 1.8 4.75 807 510 A 29 GLY HAx A 30 CYS H 1.0 1.8 4.75 808 511 A 30 CYS H A 31 PRO HDx 1.0 1.8 4.75 809 511 A 30 CYS H A 31 PRO HDy 1.0 1.8 4.75 810 512 A 30 CYS HA A 31 PRO HDx 1.0 1.8 3.50 811 512 A 30 CYS HA A 31 PRO HDy 1.0 1.8 3.50 812 513 A 30 CYS HB3 A 31 PRO HDx 1.0 1.8 6.00 813 513 A 30 CYS HB3 A 31 PRO HDy 1.0 1.8 6.00 814 514 A 30 CYS HB2 A 31 PRO HDx 1.0 1.8 4.75 815 514 A 30 CYS HB2 A 31 PRO HDy 1.0 1.8 4.75 816 515 A 32 PHE H A 31 PRO HA 1.0 1.8 4.75 817 516 A 32 PHE HD% A 31 PRO HA 1.0 1.8 6.00 818 517 A 32 PHE HE% A 31 PRO HA 1.0 1.8 6.00 819 518 A 32 PHE H A 31 PRO HBx 1.0 1.8 6.00 820 518 A 32 PHE H A 31 PRO HBy 1.0 1.8 6.00 821 519 A 32 PHE HD% A 31 PRO HBx 1.0 1.8 4.75 822 519 A 32 PHE HD% A 31 PRO HBy 1.0 1.8 4.75 823 520 A 32 PHE HE% A 31 PRO HBx 1.0 1.8 6.00 824 520 A 32 PHE HE% A 31 PRO HBy 1.0 1.8 6.00 825 521 A 32 PHE H A 31 PRO HGx 1.0 1.8 4.75 826 521 A 32 PHE H A 31 PRO HGy 1.0 1.8 4.75 827 522 A 32 PHE HA A 31 PRO HGx 1.0 1.8 6.00 828 522 A 32 PHE HA A 31 PRO HGy 1.0 1.8 6.00 829 523 A 32 PHE HZ A 31 PRO HGx 1.0 1.8 6.00 830 523 A 31 PRO HGy A 32 PHE HZ 1.0 1.8 6.00 831 524 A 32 PHE HD% A 31 PRO HGx 1.0 1.8 4.75 832 524 A 32 PHE HD% A 31 PRO HGy 1.0 1.8 4.75 833 525 A 32 PHE HE% A 31 PRO HGx 1.0 1.8 4.75 834 525 A 32 PHE HE% A 31 PRO HGy 1.0 1.8 4.75 835 526 A 32 PHE H A 31 PRO HDx 1.0 1.8 6.00 836 526 A 32 PHE H A 31 PRO HDy 1.0 1.8 6.00 837 527 A 32 PHE HD% A 31 PRO HDx 1.0 1.8 4.75 838 527 A 32 PHE HD% A 31 PRO HDy 1.0 1.8 4.75 839 528 A 32 PHE HE% A 31 PRO HDx 1.0 1.8 4.75 840 528 A 32 PHE HE% A 31 PRO HDy 1.0 1.8 4.75 841 529 A 32 PHE H A 33 LYS H 1.0 1.8 4.75 842 530 A 32 PHE HA A 33 LYS H 1.0 1.8 4.75 843 531 A 32 PHE HA A 33 LYS HBy 1.0 1.8 6.00 844 531 A 32 PHE HA A 33 LYS HBx 1.0 1.8 6.00 845 532 A 32 PHE HA A 33 LYS HGx 1.0 1.8 6.00 846 532 A 32 PHE HA A 33 LYS HGy 1.0 1.8 6.00 847 533 A 33 LYS H A 32 PHE HBx 1.0 1.8 3.50 848 533 A 32 PHE HBy A 33 LYS H 1.0 1.8 3.50 849 534 A 32 PHE HD% A 33 LYS H 1.0 1.8 3.50 850 535 A 32 PHE HD% A 33 LYS HBy 1.0 1.8 6.00 851 535 A 32 PHE HD% A 33 LYS HBx 1.0 1.8 6.00 852 536 A 33 LYS H A 34 HIS H 1.0 1.8 6.00 853 537 A 33 LYS H A 34 HIS HE1 1.0 1.8 6.00 854 538 A 33 LYS HA A 34 HIS H 1.0 1.8 4.75 855 539 A 33 LYS HA A 34 HIS HE1 1.0 1.8 6.00 856 540 A 34 HIS H A 33 LYS HBy 1.0 1.8 6.00 857 540 A 33 LYS HBx A 34 HIS H 1.0 1.8 6.00 858 541 A 34 HIS HA A 33 LYS HBy 1.0 1.8 6.00 859 541 A 33 LYS HBx A 34 HIS HA 1.0 1.8 6.00 860 542 A 34 HIS H A 33 LYS HGx 1.0 1.8 6.00 861 542 A 33 LYS HGy A 34 HIS H 1.0 1.8 6.00 862 543 A 34 HIS H A 33 LYS HDx 1.0 1.8 6.00 863 543 A 33 LYS HDy A 34 HIS H 1.0 1.8 6.00 864 544 A 34 HIS HA A 35 SER H 1.0 1.8 6.00 865 545 A 35 SER HA A 36 ASP H 1.0 1.8 4.75 866 546 A 36 ASP H A 35 SER HBx 1.0 1.8 6.00 867 546 A 35 SER HBy A 36 ASP H 1.0 1.8 6.00 868 547 A 36 ASP HA A 37 ASN H 1.0 1.8 6.00 869 548 A 37 ASN H A 36 ASP HBy 1.0 1.8 6.00 870 548 A 36 ASP HBx A 37 ASN H 1.0 1.8 6.00 871 549 A 37 ASN HA A 38 THR H 1.0 1.8 6.00 872 550 A 38 THR HA A 39 THR H 1.0 1.8 4.75 873 551 A 39 THR HA A 40 ALA H 1.0 1.8 4.75 874 552 A 40 ALA HA A 41 THR H 1.0 1.8 4.75 875 553 A 2 ASP H A 4 ILE HG2% 1.0 1.8 6.00 876 554 A 2 ASP HA A 4 ILE HG2% 1.0 1.8 6.00 877 555 A 4 ILE H A 6 PRO HDy 1.0 1.8 6.00 878 555 A 4 ILE H A 6 PRO HDx 1.0 1.8 6.00 879 556 A 4 ILE HG2% A 6 PRO HA 1.0 1.8 6.00 880 557 A 4 ILE HD1% A 6 PRO HA 1.0 1.8 6.00 881 558 A 5 ASN HA A 7 ASP H 1.0 1.8 6.00 882 559 A 5 ASN HD21 A 7 ASP H 1.0 1.8 6.00 883 560 A 5 ASN HD21 A 7 ASP HBx 1.0 1.8 6.00 884 560 A 5 ASN HD21 A 7 ASP HBy 1.0 1.8 6.00 885 561 A 7 ASP H A 5 ASN HBy 1.0 1.8 6.00 886 561 A 5 ASN HBx A 7 ASP H 1.0 1.8 6.00 887 562 A 8 TRP H A 6 PRO HA 1.0 1.8 4.75 888 563 A 8 TRP HD1 A 6 PRO HA 1.0 1.8 4.75 889 564 A 8 TRP HE1 A 6 PRO HA 1.0 1.8 6.00 890 565 A 8 TRP H A 6 PRO HBx 1.0 1.8 6.00 891 565 A 8 TRP H A 6 PRO HBy 1.0 1.8 6.00 892 566 A 8 TRP HD1 A 6 PRO HBx 1.0 1.8 6.00 893 566 A 8 TRP HD1 A 6 PRO HBy 1.0 1.8 6.00 894 567 A 8 TRP HE1 A 6 PRO HBx 1.0 1.8 6.00 895 567 A 8 TRP HE1 A 6 PRO HBy 1.0 1.8 6.00 896 568 A 8 TRP H A 6 PRO HGx 1.0 1.8 6.00 897 568 A 8 TRP H A 6 PRO HGy 1.0 1.8 6.00 898 569 A 8 TRP HE1 A 6 PRO HGx 1.0 1.8 6.00 899 569 A 8 TRP HE1 A 6 PRO HGy 1.0 1.8 6.00 900 570 A 8 TRP H A 6 PRO HDy 1.0 1.8 6.00 901 570 A 8 TRP H A 6 PRO HDx 1.0 1.8 6.00 902 571 A 7 ASP H A 9 ALA H 1.0 1.8 4.75 903 572 A 7 ASP H A 9 ALA HB% 1.0 1.8 6.00 904 573 A 8 TRP H A 10 LYS H 1.0 1.8 4.75 905 574 A 8 TRP H A 10 LYS HBx 1.0 1.8 6.00 906 574 A 8 TRP H A 10 LYS HBy 1.0 1.8 6.00 907 575 A 8 TRP HA A 10 LYS H 1.0 1.8 4.75 908 576 A 8 TRP HE3 A 10 LYS H 1.0 1.8 6.00 909 577 A 10 LYS H A 8 TRP HBx 1.0 1.8 6.00 910 577 A 8 TRP HBy A 10 LYS H 1.0 1.8 6.00 911 578 A 9 ALA HA A 11 ASP H 1.0 1.8 4.75 912 579 A 10 LYS H A 12 ILE H 1.0 1.8 6.00 913 580 A 10 LYS H A 12 ILE HD1% 1.0 1.8 6.00 914 581 A 10 LYS HA A 12 ILE H 1.0 1.8 4.75 915 582 A 12 ILE H A 10 LYS HGx 1.0 1.8 6.00 916 582 A 10 LYS HGy A 12 ILE H 1.0 1.8 6.00 917 583 A 12 ILE HG2% A 14 CYS H 1.0 1.8 6.00 918 584 A 12 ILE HG2% A 14 CYS HA 1.0 1.8 6.00 919 585 A 14 CYS H A 16 ASN H 1.0 1.8 6.00 920 586 A 14 CYS HA A 16 ASN H 1.0 1.8 4.75 921 587 A 14 CYS HB3 A 16 ASN H 1.0 1.8 6.00 922 588 A 14 CYS HB2 A 16 ASN H 1.0 1.8 6.00 923 589 A 15 ARG H A 17 ILE H 1.0 1.8 6.00 924 590 A 15 ARG HA A 17 ILE H 1.0 1.8 4.75 925 591 A 17 ILE H A 15 ARG HBx 1.0 1.8 6.00 926 591 A 15 ARG HBy A 17 ILE H 1.0 1.8 6.00 927 592 A 17 ILE H A 15 ARG HGx 1.0 1.8 6.00 928 592 A 15 ARG HGy A 17 ILE H 1.0 1.8 6.00 929 593 A 16 ASN H A 18 THR H 1.0 1.8 6.00 930 594 A 16 ASN H A 18 THR HB 1.0 1.8 6.00 931 595 A 16 ASN H A 18 THR HG2% 1.0 1.8 6.00 932 596 A 16 ASN HA A 18 THR H 1.0 1.8 6.00 933 597 A 16 ASN HA A 18 THR HG2% 1.0 1.8 6.00 934 598 A 18 THR H A 16 ASN HBx 1.0 1.8 4.75 935 598 A 16 ASN HBy A 18 THR H 1.0 1.8 4.75 936 599 A 17 ILE H A 19 ILE H 1.0 1.8 4.75 937 600 A 17 ILE HA A 19 ILE H 1.0 1.8 4.75 938 601 A 17 ILE HB A 19 ILE H 1.0 1.8 6.00 939 602 A 17 ILE HG2% A 19 ILE H 1.0 1.8 6.00 940 603 A 18 THR H A 20 TYR H 1.0 1.8 6.00 941 604 A 18 THR HA A 20 TYR H 1.0 1.8 6.00 942 605 A 18 THR HB A 20 TYR H 1.0 1.8 6.00 943 606 A 18 THR HG2% A 20 TYR H 1.0 1.8 6.00 944 607 A 19 ILE HA A 21 GLY H 1.0 1.8 4.75 945 608 A 19 ILE HB A 21 GLY H 1.0 1.8 4.75 946 609 A 19 ILE HG2% A 21 GLY H 1.0 1.8 6.00 947 610 A 19 ILE HD1% A 21 GLY H 1.0 1.8 6.00 948 611 A 21 GLY H A 19 ILE HG1y 1.0 1.8 6.00 949 611 A 19 ILE HG1x A 21 GLY H 1.0 1.8 6.00 950 612 A 20 TYR H A 22 TYR H 1.0 1.8 4.75 951 613 A 20 TYR HA A 22 TYR H 1.0 1.8 6.00 952 614 A 20 TYR HA A 22 TYR HE% 1.0 1.8 6.00 953 615 A 20 TYR HB3 A 22 TYR H 1.0 1.8 3.50 954 616 A 20 TYR HD% A 22 TYR HE% 1.0 1.8 4.75 955 617 A 23 CYS HA A 25 LYS H 1.0 1.8 6.00 956 618 A 25 LYS H A 23 CYS HBx 1.0 1.8 4.75 957 618 A 23 CYS HBy A 25 LYS H 1.0 1.8 4.75 958 619 A 26 GLU HA A 28 GLU H 1.0 1.8 4.75 959 620 A 28 GLU H A 30 CYS H 1.0 1.8 3.50 960 621 A 28 GLU HB3 A 30 CYS H 1.0 1.8 6.00 961 622 A 28 GLU HB2 A 30 CYS H 1.0 1.8 4.75 962 623 A 32 PHE H A 34 HIS HE1 1.0 1.8 3.50 963 624 A 32 PHE HA A 34 HIS HE1 1.0 1.8 6.00 964 625 A 34 HIS HE1 A 32 PHE HBx 1.0 1.8 6.00 965 625 A 32 PHE HBy A 34 HIS HE1 1.0 1.8 6.00 966 626 A 32 PHE HD% A 34 HIS HE1 1.0 1.8 6.00 967 627 A 35 SER H A 33 LYS HGx 1.0 1.8 4.75 968 627 A 33 LYS HGy A 35 SER H 1.0 1.8 4.75 969 628 A 5 ASN H A 8 TRP H 1.0 1.8 6.00 970 629 A 5 ASN H A 8 TRP HD1 1.0 1.8 6.00 971 630 A 5 ASN H A 8 TRP HBx 1.0 1.8 6.00 972 630 A 5 ASN H A 8 TRP HBy 1.0 1.8 6.00 973 631 A 5 ASN HA A 8 TRP H 1.0 1.8 6.00 974 632 A 5 ASN HA A 8 TRP HBx 1.0 1.8 6.00 975 632 A 5 ASN HA A 8 TRP HBy 1.0 1.8 6.00 976 633 A 8 TRP H A 5 ASN HBy 1.0 1.8 4.75 977 633 A 5 ASN HBx A 8 TRP H 1.0 1.8 4.75 978 634 A 8 TRP HD1 A 5 ASN HBy 1.0 1.8 4.75 979 634 A 5 ASN HBx A 8 TRP HD1 1.0 1.8 4.75 980 635 A 5 ASN HBy A 8 TRP HBx 1.0 1.8 4.75 981 635 A 5 ASN HBx A 8 TRP HBx 1.0 1.8 4.75 982 635 A 8 TRP HBy A 5 ASN HBy 1.0 1.8 4.75 983 635 A 5 ASN HBx A 8 TRP HBy 1.0 1.8 4.75 984 636 A 9 ALA HB% A 6 PRO HA 1.0 1.8 4.75 985 637 A 9 ALA HB% A 6 PRO HBx 1.0 1.8 6.00 986 637 A 9 ALA HB% A 6 PRO HBy 1.0 1.8 6.00 987 638 A 9 ALA HB% A 6 PRO HGx 1.0 1.8 6.00 988 638 A 9 ALA HB% A 6 PRO HGy 1.0 1.8 6.00 989 639 A 7 ASP H A 10 LYS H 1.0 1.8 6.00 990 640 A 7 ASP H A 10 LYS HEx 1.0 1.8 6.00 991 640 A 7 ASP H A 10 LYS HEy 1.0 1.8 6.00 992 641 A 7 ASP HA A 10 LYS H 1.0 1.8 4.75 993 642 A 7 ASP HA A 10 LYS HBx 1.0 1.8 4.75 994 642 A 7 ASP HA A 10 LYS HBy 1.0 1.8 4.75 995 643 A 7 ASP HA A 10 LYS HDx 1.0 1.8 4.75 996 643 A 7 ASP HA A 10 LYS HDy 1.0 1.8 4.75 997 644 A 7 ASP HA A 10 LYS HEx 1.0 1.8 4.75 998 644 A 7 ASP HA A 10 LYS HEy 1.0 1.8 4.75 999 645 A 10 LYS H A 7 ASP HBx 1.0 1.8 6.00 1000 645 A 7 ASP HBy A 10 LYS H 1.0 1.8 6.00 1001 646 A 9 ALA HA A 12 ILE H 1.0 1.8 4.75 1002 647 A 9 ALA HA A 12 ILE HB 1.0 1.8 4.75 1003 648 A 9 ALA HA A 12 ILE HG2% 1.0 1.8 6.00 1004 649 A 9 ALA HA A 12 ILE HD1% 1.0 1.8 4.75 1005 650 A 9 ALA HA A 12 ILE HG1y 1.0 1.8 4.75 1006 650 A 9 ALA HA A 12 ILE HG1x 1.0 1.8 4.75 1007 651 A 9 ALA HB% A 12 ILE H 1.0 1.8 6.00 1008 652 A 9 ALA HB% A 12 ILE HB 1.0 1.8 6.00 1009 653 A 9 ALA HB% A 12 ILE HD1% 1.0 1.8 6.00 1010 654 A 9 ALA HB% A 12 ILE HG1y 1.0 1.8 6.00 1011 654 A 9 ALA HB% A 12 ILE HG1x 1.0 1.8 6.00 1012 655 A 12 ILE HG2% A 15 ARG H 1.0 1.8 6.00 1013 656 A 14 CYS H A 17 ILE H 1.0 1.8 6.00 1014 657 A 14 CYS H A 17 ILE HB 1.0 1.8 6.00 1015 658 A 14 CYS H A 17 ILE HG2% 1.0 1.8 6.00 1016 659 A 14 CYS H A 17 ILE HD1% 1.0 1.8 6.00 1017 660 A 14 CYS HA A 17 ILE H 1.0 1.8 6.00 1018 661 A 14 CYS HA A 17 ILE HD1% 1.0 1.8 6.00 1019 662 A 14 CYS HB3 A 17 ILE H 1.0 1.8 4.75 1020 663 A 14 CYS HB3 A 17 ILE HG2% 1.0 1.8 6.00 1021 664 A 14 CYS HB3 A 17 ILE HD1% 1.0 1.8 6.00 1022 665 A 14 CYS HB3 A 17 ILE HG1x 1.0 1.8 4.75 1023 665 A 14 CYS HB3 A 17 ILE HG1y 1.0 1.8 4.75 1024 666 A 14 CYS HB2 A 17 ILE H 1.0 1.8 4.75 1025 667 A 14 CYS HB2 A 17 ILE HD1% 1.0 1.8 4.75 1026 668 A 15 ARG H A 18 THR H 1.0 1.8 6.00 1027 669 A 15 ARG HA A 18 THR H 1.0 1.8 4.75 1028 670 A 15 ARG HA A 18 THR HB 1.0 1.8 3.50 1029 671 A 15 ARG HA A 18 THR HG2% 1.0 1.8 6.00 1030 672 A 18 THR H A 15 ARG HBx 1.0 1.8 4.75 1031 672 A 15 ARG HBy A 18 THR H 1.0 1.8 4.75 1032 673 A 18 THR HB A 15 ARG HBx 1.0 1.8 4.75 1033 673 A 15 ARG HBy A 18 THR HB 1.0 1.8 4.75 1034 674 A 18 THR HG2% A 15 ARG HBx 1.0 1.8 6.00 1035 674 A 15 ARG HBy A 18 THR HG2% 1.0 1.8 6.00 1036 675 A 18 THR H A 15 ARG HGx 1.0 1.8 6.00 1037 675 A 15 ARG HGy A 18 THR H 1.0 1.8 6.00 1038 676 A 18 THR HB A 15 ARG HGx 1.0 1.8 6.00 1039 676 A 15 ARG HGy A 18 THR HB 1.0 1.8 6.00 1040 677 A 16 ASN H A 19 ILE H 1.0 1.8 6.00 1041 678 A 16 ASN H A 19 ILE HB 1.0 1.8 6.00 1042 679 A 16 ASN H A 19 ILE HG2% 1.0 1.8 6.00 1043 680 A 16 ASN H A 19 ILE HD1% 1.0 1.8 6.00 1044 681 A 16 ASN HA A 19 ILE H 1.0 1.8 6.00 1045 682 A 16 ASN HA A 19 ILE HA 1.0 1.8 6.00 1046 683 A 16 ASN HA A 19 ILE HB 1.0 1.8 4.75 1047 684 A 16 ASN HA A 19 ILE HG2% 1.0 1.8 6.00 1048 685 A 16 ASN HA A 19 ILE HD1% 1.0 1.8 6.00 1049 686 A 16 ASN HA A 19 ILE HG1y 1.0 1.8 6.00 1050 686 A 16 ASN HA A 19 ILE HG1x 1.0 1.8 6.00 1051 687 A 17 ILE HA A 20 TYR H 1.0 1.8 4.75 1052 688 A 17 ILE HA A 20 TYR HB3 1.0 1.8 6.00 1053 689 A 17 ILE HA A 20 TYR HB2 1.0 1.8 4.75 1054 690 A 17 ILE HG2% A 20 TYR H 1.0 1.8 6.00 1055 691 A 18 THR H A 21 GLY H 1.0 1.8 6.00 1056 692 A 18 THR HA A 21 GLY H 1.0 1.8 4.75 1057 693 A 18 THR HG2% A 21 GLY H 1.0 1.8 6.00 1058 694 A 19 ILE H A 22 TYR H 1.0 1.8 6.00 1059 695 A 19 ILE HG2% A 22 TYR H 1.0 1.8 6.00 1060 696 A 19 ILE HG2% A 22 TYR HE% 1.0 1.8 6.00 1061 697 A 20 TYR HD% A 23 CYS HA 1.0 1.8 4.75 1062 698 A 22 TYR HD% A 25 LYS HGy 1.0 1.8 6.00 1063 698 A 22 TYR HD% A 25 LYS HGx 1.0 1.8 6.00 1064 699 A 22 TYR HD% A 25 LYS HDx 1.0 1.8 6.00 1065 699 A 22 TYR HD% A 25 LYS HDy 1.0 1.8 6.00 1066 700 A 22 TYR HE% A 25 LYS HGy 1.0 1.8 4.75 1067 700 A 22 TYR HE% A 25 LYS HGx 1.0 1.8 4.75 1068 701 A 22 TYR HE% A 25 LYS HDx 1.0 1.8 4.75 1069 701 A 22 TYR HE% A 25 LYS HDy 1.0 1.8 4.75 1070 702 A 23 CYS H A 26 GLU H 1.0 1.8 6.00 1071 703 A 23 CYS H A 26 GLU HBy 1.0 1.8 4.75 1072 703 A 23 CYS H A 26 GLU HBx 1.0 1.8 4.75 1073 704 A 23 CYS H A 26 GLU HGx 1.0 1.8 6.00 1074 704 A 23 CYS H A 26 GLU HGy 1.0 1.8 6.00 1075 705 A 23 CYS HA A 26 GLU H 1.0 1.8 4.75 1076 706 A 26 GLU H A 23 CYS HBx 1.0 1.8 4.75 1077 706 A 23 CYS HBy A 26 GLU H 1.0 1.8 4.75 1078 707 A 23 CYS HBy A 26 GLU HBy 1.0 1.8 3.50 1079 707 A 23 CYS HBx A 26 GLU HBy 1.0 1.8 3.50 1080 707 A 26 GLU HBx A 23 CYS HBx 1.0 1.8 3.50 1081 707 A 23 CYS HBy A 26 GLU HBx 1.0 1.8 3.50 1082 708 A 25 LYS HA A 28 GLU HB3 1.0 1.8 4.75 1083 709 A 25 LYS HA A 28 GLU HGx 1.0 1.8 4.75 1084 709 A 25 LYS HA A 28 GLU HGy 1.0 1.8 4.75 1085 710 A 25 LYS HB3 A 28 GLU H 1.0 1.8 4.75 1086 711 A 34 HIS HE1 A 31 PRO HA 1.0 1.8 6.00 1087 712 A 34 HIS HE1 A 31 PRO HBx 1.0 1.8 6.00 1088 712 A 34 HIS HE1 A 31 PRO HBy 1.0 1.8 6.00 1089 713 A 34 HIS HE1 A 31 PRO HDx 1.0 1.8 4.75 1090 713 A 34 HIS HE1 A 31 PRO HDy 1.0 1.8 4.75 1091 714 A 4 ILE HB A 8 TRP HE3 1.0 1.8 6.00 1092 715 A 4 ILE HG2% A 8 TRP H 1.0 1.8 6.00 1093 716 A 4 ILE HG2% A 8 TRP HD1 1.0 1.8 6.00 1094 717 A 4 ILE HG2% A 8 TRP HE1 1.0 1.8 6.00 1095 718 A 4 ILE HG2% A 8 TRP HE3 1.0 1.8 4.75 1096 719 A 4 ILE HG2% A 8 TRP HZ3 1.0 1.8 4.75 1097 720 A 4 ILE HG2% A 8 TRP HBx 1.0 1.8 6.00 1098 720 A 4 ILE HG2% A 8 TRP HBy 1.0 1.8 6.00 1099 721 A 4 ILE HD1% A 8 TRP HE1 1.0 1.8 6.00 1100 722 A 5 ASN H A 9 ALA H 1.0 1.8 6.00 1101 723 A 10 LYS H A 6 PRO HA 1.0 1.8 6.00 1102 724 A 8 TRP H A 12 ILE HD1% 1.0 1.8 6.00 1103 725 A 8 TRP HD1 A 12 ILE HD1% 1.0 1.8 6.00 1104 726 A 8 TRP HE1 A 12 ILE HD1% 1.0 1.8 6.00 1105 727 A 8 TRP HE3 A 12 ILE H 1.0 1.8 6.00 1106 728 A 8 TRP HE3 A 12 ILE HD1% 1.0 1.8 4.75 1107 729 A 8 TRP HE3 A 12 ILE HG1y 1.0 1.8 6.00 1108 729 A 8 TRP HE3 A 12 ILE HG1x 1.0 1.8 6.00 1109 730 A 12 ILE HD1% A 8 TRP HZ2 1.0 1.8 6.00 1110 731 A 8 TRP HZ3 A 12 ILE HG2% 1.0 1.8 6.00 1111 732 A 8 TRP HZ3 A 12 ILE HD1% 1.0 1.8 6.00 1112 733 A 12 ILE HG2% A 8 TRP HH2 1.0 1.8 6.00 1113 734 A 12 ILE HD1% A 8 TRP HH2 1.0 1.8 6.00 1114 735 A 12 ILE HG2% A 8 TRP HBx 1.0 1.8 6.00 1115 735 A 8 TRP HBy A 12 ILE HG2% 1.0 1.8 6.00 1116 736 A 12 ILE HD1% A 8 TRP HBx 1.0 1.8 6.00 1117 736 A 8 TRP HBy A 12 ILE HD1% 1.0 1.8 6.00 1118 737 A 17 ILE HD1% A 13 PRO HA 1.0 1.8 6.00 1119 738 A 13 PRO HA A 17 ILE HG1x 1.0 1.8 4.75 1120 738 A 17 ILE HG1y A 13 PRO HA 1.0 1.8 4.75 1121 739 A 14 CYS HA A 18 THR H 1.0 1.8 6.00 1122 740 A 14 CYS HB2 A 18 THR H 1.0 1.8 6.00 1123 741 A 15 ARG HA A 19 ILE H 1.0 1.8 6.00 1124 742 A 15 ARG HA A 19 ILE HG2% 1.0 1.8 6.00 1125 743 A 15 ARG HA A 19 ILE HD1% 1.0 1.8 6.00 1126 744 A 19 ILE H A 15 ARG HBx 1.0 1.8 6.00 1127 744 A 15 ARG HBy A 19 ILE H 1.0 1.8 6.00 1128 745 A 19 ILE HB A 15 ARG HBx 1.0 1.8 3.50 1129 745 A 15 ARG HBy A 19 ILE HB 1.0 1.8 3.50 1130 746 A 19 ILE HG2% A 15 ARG HBx 1.0 1.8 6.00 1131 746 A 15 ARG HBy A 19 ILE HG2% 1.0 1.8 6.00 1132 747 A 19 ILE HD1% A 15 ARG HBx 1.0 1.8 6.00 1133 747 A 15 ARG HBy A 19 ILE HD1% 1.0 1.8 6.00 1134 748 A 19 ILE H A 15 ARG HGx 1.0 1.8 6.00 1135 748 A 15 ARG HGy A 19 ILE H 1.0 1.8 6.00 1136 749 A 19 ILE HG2% A 15 ARG HGx 1.0 1.8 6.00 1137 749 A 15 ARG HGy A 19 ILE HG2% 1.0 1.8 6.00 1138 750 A 19 ILE HD1% A 15 ARG HGx 1.0 1.8 4.75 1139 750 A 15 ARG HGy A 19 ILE HD1% 1.0 1.8 4.75 1140 751 A 15 ARG HGx A 19 ILE HG1y 1.0 1.8 6.00 1141 751 A 19 ILE HG1x A 15 ARG HGx 1.0 1.8 6.00 1142 751 A 15 ARG HGy A 19 ILE HG1x 1.0 1.8 6.00 1143 751 A 15 ARG HGy A 19 ILE HG1y 1.0 1.8 6.00 1144 752 A 19 ILE HD1% A 15 ARG HDx 1.0 1.8 6.00 1145 752 A 15 ARG HDy A 19 ILE HD1% 1.0 1.8 6.00 1146 753 A 16 ASN H A 20 TYR H 1.0 1.8 6.00 1147 754 A 16 ASN H A 20 TYR HE% 1.0 1.8 6.00 1148 755 A 16 ASN HA A 20 TYR H 1.0 1.8 4.75 1149 756 A 16 ASN HA A 20 TYR HB3 1.0 1.8 6.00 1150 757 A 16 ASN HA A 20 TYR HB2 1.0 1.8 6.00 1151 758 A 16 ASN HA A 20 TYR HD% 1.0 1.8 3.50 1152 759 A 16 ASN HA A 20 TYR HE% 1.0 1.8 4.75 1153 760 A 16 ASN HD22 A 20 TYR HD% 1.0 1.8 3.50 1154 761 A 20 TYR H A 16 ASN HBx 1.0 1.8 6.00 1155 761 A 16 ASN HBy A 20 TYR H 1.0 1.8 6.00 1156 762 A 20 TYR HD% A 16 ASN HBx 1.0 1.8 3.50 1157 762 A 16 ASN HBy A 20 TYR HD% 1.0 1.8 3.50 1158 763 A 20 TYR HE% A 16 ASN HBx 1.0 1.8 4.75 1159 763 A 16 ASN HBy A 20 TYR HE% 1.0 1.8 4.75 1160 764 A 17 ILE H A 21 GLY HAy 1.0 1.8 6.00 1161 764 A 17 ILE H A 21 GLY HAx 1.0 1.8 6.00 1162 765 A 17 ILE HA A 21 GLY H 1.0 1.8 4.75 1163 766 A 17 ILE HA A 21 GLY HAy 1.0 1.8 4.75 1164 766 A 17 ILE HA A 21 GLY HAx 1.0 1.8 4.75 1165 767 A 17 ILE HB A 21 GLY H 1.0 1.8 6.00 1166 768 A 17 ILE HG2% A 21 GLY H 1.0 1.8 6.00 1167 769 A 17 ILE HG2% A 21 GLY HAy 1.0 1.8 6.00 1168 769 A 17 ILE HG2% A 21 GLY HAx 1.0 1.8 6.00 1169 770 A 17 ILE HD1% A 21 GLY H 1.0 1.8 6.00 1170 771 A 17 ILE HD1% A 21 GLY HAy 1.0 1.8 6.00 1171 771 A 17 ILE HD1% A 21 GLY HAx 1.0 1.8 6.00 1172 772 A 21 GLY H A 17 ILE HG1x 1.0 1.8 6.00 1173 772 A 17 ILE HG1y A 21 GLY H 1.0 1.8 6.00 1174 773 A 26 GLU H A 30 CYS HB3 1.0 1.8 6.00 1175 774 A 26 GLU HA A 30 CYS H 1.0 1.8 4.75 1176 775 A 26 GLU HA A 30 CYS HB3 1.0 1.8 3.50 1177 776 A 26 GLU HA A 30 CYS HB2 1.0 1.8 4.75 1178 777 A 30 CYS H A 26 GLU HBy 1.0 1.8 6.00 1179 777 A 26 GLU HBx A 30 CYS H 1.0 1.8 6.00 1180 778 A 30 CYS HB2 A 26 GLU HBy 1.0 1.8 6.00 1181 778 A 26 GLU HBx A 30 CYS HB2 1.0 1.8 6.00 1182 779 A 30 CYS H A 34 HIS HE1 1.0 1.8 6.00 1183 780 A 30 CYS HA A 34 HIS HE1 1.0 1.8 6.00 1184 781 A 30 CYS HB3 A 34 HIS HE1 1.0 1.8 3.50 1185 782 A 30 CYS HB2 A 34 HIS HE1 1.0 1.8 4.75 1186 783 A 4 ILE HG2% A 9 ALA HA 1.0 1.8 6.00 1187 784 A 4 ILE HG2% A 9 ALA HB% 1.0 1.8 4.75 1188 785 A 4 ILE HD1% A 9 ALA HB% 1.0 1.8 6.00 1189 786 A 8 TRP HE3 A 31 PRO HBx 1.0 1.8 6.00 1190 786 A 8 TRP HE3 A 31 PRO HBy 1.0 1.8 6.00 1191 787 A 8 TRP HZ3 A 32 PHE HD% 1.0 1.8 4.75 1192 788 A 8 TRP HZ3 A 32 PHE HE% 1.0 1.8 3.50 1193 789 A 32 PHE HD% A 8 TRP HH2 1.0 1.8 4.75 1194 790 A 32 PHE HE% A 8 TRP HH2 1.0 1.8 3.50 1195 791 A 9 ALA HB% A 31 PRO HA 1.0 1.8 6.00 1196 792 A 9 ALA HB% A 31 PRO HBx 1.0 1.8 4.75 1197 792 A 9 ALA HB% A 31 PRO HBy 1.0 1.8 4.75 1198 793 A 9 ALA HB% A 31 PRO HGx 1.0 1.8 6.00 1199 793 A 9 ALA HB% A 31 PRO HGy 1.0 1.8 6.00 1200 794 A 9 ALA HB% A 31 PRO HDx 1.0 1.8 6.00 1201 794 A 9 ALA HB% A 31 PRO HDy 1.0 1.8 6.00 1202 795 A 9 ALA HA A 32 PHE HA 1.0 1.8 6.00 1203 796 A 9 ALA HA A 32 PHE HD% 1.0 1.8 4.75 1204 797 A 9 ALA HA A 32 PHE HE% 1.0 1.8 4.75 1205 798 A 9 ALA HB% A 32 PHE H 1.0 1.8 4.75 1206 799 A 9 ALA HB% A 32 PHE HA 1.0 1.8 6.00 1207 800 A 9 ALA HB% A 32 PHE HBx 1.0 1.8 6.00 1208 800 A 9 ALA HB% A 32 PHE HBy 1.0 1.8 6.00 1209 801 A 9 ALA HB% A 32 PHE HD% 1.0 1.8 4.75 1210 802 A 9 ALA HB% A 32 PHE HE% 1.0 1.8 4.75 1211 803 A 9 ALA HB% A 33 LYS H 1.0 1.8 6.00 1212 804 A 9 ALA HB% A 34 HIS HE1 1.0 1.8 6.00 1213 805 A 10 LYS H A 32 PHE HD% 1.0 1.8 6.00 1214 806 A 10 LYS H A 32 PHE HE% 1.0 1.8 6.00 1215 807 A 10 LYS HA A 32 PHE HA 1.0 1.8 4.75 1216 808 A 10 LYS HA A 32 PHE HD% 1.0 1.8 6.00 1217 809 A 10 LYS HA A 33 LYS H 1.0 1.8 6.00 1218 810 A 33 LYS H A 10 LYS HGx 1.0 1.8 4.75 1219 810 A 10 LYS HGy A 33 LYS H 1.0 1.8 4.75 1220 811 A 34 HIS H A 10 LYS HGx 1.0 1.8 6.00 1221 811 A 10 LYS HGy A 34 HIS H 1.0 1.8 6.00 1222 812 A 35 SER H A 10 LYS HGx 1.0 1.8 6.00 1223 812 A 10 LYS HGy A 35 SER H 1.0 1.8 6.00 1224 813 A 11 ASP HA A 33 LYS H 1.0 1.8 6.00 1225 814 A 12 ILE H A 32 PHE HA 1.0 1.8 6.00 1226 815 A 12 ILE H A 32 PHE HD% 1.0 1.8 4.75 1227 816 A 12 ILE H A 32 PHE HE% 1.0 1.8 4.75 1228 817 A 12 ILE HA A 32 PHE HD% 1.0 1.8 4.75 1229 818 A 12 ILE HA A 32 PHE HE% 1.0 1.8 6.00 1230 819 A 12 ILE HB A 32 PHE HA 1.0 1.8 6.00 1231 820 A 12 ILE HB A 32 PHE HZ 1.0 1.8 4.75 1232 821 A 12 ILE HB A 32 PHE HBx 1.0 1.8 6.00 1233 821 A 12 ILE HB A 32 PHE HBy 1.0 1.8 6.00 1234 822 A 12 ILE HB A 32 PHE HD% 1.0 1.8 3.50 1235 823 A 12 ILE HB A 32 PHE HE% 1.0 1.8 3.50 1236 824 A 12 ILE HG2% A 32 PHE HA 1.0 1.8 6.00 1237 825 A 12 ILE HG2% A 32 PHE HZ 1.0 1.8 4.75 1238 826 A 12 ILE HG2% A 32 PHE HBx 1.0 1.8 6.00 1239 826 A 12 ILE HG2% A 32 PHE HBy 1.0 1.8 6.00 1240 827 A 12 ILE HG2% A 32 PHE HD% 1.0 1.8 4.75 1241 828 A 12 ILE HG2% A 32 PHE HE% 1.0 1.8 4.75 1242 829 A 12 ILE HD1% A 32 PHE HD% 1.0 1.8 6.00 1243 830 A 12 ILE HD1% A 32 PHE HE% 1.0 1.8 4.75 1244 831 A 32 PHE HD% A 12 ILE HG1y 1.0 1.8 4.75 1245 831 A 12 ILE HG1x A 32 PHE HD% 1.0 1.8 4.75 1246 832 A 32 PHE HE% A 12 ILE HG1y 1.0 1.8 4.75 1247 832 A 12 ILE HG1x A 32 PHE HE% 1.0 1.8 4.75 1248 833 A 12 ILE H A 33 LYS H 1.0 1.8 4.75 1249 834 A 12 ILE H A 33 LYS HBy 1.0 1.8 4.75 1250 834 A 12 ILE H A 33 LYS HBx 1.0 1.8 4.75 1251 835 A 12 ILE HG2% A 33 LYS H 1.0 1.8 6.00 1252 836 A 18 THR HB A 13 PRO HBx 1.0 1.8 4.75 1253 836 A 18 THR HB A 13 PRO HBy 1.0 1.8 4.75 1254 837 A 13 PRO HA A 32 PHE HBx 1.0 1.8 6.00 1255 837 A 32 PHE HBy A 13 PRO HA 1.0 1.8 6.00 1256 838 A 32 PHE HD% A 13 PRO HA 1.0 1.8 6.00 1257 839 A 14 CYS H A 32 PHE HBx 1.0 1.8 3.50 1258 839 A 14 CYS H A 32 PHE HBy 1.0 1.8 3.50 1259 840 A 14 CYS H A 32 PHE HD% 1.0 1.8 4.75 1260 841 A 14 CYS HA A 32 PHE HBx 1.0 1.8 3.50 1261 841 A 14 CYS HA A 32 PHE HBy 1.0 1.8 3.50 1262 842 A 14 CYS HA A 32 PHE HD% 1.0 1.8 4.75 1263 843 A 14 CYS HA A 32 PHE HE% 1.0 1.8 4.75 1264 844 A 14 CYS HB3 A 32 PHE HBx 1.0 1.8 4.75 1265 844 A 14 CYS HB3 A 32 PHE HBy 1.0 1.8 4.75 1266 845 A 14 CYS HB3 A 32 PHE HD% 1.0 1.8 4.75 1267 846 A 14 CYS HB2 A 32 PHE HBx 1.0 1.8 4.75 1268 846 A 14 CYS HB2 A 32 PHE HBy 1.0 1.8 4.75 1269 847 A 14 CYS HB2 A 32 PHE HD% 1.0 1.8 4.75 1270 848 A 14 CYS HB2 A 32 PHE HE% 1.0 1.8 4.75 1271 849 A 14 CYS H A 34 HIS HA 1.0 1.8 6.00 1272 850 A 14 CYS H A 34 HIS HD2 1.0 1.8 4.75 1273 851 A 14 CYS H A 34 HIS HE1 1.0 1.8 6.00 1274 852 A 14 CYS HA A 34 HIS HD2 1.0 1.8 6.00 1275 853 A 14 CYS HA A 34 HIS HE1 1.0 1.8 6.00 1276 854 A 14 CYS HB3 A 34 HIS HD2 1.0 1.8 4.75 1277 855 A 15 ARG H A 32 PHE HBx 1.0 1.8 6.00 1278 855 A 15 ARG H A 32 PHE HBy 1.0 1.8 6.00 1279 856 A 15 ARG H A 32 PHE HD% 1.0 1.8 4.75 1280 857 A 15 ARG H A 32 PHE HE% 1.0 1.8 6.00 1281 858 A 16 ASN HA A 21 GLY H 1.0 1.8 6.00 1282 859 A 16 ASN H A 23 CYS HBx 1.0 1.8 4.75 1283 859 A 16 ASN H A 23 CYS HBy 1.0 1.8 4.75 1284 860 A 23 CYS H A 16 ASN HBx 1.0 1.8 6.00 1285 860 A 16 ASN HBy A 23 CYS H 1.0 1.8 6.00 1286 861 A 23 CYS HA A 16 ASN HBx 1.0 1.8 4.75 1287 861 A 16 ASN HBy A 23 CYS HA 1.0 1.8 4.75 1288 862 A 16 ASN HBy A 23 CYS HBx 1.0 1.8 3.50 1289 862 A 16 ASN HBx A 23 CYS HBx 1.0 1.8 3.50 1290 862 A 23 CYS HBy A 16 ASN HBx 1.0 1.8 3.50 1291 862 A 16 ASN HBy A 23 CYS HBy 1.0 1.8 3.50 1292 863 A 16 ASN H A 34 HIS HD2 1.0 1.8 6.00 1293 864 A 16 ASN HD22 A 34 HIS HD2 1.0 1.8 6.00 1294 865 A 34 HIS HD2 A 16 ASN HBx 1.0 1.8 4.75 1295 865 A 16 ASN HBy A 34 HIS HD2 1.0 1.8 4.75 1296 866 A 17 ILE H A 22 TYR HA 1.0 1.8 6.00 1297 867 A 17 ILE HA A 22 TYR H 1.0 1.8 3.50 1298 868 A 17 ILE HA A 22 TYR HA 1.0 1.8 4.75 1299 869 A 17 ILE HA A 22 TYR HD% 1.0 1.8 6.00 1300 870 A 17 ILE HB A 22 TYR H 1.0 1.8 6.00 1301 871 A 17 ILE HG2% A 22 TYR H 1.0 1.8 4.75 1302 872 A 17 ILE HG2% A 22 TYR HA 1.0 1.8 6.00 1303 873 A 17 ILE HG2% A 22 TYR HB3 1.0 1.8 6.00 1304 874 A 17 ILE HG2% A 22 TYR HB2 1.0 1.8 6.00 1305 875 A 17 ILE HD1% A 22 TYR H 1.0 1.8 6.00 1306 876 A 17 ILE HD1% A 22 TYR HA 1.0 1.8 6.00 1307 877 A 17 ILE HD1% A 22 TYR HB3 1.0 1.8 6.00 1308 878 A 17 ILE HD1% A 22 TYR HB2 1.0 1.8 6.00 1309 879 A 22 TYR H A 17 ILE HG1x 1.0 1.8 6.00 1310 879 A 17 ILE HG1y A 22 TYR H 1.0 1.8 6.00 1311 880 A 22 TYR HA A 17 ILE HG1x 1.0 1.8 4.75 1312 880 A 17 ILE HG1y A 22 TYR HA 1.0 1.8 4.75 1313 881 A 17 ILE H A 23 CYS H 1.0 1.8 6.00 1314 882 A 17 ILE H A 23 CYS HA 1.0 1.8 4.75 1315 883 A 17 ILE HA A 23 CYS H 1.0 1.8 6.00 1316 884 A 17 ILE HG2% A 23 CYS H 1.0 1.8 6.00 1317 885 A 17 ILE HG2% A 23 CYS HBx 1.0 1.8 6.00 1318 885 A 17 ILE HG2% A 23 CYS HBy 1.0 1.8 6.00 1319 886 A 17 ILE HD1% A 23 CYS H 1.0 1.8 6.00 1320 887 A 17 ILE HD1% A 23 CYS HBx 1.0 1.8 4.75 1321 887 A 17 ILE HD1% A 23 CYS HBy 1.0 1.8 4.75 1322 888 A 23 CYS H A 17 ILE HG1x 1.0 1.8 6.00 1323 888 A 17 ILE HG1y A 23 CYS H 1.0 1.8 6.00 1324 889 A 17 ILE HG1y A 23 CYS HBx 1.0 1.8 4.75 1325 889 A 17 ILE HG1x A 23 CYS HBx 1.0 1.8 4.75 1326 889 A 23 CYS HBy A 17 ILE HG1x 1.0 1.8 4.75 1327 889 A 17 ILE HG1y A 23 CYS HBy 1.0 1.8 4.75 1328 890 A 17 ILE H A 34 HIS HD2 1.0 1.8 4.75 1329 891 A 17 ILE HA A 34 HIS HD2 1.0 1.8 6.00 1330 892 A 17 ILE HB A 34 HIS HD2 1.0 1.8 6.00 1331 893 A 17 ILE HG2% A 34 HIS HA 1.0 1.8 6.00 1332 894 A 17 ILE HG2% A 34 HIS HD2 1.0 1.8 6.00 1333 895 A 17 ILE HD1% A 34 HIS H 1.0 1.8 6.00 1334 896 A 17 ILE HD1% A 34 HIS HA 1.0 1.8 4.75 1335 897 A 17 ILE HD1% A 34 HIS HB3 1.0 1.8 4.75 1336 898 A 17 ILE HD1% A 34 HIS HB2 1.0 1.8 6.00 1337 899 A 17 ILE HD1% A 34 HIS HD2 1.0 1.8 4.75 1338 900 A 17 ILE HD1% A 34 HIS HE1 1.0 1.8 6.00 1339 901 A 34 HIS HA A 17 ILE HG1x 1.0 1.8 6.00 1340 901 A 17 ILE HG1y A 34 HIS HA 1.0 1.8 6.00 1341 902 A 34 HIS HD2 A 17 ILE HG1x 1.0 1.8 4.75 1342 902 A 17 ILE HG1y A 34 HIS HD2 1.0 1.8 4.75 1343 903 A 34 HIS HE1 A 17 ILE HG1x 1.0 1.8 6.00 1344 903 A 17 ILE HG1y A 34 HIS HE1 1.0 1.8 6.00 1345 904 A 17 ILE HG2% A 35 SER H 1.0 1.8 6.00 1346 905 A 17 ILE HD1% A 35 SER H 1.0 1.8 6.00 1347 906 A 18 THR H A 34 HIS HD2 1.0 1.8 6.00 1348 907 A 22 TYR HA A 34 HIS HD2 1.0 1.8 6.00 1349 908 A 23 CYS H A 34 HIS HD2 1.0 1.8 4.75 1350 909 A 23 CYS HA A 34 HIS HD2 1.0 1.8 6.00 1351 910 A 34 HIS HD2 A 23 CYS HBx 1.0 1.8 3.50 1352 910 A 23 CYS HBy A 34 HIS HD2 1.0 1.8 3.50 1353 911 A 34 HIS HE1 A 23 CYS HBx 1.0 1.8 6.00 1354 911 A 23 CYS HBy A 34 HIS HE1 1.0 1.8 6.00 1355 912 A 25 LYS H A 30 CYS HB3 1.0 1.8 6.00 1356 913 A 25 LYS H A 30 CYS HB2 1.0 1.8 6.00 1357 914 A 25 LYS HA A 30 CYS H 1.0 1.8 6.00 1358 915 A 25 LYS HA A 30 CYS HB3 1.0 1.8 6.00 1359 916 A 25 LYS HA A 30 CYS HB2 1.0 1.8 6.00 1360 917 A 25 LYS HB3 A 30 CYS H 1.0 1.8 4.75 1361 918 A 25 LYS HB3 A 30 CYS HB2 1.0 1.8 4.75 1362 919 A 25 LYS HB2 A 30 CYS H 1.0 1.8 4.75 1363 920 A 25 LYS HB2 A 30 CYS HB3 1.0 1.8 4.75 1364 921 A 25 LYS HB2 A 30 CYS HB2 1.0 1.8 4.75 1365 922 A 30 CYS HB3 A 25 LYS HGy 1.0 1.8 6.00 1366 922 A 25 LYS HGx A 30 CYS HB3 1.0 1.8 6.00 1367 923 A 30 CYS HB2 A 25 LYS HGy 1.0 1.8 6.00 1368 923 A 25 LYS HGx A 30 CYS HB2 1.0 1.8 6.00 1369 924 A 25 LYS H A 34 HIS HD2 1.0 1.8 6.00 1370 925 A 26 GLU H A 34 HIS HD2 1.0 1.8 6.00 1371 926 A 26 GLU HA A 34 HIS HD2 1.0 1.8 4.75 1372 927 A 26 GLU HA A 34 HIS HE1 1.0 1.8 4.75 1373 928 A 34 HIS HD2 A 26 GLU HBy 1.0 1.8 3.50 1374 928 A 26 GLU HBx A 34 HIS HD2 1.0 1.8 3.50 1375 929 A 34 HIS HE1 A 26 GLU HBy 1.0 1.8 4.75 1376 929 A 26 GLU HBx A 34 HIS HE1 1.0 1.8 4.75 1377 930 A 34 HIS HD2 A 26 GLU HGx 1.0 1.8 6.00 1378 930 A 26 GLU HGy A 34 HIS HD2 1.0 1.8 6.00 1379 931 A 34 HIS HE1 A 26 GLU HGx 1.0 1.8 4.75 1380 931 A 26 GLU HGy A 34 HIS HE1 1.0 1.8 4.75 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 undefined _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 14 CYS SG A 23 CYS SG 1.0 3.55 3.95 2 2 A 14 CYS SG A 30 CYS SG 1.0 3.55 3.95 3 3 A 14 CYS SG A 34 HIS NE2 1.0 3.25 3.65 4 4 A 23 CYS SG A 30 CYS SG 1.0 3.55 3.95 5 5 A 23 CYS SG A 34 HIS NE2 1.0 3.25 3.65 6 6 A 30 CYS SG A 34 HIS NE2 1.0 3.25 3.65 stop_ save_ save_CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type 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 11 ASP H A 8 TRP O 1.0 1.8 2.1 2 2 A 8 TRP O A 11 ASP N 1.0 2.7 3.1 3 3 A 12 ILE H A 9 ALA O 1.0 1.8 2.1 4 4 A 9 ALA O A 12 ILE N 1.0 2.7 3.1 5 5 A 20 TYR H A 16 ASN O 1.0 1.8 2.1 6 6 A 16 ASN O A 20 TYR N 1.0 2.7 3.1 7 7 A 21 GLY H A 16 ASN O 1.0 1.8 2.1 8 8 A 16 ASN O A 21 GLY N 1.0 2.7 3.1 stop_ save_ save_CNS/XPLOR_dihedral_5 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_5 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 14 CYS N A 14 CYS CA A 14 CYS CB A 14 CYS SG 1.0 135.0 225.0 CHI1 2 2 A 20 TYR N A 20 TYR CA A 20 TYR CB A 20 TYR CG 1.0 -105.0 -15.0 CHI1 3 3 A 22 TYR N A 22 TYR CA A 22 TYR CB A 22 TYR CG 1.0 15.0 105.0 CHI1 4 4 A 25 LYS N A 25 LYS CA A 25 LYS CB A 25 LYS CG 1.0 -105.0 -15.0 CHI1 5 5 A 27 LYS N A 27 LYS CA A 27 LYS CB A 27 LYS CG 1.0 -105.0 -15.0 CHI1 6 6 A 28 GLU N A 28 GLU CA A 28 GLU CB A 28 GLU CG 1.0 -105.0 -15.0 CHI1 7 7 A 30 CYS N A 30 CYS CA A 30 CYS CB A 30 CYS SG 1.0 135.0 225.0 CHI1 8 8 A 34 HIS N A 34 HIS CA A 34 HIS CB A 34 HIS CG 1.0 -105.0 -15.0 CHI1 stop_ save_ save_CNS/XPLOR_dihedral_6 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_6 _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 ASP C A 3 LYS N A 3 LYS CA A 3 LYS C 1.0 -113.0 -53.0 PHI 2 2 A 3 LYS C A 4 ILE N A 4 ILE CA A 4 ILE C 1.0 -154.0 -58.0 PHI 3 3 A 4 ILE C A 5 ASN N A 5 ASN CA A 5 ASN C 1.0 -105.0 -56.2 PHI 4 4 A 5 ASN C A 6 PRO N A 6 PRO CA A 6 PRO C 1.0 -75.5 -43.3 PHI 5 5 A 6 PRO C A 7 ASP N A 7 ASP CA A 7 ASP C 1.0 -78.7 -55.9 PHI 6 6 A 7 ASP C A 8 TRP N A 8 TRP CA A 8 TRP C 1.0 -87.2 -51.6 PHI 7 7 A 8 TRP C A 9 ALA N A 9 ALA CA A 9 ALA C 1.0 -73.8 -62.6 PHI 8 8 A 9 ALA C A 10 LYS N A 10 LYS CA A 10 LYS C 1.0 -91.9 -46.5 PHI 9 9 A 10 LYS C A 11 ASP N A 11 ASP CA A 11 ASP C 1.0 -114.0 -66.0 PHI 10 10 A 11 ASP C A 12 ILE N A 12 ILE CA A 12 ILE C 1.0 -124.1 -76.1 PHI 11 11 A 12 ILE C A 13 PRO N A 13 PRO CA A 13 PRO C 1.0 -76.3 -47.9 PHI 12 12 A 13 PRO C A 14 CYS N A 14 CYS CA A 14 CYS C 1.0 -87.5 -42.5 PHI 13 13 A 14 CYS C A 15 ARG N A 15 ARG CA A 15 ARG C 1.0 -66.4 -54.6 PHI 14 14 A 15 ARG C A 16 ASN N A 16 ASN CA A 16 ASN C 1.0 -69.9 -50.5 PHI 15 15 A 16 ASN C A 17 ILE N A 17 ILE CA A 17 ILE C 1.0 -71.1 -56.1 PHI 16 16 A 17 ILE C A 18 THR N A 18 THR CA A 18 THR C 1.0 -78.5 -51.5 PHI 17 17 A 18 THR C A 19 ILE N A 19 ILE CA A 19 ILE C 1.0 -99.8 -55.4 PHI 18 18 A 19 ILE C A 20 TYR N A 20 TYR CA A 20 TYR C 1.0 -109.5 -85.9 PHI 19 19 A 20 TYR C A 21 GLY N A 21 GLY CA A 21 GLY C 1.0 47.4 118.2 PHI 20 20 A 21 GLY C A 22 TYR N A 22 TYR CA A 22 TYR C 1.0 -160.0 -94.0 PHI 21 21 A 22 TYR C A 23 CYS N A 23 CYS CA A 23 CYS C 1.0 -120.5 -63.5 PHI 22 22 A 23 CYS C A 24 LYS N A 24 LYS CA A 24 LYS C 1.0 -77.5 -56.5 PHI 23 23 A 24 LYS C A 25 LYS N A 25 LYS CA A 25 LYS C 1.0 -129.4 -80.0 PHI 24 24 A 25 LYS C A 26 GLU N A 26 GLU CA A 26 GLU C 1.0 -78.6 -34.2 PHI 25 25 A 26 GLU C A 27 LYS N A 27 LYS CA A 27 LYS C 1.0 -122.0 -65.6 PHI 26 26 A 27 LYS C A 28 GLU N A 28 GLU CA A 28 GLU C 1.0 -164.0 -56.0 PHI 27 27 A 29 GLY C A 30 CYS N A 30 CYS CA A 30 CYS C 1.0 -99.5 -66.5 PHI 28 28 A 30 CYS C A 31 PRO N A 31 PRO CA A 31 PRO C 1.0 -88.0 -58.0 PHI 29 29 A 32 PHE C A 33 LYS N A 33 LYS CA A 33 LYS C 1.0 -152.5 -59.5 PHI 30 30 A 33 LYS C A 34 HIS N A 34 HIS CA A 34 HIS C 1.0 -127.0 -49.0 PHI 31 31 A 34 HIS C A 35 SER N A 35 SER CA A 35 SER C 1.0 -128.5 -59.5 PHI 32 32 A 3 LYS N A 3 LYS CA A 3 LYS C A 4 ILE N 1.0 90.5 171.5 PSI 33 33 A 4 ILE N A 4 ILE CA A 4 ILE C A 5 ASN N 1.0 100.5 163.5 PSI 34 34 A 5 ASN N A 5 ASN CA A 5 ASN C A 6 PRO N 1.0 104.8 169.8 PSI 35 35 A 6 PRO N A 6 PRO CA A 6 PRO C A 7 ASP N 1.0 -42.0 -16.2 PSI 36 36 A 7 ASP N A 7 ASP CA A 7 ASP C A 8 TRP N 1.0 -29.6 -13.0 PSI 37 37 A 8 TRP N A 8 TRP CA A 8 TRP C A 9 ALA N 1.0 -51.5 -12.9 PSI 38 38 A 9 ALA N A 9 ALA CA A 9 ALA C A 10 LYS N 1.0 -46.1 -19.9 PSI 39 39 A 10 LYS N A 10 LYS CA A 10 LYS C A 11 ASP N 1.0 -41.6 -12.2 PSI 40 40 A 11 ASP N A 11 ASP CA A 11 ASP C A 12 ILE N 1.0 -35.5 9.5 PSI 41 41 A 12 ILE N A 12 ILE CA A 12 ILE C A 13 PRO N 1.0 101.6 150.0 PSI 42 42 A 13 PRO N A 13 PRO CA A 13 PRO C A 14 CYS N 1.0 130.7 163.3 PSI 43 43 A 14 CYS N A 14 CYS CA A 14 CYS C A 15 ARG N 1.0 111.0 135.0 PSI 44 44 A 15 ARG N A 15 ARG CA A 15 ARG C A 16 ASN N 1.0 -54.2 -16.4 PSI 45 45 A 16 ASN N A 16 ASN CA A 16 ASN C A 17 ILE N 1.0 -57.0 -16.4 PSI 46 46 A 17 ILE N A 17 ILE CA A 17 ILE C A 18 THR N 1.0 -49.7 -20.1 PSI 47 47 A 18 THR N A 18 THR CA A 18 THR C A 19 ILE N 1.0 -49.1 -19.9 PSI 48 48 A 19 ILE N A 19 ILE CA A 19 ILE C A 20 TYR N 1.0 -54.5 -28.9 PSI 49 49 A 20 TYR N A 20 TYR CA A 20 TYR C A 21 GLY N 1.0 -28.2 23.6 PSI 50 50 A 21 GLY N A 21 GLY CA A 21 GLY C A 22 TYR N 1.0 -6.9 54.9 PSI 51 51 A 22 TYR N A 22 TYR CA A 22 TYR C A 23 CYS N 1.0 127.0 175.0 PSI 52 52 A 23 CYS N A 23 CYS CA A 23 CYS C A 24 LYS N 1.0 78.5 159.5 PSI 53 53 A 24 LYS N A 24 LYS CA A 24 LYS C A 25 LYS N 1.0 -38.5 12.5 PSI 54 54 A 25 LYS N A 25 LYS CA A 25 LYS C A 26 GLU N 1.0 -25.8 38.2 PSI 55 55 A 26 GLU N A 26 GLU CA A 26 GLU C A 27 LYS N 1.0 -53.4 -17.8 PSI 56 56 A 27 LYS N A 27 LYS CA A 27 LYS C A 28 GLU N 1.0 -41.4 40.8 PSI 57 57 A 28 GLU N A 28 GLU CA A 28 GLU C A 29 GLY N 1.0 138.5 177.5 PSI 58 58 A 30 CYS N A 30 CYS CA A 30 CYS C A 31 PRO N 1.0 104.0 152.0 PSI 59 59 A 31 PRO N A 31 PRO CA A 31 PRO C A 32 PHE N 1.0 133.5 166.5 PSI 60 60 A 33 LYS N A 33 LYS CA A 33 LYS C A 34 HIS N 1.0 96.5 171.5 PSI 61 61 A 34 HIS N A 34 HIS CA A 34 HIS C A 35 SER N 1.0 79.5 190.5 PSI 62 62 A 35 SER N A 35 SER CA A 35 SER C A 36 ASP N 1.0 85.5 160.5 PSI stop_ save_