data_nef_c15536_2jwt 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 1ENH stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly 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 0 ASP middle . . 3 A 1 GLU middle . . 4 A 2 LYS middle . . 5 A 3 ARG middle . . 6 A 4 PRO middle . false 7 A 5 ARG middle . . 8 A 6 THR middle . . 9 A 7 ALA middle . . 10 A 8 PHE middle . . 11 A 9 SER middle . . 12 A 10 SER middle . . 13 A 11 GLU middle . . 14 A 12 GLN middle . . 15 A 13 LEU middle . . 16 A 14 ALA middle . . 17 A 15 ARG middle . . 18 A 16 LEU middle . . 19 A 17 LYS middle . . 20 A 18 ARG middle . . 21 A 19 GLU middle . . 22 A 20 PHE middle . . 23 A 21 ASN middle . . 24 A 22 GLU middle . . 25 A 23 ASN middle . . 26 A 24 ARG middle . . 27 A 25 TYR middle . . 28 A 26 LEU middle . . 29 A 27 THR middle . . 30 A 28 GLU middle . . 31 A 29 ARG middle . . 32 A 30 ARG middle . . 33 A 31 ARG middle . . 34 A 32 GLN middle . . 35 A 33 GLN middle . . 36 A 34 LEU middle . . 37 A 35 SER middle . . 38 A 36 SER middle . . 39 A 37 GLU middle . . 40 A 38 LEU middle . . 41 A 39 GLY middle . false 42 A 40 LEU middle . . 43 A 41 ASN middle . . 44 A 42 GLU middle . . 45 A 43 ALA middle . . 46 A 44 GLN middle . . 47 A 45 ILE middle . . 48 A 46 LYS middle . . 49 A 47 ILE middle . . 50 A 48 TRP middle . . 51 A 49 PHE middle . . 52 A 50 GLN middle . . 53 A 51 ASN middle . . 54 A 52 LYS middle . . 55 A 53 ARG middle . . 56 A 54 ALA middle . . 57 A 55 LYS middle . . 58 A 56 ILE middle . . 59 A 57 LYS middle . . 60 A 58 LYS middle . . 61 A 59 SER end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A -1 MET HA H 1 4.152 0.02 A -1 MET HBx H 1 2.176 0.02 A -1 MET HBy H 1 2.176 0.02 A -1 MET HGy H 1 2.632 0.02 A -1 MET HGx H 1 2.587 0.02 A 0 ASP H H 1 8.953 0.02 A 0 ASP HA H 1 4.657 0.02 A 0 ASP HBy H 1 2.759 0.02 A 0 ASP HBx H 1 2.610 0.02 A 0 ASP CB C 13 40.999 0.10 A 0 ASP N N 15 123.847 0.10 A 1 GLU H H 1 8.780 0.02 A 1 GLU HA H 1 4.253 0.02 A 1 GLU HBx H 1 1.949 0.02 A 1 GLU HBy H 1 2.057 0.02 A 1 GLU HGx H 1 2.317 0.02 A 1 GLU HGy H 1 2.317 0.02 A 1 GLU C C 13 176.839 0.10 A 1 GLU CA C 13 56.847 0.10 A 1 GLU CB C 13 29.872 0.10 A 1 GLU N N 15 122.811 0.10 A 2 LYS H H 1 8.607 0.02 A 2 LYS HA H 1 4.299 0.02 A 2 LYS HBx H 1 1.808 0.02 A 2 LYS HBy H 1 1.808 0.02 A 2 LYS HDx H 1 1.699 0.02 A 2 LYS HDy H 1 1.699 0.02 A 2 LYS HEx H 1 3.010 0.02 A 2 LYS HEy H 1 3.010 0.02 A 2 LYS HGy H 1 1.470 0.02 A 2 LYS HGx H 1 1.404 0.02 A 2 LYS C C 13 176.829 0.10 A 2 LYS CA C 13 56.424 0.10 A 2 LYS CB C 13 32.446 0.10 A 2 LYS N N 15 122.714 0.10 A 3 ARG H H 1 8.396 0.02 A 3 ARG HA H 1 4.634 0.02 A 3 ARG HBy H 1 1.835 0.02 A 3 ARG HBx H 1 1.731 0.02 A 3 ARG HDx H 1 3.218 0.02 A 3 ARG HDy H 1 3.218 0.02 A 3 ARG HGx H 1 1.669 0.02 A 3 ARG HGy H 1 1.669 0.02 A 3 ARG N N 15 123.399 0.10 A 4 PRO HA H 1 4.445 0.02 A 4 PRO HBy H 1 2.315 0.02 A 4 PRO HBx H 1 1.898 0.02 A 4 PRO HDy H 1 3.812 0.02 A 4 PRO HDx H 1 3.631 0.02 A 4 PRO HGx H 1 2.017 0.02 A 4 PRO HGy H 1 2.017 0.02 A 4 PRO C C 13 177.222 0.10 A 4 PRO CA C 13 63.085 0.10 A 4 PRO CB C 13 32.048 0.10 A 4 PRO CD C 13 50.712 0.10 A 5 ARG H H 1 8.700 0.02 A 5 ARG HA H 1 4.361 0.02 A 5 ARG HBy H 1 1.891 0.02 A 5 ARG HBx H 1 1.799 0.02 A 5 ARG HDx H 1 3.228 0.02 A 5 ARG HDy H 1 3.228 0.02 A 5 ARG HE H 1 7.293 0.02 A 5 ARG HGy H 1 1.711 0.02 A 5 ARG HGx H 1 1.655 0.02 A 5 ARG C C 13 176.946 0.10 A 5 ARG CA C 13 56.316 0.10 A 5 ARG CB C 13 30.638 0.10 A 5 ARG N N 15 122.303 0.10 A 6 THR H H 1 8.310 0.02 A 6 THR HA H 1 4.263 0.02 A 6 THR HB H 1 4.105 0.02 A 6 THR HG21 H 1 1.140 0.02 A 6 THR HG22 H 1 1.140 0.02 A 6 THR HG23 H 1 1.140 0.02 A 6 THR C C 13 174.078 0.10 A 6 THR CA C 13 61.801 0.10 A 6 THR CB C 13 70.133 0.10 A 6 THR CG2 C 13 21.720 0.10 A 6 THR N N 15 116.133 0.10 A 7 ALA H H 1 8.347 0.02 A 7 ALA HA H 1 4.303 0.02 A 7 ALA HB1 H 1 1.276 0.02 A 7 ALA HB2 H 1 1.276 0.02 A 7 ALA HB3 H 1 1.276 0.02 A 7 ALA C C 13 177.528 0.10 A 7 ALA CA C 13 52.109 0.10 A 7 ALA CB C 13 19.494 0.10 A 7 ALA N N 15 127.319 0.10 A 8 PHE H H 1 8.251 0.02 A 8 PHE HA H 1 5.004 0.02 A 8 PHE HBx H 1 2.853 0.02 A 8 PHE HBy H 1 3.198 0.02 A 8 PHE HDx H 1 7.038 0.02 A 8 PHE HDy H 1 7.038 0.02 A 8 PHE HEx H 1 7.165 0.02 A 8 PHE HEy H 1 7.165 0.02 A 8 PHE HZ H 1 7.257 0.02 A 8 PHE C C 13 176.686 0.10 A 8 PHE CA C 13 55.506 0.10 A 8 PHE CB C 13 39.870 0.10 A 8 PHE N N 15 119.722 0.10 A 9 SER H H 1 9.349 0.02 A 9 SER HA H 1 4.630 0.02 A 9 SER HBy H 1 4.504 0.02 A 9 SER HBx H 1 3.990 0.02 A 9 SER C C 13 175.438 0.10 A 9 SER CA C 13 56.991 0.10 A 9 SER CB C 13 65.848 0.10 A 9 SER N N 15 119.199 0.10 A 10 SER H H 1 9.343 0.02 A 10 SER HBy H 1 4.178 0.02 A 10 SER HBx H 1 3.969 0.02 A 10 SER C C 13 178.098 0.10 A 10 SER CB C 13 62.481 0.10 A 10 SER N N 15 117.192 0.10 A 11 GLU H H 1 8.843 0.02 A 11 GLU HA H 1 4.151 0.02 A 11 GLU HBy H 1 2.074 0.02 A 11 GLU HBx H 1 1.936 0.02 A 11 GLU HGy H 1 2.387 0.02 A 11 GLU HGx H 1 2.321 0.02 A 11 GLU C C 13 180.063 0.10 A 11 GLU CA C 13 59.953 0.10 A 11 GLU CB C 13 28.873 0.10 A 11 GLU N N 15 122.296 0.10 A 12 GLN H H 1 7.960 0.02 A 12 GLN HA H 1 3.809 0.02 A 12 GLN HBx H 1 2.604 0.02 A 12 GLN HBy H 1 2.656 0.02 A 12 GLN HE2x H 1 6.902 0.02 A 12 GLN HE2y H 1 7.618 0.02 A 12 GLN HGy H 1 2.304 0.02 A 12 GLN HGx H 1 1.457 0.02 A 12 GLN C C 13 178.150 0.10 A 12 GLN CA C 13 59.172 0.10 A 12 GLN CB C 13 27.717 0.10 A 12 GLN N N 15 120.394 0.10 A 12 GLN NE2 N 15 111.409 0.10 A 13 LEU H H 1 8.503 0.02 A 13 LEU HA H 1 3.653 0.02 A 13 LEU HBx H 1 1.572 0.02 A 13 LEU HBy H 1 1.736 0.02 A 13 LEU HDx% H 1 0.976 0.02 A 13 LEU HDy% H 1 0.940 0.02 A 13 LEU HG H 1 1.648 0.02 A 13 LEU C C 13 178.803 0.10 A 13 LEU CA C 13 57.961 0.10 A 13 LEU CB C 13 41.647 0.10 A 13 LEU CD1 C 13 24.701 0.10 A 13 LEU CD2 C 13 24.259 0.10 A 13 LEU N N 15 118.026 0.10 A 14 ALA H H 1 8.123 0.02 A 14 ALA HA H 1 4.047 0.02 A 14 ALA HB1 H 1 1.481 0.02 A 14 ALA HB2 H 1 1.481 0.02 A 14 ALA HB3 H 1 1.481 0.02 A 14 ALA C C 13 181.443 0.10 A 14 ALA CA C 13 55.395 0.10 A 14 ALA CB C 13 17.880 0.10 A 14 ALA N N 15 120.182 0.10 A 15 ARG H H 1 7.604 0.02 A 15 ARG HA H 1 4.134 0.02 A 15 ARG HBx H 1 1.927 0.02 A 15 ARG HBy H 1 1.927 0.02 A 15 ARG HDx H 1 3.252 0.02 A 15 ARG HDy H 1 3.252 0.02 A 15 ARG C C 13 179.008 0.10 A 15 ARG CA C 13 57.875 0.10 A 15 ARG CB C 13 28.601 0.10 A 15 ARG N N 15 118.428 0.10 A 16 LEU H H 1 8.219 0.02 A 16 LEU HA H 1 3.623 0.02 A 16 LEU HBx H 1 0.754 0.02 A 16 LEU HBy H 1 0.754 0.02 A 16 LEU HDx% H 1 -0.479 0.02 A 16 LEU HDy% H 1 0.480 0.02 A 16 LEU HG H 1 1.217 0.02 A 16 LEU C C 13 178.355 0.10 A 16 LEU CA C 13 58.483 0.10 A 16 LEU CB C 13 38.174 0.10 A 16 LEU CD1 C 13 24.576 0.10 A 16 LEU CD2 C 13 22.721 0.10 A 16 LEU N N 15 121.555 0.10 A 17 LYS H H 1 8.317 0.02 A 17 LYS HA H 1 4.004 0.02 A 17 LYS HBy H 1 1.892 0.02 A 17 LYS HBx H 1 1.800 0.02 A 17 LYS HDx H 1 1.951 0.02 A 17 LYS HDy H 1 1.951 0.02 A 17 LYS HEx H 1 2.934 0.02 A 17 LYS HEy H 1 2.934 0.02 A 17 LYS HGx H 1 1.464 0.02 A 17 LYS HGy H 1 1.464 0.02 A 17 LYS C C 13 179.506 0.10 A 17 LYS CA C 13 60.675 0.10 A 17 LYS CB C 13 32.423 0.10 A 17 LYS N N 15 117.890 0.10 A 18 ARG H H 1 7.686 0.02 A 18 ARG HA H 1 4.146 0.02 A 18 ARG HBy H 1 2.025 0.02 A 18 ARG HBx H 1 1.872 0.02 A 18 ARG HDx H 1 3.241 0.02 A 18 ARG HDy H 1 3.241 0.02 A 18 ARG HE H 1 7.422 0.02 A 18 ARG HGx H 1 1.647 0.02 A 18 ARG HGy H 1 1.647 0.02 A 18 ARG C C 13 179.821 0.10 A 18 ARG CA C 13 59.912 0.10 A 18 ARG CB C 13 30.023 0.10 A 18 ARG N N 15 119.470 0.10 A 19 GLU H H 1 8.378 0.02 A 19 GLU HA H 1 4.065 0.02 A 19 GLU HBx H 1 2.321 0.02 A 19 GLU HBy H 1 2.398 0.02 A 19 GLU HGx H 1 2.574 0.02 A 19 GLU HGy H 1 2.574 0.02 A 19 GLU C C 13 179.124 0.10 A 19 GLU CA C 13 59.201 0.10 A 19 GLU CB C 13 28.273 0.10 A 19 GLU N N 15 119.660 0.10 A 20 PHE H H 1 8.982 0.02 A 20 PHE HA H 1 4.367 0.02 A 20 PHE HBy H 1 3.134 0.02 A 20 PHE HBx H 1 2.993 0.02 A 20 PHE HDx H 1 6.936 0.02 A 20 PHE HDy H 1 6.936 0.02 A 20 PHE HEx H 1 7.215 0.02 A 20 PHE HEy H 1 7.215 0.02 A 20 PHE HZ H 1 6.819 0.02 A 20 PHE C C 13 176.515 0.10 A 20 PHE CA C 13 60.961 0.10 A 20 PHE CB C 13 39.299 0.10 A 20 PHE N N 15 121.715 0.10 A 21 ASN H H 1 7.918 0.02 A 21 ASN HA H 1 4.409 0.02 A 21 ASN HBy H 1 2.961 0.02 A 21 ASN HBx H 1 2.918 0.02 A 21 ASN HD2x H 1 7.016 0.02 A 21 ASN HD2y H 1 7.799 0.02 A 21 ASN C C 13 177.312 0.10 A 21 ASN CA C 13 55.293 0.10 A 21 ASN CB C 13 38.419 0.10 A 21 ASN N N 15 114.382 0.10 A 21 ASN ND2 N 15 113.085 0.10 A 22 GLU H H 1 7.652 0.02 A 22 GLU HA H 1 4.196 0.02 A 22 GLU HBx H 1 2.184 0.02 A 22 GLU HBy H 1 2.184 0.02 A 22 GLU HGy H 1 2.516 0.02 A 22 GLU HGx H 1 2.373 0.02 A 22 GLU C C 13 177.269 0.10 A 22 GLU CA C 13 58.256 0.10 A 22 GLU CB C 13 29.707 0.10 A 22 GLU N N 15 119.042 0.10 A 23 ASN H H 1 8.268 0.02 A 23 ASN HA H 1 4.675 0.02 A 23 ASN HBy H 1 2.943 0.02 A 23 ASN HBx H 1 2.876 0.02 A 23 ASN HD2y H 1 7.977 0.02 A 23 ASN HD2x H 1 7.090 0.02 A 23 ASN C C 13 173.730 0.10 A 23 ASN CA C 13 53.434 0.10 A 23 ASN CB C 13 40.287 0.10 A 23 ASN N N 15 117.173 0.10 A 23 ASN ND2 N 15 113.662 0.10 A 24 ARG H H 1 8.425 0.02 A 24 ARG HA H 1 3.679 0.02 A 24 ARG HBy H 1 1.389 0.02 A 24 ARG HBx H 1 1.147 0.02 A 24 ARG HDx H 1 2.871 0.02 A 24 ARG HDy H 1 3.013 0.02 A 24 ARG HE H 1 7.240 0.02 A 24 ARG HGy H 1 1.262 0.02 A 24 ARG HGx H 1 0.828 0.02 A 24 ARG C C 13 174.819 0.10 A 24 ARG CA C 13 57.239 0.10 A 24 ARG CB C 13 30.098 0.10 A 24 ARG N N 15 122.594 0.10 A 25 TYR H H 1 7.941 0.02 A 25 TYR HA H 1 4.667 0.02 A 25 TYR HBy H 1 2.941 0.02 A 25 TYR HBx H 1 2.740 0.02 A 25 TYR HDx H 1 7.171 0.02 A 25 TYR HDy H 1 7.171 0.02 A 25 TYR HEx H 1 6.811 0.02 A 25 TYR HEy H 1 6.811 0.02 A 25 TYR C C 13 175.555 0.10 A 25 TYR CA C 13 56.764 0.10 A 25 TYR CB C 13 40.449 0.10 A 25 TYR N N 15 115.608 0.10 A 26 LEU H H 1 8.538 0.02 A 26 LEU HA H 1 4.504 0.02 A 26 LEU HBy H 1 1.391 0.02 A 26 LEU HBx H 1 1.276 0.02 A 26 LEU HDx% H 1 0.291 0.02 A 26 LEU HDy% H 1 0.438 0.02 A 26 LEU HG H 1 0.798 0.02 A 26 LEU C C 13 178.129 0.10 A 26 LEU CA C 13 53.490 0.10 A 26 LEU CB C 13 43.472 0.10 A 26 LEU CD1 C 13 26.012 0.10 A 26 LEU CD2 C 13 24.066 0.10 A 26 LEU N N 15 123.054 0.10 A 27 THR H H 1 7.590 0.02 A 27 THR HA H 1 4.426 0.02 A 27 THR HB H 1 4.684 0.02 A 27 THR HG21 H 1 1.354 0.02 A 27 THR HG22 H 1 1.354 0.02 A 27 THR HG23 H 1 1.354 0.02 A 27 THR C C 13 175.241 0.10 A 27 THR CA C 13 60.564 0.10 A 27 THR CB C 13 71.300 0.10 A 27 THR CG2 C 13 22.175 0.10 A 27 THR N N 15 113.126 0.10 A 28 GLU H H 1 9.029 0.02 A 28 GLU HA H 1 3.933 0.02 A 28 GLU HBx H 1 2.015 0.02 A 28 GLU HBy H 1 2.127 0.02 A 28 GLU HGx H 1 2.329 0.02 A 28 GLU HGy H 1 2.329 0.02 A 28 GLU C C 13 178.818 0.10 A 28 GLU CA C 13 59.879 0.10 A 28 GLU CB C 13 28.336 0.10 A 28 GLU N N 15 122.414 0.10 A 29 ARG H H 1 8.527 0.02 A 29 ARG HA H 1 4.094 0.02 A 29 ARG HBy H 1 1.877 0.02 A 29 ARG HBx H 1 1.721 0.02 A 29 ARG HDx H 1 3.227 0.02 A 29 ARG HDy H 1 3.227 0.02 A 29 ARG HGx H 1 1.649 0.02 A 29 ARG HGy H 1 1.649 0.02 A 29 ARG C C 13 179.152 0.10 A 29 ARG CA C 13 58.870 0.10 A 29 ARG CB C 13 29.611 0.10 A 29 ARG N N 15 118.009 0.10 A 30 ARG H H 1 7.883 0.02 A 30 ARG HA H 1 4.182 0.02 A 30 ARG HBx H 1 1.721 0.02 A 30 ARG HBy H 1 1.823 0.02 A 30 ARG HDx H 1 3.128 0.02 A 30 ARG HDy H 1 3.422 0.02 A 30 ARG HE H 1 7.750 0.02 A 30 ARG HGx H 1 1.612 0.02 A 30 ARG HGy H 1 1.612 0.02 A 30 ARG C C 13 178.602 0.10 A 30 ARG CA C 13 58.009 0.10 A 30 ARG CB C 13 29.800 0.10 A 30 ARG N N 15 120.213 0.10 A 31 ARG H H 1 8.615 0.02 A 31 ARG HA H 1 3.684 0.02 A 31 ARG HBx H 1 1.747 0.02 A 31 ARG HBy H 1 2.045 0.02 A 31 ARG HDx H 1 3.385 0.02 A 31 ARG HDy H 1 3.385 0.02 A 31 ARG HE H 1 7.796 0.02 A 31 ARG HGx H 1 1.517 0.02 A 31 ARG HGy H 1 1.517 0.02 A 31 ARG C C 13 178.725 0.10 A 31 ARG CA C 13 60.742 0.10 A 31 ARG CB C 13 29.743 0.10 A 31 ARG N N 15 120.240 0.10 A 32 GLN H H 1 8.310 0.02 A 32 GLN HA H 1 3.926 0.02 A 32 GLN HBy H 1 2.294 0.02 A 32 GLN HBx H 1 2.146 0.02 A 32 GLN HE2x H 1 6.851 0.02 A 32 GLN HE2y H 1 7.761 0.02 A 32 GLN HGy H 1 2.651 0.02 A 32 GLN HGx H 1 2.431 0.02 A 32 GLN C C 13 179.383 0.10 A 32 GLN CA C 13 59.534 0.10 A 32 GLN CB C 13 27.808 0.10 A 32 GLN N N 15 119.168 0.10 A 32 GLN NE2 N 15 111.896 0.10 A 33 GLN H H 1 8.179 0.02 A 33 GLN HA H 1 4.072 0.02 A 33 GLN HBx H 1 2.104 0.02 A 33 GLN HBy H 1 2.276 0.02 A 33 GLN HE2x H 1 6.867 0.02 A 33 GLN HE2y H 1 7.806 0.02 A 33 GLN HGy H 1 2.565 0.02 A 33 GLN HGx H 1 2.322 0.02 A 33 GLN C C 13 179.171 0.10 A 33 GLN CA C 13 59.078 0.10 A 33 GLN CB C 13 28.097 0.10 A 33 GLN N N 15 121.183 0.10 A 33 GLN NE2 N 15 112.196 0.10 A 34 LEU H H 1 8.750 0.02 A 34 LEU HA H 1 3.999 0.02 A 34 LEU HBy H 1 1.794 0.02 A 34 LEU HBx H 1 1.725 0.02 A 34 LEU HDx% H 1 0.767 0.02 A 34 LEU HDy% H 1 0.756 0.02 A 34 LEU HG H 1 1.280 0.02 A 34 LEU C C 13 178.988 0.10 A 34 LEU CA C 13 57.819 0.10 A 34 LEU CB C 13 42.237 0.10 A 34 LEU CD1 C 13 25.749 0.10 A 34 LEU CD2 C 13 23.502 0.10 A 34 LEU N N 15 119.450 0.10 A 35 SER H H 1 8.166 0.02 A 35 SER HA H 1 4.191 0.02 A 35 SER HBy H 1 4.055 0.02 A 35 SER HBx H 1 3.950 0.02 A 35 SER C C 13 177.900 0.10 A 35 SER CA C 13 61.353 0.10 A 35 SER CB C 13 63.481 0.10 A 35 SER N N 15 114.425 0.10 A 36 SER H H 1 7.873 0.02 A 36 SER HA H 1 4.276 0.02 A 36 SER HBx H 1 4.043 0.02 A 36 SER HBy H 1 4.043 0.02 A 36 SER C C 13 177.476 0.10 A 36 SER CA C 13 60.892 0.10 A 36 SER CB C 13 63.235 0.10 A 36 SER N N 15 115.483 0.10 A 37 GLU H H 1 8.419 0.02 A 37 GLU HA H 1 4.087 0.02 A 37 GLU HBy H 1 2.264 0.02 A 37 GLU HBx H 1 2.079 0.02 A 37 GLU HGx H 1 2.579 0.02 A 37 GLU HGy H 1 2.579 0.02 A 37 GLU C C 13 179.123 0.10 A 37 GLU CA C 13 59.161 0.10 A 37 GLU CB C 13 30.009 0.10 A 37 GLU N N 15 120.255 0.10 A 38 LEU H H 1 8.422 0.02 A 38 LEU HA H 1 4.442 0.02 A 38 LEU HBx H 1 1.809 0.02 A 38 LEU HBy H 1 1.809 0.02 A 38 LEU HDx% H 1 0.708 0.02 A 38 LEU HDy% H 1 0.817 0.02 A 38 LEU HG H 1 1.382 0.02 A 38 LEU C C 13 177.985 0.10 A 38 LEU CA C 13 54.923 0.10 A 38 LEU CB C 13 43.064 0.10 A 38 LEU CD1 C 13 26.020 0.10 A 38 LEU CD2 C 13 23.062 0.10 A 38 LEU N N 15 113.904 0.10 A 39 GLY H H 1 7.899 0.02 A 39 GLY HAx H 1 3.941 0.02 A 39 GLY HAy H 1 3.941 0.02 A 39 GLY C C 13 174.738 0.10 A 39 GLY CA C 13 46.819 0.10 A 39 GLY N N 15 109.551 0.10 A 40 LEU H H 1 7.292 0.02 A 40 LEU HA H 1 4.759 0.02 A 40 LEU HBy H 1 1.361 0.02 A 40 LEU HBx H 1 1.231 0.02 A 40 LEU HDx% H 1 0.360 0.02 A 40 LEU HDy% H 1 0.750 0.02 A 40 LEU C C 13 176.154 0.10 A 40 LEU CA C 13 52.100 0.10 A 40 LEU CB C 13 46.273 0.10 A 40 LEU CD1 C 13 25.697 0.10 A 40 LEU CD2 C 13 23.454 0.10 A 40 LEU N N 15 118.231 0.10 A 41 ASN H H 1 9.022 0.02 A 41 ASN HA H 1 4.720 0.02 A 41 ASN HBy H 1 3.078 0.02 A 41 ASN HBx H 1 2.856 0.02 A 41 ASN HD2x H 1 7.153 0.02 A 41 ASN HD2y H 1 7.806 0.02 A 41 ASN C C 13 176.631 0.10 A 41 ASN CA C 13 52.909 0.10 A 41 ASN CB C 13 39.364 0.10 A 41 ASN N N 15 120.115 0.10 A 41 ASN ND2 N 15 113.934 0.10 A 42 GLU H H 1 9.232 0.02 A 42 GLU HA H 1 3.780 0.02 A 42 GLU HBx H 1 2.075 0.02 A 42 GLU HBy H 1 2.075 0.02 A 42 GLU HGy H 1 2.565 0.02 A 42 GLU HGx H 1 2.208 0.02 A 42 GLU C C 13 178.343 0.10 A 42 GLU CA C 13 61.066 0.10 A 42 GLU CB C 13 29.601 0.10 A 42 GLU N N 15 122.470 0.10 A 43 ALA H H 1 8.681 0.02 A 43 ALA HA H 1 4.129 0.02 A 43 ALA HB1 H 1 1.504 0.02 A 43 ALA HB2 H 1 1.504 0.02 A 43 ALA HB3 H 1 1.504 0.02 A 43 ALA C C 13 180.822 0.10 A 43 ALA CA C 13 55.608 0.10 A 43 ALA CB C 13 18.000 0.10 A 43 ALA N N 15 121.749 0.10 A 44 GLN H H 1 8.034 0.02 A 44 GLN HA H 1 4.199 0.02 A 44 GLN HBy H 1 2.525 0.02 A 44 GLN HBx H 1 2.180 0.02 A 44 GLN HE2x H 1 7.069 0.02 A 44 GLN HE2y H 1 7.622 0.02 A 44 GLN HGx H 1 2.662 0.02 A 44 GLN HGy H 1 2.662 0.02 A 44 GLN C C 13 180.018 0.10 A 44 GLN CA C 13 59.907 0.10 A 44 GLN CB C 13 29.456 0.10 A 44 GLN N N 15 115.886 0.10 A 44 GLN NE2 N 15 113.237 0.10 A 45 ILE H H 1 7.552 0.02 A 45 ILE HA H 1 3.801 0.02 A 45 ILE HB H 1 1.963 0.02 A 45 ILE HD11 H 1 0.730 0.02 A 45 ILE HD12 H 1 0.730 0.02 A 45 ILE HD13 H 1 0.730 0.02 A 45 ILE HG12 H 1 0.905 0.02 A 45 ILE HG13 H 1 0.905 0.02 A 45 ILE HG21 H 1 0.965 0.02 A 45 ILE HG22 H 1 0.965 0.02 A 45 ILE HG23 H 1 0.965 0.02 A 45 ILE C C 13 177.478 0.10 A 45 ILE CA C 13 65.741 0.10 A 45 ILE CB C 13 38.049 0.10 A 45 ILE CD1 C 13 13.602 0.10 A 45 ILE CG2 C 13 18.649 0.10 A 45 ILE N N 15 119.852 0.10 A 46 LYS H H 1 8.460 0.02 A 46 LYS HA H 1 4.339 0.02 A 46 LYS HBy H 1 2.096 0.02 A 46 LYS HBx H 1 1.891 0.02 A 46 LYS HDx H 1 1.655 0.02 A 46 LYS HDy H 1 1.655 0.02 A 46 LYS HEx H 1 2.970 0.02 A 46 LYS HEy H 1 2.970 0.02 A 46 LYS HGx H 1 1.484 0.02 A 46 LYS HGy H 1 1.484 0.02 A 46 LYS C C 13 180.195 0.10 A 46 LYS CA C 13 60.366 0.10 A 46 LYS CB C 13 32.990 0.10 A 46 LYS N N 15 120.393 0.10 A 47 ILE H H 1 8.252 0.02 A 47 ILE HA H 1 3.879 0.02 A 47 ILE HB H 1 2.005 0.02 A 47 ILE HD11 H 1 0.904 0.02 A 47 ILE HD12 H 1 0.904 0.02 A 47 ILE HD13 H 1 0.904 0.02 A 47 ILE HG12 H 1 1.309 0.02 A 47 ILE HG13 H 1 1.757 0.02 A 47 ILE HG21 H 1 1.029 0.02 A 47 ILE HG22 H 1 1.029 0.02 A 47 ILE HG23 H 1 1.029 0.02 A 47 ILE C C 13 177.642 0.10 A 47 ILE CA C 13 64.661 0.10 A 47 ILE CB C 13 38.331 0.10 A 47 ILE CD1 C 13 13.042 0.10 A 47 ILE CG1 C 13 29.938 0.10 A 47 ILE CG2 C 13 17.777 0.10 A 47 ILE N N 15 119.784 0.10 A 48 TRP H H 1 8.177 0.02 A 48 TRP HA H 1 4.096 0.02 A 48 TRP HBx H 1 3.467 0.02 A 48 TRP HBy H 1 3.631 0.02 A 48 TRP HD1 H 1 7.074 0.02 A 48 TRP HE1 H 1 9.556 0.02 A 48 TRP HE3 H 1 7.109 0.02 A 48 TRP HH2 H 1 6.307 0.02 A 48 TRP HZ2 H 1 7.078 0.02 A 48 TRP HZ3 H 1 5.884 0.02 A 48 TRP C C 13 180.070 0.10 A 48 TRP CA C 13 63.201 0.10 A 48 TRP CB C 13 29.295 0.10 A 48 TRP N N 15 122.175 0.10 A 48 TRP NE1 N 15 128.800 0.10 A 49 PHE H H 1 8.880 0.02 A 49 PHE HA H 1 3.811 0.02 A 49 PHE HBy H 1 3.601 0.02 A 49 PHE HBx H 1 3.275 0.02 A 49 PHE HDx H 1 7.849 0.02 A 49 PHE HDy H 1 7.849 0.02 A 49 PHE HEx H 1 7.504 0.02 A 49 PHE HEy H 1 7.504 0.02 A 49 PHE HZ H 1 7.210 0.02 A 49 PHE C C 13 178.369 0.10 A 49 PHE CA C 13 63.141 0.10 A 49 PHE CB C 13 39.886 0.10 A 49 PHE N N 15 118.807 0.10 A 50 GLN H H 1 8.356 0.02 A 50 GLN HA H 1 3.940 0.02 A 50 GLN HBy H 1 2.316 0.02 A 50 GLN HBx H 1 2.174 0.02 A 50 GLN HE2x H 1 7.022 0.02 A 50 GLN HE2y H 1 7.695 0.02 A 50 GLN HGy H 1 2.570 0.02 A 50 GLN HGx H 1 2.482 0.02 A 50 GLN C C 13 179.537 0.10 A 50 GLN CA C 13 59.540 0.10 A 50 GLN CB C 13 28.412 0.10 A 50 GLN N N 15 118.413 0.10 A 50 GLN NE2 N 15 111.894 0.10 A 51 ASN H H 1 8.623 0.02 A 51 ASN HA H 1 4.345 0.02 A 51 ASN HBy H 1 2.743 0.02 A 51 ASN HBx H 1 2.535 0.02 A 51 ASN HD2y H 1 7.635 0.02 A 51 ASN HD2x H 1 6.966 0.02 A 51 ASN C C 13 177.883 0.10 A 51 ASN CA C 13 55.469 0.10 A 51 ASN CB C 13 37.559 0.10 A 51 ASN N N 15 118.977 0.10 A 51 ASN ND2 N 15 112.733 0.10 A 52 LYS H H 1 7.731 0.02 A 52 LYS HA H 1 3.466 0.02 A 52 LYS HBy H 1 0.552 0.02 A 52 LYS HBx H 1 0.283 0.02 A 52 LYS HDx H 1 0.368 0.02 A 52 LYS HDy H 1 0.730 0.02 A 52 LYS HEx H 1 2.122 0.02 A 52 LYS HEy H 1 2.172 0.02 A 52 LYS HGy H 1 -0.354 0.02 A 52 LYS HGx H 1 -0.481 0.02 A 52 LYS C C 13 179.530 0.10 A 52 LYS CA C 13 57.259 0.10 A 52 LYS CB C 13 30.504 0.10 A 52 LYS CD C 13 27.285 0.10 A 52 LYS CG C 13 22.096 0.10 A 52 LYS N N 15 121.817 0.10 A 53 ARG H H 1 8.046 0.02 A 53 ARG HA H 1 4.109 0.02 A 53 ARG HBy H 1 2.093 0.02 A 53 ARG HBx H 1 1.849 0.02 A 53 ARG HDy H 1 3.279 0.02 A 53 ARG HDx H 1 3.184 0.02 A 53 ARG HE H 1 8.409 0.02 A 53 ARG HGx H 1 1.426 0.02 A 53 ARG HGy H 1 1.426 0.02 A 53 ARG C C 13 178.354 0.10 A 53 ARG CA C 13 58.944 0.10 A 53 ARG CB C 13 31.093 0.10 A 53 ARG N N 15 117.662 0.10 A 54 ALA H H 1 7.556 0.02 A 54 ALA HA H 1 4.198 0.02 A 54 ALA HB1 H 1 1.483 0.02 A 54 ALA HB2 H 1 1.483 0.02 A 54 ALA HB3 H 1 1.483 0.02 A 54 ALA C C 13 178.727 0.10 A 54 ALA CA C 13 53.751 0.10 A 54 ALA CB C 13 18.540 0.10 A 54 ALA N N 15 120.123 0.10 A 55 LYS H H 1 7.556 0.02 A 55 LYS HA H 1 4.195 0.02 A 55 LYS HBx H 1 1.737 0.02 A 55 LYS HBy H 1 1.849 0.02 A 55 LYS HDx H 1 1.587 0.02 A 55 LYS HDy H 1 1.587 0.02 A 55 LYS HEx H 1 2.913 0.02 A 55 LYS HEy H 1 2.913 0.02 A 55 LYS HGx H 1 1.416 0.02 A 55 LYS HGy H 1 1.416 0.02 A 55 LYS C C 13 177.329 0.10 A 55 LYS CA C 13 56.659 0.10 A 55 LYS CB C 13 32.563 0.10 A 55 LYS CG C 13 24.911 0.10 A 55 LYS N N 15 117.833 0.10 A 56 ILE H H 1 7.802 0.02 A 56 ILE HA H 1 4.098 0.02 A 56 ILE HB H 1 1.932 0.02 A 56 ILE HD11 H 1 0.907 0.02 A 56 ILE HD12 H 1 0.907 0.02 A 56 ILE HD13 H 1 0.907 0.02 A 56 ILE HG12 H 1 1.287 0.02 A 56 ILE HG13 H 1 1.558 0.02 A 56 ILE HG21 H 1 0.940 0.02 A 56 ILE HG22 H 1 0.940 0.02 A 56 ILE HG23 H 1 0.940 0.02 A 56 ILE C C 13 176.473 0.10 A 56 ILE CA C 13 61.046 0.10 A 56 ILE CB C 13 38.230 0.10 A 56 ILE CD1 C 13 13.099 0.10 A 56 ILE CG1 C 13 27.518 0.10 A 56 ILE CG2 C 13 17.450 0.10 A 56 ILE N N 15 120.989 0.10 A 57 LYS H H 1 8.353 0.02 A 57 LYS HA H 1 4.308 0.02 A 57 LYS HBx H 1 1.807 0.02 A 57 LYS HBy H 1 1.860 0.02 A 57 LYS HDx H 1 1.697 0.02 A 57 LYS HDy H 1 1.697 0.02 A 57 LYS HEx H 1 3.016 0.02 A 57 LYS HEy H 1 3.016 0.02 A 57 LYS HGx H 1 1.464 0.02 A 57 LYS HGy H 1 1.464 0.02 A 57 LYS C C 13 176.713 0.10 A 57 LYS CA C 13 56.564 0.10 A 57 LYS CB C 13 32.954 0.10 A 57 LYS CG C 13 24.873 0.10 A 57 LYS N N 15 126.380 0.10 A 58 LYS H H 1 8.531 0.02 A 58 LYS HA H 1 4.364 0.02 A 58 LYS HBx H 1 1.795 0.02 A 58 LYS HBy H 1 1.795 0.02 A 58 LYS HDx H 1 1.708 0.02 A 58 LYS HDy H 1 1.708 0.02 A 58 LYS HEx H 1 3.027 0.02 A 58 LYS HEy H 1 3.027 0.02 A 58 LYS HGx H 1 1.487 0.02 A 58 LYS HGy H 1 1.487 0.02 A 58 LYS C C 13 176.128 0.10 A 58 LYS CA C 13 56.621 0.10 A 58 LYS CB C 13 33.002 0.10 A 58 LYS CG C 13 24.787 0.10 A 58 LYS N N 15 124.453 0.10 A 59 SER H H 1 8.155 0.02 A 59 SER HA H 1 4.276 0.02 A 59 SER HBx H 1 3.870 0.02 A 59 SER HBy H 1 3.870 0.02 A 59 SER CB C 13 64.754 0.10 A 59 SER N N 15 123.606 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 GLU HA A 2 LYS H 1.0 1.8 5.5 2 2 A 2 LYS H A 1 GLU HBx 1.0 1.8 5.5 3 2 A 2 LYS H A 1 GLU HBy 1.0 1.8 5.5 4 3 A 2 LYS H A 1 GLU H 1.0 1.8 5.5 5 4 A 2 LYS HA A 3 ARG H 1.0 1.8 5.5 6 5 A 3 ARG H A 2 LYS HBx 1.0 1.8 5.5 7 5 A 3 ARG H A 2 LYS HBy 1.0 1.8 5.5 8 6 A 2 LYS HGy A 3 ARG HDx 1.0 1.8 5.5 9 6 A 2 LYS HGx A 3 ARG HDx 1.0 1.8 5.5 10 6 A 3 ARG HDy A 2 LYS HGy 1.0 1.8 5.5 11 6 A 2 LYS HGx A 3 ARG HDy 1.0 1.8 5.5 12 7 A 2 LYS H A 3 ARG H 1.0 1.8 5.5 13 8 A 3 ARG HA A 4 PRO HDy 1.0 1.8 2.7 14 8 A 3 ARG HA A 4 PRO HDx 1.0 1.8 2.7 15 9 A 3 ARG HA A 4 PRO HGx 1.0 1.8 5.5 16 9 A 3 ARG HA A 4 PRO HGy 1.0 1.8 5.5 17 10 A 3 ARG HBx A 4 PRO HDy 1.0 1.8 5.5 18 10 A 3 ARG HBy A 4 PRO HDy 1.0 1.8 5.5 19 10 A 4 PRO HDx A 3 ARG HBy 1.0 1.8 5.5 20 10 A 4 PRO HDx A 3 ARG HBx 1.0 1.8 5.5 21 11 A 4 PRO HA A 5 ARG HBy 1.0 1.8 5.5 22 11 A 4 PRO HA A 5 ARG HBx 1.0 1.8 5.5 23 12 A 4 PRO HA A 5 ARG H 1.0 1.8 5.5 24 13 A 5 ARG H A 4 PRO HBy 1.0 1.8 3.6 25 13 A 5 ARG H A 4 PRO HBx 1.0 1.8 3.6 26 14 A 5 ARG HA A 6 THR H 1.0 1.8 5.5 27 15 A 6 THR H A 5 ARG HBy 1.0 1.8 5.5 28 15 A 5 ARG HBx A 6 THR H 1.0 1.8 5.5 29 16 A 6 THR H A 5 ARG HDx 1.0 1.8 5.5 30 16 A 6 THR H A 5 ARG HDy 1.0 1.8 5.5 31 17 A 6 THR H A 5 ARG HE 1.0 1.8 5.5 32 18 A 6 THR H A 5 ARG HGy 1.0 1.8 5.5 33 18 A 6 THR H A 5 ARG HGx 1.0 1.8 5.5 34 19 A 8 PHE HE% A 5 ARG HGy 1.0 1.8 5.5 35 19 A 5 ARG HGx A 8 PHE HE% 1.0 1.8 5.5 36 20 A 5 ARG H A 6 THR HG21 1.0 1.8 5.5 37 21 A 5 ARG H A 6 THR H 1.0 1.8 5.5 38 22 A 6 THR HA A 7 ALA H 1.0 1.8 5.5 39 23 A 7 ALA H A 6 THR HB 1.0 1.8 5.5 40 24 A 6 THR HG21 A 7 ALA H 1.0 1.8 5.5 41 25 A 8 PHE HE% A 6 THR HG21 1.0 1.8 3.6 42 26 A 6 THR HG21 A 8 PHE H 1.0 1.8 5.5 43 27 A 7 ALA HA A 8 PHE HBx 1.0 1.8 5.5 44 27 A 7 ALA HA A 8 PHE HBy 1.0 1.8 5.5 45 28 A 7 ALA HA A 8 PHE HD% 1.0 1.8 5.5 46 29 A 8 PHE H A 7 ALA HA 1.0 1.8 2.7 47 30 A 8 PHE HD% A 7 ALA HB1 1.0 1.8 5.5 48 31 A 8 PHE H A 7 ALA HB1 1.0 1.8 3.6 49 32 A 7 ALA H A 8 PHE HD% 1.0 1.8 5.5 50 33 A 8 PHE HA A 9 SER H 1.0 1.8 5.5 51 34 A 8 PHE HBx A 12 GLN HBx 1.0 1.8 5.5 52 34 A 12 GLN HBy A 8 PHE HBx 1.0 1.8 5.5 53 34 A 8 PHE HBy A 12 GLN HBy 1.0 1.8 5.5 54 34 A 8 PHE HBy A 12 GLN HBx 1.0 1.8 5.5 55 35 A 12 GLN H A 8 PHE HBx 1.0 1.8 5.5 56 35 A 8 PHE HBy A 12 GLN H 1.0 1.8 5.5 57 36 A 13 LEU HDx% A 8 PHE HBx 1.0 1.8 5.5 58 36 A 8 PHE HBy A 13 LEU HDx% 1.0 1.8 5.5 59 37 A 13 LEU HDy% A 8 PHE HBx 1.0 1.8 3.6 60 37 A 8 PHE HBy A 13 LEU HDy% 1.0 1.8 3.6 61 38 A 13 LEU HG A 8 PHE HBx 1.0 1.8 5.5 62 38 A 8 PHE HBy A 13 LEU HG 1.0 1.8 5.5 63 39 A 13 LEU H A 8 PHE HBx 1.0 1.8 5.5 64 39 A 8 PHE HBy A 13 LEU H 1.0 1.8 5.5 65 40 A 9 SER H A 8 PHE HBx 1.0 1.8 3.6 66 40 A 8 PHE HBy A 9 SER H 1.0 1.8 3.6 67 41 A 8 PHE HD% A 12 GLN HGy 1.0 1.8 5.5 68 41 A 8 PHE HD% A 12 GLN HGx 1.0 1.8 5.5 69 42 A 8 PHE HD% A 13 LEU HDx% 1.0 1.8 5.5 70 43 A 8 PHE HD% A 13 LEU HDy% 1.0 1.8 5.5 71 44 A 8 PHE HD% A 13 LEU H 1.0 1.8 5.5 72 45 A 8 PHE HD% A 16 LEU HDx% 1.0 1.8 3.6 73 46 A 8 PHE HD% A 40 LEU HDx% 1.0 1.8 3.6 74 47 A 8 PHE HD% A 40 LEU HDy% 1.0 1.8 2.7 75 48 A 8 PHE HD% A 9 SER H 1.0 1.8 5.5 76 49 A 8 PHE HE% A 13 LEU HDy% 1.0 1.8 5.5 77 50 A 8 PHE HE% A 16 LEU HDx% 1.0 1.8 3.6 78 51 A 8 PHE HE% A 40 LEU HBy 1.0 1.8 5.5 79 51 A 8 PHE HE% A 40 LEU HBx 1.0 1.8 5.5 80 52 A 8 PHE HE% A 40 LEU HDx% 1.0 1.8 3.6 81 53 A 8 PHE HE% A 40 LEU HDy% 1.0 1.8 3.6 82 54 A 8 PHE HE% A 44 GLN HA 1.0 1.8 5.5 83 55 A 8 PHE HE% A 44 GLN HBy 1.0 1.8 3.6 84 55 A 8 PHE HE% A 44 GLN HBx 1.0 1.8 3.6 85 56 A 8 PHE HE% A 44 GLN HGx 1.0 1.8 5.5 86 56 A 8 PHE HE% A 44 GLN HGy 1.0 1.8 5.5 87 57 A 8 PHE HE% A 45 ILE HA 1.0 1.8 5.5 88 58 A 8 PHE HE% A 48 TRP HA 1.0 1.8 5.5 89 59 A 8 PHE HE% A 48 TRP HBx 1.0 1.8 3.6 90 59 A 8 PHE HE% A 48 TRP HBy 1.0 1.8 3.6 91 60 A 8 PHE HE% A 48 TRP HE1 1.0 1.8 5.5 92 61 A 8 PHE HE% A 48 TRP H 1.0 1.8 5.5 93 62 A 8 PHE H A 13 LEU HDx% 1.0 1.8 5.5 94 63 A 8 PHE H A 9 SER H 1.0 1.8 5.5 95 64 A 16 LEU HDx% A 8 PHE HZ 1.0 1.8 5.5 96 65 A 40 LEU HDx% A 8 PHE HZ 1.0 1.8 5.5 97 66 A 40 LEU HDy% A 8 PHE HZ 1.0 1.8 5.5 98 67 A 44 GLN HA A 8 PHE HZ 1.0 1.8 5.5 99 68 A 8 PHE HZ A 44 GLN HBy 1.0 1.8 3.6 100 68 A 44 GLN HBx A 8 PHE HZ 1.0 1.8 3.6 101 69 A 8 PHE HZ A 44 GLN HGx 1.0 1.8 5.5 102 69 A 44 GLN HGy A 8 PHE HZ 1.0 1.8 5.5 103 70 A 45 ILE HA A 8 PHE HZ 1.0 1.8 5.5 104 71 A 48 TRP HA A 8 PHE HZ 1.0 1.8 5.5 105 72 A 8 PHE HZ A 48 TRP HBx 1.0 1.8 3.6 106 72 A 48 TRP HBy A 8 PHE HZ 1.0 1.8 3.6 107 73 A 48 TRP H A 8 PHE HZ 1.0 1.8 5.5 108 74 A 9 SER HA A 10 SER H 1.0 1.8 5.5 109 75 A 9 SER HA A 11 GLU H 1.0 1.8 5.5 110 76 A 12 GLN H A 9 SER HA 1.0 1.8 5.5 111 77 A 10 SER H A 9 SER HBy 1.0 1.8 5.5 112 77 A 10 SER H A 9 SER HBx 1.0 1.8 5.5 113 78 A 11 GLU H A 9 SER HBy 1.0 1.8 5.5 114 78 A 11 GLU H A 9 SER HBx 1.0 1.8 5.5 115 79 A 12 GLN H A 9 SER HBy 1.0 1.8 5.5 116 79 A 12 GLN H A 9 SER HBx 1.0 1.8 5.5 117 80 A 9 SER H A 12 GLN HA 1.0 1.8 5.5 118 81 A 9 SER H A 12 GLN HBx 1.0 1.8 3.6 119 81 A 9 SER H A 12 GLN HBy 1.0 1.8 3.6 120 82 A 9 SER H A 12 GLN HGy 1.0 1.8 3.6 121 82 A 9 SER H A 12 GLN HGx 1.0 1.8 3.6 122 83 A 9 SER H A 12 GLN H 1.0 1.8 3.6 123 84 A 9 SER H A 13 LEU HDx% 1.0 1.8 5.5 124 85 A 9 SER H A 13 LEU H 1.0 1.8 5.5 125 86 A 9 SER H A 40 LEU HDx% 1.0 1.8 5.5 126 87 A 11 GLU H A 10 SER HBy 1.0 1.8 2.7 127 87 A 11 GLU H A 10 SER HBx 1.0 1.8 2.7 128 88 A 13 LEU HDx% A 10 SER HBy 1.0 1.8 5.5 129 88 A 13 LEU HDx% A 10 SER HBx 1.0 1.8 5.5 130 89 A 13 LEU H A 10 SER HBy 1.0 1.8 5.5 131 89 A 13 LEU H A 10 SER HBx 1.0 1.8 5.5 132 90 A 10 SER H A 11 GLU HBy 1.0 1.8 5.5 133 90 A 10 SER H A 11 GLU HBx 1.0 1.8 5.5 134 91 A 10 SER H A 11 GLU H 1.0 1.8 3.6 135 92 A 12 GLN H A 11 GLU HA 1.0 1.8 3.6 136 93 A 11 GLU HA A 14 ALA H 1.0 1.8 3.6 137 94 A 12 GLN H A 11 GLU HBy 1.0 1.8 3.6 138 94 A 12 GLN H A 11 GLU HBx 1.0 1.8 3.6 139 95 A 12 GLN H A 11 GLU HGy 1.0 1.8 5.5 140 95 A 12 GLN H A 11 GLU HGx 1.0 1.8 5.5 141 96 A 12 GLN H A 11 GLU H 1.0 1.8 2.7 142 97 A 11 GLU H A 14 ALA HB1 1.0 1.8 5.5 143 98 A 13 LEU H A 12 GLN HA 1.0 1.8 5.5 144 99 A 12 GLN HA A 15 ARG HBx 1.0 1.8 3.6 145 99 A 12 GLN HA A 15 ARG HBy 1.0 1.8 3.6 146 100 A 12 GLN HA A 15 ARG H 1.0 1.8 3.6 147 101 A 12 GLN HA A 16 LEU HG 1.0 1.8 5.5 148 102 A 12 GLN HA A 16 LEU H 1.0 1.8 5.5 149 103 A 12 GLN HA A 38 LEU HDx% 1.0 1.8 3.6 150 104 A 12 GLN HA A 38 LEU HDy% 1.0 1.8 2.7 151 105 A 12 GLN HA A 38 LEU HG 1.0 1.8 5.5 152 106 A 40 LEU HDx% A 12 GLN HA 1.0 1.8 5.5 153 107 A 13 LEU H A 12 GLN HBx 1.0 1.8 3.6 154 107 A 12 GLN HBy A 13 LEU H 1.0 1.8 3.6 155 108 A 38 LEU HDy% A 12 GLN HBx 1.0 1.8 5.5 156 108 A 12 GLN HBy A 38 LEU HDy% 1.0 1.8 5.5 157 109 A 38 LEU HG A 12 GLN HBx 1.0 1.8 5.5 158 109 A 12 GLN HBy A 38 LEU HG 1.0 1.8 5.5 159 110 A 12 GLN HE2y A 39 GLY HAx 1.0 1.8 5.5 160 110 A 12 GLN HE2x A 39 GLY HAx 1.0 1.8 5.5 161 110 A 39 GLY HAy A 12 GLN HE2y 1.0 1.8 5.5 162 110 A 12 GLN HE2x A 39 GLY HAy 1.0 1.8 5.5 163 111 A 12 GLN HE2x A 40 LEU HBy 1.0 1.8 5.5 164 111 A 12 GLN HE2y A 40 LEU HBy 1.0 1.8 5.5 165 111 A 40 LEU HBx A 12 GLN HE2y 1.0 1.8 5.5 166 111 A 40 LEU HBx A 12 GLN HE2x 1.0 1.8 5.5 167 112 A 40 LEU HDx% A 12 GLN HE2y 1.0 1.8 5.5 168 112 A 40 LEU HDx% A 12 GLN HE2x 1.0 1.8 5.5 169 113 A 40 LEU HDy% A 12 GLN HE2y 1.0 1.8 3.6 170 113 A 40 LEU HDy% A 12 GLN HE2x 1.0 1.8 3.6 171 114 A 38 LEU HDx% A 12 GLN HGy 1.0 1.8 5.5 172 114 A 12 GLN HGx A 38 LEU HDx% 1.0 1.8 5.5 173 115 A 38 LEU HDy% A 12 GLN HGy 1.0 1.8 3.6 174 115 A 12 GLN HGx A 38 LEU HDy% 1.0 1.8 3.6 175 116 A 12 GLN H A 13 LEU H 1.0 1.8 3.6 176 117 A 12 GLN H A 14 ALA H 1.0 1.8 5.5 177 118 A 12 GLN H A 38 LEU HDy% 1.0 1.8 5.5 178 119 A 14 ALA H A 13 LEU HA 1.0 1.8 3.6 179 120 A 15 ARG H A 13 LEU HA 1.0 1.8 5.5 180 121 A 16 LEU HDx% A 13 LEU HA 1.0 1.8 2.7 181 122 A 16 LEU H A 13 LEU HA 1.0 1.8 5.5 182 123 A 13 LEU HA A 17 LYS H 1.0 1.8 5.5 183 124 A 14 ALA H A 13 LEU HBx 1.0 1.8 2.7 184 124 A 14 ALA H A 13 LEU HBy 1.0 1.8 2.7 185 125 A 16 LEU HDx% A 13 LEU HBx 1.0 1.8 5.5 186 125 A 16 LEU HDx% A 13 LEU HBy 1.0 1.8 5.5 187 126 A 13 LEU HDx% A 17 LYS HEx 1.0 1.8 5.5 188 126 A 13 LEU HDx% A 17 LYS HEy 1.0 1.8 5.5 189 127 A 13 LEU HDx% A 48 TRP HE1 1.0 1.8 3.6 190 128 A 13 LEU HDx% A 48 TRP HZ2 1.0 1.8 3.6 191 129 A 13 LEU HDy% A 14 ALA H 1.0 1.8 5.5 192 130 A 13 LEU HDy% A 16 LEU HDx% 1.0 1.8 3.6 193 131 A 13 LEU HDy% A 17 LYS HEx 1.0 1.8 5.5 194 131 A 13 LEU HDy% A 17 LYS HEy 1.0 1.8 5.5 195 132 A 13 LEU HDy% A 17 LYS H 1.0 1.8 5.5 196 133 A 13 LEU HDy% A 48 TRP HE1 1.0 1.8 3.6 197 134 A 13 LEU HDy% A 48 TRP HZ2 1.0 1.8 5.5 198 135 A 13 LEU H A 14 ALA H 1.0 1.8 2.7 199 136 A 13 LEU H A 15 ARG H 1.0 1.8 5.5 200 137 A 13 LEU H A 16 LEU HDx% 1.0 1.8 5.5 201 138 A 15 ARG H A 14 ALA HA 1.0 1.8 3.6 202 139 A 14 ALA HA A 18 ARG H 1.0 1.8 5.5 203 140 A 14 ALA HB1 A 15 ARG H 1.0 1.8 2.7 204 141 A 14 ALA HB1 A 16 LEU H 1.0 1.8 5.5 205 142 A 14 ALA H A 15 ARG HBx 1.0 1.8 5.5 206 142 A 14 ALA H A 15 ARG HBy 1.0 1.8 5.5 207 143 A 14 ALA H A 15 ARG H 1.0 1.8 2.7 208 144 A 16 LEU H A 15 ARG HA 1.0 1.8 3.6 209 145 A 16 LEU H A 15 ARG HBx 1.0 1.8 2.7 210 145 A 15 ARG HBy A 16 LEU H 1.0 1.8 2.7 211 146 A 38 LEU HDy% A 15 ARG HBx 1.0 1.8 5.5 212 146 A 15 ARG HBy A 38 LEU HDy% 1.0 1.8 5.5 213 147 A 15 ARG H A 16 LEU HBx 1.0 1.8 5.5 214 147 A 15 ARG H A 16 LEU HBy 1.0 1.8 5.5 215 148 A 15 ARG H A 16 LEU HG 1.0 1.8 5.5 216 149 A 15 ARG H A 16 LEU H 1.0 1.8 2.7 217 150 A 15 ARG H A 17 LYS H 1.0 1.8 5.5 218 151 A 15 ARG H A 38 LEU HDy% 1.0 1.8 5.5 219 152 A 17 LYS H A 16 LEU HA 1.0 1.8 5.5 220 153 A 16 LEU HA A 19 GLU HBx 1.0 1.8 3.6 221 153 A 16 LEU HA A 19 GLU HBy 1.0 1.8 3.6 222 154 A 16 LEU HA A 19 GLU H 1.0 1.8 3.6 223 155 A 16 LEU HA A 20 PHE H 1.0 1.8 5.5 224 156 A 16 LEU HA A 49 PHE HZ 1.0 1.8 5.5 225 157 A 17 LYS H A 16 LEU HBx 1.0 1.8 2.7 226 157 A 17 LYS H A 16 LEU HBy 1.0 1.8 2.7 227 158 A 19 GLU H A 16 LEU HBx 1.0 1.8 5.5 228 158 A 16 LEU HBy A 19 GLU H 1.0 1.8 5.5 229 159 A 48 TRP HE3 A 16 LEU HBx 1.0 1.8 5.5 230 159 A 16 LEU HBy A 48 TRP HE3 1.0 1.8 5.5 231 160 A 48 TRP HH2 A 16 LEU HBx 1.0 1.8 5.5 232 160 A 16 LEU HBy A 48 TRP HH2 1.0 1.8 5.5 233 161 A 48 TRP HZ2 A 16 LEU HBx 1.0 1.8 5.5 234 161 A 48 TRP HZ2 A 16 LEU HBy 1.0 1.8 5.5 235 162 A 16 LEU HDx% A 17 LYS H 1.0 1.8 5.5 236 163 A 16 LEU HDx% A 40 LEU HDx% 1.0 1.8 5.5 237 164 A 16 LEU HDx% A 45 ILE HA 1.0 1.8 5.5 238 165 A 16 LEU HDx% A 48 TRP HE1 1.0 1.8 5.5 239 166 A 16 LEU HDx% A 48 TRP HE3 1.0 1.8 5.5 240 167 A 16 LEU HDx% A 48 TRP HH2 1.0 1.8 5.5 241 168 A 16 LEU HDx% A 48 TRP HZ3 1.0 1.8 5.5 242 169 A 16 LEU HDx% A 49 PHE HD% 1.0 1.8 5.5 243 170 A 16 LEU HDx% A 49 PHE HE% 1.0 1.8 5.5 244 171 A 17 LYS H A 16 LEU HDy% 1.0 1.8 5.5 245 172 A 16 LEU HDy% A 34 LEU HBy 1.0 1.8 5.5 246 172 A 16 LEU HDy% A 34 LEU HBx 1.0 1.8 5.5 247 173 A 38 LEU HDx% A 16 LEU HDy% 1.0 1.8 5.5 248 174 A 45 ILE HA A 16 LEU HDy% 1.0 1.8 3.6 249 175 A 16 LEU HDy% A 45 ILE HG12 1.0 1.8 5.5 250 175 A 16 LEU HDy% A 45 ILE HG13 1.0 1.8 5.5 251 176 A 16 LEU HDy% A 45 ILE HG21 1.0 1.8 5.5 252 177 A 16 LEU HDy% A 48 TRP HD1 1.0 1.8 5.5 253 178 A 48 TRP HE3 A 16 LEU HDy% 1.0 1.8 5.5 254 179 A 48 TRP HZ3 A 16 LEU HDy% 1.0 1.8 5.5 255 180 A 49 PHE HD% A 16 LEU HDy% 1.0 1.8 3.6 256 181 A 49 PHE HE% A 16 LEU HDy% 1.0 1.8 2.7 257 182 A 49 PHE HZ A 16 LEU HDy% 1.0 1.8 5.5 258 183 A 16 LEU HG A 17 LYS H 1.0 1.8 5.5 259 184 A 16 LEU HG A 38 LEU HDx% 1.0 1.8 5.5 260 185 A 18 ARG H A 17 LYS HA 1.0 1.8 5.5 261 186 A 17 LYS HA A 20 PHE HBy 1.0 1.8 3.6 262 186 A 17 LYS HA A 20 PHE HBx 1.0 1.8 3.6 263 187 A 17 LYS HA A 20 PHE HD% 1.0 1.8 5.5 264 188 A 20 PHE H A 17 LYS HA 1.0 1.8 5.5 265 189 A 17 LYS HA A 21 ASN H 1.0 1.8 5.5 266 190 A 48 TRP HH2 A 17 LYS HA 1.0 1.8 2.7 267 191 A 48 TRP HZ2 A 17 LYS HA 1.0 1.8 3.6 268 192 A 48 TRP HH2 A 17 LYS HBy 1.0 1.8 5.5 269 192 A 48 TRP HH2 A 17 LYS HBx 1.0 1.8 5.5 270 193 A 48 TRP HZ2 A 17 LYS HBy 1.0 1.8 5.5 271 193 A 48 TRP HZ2 A 17 LYS HBx 1.0 1.8 5.5 272 194 A 48 TRP HZ2 A 17 LYS HDx 1.0 1.8 5.5 273 194 A 48 TRP HZ2 A 17 LYS HDy 1.0 1.8 5.5 274 195 A 18 ARG H A 17 LYS HGx 1.0 1.8 5.5 275 195 A 18 ARG H A 17 LYS HGy 1.0 1.8 5.5 276 196 A 48 TRP HH2 A 17 LYS HGx 1.0 1.8 5.5 277 196 A 48 TRP HH2 A 17 LYS HGy 1.0 1.8 5.5 278 197 A 48 TRP HZ2 A 17 LYS HGx 1.0 1.8 3.6 279 197 A 48 TRP HZ2 A 17 LYS HGy 1.0 1.8 3.6 280 198 A 17 LYS H A 18 ARG H 1.0 1.8 2.7 281 199 A 17 LYS H A 48 TRP HH2 1.0 1.8 5.5 282 200 A 17 LYS H A 48 TRP HZ2 1.0 1.8 5.5 283 201 A 19 GLU H A 18 ARG HA 1.0 1.8 5.5 284 202 A 18 ARG HA A 21 ASN HBy 1.0 1.8 3.6 285 202 A 18 ARG HA A 21 ASN HBx 1.0 1.8 3.6 286 203 A 18 ARG HA A 21 ASN HD2y 1.0 1.8 5.5 287 203 A 18 ARG HA A 21 ASN HD2x 1.0 1.8 5.5 288 204 A 21 ASN H A 18 ARG HA 1.0 1.8 5.5 289 205 A 19 GLU H A 18 ARG HBy 1.0 1.8 2.7 290 205 A 19 GLU H A 18 ARG HBx 1.0 1.8 2.7 291 206 A 19 GLU H A 18 ARG HDx 1.0 1.8 5.5 292 206 A 19 GLU H A 18 ARG HDy 1.0 1.8 5.5 293 207 A 18 ARG H A 19 GLU H 1.0 1.8 2.7 294 208 A 18 ARG H A 20 PHE H 1.0 1.8 5.5 295 209 A 20 PHE H A 19 GLU HA 1.0 1.8 5.5 296 210 A 19 GLU HA A 22 GLU H 1.0 1.8 5.5 297 211 A 19 GLU HA A 23 ASN H 1.0 1.8 5.5 298 212 A 19 GLU HA A 34 LEU HDy% 1.0 1.8 5.5 299 212 A 19 GLU HA A 34 LEU HDx% 1.0 1.8 5.5 300 213 A 20 PHE H A 19 GLU HBx 1.0 1.8 3.6 301 213 A 19 GLU HBy A 20 PHE H 1.0 1.8 3.6 302 214 A 26 LEU HDy% A 19 GLU HBx 1.0 1.8 5.5 303 214 A 19 GLU HBy A 26 LEU HDy% 1.0 1.8 5.5 304 215 A 19 GLU HBx A 34 LEU HDy% 1.0 1.8 3.6 305 215 A 19 GLU HBy A 34 LEU HDy% 1.0 1.8 3.6 306 215 A 34 LEU HDx% A 19 GLU HBx 1.0 1.8 3.6 307 215 A 19 GLU HBy A 34 LEU HDx% 1.0 1.8 3.6 308 216 A 49 PHE HE% A 19 GLU HBx 1.0 1.8 5.5 309 216 A 19 GLU HBy A 49 PHE HE% 1.0 1.8 5.5 310 217 A 49 PHE HZ A 19 GLU HBx 1.0 1.8 2.7 311 217 A 19 GLU HBy A 49 PHE HZ 1.0 1.8 2.7 312 218 A 19 GLU HGy A 34 LEU HDy% 1.0 1.8 3.6 313 218 A 19 GLU HGx A 34 LEU HDy% 1.0 1.8 3.6 314 218 A 34 LEU HDx% A 19 GLU HGx 1.0 1.8 3.6 315 218 A 34 LEU HDx% A 19 GLU HGy 1.0 1.8 3.6 316 219 A 49 PHE HZ A 19 GLU HGx 1.0 1.8 5.5 317 219 A 49 PHE HZ A 19 GLU HGy 1.0 1.8 5.5 318 220 A 19 GLU H A 20 PHE H 1.0 1.8 3.6 319 221 A 23 ASN H A 20 PHE HA 1.0 1.8 3.6 320 222 A 20 PHE HA A 24 ARG HA 1.0 1.8 5.5 321 223 A 20 PHE HA A 24 ARG HBy 1.0 1.8 5.5 322 223 A 20 PHE HA A 24 ARG HBx 1.0 1.8 5.5 323 224 A 49 PHE HD% A 20 PHE HA 1.0 1.8 5.5 324 225 A 49 PHE HE% A 20 PHE HA 1.0 1.8 2.7 325 226 A 49 PHE HZ A 20 PHE HA 1.0 1.8 3.6 326 227 A 21 ASN H A 20 PHE HBy 1.0 1.8 3.6 327 227 A 20 PHE HBx A 21 ASN H 1.0 1.8 3.6 328 228 A 48 TRP HH2 A 20 PHE HBy 1.0 1.8 5.5 329 228 A 48 TRP HH2 A 20 PHE HBx 1.0 1.8 5.5 330 229 A 48 TRP HZ2 A 20 PHE HBy 1.0 1.8 5.5 331 229 A 48 TRP HZ2 A 20 PHE HBx 1.0 1.8 5.5 332 230 A 48 TRP HZ3 A 20 PHE HBy 1.0 1.8 5.5 333 230 A 48 TRP HZ3 A 20 PHE HBx 1.0 1.8 5.5 334 231 A 49 PHE HE% A 20 PHE HBy 1.0 1.8 5.5 335 231 A 49 PHE HE% A 20 PHE HBx 1.0 1.8 5.5 336 232 A 20 PHE HBx A 52 LYS HBy 1.0 1.8 5.5 337 232 A 20 PHE HBy A 52 LYS HBy 1.0 1.8 5.5 338 232 A 52 LYS HBx A 20 PHE HBy 1.0 1.8 5.5 339 232 A 20 PHE HBx A 52 LYS HBx 1.0 1.8 5.5 340 233 A 20 PHE HD% A 21 ASN HA 1.0 1.8 5.5 341 234 A 20 PHE HD% A 21 ASN HBy 1.0 1.8 5.5 342 234 A 20 PHE HD% A 21 ASN HBx 1.0 1.8 5.5 343 235 A 20 PHE HD% A 21 ASN HD2y 1.0 1.8 5.5 344 235 A 20 PHE HD% A 21 ASN HD2x 1.0 1.8 5.5 345 236 A 20 PHE HD% A 21 ASN H 1.0 1.8 5.5 346 237 A 20 PHE HD% A 24 ARG HA 1.0 1.8 3.6 347 238 A 20 PHE HD% A 24 ARG HBy 1.0 1.8 5.5 348 238 A 20 PHE HD% A 24 ARG HBx 1.0 1.8 5.5 349 239 A 48 TRP HH2 A 20 PHE HD% 1.0 1.8 5.5 350 240 A 48 TRP HZ3 A 20 PHE HD% 1.0 1.8 3.6 351 241 A 20 PHE HD% A 49 PHE HA 1.0 1.8 3.6 352 242 A 49 PHE HD% A 20 PHE HD% 1.0 1.8 5.5 353 243 A 49 PHE HE% A 20 PHE HD% 1.0 1.8 5.5 354 244 A 20 PHE HD% A 52 LYS HBy 1.0 1.8 5.5 355 244 A 20 PHE HD% A 52 LYS HBx 1.0 1.8 5.5 356 245 A 20 PHE HD% A 52 LYS HEx 1.0 1.8 5.5 357 245 A 20 PHE HD% A 52 LYS HEy 1.0 1.8 5.5 358 246 A 20 PHE HD% A 52 LYS HGy 1.0 1.8 5.5 359 246 A 20 PHE HD% A 52 LYS HGx 1.0 1.8 5.5 360 247 A 20 PHE HD% A 53 ARG H 1.0 1.8 5.5 361 248 A 20 PHE HD% A 56 ILE HD11 1.0 1.8 5.5 362 249 A 24 ARG HA A 20 PHE HE% 1.0 1.8 5.5 363 250 A 20 PHE HE% A 24 ARG HBy 1.0 1.8 5.5 364 250 A 24 ARG HBx A 20 PHE HE% 1.0 1.8 5.5 365 251 A 20 PHE HE% A 24 ARG HGy 1.0 1.8 5.5 366 251 A 20 PHE HE% A 24 ARG HGx 1.0 1.8 5.5 367 252 A 49 PHE HA A 20 PHE HE% 1.0 1.8 5.5 368 253 A 20 PHE HE% A 52 LYS HBy 1.0 1.8 3.6 369 253 A 52 LYS HBx A 20 PHE HE% 1.0 1.8 3.6 370 254 A 20 PHE HE% A 52 LYS HEx 1.0 1.8 5.5 371 254 A 52 LYS HEy A 20 PHE HE% 1.0 1.8 5.5 372 255 A 20 PHE HE% A 52 LYS HGy 1.0 1.8 5.5 373 255 A 52 LYS HGx A 20 PHE HE% 1.0 1.8 5.5 374 256 A 20 PHE HE% A 53 ARG HA 1.0 1.8 3.6 375 257 A 20 PHE HE% A 53 ARG HBy 1.0 1.8 5.5 376 257 A 20 PHE HE% A 53 ARG HBx 1.0 1.8 5.5 377 258 A 20 PHE HE% A 53 ARG HGx 1.0 1.8 5.5 378 258 A 20 PHE HE% A 53 ARG HGy 1.0 1.8 5.5 379 259 A 53 ARG H A 20 PHE HE% 1.0 1.8 5.5 380 260 A 56 ILE HD11 A 20 PHE HE% 1.0 1.8 3.6 381 261 A 20 PHE H A 21 ASN H 1.0 1.8 3.6 382 262 A 20 PHE H A 22 GLU H 1.0 1.8 5.5 383 263 A 20 PHE H A 48 TRP HH2 1.0 1.8 5.5 384 264 A 20 PHE H A 48 TRP HZ3 1.0 1.8 5.5 385 265 A 20 PHE H A 49 PHE HE% 1.0 1.8 5.5 386 266 A 20 PHE H A 49 PHE HZ 1.0 1.8 5.5 387 267 A 24 ARG HA A 20 PHE HZ 1.0 1.8 5.5 388 268 A 20 PHE HZ A 24 ARG HBy 1.0 1.8 5.5 389 268 A 24 ARG HBx A 20 PHE HZ 1.0 1.8 5.5 390 269 A 20 PHE HZ A 24 ARG HDx 1.0 1.8 3.6 391 269 A 20 PHE HZ A 24 ARG HDy 1.0 1.8 3.6 392 270 A 20 PHE HZ A 24 ARG HGy 1.0 1.8 5.5 393 270 A 24 ARG HGx A 20 PHE HZ 1.0 1.8 5.5 394 271 A 20 PHE HZ A 52 LYS HBy 1.0 1.8 5.5 395 271 A 52 LYS HBx A 20 PHE HZ 1.0 1.8 5.5 396 272 A 20 PHE HZ A 52 LYS HGy 1.0 1.8 5.5 397 272 A 52 LYS HGx A 20 PHE HZ 1.0 1.8 5.5 398 273 A 53 ARG HA A 20 PHE HZ 1.0 1.8 2.7 399 274 A 20 PHE HZ A 53 ARG HBy 1.0 1.8 5.5 400 274 A 53 ARG HBx A 20 PHE HZ 1.0 1.8 5.5 401 275 A 20 PHE HZ A 53 ARG HGx 1.0 1.8 5.5 402 275 A 53 ARG HGy A 20 PHE HZ 1.0 1.8 5.5 403 276 A 53 ARG H A 20 PHE HZ 1.0 1.8 5.5 404 277 A 20 PHE HZ A 56 ILE HB 1.0 1.8 5.5 405 278 A 56 ILE HD11 A 20 PHE HZ 1.0 1.8 3.6 406 279 A 20 PHE HZ A 56 ILE HG12 1.0 1.8 5.5 407 280 A 22 GLU H A 21 ASN HA 1.0 1.8 3.6 408 281 A 22 GLU H A 21 ASN HBy 1.0 1.8 3.6 409 281 A 21 ASN HBx A 22 GLU H 1.0 1.8 3.6 410 282 A 21 ASN H A 22 GLU HBx 1.0 1.8 5.5 411 282 A 21 ASN H A 22 GLU HBy 1.0 1.8 5.5 412 283 A 21 ASN H A 22 GLU HGy 1.0 1.8 5.5 413 283 A 21 ASN H A 22 GLU HGx 1.0 1.8 5.5 414 284 A 21 ASN H A 22 GLU H 1.0 1.8 2.7 415 285 A 21 ASN H A 23 ASN H 1.0 1.8 5.5 416 286 A 23 ASN H A 22 GLU HA 1.0 1.8 3.6 417 287 A 23 ASN H A 22 GLU HBx 1.0 1.8 2.7 418 287 A 23 ASN H A 22 GLU HBy 1.0 1.8 2.7 419 288 A 23 ASN H A 22 GLU HGy 1.0 1.8 5.5 420 288 A 23 ASN H A 22 GLU HGx 1.0 1.8 5.5 421 289 A 22 GLU H A 23 ASN HA 1.0 1.8 5.5 422 290 A 22 GLU H A 23 ASN H 1.0 1.8 2.7 423 291 A 23 ASN HA A 24 ARG HBy 1.0 1.8 5.5 424 291 A 24 ARG HBx A 23 ASN HA 1.0 1.8 5.5 425 292 A 23 ASN HA A 24 ARG HGy 1.0 1.8 5.5 426 292 A 24 ARG HGx A 23 ASN HA 1.0 1.8 5.5 427 293 A 23 ASN HA A 24 ARG H 1.0 1.8 2.7 428 294 A 24 ARG H A 23 ASN HBy 1.0 1.8 5.5 429 294 A 24 ARG H A 23 ASN HBx 1.0 1.8 5.5 430 295 A 26 LEU HDy% A 23 ASN HBy 1.0 1.8 5.5 431 295 A 26 LEU HDy% A 23 ASN HBx 1.0 1.8 5.5 432 296 A 26 LEU HDy% A 23 ASN HD2x 1.0 1.8 5.5 433 296 A 26 LEU HDy% A 23 ASN HD2y 1.0 1.8 5.5 434 297 A 23 ASN H A 24 ARG H 1.0 1.8 5.5 435 298 A 24 ARG HA A 25 TYR H 1.0 1.8 3.6 436 299 A 49 PHE HD% A 24 ARG HA 1.0 1.8 5.5 437 300 A 49 PHE HE% A 24 ARG HA 1.0 1.8 3.6 438 301 A 25 TYR HD% A 24 ARG HBy 1.0 1.8 5.5 439 301 A 24 ARG HBx A 25 TYR HD% 1.0 1.8 5.5 440 302 A 25 TYR H A 24 ARG HBy 1.0 1.8 5.5 441 302 A 24 ARG HBx A 25 TYR H 1.0 1.8 5.5 442 303 A 25 TYR HE% A 24 ARG HDx 1.0 1.8 5.5 443 303 A 24 ARG HDy A 25 TYR HE% 1.0 1.8 5.5 444 304 A 25 TYR HD% A 24 ARG HGy 1.0 1.8 5.5 445 304 A 24 ARG HGx A 25 TYR HD% 1.0 1.8 5.5 446 305 A 25 TYR HE% A 24 ARG HGy 1.0 1.8 5.5 447 305 A 24 ARG HGx A 25 TYR HE% 1.0 1.8 5.5 448 306 A 25 TYR H A 24 ARG HGy 1.0 1.8 5.5 449 306 A 24 ARG HGx A 25 TYR H 1.0 1.8 5.5 450 307 A 53 ARG HA A 24 ARG HGy 1.0 1.8 5.5 451 307 A 24 ARG HGx A 53 ARG HA 1.0 1.8 5.5 452 308 A 24 ARG HGx A 53 ARG HDy 1.0 1.8 5.5 453 308 A 24 ARG HGy A 53 ARG HDy 1.0 1.8 5.5 454 308 A 53 ARG HDx A 24 ARG HGy 1.0 1.8 5.5 455 308 A 24 ARG HGx A 53 ARG HDx 1.0 1.8 5.5 456 309 A 24 ARG H A 25 TYR HD% 1.0 1.8 5.5 457 310 A 24 ARG H A 25 TYR H 1.0 1.8 2.7 458 311 A 25 TYR HA A 26 LEU H 1.0 1.8 2.7 459 312 A 49 PHE HD% A 25 TYR HA 1.0 1.8 5.5 460 313 A 49 PHE HE% A 25 TYR HA 1.0 1.8 5.5 461 314 A 26 LEU H A 25 TYR HBy 1.0 1.8 3.6 462 314 A 26 LEU H A 25 TYR HBx 1.0 1.8 3.6 463 315 A 25 TYR HD% A 26 LEU H 1.0 1.8 5.5 464 316 A 25 TYR H A 26 LEU HG 1.0 1.8 5.5 465 317 A 25 TYR H A 26 LEU H 1.0 1.8 5.5 466 318 A 49 PHE HE% A 25 TYR H 1.0 1.8 5.5 467 319 A 26 LEU HA A 27 THR HG21 1.0 1.8 5.5 468 320 A 26 LEU HA A 27 THR H 1.0 1.8 2.7 469 321 A 27 THR H A 26 LEU HBy 1.0 1.8 5.5 470 321 A 27 THR H A 26 LEU HBx 1.0 1.8 5.5 471 322 A 31 ARG H A 26 LEU HBy 1.0 1.8 5.5 472 322 A 26 LEU HBx A 31 ARG H 1.0 1.8 5.5 473 323 A 27 THR H A 26 LEU HDx% 1.0 1.8 5.5 474 324 A 26 LEU HDx% A 30 ARG HGx 1.0 1.8 5.5 475 324 A 26 LEU HDx% A 30 ARG HGy 1.0 1.8 5.5 476 325 A 26 LEU HDx% A 30 ARG H 1.0 1.8 5.5 477 326 A 26 LEU HDx% A 31 ARG HA 1.0 1.8 3.6 478 327 A 26 LEU HDx% A 31 ARG HBx 1.0 1.8 5.5 479 327 A 26 LEU HDx% A 31 ARG HBy 1.0 1.8 5.5 480 328 A 26 LEU HDx% A 31 ARG HDx 1.0 1.8 5.5 481 328 A 26 LEU HDx% A 31 ARG HDy 1.0 1.8 5.5 482 329 A 26 LEU HDx% A 31 ARG HGx 1.0 1.8 3.6 483 329 A 26 LEU HDx% A 31 ARG HGy 1.0 1.8 3.6 484 330 A 31 ARG H A 26 LEU HDx% 1.0 1.8 5.5 485 331 A 26 LEU HDx% A 32 GLN H 1.0 1.8 5.5 486 332 A 26 LEU HDx% A 34 LEU HBy 1.0 1.8 5.5 487 332 A 34 LEU HBx A 26 LEU HDx% 1.0 1.8 5.5 488 333 A 26 LEU HDx% A 34 LEU HDy% 1.0 1.8 5.5 489 333 A 34 LEU HDx% A 26 LEU HDx% 1.0 1.8 5.5 490 334 A 26 LEU HDx% A 34 LEU H 1.0 1.8 5.5 491 335 A 45 ILE HG21 A 26 LEU HDx% 1.0 1.8 2.7 492 336 A 26 LEU HDx% A 46 LYS HA 1.0 1.8 3.6 493 337 A 26 LEU HDx% A 46 LYS H 1.0 1.8 5.5 494 338 A 26 LEU HDx% A 49 PHE HBy 1.0 1.8 5.5 495 338 A 26 LEU HDx% A 49 PHE HBx 1.0 1.8 5.5 496 339 A 49 PHE HD% A 26 LEU HDx% 1.0 1.8 3.6 497 340 A 49 PHE HE% A 26 LEU HDx% 1.0 1.8 3.6 498 341 A 26 LEU HDx% A 49 PHE H 1.0 1.8 5.5 499 342 A 26 LEU HDy% A 27 THR H 1.0 1.8 3.6 500 343 A 26 LEU HDy% A 30 ARG HDx 1.0 1.8 5.5 501 343 A 26 LEU HDy% A 30 ARG HDy 1.0 1.8 5.5 502 344 A 26 LEU HDy% A 30 ARG HGx 1.0 1.8 5.5 503 344 A 26 LEU HDy% A 30 ARG HGy 1.0 1.8 5.5 504 345 A 26 LEU HDy% A 30 ARG H 1.0 1.8 5.5 505 346 A 26 LEU HDy% A 31 ARG HA 1.0 1.8 3.6 506 347 A 26 LEU HDy% A 31 ARG HBx 1.0 1.8 5.5 507 347 A 26 LEU HDy% A 31 ARG HBy 1.0 1.8 5.5 508 348 A 26 LEU HDy% A 31 ARG HDx 1.0 1.8 5.5 509 348 A 26 LEU HDy% A 31 ARG HDy 1.0 1.8 5.5 510 349 A 26 LEU HDy% A 31 ARG HGx 1.0 1.8 5.5 511 349 A 26 LEU HDy% A 31 ARG HGy 1.0 1.8 5.5 512 350 A 26 LEU HDy% A 31 ARG H 1.0 1.8 5.5 513 351 A 26 LEU HDy% A 34 LEU HBy 1.0 1.8 5.5 514 351 A 34 LEU HBx A 26 LEU HDy% 1.0 1.8 5.5 515 352 A 26 LEU HDy% A 34 LEU HDy% 1.0 1.8 5.5 516 352 A 34 LEU HDx% A 26 LEU HDy% 1.0 1.8 5.5 517 353 A 45 ILE HG21 A 26 LEU HDy% 1.0 1.8 5.5 518 354 A 26 LEU HDy% A 46 LYS HA 1.0 1.8 5.5 519 355 A 48 TRP HE3 A 26 LEU HDy% 1.0 1.8 5.5 520 356 A 26 LEU HDy% A 49 PHE HBy 1.0 1.8 5.5 521 356 A 26 LEU HDy% A 49 PHE HBx 1.0 1.8 5.5 522 357 A 49 PHE HD% A 26 LEU HDy% 1.0 1.8 3.6 523 358 A 49 PHE HE% A 26 LEU HDy% 1.0 1.8 3.6 524 359 A 49 PHE HZ A 26 LEU HDy% 1.0 1.8 5.5 525 360 A 26 LEU H A 27 THR H 1.0 1.8 5.5 526 361 A 27 THR HA A 28 GLU HBx 1.0 1.8 5.5 527 361 A 27 THR HA A 28 GLU HBy 1.0 1.8 5.5 528 362 A 27 THR HA A 28 GLU H 1.0 1.8 2.7 529 363 A 27 THR HA A 29 ARG H 1.0 1.8 5.5 530 364 A 30 ARG H A 27 THR HA 1.0 1.8 5.5 531 365 A 27 THR HB A 28 GLU HBx 1.0 1.8 5.5 532 365 A 28 GLU HBy A 27 THR HB 1.0 1.8 5.5 533 366 A 28 GLU H A 27 THR HB 1.0 1.8 5.5 534 367 A 29 ARG H A 27 THR HB 1.0 1.8 5.5 535 368 A 30 ARG H A 27 THR HB 1.0 1.8 5.5 536 369 A 27 THR HG21 A 28 GLU H 1.0 1.8 5.5 537 370 A 27 THR HG21 A 30 ARG H 1.0 1.8 5.5 538 371 A 27 THR H A 28 GLU H 1.0 1.8 5.5 539 372 A 27 THR H A 30 ARG HBx 1.0 1.8 5.5 540 372 A 27 THR H A 30 ARG HBy 1.0 1.8 5.5 541 373 A 27 THR H A 31 ARG H 1.0 1.8 5.5 542 374 A 29 ARG H A 28 GLU HA 1.0 1.8 3.6 543 375 A 30 ARG H A 28 GLU HA 1.0 1.8 5.5 544 376 A 28 GLU HA A 31 ARG HBx 1.0 1.8 5.5 545 376 A 31 ARG HBy A 28 GLU HA 1.0 1.8 5.5 546 377 A 28 GLU HA A 31 ARG HDx 1.0 1.8 5.5 547 377 A 31 ARG HDy A 28 GLU HA 1.0 1.8 5.5 548 378 A 31 ARG H A 28 GLU HA 1.0 1.8 3.6 549 379 A 29 ARG H A 28 GLU HBx 1.0 1.8 2.7 550 379 A 28 GLU HBy A 29 ARG H 1.0 1.8 2.7 551 380 A 29 ARG H A 28 GLU HGx 1.0 1.8 5.5 552 380 A 29 ARG H A 28 GLU HGy 1.0 1.8 5.5 553 381 A 28 GLU H A 29 ARG HBy 1.0 1.8 5.5 554 381 A 28 GLU H A 29 ARG HBx 1.0 1.8 5.5 555 382 A 28 GLU H A 29 ARG H 1.0 1.8 3.6 556 383 A 31 ARG H A 28 GLU H 1.0 1.8 5.5 557 384 A 30 ARG H A 29 ARG HA 1.0 1.8 3.6 558 385 A 31 ARG H A 29 ARG HA 1.0 1.8 5.5 559 386 A 32 GLN H A 29 ARG HA 1.0 1.8 5.5 560 387 A 30 ARG H A 29 ARG HBy 1.0 1.8 2.7 561 387 A 30 ARG H A 29 ARG HBx 1.0 1.8 2.7 562 388 A 30 ARG H A 29 ARG HDx 1.0 1.8 5.5 563 388 A 30 ARG H A 29 ARG HDy 1.0 1.8 5.5 564 389 A 29 ARG HDy A 32 GLN HBy 1.0 1.8 5.5 565 389 A 29 ARG HDx A 32 GLN HBy 1.0 1.8 5.5 566 389 A 32 GLN HBx A 29 ARG HDx 1.0 1.8 5.5 567 389 A 29 ARG HDy A 32 GLN HBx 1.0 1.8 5.5 568 390 A 30 ARG H A 29 ARG H 1.0 1.8 3.6 569 391 A 31 ARG H A 29 ARG H 1.0 1.8 5.5 570 392 A 31 ARG H A 30 ARG HA 1.0 1.8 3.6 571 393 A 34 LEU H A 30 ARG HA 1.0 1.8 5.5 572 394 A 34 LEU HDx% A 30 ARG HE 1.0 1.8 5.5 573 395 A 31 ARG H A 30 ARG HGx 1.0 1.8 5.5 574 395 A 31 ARG H A 30 ARG HGy 1.0 1.8 5.5 575 396 A 30 ARG HGy A 33 GLN HGy 1.0 1.8 5.5 576 396 A 30 ARG HGx A 33 GLN HGy 1.0 1.8 5.5 577 396 A 33 GLN HGx A 30 ARG HGx 1.0 1.8 5.5 578 396 A 30 ARG HGy A 33 GLN HGx 1.0 1.8 5.5 579 397 A 30 ARG HGx A 34 LEU HDy% 1.0 1.8 5.5 580 397 A 30 ARG HGy A 34 LEU HDy% 1.0 1.8 5.5 581 397 A 34 LEU HDx% A 30 ARG HGx 1.0 1.8 5.5 582 397 A 34 LEU HDx% A 30 ARG HGy 1.0 1.8 5.5 583 398 A 30 ARG H A 31 ARG HA 1.0 1.8 5.5 584 399 A 30 ARG H A 31 ARG HBx 1.0 1.8 5.5 585 399 A 30 ARG H A 31 ARG HBy 1.0 1.8 5.5 586 400 A 31 ARG H A 30 ARG H 1.0 1.8 2.7 587 401 A 30 ARG H A 32 GLN HBy 1.0 1.8 5.5 588 401 A 30 ARG H A 32 GLN HBx 1.0 1.8 5.5 589 402 A 30 ARG H A 32 GLN H 1.0 1.8 5.5 590 403 A 31 ARG HA A 32 GLN H 1.0 1.8 3.6 591 404 A 31 ARG HA A 34 LEU HDy% 1.0 1.8 3.6 592 404 A 34 LEU HDx% A 31 ARG HA 1.0 1.8 3.6 593 405 A 31 ARG HA A 34 LEU H 1.0 1.8 5.5 594 406 A 31 ARG HA A 35 SER H 1.0 1.8 5.5 595 407 A 32 GLN H A 31 ARG HBx 1.0 1.8 2.7 596 407 A 31 ARG HBy A 32 GLN H 1.0 1.8 2.7 597 408 A 42 GLU HA A 31 ARG HDx 1.0 1.8 5.5 598 408 A 31 ARG HDy A 42 GLU HA 1.0 1.8 5.5 599 409 A 31 ARG HDy A 42 GLU HBx 1.0 1.8 5.5 600 409 A 31 ARG HDx A 42 GLU HBx 1.0 1.8 5.5 601 409 A 42 GLU HBy A 31 ARG HDx 1.0 1.8 5.5 602 409 A 31 ARG HDy A 42 GLU HBy 1.0 1.8 5.5 603 410 A 31 ARG HDy A 42 GLU HGy 1.0 1.8 5.5 604 410 A 31 ARG HDx A 42 GLU HGy 1.0 1.8 5.5 605 410 A 42 GLU HGx A 31 ARG HDx 1.0 1.8 5.5 606 410 A 31 ARG HDy A 42 GLU HGx 1.0 1.8 5.5 607 411 A 45 ILE HB A 31 ARG HDx 1.0 1.8 5.5 608 411 A 31 ARG HDy A 45 ILE HB 1.0 1.8 5.5 609 412 A 45 ILE HG21 A 31 ARG HDx 1.0 1.8 5.5 610 412 A 45 ILE HG21 A 31 ARG HDy 1.0 1.8 5.5 611 413 A 46 LYS HA A 31 ARG HDx 1.0 1.8 5.5 612 413 A 31 ARG HDy A 46 LYS HA 1.0 1.8 5.5 613 414 A 31 ARG HDy A 46 LYS HBy 1.0 1.8 3.6 614 414 A 31 ARG HDx A 46 LYS HBy 1.0 1.8 3.6 615 414 A 46 LYS HBx A 31 ARG HDx 1.0 1.8 3.6 616 414 A 31 ARG HDy A 46 LYS HBx 1.0 1.8 3.6 617 415 A 46 LYS H A 31 ARG HDx 1.0 1.8 5.5 618 415 A 31 ARG HDy A 46 LYS H 1.0 1.8 5.5 619 416 A 32 GLN HA A 31 ARG HGx 1.0 1.8 5.5 620 416 A 31 ARG HGy A 32 GLN HA 1.0 1.8 5.5 621 417 A 32 GLN H A 31 ARG HGx 1.0 1.8 5.5 622 417 A 31 ARG HGy A 32 GLN H 1.0 1.8 5.5 623 418 A 42 GLU HA A 31 ARG HGx 1.0 1.8 3.6 624 418 A 31 ARG HGy A 42 GLU HA 1.0 1.8 3.6 625 419 A 31 ARG HGx A 42 GLU HGy 1.0 1.8 3.6 626 419 A 31 ARG HGy A 42 GLU HGy 1.0 1.8 3.6 627 419 A 42 GLU HGx A 31 ARG HGx 1.0 1.8 3.6 628 419 A 31 ARG HGy A 42 GLU HGx 1.0 1.8 3.6 629 420 A 45 ILE HG21 A 31 ARG HGx 1.0 1.8 5.5 630 420 A 45 ILE HG21 A 31 ARG HGy 1.0 1.8 5.5 631 421 A 31 ARG H A 32 GLN HBy 1.0 1.8 5.5 632 421 A 31 ARG H A 32 GLN HBx 1.0 1.8 5.5 633 422 A 31 ARG H A 32 GLN H 1.0 1.8 3.6 634 423 A 31 ARG H A 33 GLN H 1.0 1.8 5.5 635 424 A 31 ARG H A 34 LEU HDy% 1.0 1.8 5.5 636 424 A 34 LEU HDx% A 31 ARG H 1.0 1.8 5.5 637 425 A 32 GLN HA A 33 GLN H 1.0 1.8 3.6 638 426 A 34 LEU H A 32 GLN HA 1.0 1.8 5.5 639 427 A 35 SER H A 32 GLN HA 1.0 1.8 3.6 640 428 A 32 GLN HA A 36 SER H 1.0 1.8 5.5 641 429 A 32 GLN HE2y A 33 GLN HGy 1.0 1.8 3.6 642 429 A 32 GLN HE2x A 33 GLN HGy 1.0 1.8 3.6 643 429 A 33 GLN HGx A 32 GLN HE2y 1.0 1.8 3.6 644 429 A 33 GLN HGx A 32 GLN HE2x 1.0 1.8 3.6 645 430 A 33 GLN H A 32 GLN HE2y 1.0 1.8 5.5 646 430 A 33 GLN H A 32 GLN HE2x 1.0 1.8 5.5 647 431 A 32 GLN H A 33 GLN H 1.0 1.8 2.7 648 432 A 34 LEU H A 33 GLN HA 1.0 1.8 3.6 649 433 A 34 LEU H A 33 GLN HBx 1.0 1.8 2.7 650 433 A 34 LEU H A 33 GLN HBy 1.0 1.8 2.7 651 434 A 35 SER H A 33 GLN HBx 1.0 1.8 5.5 652 434 A 35 SER H A 33 GLN HBy 1.0 1.8 5.5 653 435 A 34 LEU H A 33 GLN HGy 1.0 1.8 5.5 654 435 A 34 LEU H A 33 GLN HGx 1.0 1.8 5.5 655 436 A 34 LEU H A 33 GLN H 1.0 1.8 2.7 656 437 A 35 SER H A 34 LEU HA 1.0 1.8 3.6 657 438 A 34 LEU HA A 37 GLU HBy 1.0 1.8 5.5 658 438 A 34 LEU HA A 37 GLU HBx 1.0 1.8 5.5 659 439 A 34 LEU HA A 37 GLU H 1.0 1.8 5.5 660 440 A 38 LEU HDx% A 34 LEU HA 1.0 1.8 5.5 661 441 A 38 LEU HG A 34 LEU HA 1.0 1.8 5.5 662 442 A 35 SER H A 34 LEU HBy 1.0 1.8 3.6 663 442 A 34 LEU HBx A 35 SER H 1.0 1.8 3.6 664 443 A 36 SER H A 34 LEU HBy 1.0 1.8 5.5 665 443 A 34 LEU HBx A 36 SER H 1.0 1.8 5.5 666 444 A 40 LEU HDx% A 34 LEU HBy 1.0 1.8 5.5 667 444 A 40 LEU HDx% A 34 LEU HBx 1.0 1.8 5.5 668 445 A 45 ILE HD11 A 34 LEU HBy 1.0 1.8 5.5 669 445 A 34 LEU HBx A 45 ILE HD11 1.0 1.8 5.5 670 446 A 37 GLU H A 34 LEU HDy% 1.0 1.8 5.5 671 446 A 34 LEU HDx% A 37 GLU H 1.0 1.8 5.5 672 447 A 49 PHE HD% A 34 LEU HDy% 1.0 1.8 5.5 673 447 A 49 PHE HD% A 34 LEU HDx% 1.0 1.8 5.5 674 448 A 49 PHE HE% A 34 LEU HDy% 1.0 1.8 3.6 675 448 A 49 PHE HE% A 34 LEU HDx% 1.0 1.8 3.6 676 449 A 49 PHE HZ A 34 LEU HDy% 1.0 1.8 5.5 677 449 A 49 PHE HZ A 34 LEU HDx% 1.0 1.8 5.5 678 450 A 35 SER H A 34 LEU HG 1.0 1.8 5.5 679 451 A 34 LEU H A 35 SER H 1.0 1.8 2.7 680 452 A 34 LEU H A 36 SER H 1.0 1.8 5.5 681 453 A 34 LEU H A 37 GLU H 1.0 1.8 5.5 682 454 A 34 LEU H A 45 ILE HD11 1.0 1.8 5.5 683 455 A 36 SER H A 35 SER HA 1.0 1.8 3.6 684 456 A 35 SER HA A 38 LEU H 1.0 1.8 5.5 685 457 A 35 SER HA A 40 LEU HBy 1.0 1.8 5.5 686 457 A 40 LEU HBx A 35 SER HA 1.0 1.8 5.5 687 458 A 40 LEU HDx% A 35 SER HA 1.0 1.8 5.5 688 459 A 35 SER HA A 40 LEU H 1.0 1.8 5.5 689 460 A 42 GLU HA A 35 SER HA 1.0 1.8 5.5 690 461 A 45 ILE HD11 A 35 SER HA 1.0 1.8 2.7 691 462 A 42 GLU HA A 35 SER HBy 1.0 1.8 5.5 692 462 A 42 GLU HA A 35 SER HBx 1.0 1.8 5.5 693 463 A 42 GLU H A 35 SER HBy 1.0 1.8 5.5 694 463 A 35 SER HBx A 42 GLU H 1.0 1.8 5.5 695 464 A 45 ILE HD11 A 35 SER HBy 1.0 1.8 5.5 696 464 A 45 ILE HD11 A 35 SER HBx 1.0 1.8 5.5 697 465 A 35 SER H A 36 SER H 1.0 1.8 2.7 698 466 A 35 SER H A 37 GLU HBy 1.0 1.8 5.5 699 466 A 35 SER H A 37 GLU HBx 1.0 1.8 5.5 700 467 A 35 SER H A 37 GLU H 1.0 1.8 5.5 701 468 A 35 SER H A 42 GLU HGy 1.0 1.8 5.5 702 468 A 35 SER H A 42 GLU HGx 1.0 1.8 5.5 703 469 A 35 SER H A 45 ILE HD11 1.0 1.8 3.6 704 470 A 45 ILE HG21 A 35 SER H 1.0 1.8 5.5 705 471 A 37 GLU H A 36 SER HA 1.0 1.8 3.6 706 472 A 36 SER HA A 39 GLY H 1.0 1.8 5.5 707 473 A 37 GLU H A 36 SER HBx 1.0 1.8 2.7 708 473 A 37 GLU H A 36 SER HBy 1.0 1.8 2.7 709 474 A 36 SER H A 37 GLU HBy 1.0 1.8 5.5 710 474 A 36 SER H A 37 GLU HBx 1.0 1.8 5.5 711 475 A 36 SER H A 37 GLU H 1.0 1.8 3.6 712 476 A 36 SER H A 42 GLU HGy 1.0 1.8 5.5 713 476 A 42 GLU HGx A 36 SER H 1.0 1.8 5.5 714 477 A 36 SER H A 45 ILE HD11 1.0 1.8 5.5 715 478 A 38 LEU H A 37 GLU HBy 1.0 1.8 5.5 716 478 A 37 GLU HBx A 38 LEU H 1.0 1.8 5.5 717 479 A 39 GLY H A 38 LEU HA 1.0 1.8 5.5 718 480 A 40 LEU HDx% A 38 LEU HA 1.0 1.8 5.5 719 481 A 39 GLY H A 38 LEU HBx 1.0 1.8 5.5 720 481 A 39 GLY H A 38 LEU HBy 1.0 1.8 5.5 721 482 A 40 LEU HDx% A 38 LEU HBx 1.0 1.8 5.5 722 482 A 40 LEU HDx% A 38 LEU HBy 1.0 1.8 5.5 723 483 A 40 LEU H A 38 LEU HBx 1.0 1.8 3.6 724 483 A 40 LEU H A 38 LEU HBy 1.0 1.8 3.6 725 484 A 38 LEU HG A 39 GLY H 1.0 1.8 5.5 726 485 A 38 LEU H A 39 GLY H 1.0 1.8 2.7 727 486 A 40 LEU HDx% A 38 LEU H 1.0 1.8 5.5 728 487 A 38 LEU H A 40 LEU H 1.0 1.8 5.5 729 488 A 39 GLY HAx A 40 LEU HBy 1.0 1.8 5.5 730 488 A 39 GLY HAy A 40 LEU HBy 1.0 1.8 5.5 731 488 A 40 LEU HBx A 39 GLY HAx 1.0 1.8 5.5 732 488 A 40 LEU HBx A 39 GLY HAy 1.0 1.8 5.5 733 489 A 40 LEU H A 39 GLY HAx 1.0 1.8 3.6 734 489 A 39 GLY HAy A 40 LEU H 1.0 1.8 3.6 735 490 A 39 GLY H A 40 LEU HBy 1.0 1.8 5.5 736 490 A 40 LEU HBx A 39 GLY H 1.0 1.8 5.5 737 491 A 40 LEU H A 39 GLY H 1.0 1.8 3.6 738 492 A 40 LEU HA A 41 ASN H 1.0 1.8 2.7 739 493 A 40 LEU HA A 44 GLN HGx 1.0 1.8 5.5 740 493 A 44 GLN HGy A 40 LEU HA 1.0 1.8 5.5 741 494 A 40 LEU HBx A 41 ASN HBy 1.0 1.8 5.5 742 494 A 40 LEU HBy A 41 ASN HBy 1.0 1.8 5.5 743 494 A 41 ASN HBx A 40 LEU HBy 1.0 1.8 5.5 744 494 A 40 LEU HBx A 41 ASN HBx 1.0 1.8 5.5 745 495 A 41 ASN H A 40 LEU HBy 1.0 1.8 2.7 746 495 A 40 LEU HBx A 41 ASN H 1.0 1.8 2.7 747 496 A 40 LEU HBy A 44 GLN HBy 1.0 1.8 5.5 748 496 A 40 LEU HBx A 44 GLN HBy 1.0 1.8 5.5 749 496 A 44 GLN HBx A 40 LEU HBy 1.0 1.8 5.5 750 496 A 40 LEU HBx A 44 GLN HBx 1.0 1.8 5.5 751 497 A 40 LEU HBx A 44 GLN HGx 1.0 1.8 5.5 752 497 A 40 LEU HBy A 44 GLN HGx 1.0 1.8 5.5 753 497 A 44 GLN HGy A 40 LEU HBy 1.0 1.8 5.5 754 497 A 40 LEU HBx A 44 GLN HGy 1.0 1.8 5.5 755 498 A 45 ILE H A 40 LEU HBy 1.0 1.8 5.5 756 498 A 40 LEU HBx A 45 ILE H 1.0 1.8 5.5 757 499 A 40 LEU HDx% A 41 ASN H 1.0 1.8 5.5 758 500 A 40 LEU HDx% A 44 GLN HBy 1.0 1.8 5.5 759 500 A 40 LEU HDx% A 44 GLN HBx 1.0 1.8 5.5 760 501 A 40 LEU HDx% A 45 ILE HA 1.0 1.8 5.5 761 502 A 40 LEU HDx% A 45 ILE HG12 1.0 1.8 3.6 762 502 A 40 LEU HDx% A 45 ILE HG13 1.0 1.8 3.6 763 503 A 40 LEU HDx% A 45 ILE H 1.0 1.8 5.5 764 504 A 40 LEU HDy% A 41 ASN H 1.0 1.8 3.6 765 505 A 40 LEU H A 41 ASN H 1.0 1.8 5.5 766 506 A 42 GLU HA A 41 ASN HA 1.0 1.8 5.5 767 507 A 41 ASN HA A 42 GLU HBx 1.0 1.8 5.5 768 507 A 42 GLU HBy A 41 ASN HA 1.0 1.8 5.5 769 508 A 41 ASN HA A 42 GLU HGy 1.0 1.8 5.5 770 508 A 42 GLU HGx A 41 ASN HA 1.0 1.8 5.5 771 509 A 42 GLU H A 41 ASN HA 1.0 1.8 2.7 772 510 A 41 ASN HA A 43 ALA H 1.0 1.8 5.5 773 511 A 41 ASN HA A 44 GLN H 1.0 1.8 5.5 774 512 A 42 GLU H A 41 ASN HBy 1.0 1.8 3.6 775 512 A 42 GLU H A 41 ASN HBx 1.0 1.8 3.6 776 513 A 43 ALA H A 41 ASN HBy 1.0 1.8 3.6 777 513 A 41 ASN HBx A 43 ALA H 1.0 1.8 3.6 778 514 A 44 GLN H A 41 ASN HBy 1.0 1.8 5.5 779 514 A 41 ASN HBx A 44 GLN H 1.0 1.8 5.5 780 515 A 41 ASN HD2x A 42 GLU HBx 1.0 1.8 5.5 781 515 A 41 ASN HD2y A 42 GLU HBx 1.0 1.8 5.5 782 515 A 42 GLU HBy A 41 ASN HD2y 1.0 1.8 5.5 783 515 A 42 GLU HBy A 41 ASN HD2x 1.0 1.8 5.5 784 516 A 42 GLU H A 41 ASN HD2y 1.0 1.8 5.5 785 516 A 42 GLU H A 41 ASN HD2x 1.0 1.8 5.5 786 517 A 43 ALA HB1 A 41 ASN HD2y 1.0 1.8 5.5 787 517 A 41 ASN HD2x A 43 ALA HB1 1.0 1.8 5.5 788 518 A 43 ALA H A 41 ASN HD2y 1.0 1.8 5.5 789 518 A 43 ALA H A 41 ASN HD2x 1.0 1.8 5.5 790 519 A 41 ASN HD2y A 44 GLN HE2y 1.0 1.8 5.5 791 519 A 41 ASN HD2x A 44 GLN HE2y 1.0 1.8 5.5 792 519 A 44 GLN HE2x A 41 ASN HD2y 1.0 1.8 5.5 793 519 A 41 ASN HD2x A 44 GLN HE2x 1.0 1.8 5.5 794 520 A 41 ASN HD2y A 44 GLN HGx 1.0 1.8 5.5 795 520 A 41 ASN HD2x A 44 GLN HGx 1.0 1.8 5.5 796 520 A 44 GLN HGy A 41 ASN HD2y 1.0 1.8 5.5 797 520 A 44 GLN HGy A 41 ASN HD2x 1.0 1.8 5.5 798 521 A 42 GLU H A 41 ASN H 1.0 1.8 5.5 799 522 A 41 ASN H A 44 GLN HBy 1.0 1.8 3.6 800 522 A 44 GLN HBx A 41 ASN H 1.0 1.8 3.6 801 523 A 41 ASN H A 44 GLN HGx 1.0 1.8 5.5 802 523 A 44 GLN HGy A 41 ASN H 1.0 1.8 5.5 803 524 A 41 ASN H A 44 GLN H 1.0 1.8 5.5 804 525 A 42 GLU HA A 43 ALA H 1.0 1.8 5.5 805 526 A 42 GLU HA A 45 ILE HB 1.0 1.8 5.5 806 527 A 43 ALA H A 42 GLU HBx 1.0 1.8 2.7 807 527 A 42 GLU HBy A 43 ALA H 1.0 1.8 2.7 808 528 A 43 ALA H A 42 GLU HGy 1.0 1.8 5.5 809 528 A 42 GLU HGx A 43 ALA H 1.0 1.8 5.5 810 529 A 42 GLU H A 43 ALA HB1 1.0 1.8 5.5 811 530 A 42 GLU H A 43 ALA H 1.0 1.8 3.6 812 531 A 42 GLU H A 44 GLN H 1.0 1.8 5.5 813 532 A 46 LYS H A 43 ALA HA 1.0 1.8 3.6 814 533 A 43 ALA HA A 47 ILE H 1.0 1.8 5.5 815 534 A 44 GLN H A 43 ALA HB1 1.0 1.8 2.7 816 535 A 43 ALA HB1 A 47 ILE HD11 1.0 1.8 5.5 817 536 A 43 ALA H A 44 GLN HBy 1.0 1.8 5.5 818 536 A 44 GLN HBx A 43 ALA H 1.0 1.8 5.5 819 537 A 43 ALA H A 44 GLN H 1.0 1.8 2.7 820 538 A 45 ILE H A 43 ALA H 1.0 1.8 5.5 821 539 A 44 GLN HA A 46 LYS H 1.0 1.8 5.5 822 540 A 44 GLN HA A 47 ILE HB 1.0 1.8 5.5 823 541 A 44 GLN HA A 47 ILE HD11 1.0 1.8 3.6 824 542 A 44 GLN HA A 47 ILE HG13 1.0 1.8 5.5 825 543 A 44 GLN HA A 47 ILE HG21 1.0 1.8 5.5 826 544 A 44 GLN HA A 47 ILE H 1.0 1.8 3.6 827 545 A 44 GLN HA A 48 TRP H 1.0 1.8 5.5 828 546 A 45 ILE H A 44 GLN HBy 1.0 1.8 3.6 829 546 A 44 GLN HBx A 45 ILE H 1.0 1.8 3.6 830 547 A 45 ILE H A 44 GLN HGx 1.0 1.8 5.5 831 547 A 44 GLN HGy A 45 ILE H 1.0 1.8 5.5 832 548 A 45 ILE HA A 44 GLN H 1.0 1.8 5.5 833 549 A 45 ILE HB A 44 GLN H 1.0 1.8 5.5 834 550 A 45 ILE HD11 A 44 GLN H 1.0 1.8 5.5 835 551 A 44 GLN H A 45 ILE HG12 1.0 1.8 5.5 836 551 A 45 ILE HG13 A 44 GLN H 1.0 1.8 5.5 837 552 A 45 ILE H A 44 GLN H 1.0 1.8 2.7 838 553 A 46 LYS H A 44 GLN H 1.0 1.8 5.5 839 554 A 45 ILE HA A 46 LYS H 1.0 1.8 5.5 840 555 A 45 ILE HA A 48 TRP HBx 1.0 1.8 3.6 841 555 A 45 ILE HA A 48 TRP HBy 1.0 1.8 3.6 842 556 A 45 ILE HA A 48 TRP H 1.0 1.8 3.6 843 557 A 46 LYS H A 45 ILE HB 1.0 1.8 2.7 844 558 A 45 ILE HG21 A 46 LYS HA 1.0 1.8 5.5 845 559 A 45 ILE HG21 A 46 LYS H 1.0 1.8 5.5 846 560 A 49 PHE HD% A 45 ILE HG21 1.0 1.8 3.6 847 561 A 49 PHE HE% A 45 ILE HG21 1.0 1.8 3.6 848 562 A 46 LYS H A 45 ILE H 1.0 1.8 3.6 849 563 A 46 LYS HA A 49 PHE HBy 1.0 1.8 5.5 850 563 A 46 LYS HA A 49 PHE HBx 1.0 1.8 5.5 851 564 A 46 LYS HA A 49 PHE H 1.0 1.8 5.5 852 565 A 46 LYS HA A 50 GLN H 1.0 1.8 5.5 853 566 A 47 ILE HG13 A 46 LYS HBy 1.0 1.8 5.5 854 566 A 46 LYS HBx A 47 ILE HG13 1.0 1.8 5.5 855 567 A 47 ILE H A 46 LYS HBy 1.0 1.8 5.5 856 567 A 46 LYS HBx A 47 ILE H 1.0 1.8 5.5 857 568 A 46 LYS HDy A 50 GLN HE2y 1.0 1.8 5.5 858 568 A 46 LYS HDx A 50 GLN HE2y 1.0 1.8 5.5 859 568 A 50 GLN HE2x A 46 LYS HDx 1.0 1.8 5.5 860 568 A 46 LYS HDy A 50 GLN HE2x 1.0 1.8 5.5 861 569 A 46 LYS H A 47 ILE H 1.0 1.8 3.6 862 570 A 49 PHE H A 47 ILE HA 1.0 1.8 5.5 863 571 A 47 ILE HA A 50 GLN HBy 1.0 1.8 5.5 864 571 A 47 ILE HA A 50 GLN HBx 1.0 1.8 5.5 865 572 A 47 ILE HA A 50 GLN HGy 1.0 1.8 5.5 866 572 A 47 ILE HA A 50 GLN HGx 1.0 1.8 5.5 867 573 A 50 GLN H A 47 ILE HA 1.0 1.8 3.6 868 574 A 47 ILE HA A 51 ASN H 1.0 1.8 5.5 869 575 A 48 TRP H A 47 ILE HB 1.0 1.8 2.7 870 576 A 48 TRP H A 47 ILE HD11 1.0 1.8 5.5 871 577 A 48 TRP H A 47 ILE HG12 1.0 1.8 5.5 872 578 A 47 ILE HG12 A 50 GLN HBy 1.0 1.8 5.5 873 578 A 50 GLN HBx A 47 ILE HG12 1.0 1.8 5.5 874 579 A 48 TRP HA A 47 ILE HG21 1.0 1.8 5.5 875 580 A 48 TRP H A 47 ILE HG21 1.0 1.8 3.6 876 581 A 47 ILE HG21 A 50 GLN HBy 1.0 1.8 5.5 877 581 A 47 ILE HG21 A 50 GLN HBx 1.0 1.8 5.5 878 582 A 47 ILE HG21 A 50 GLN H 1.0 1.8 5.5 879 583 A 47 ILE HG21 A 51 ASN HBy 1.0 1.8 5.5 880 583 A 47 ILE HG21 A 51 ASN HBx 1.0 1.8 5.5 881 584 A 47 ILE HG21 A 51 ASN HD2x 1.0 1.8 3.6 882 584 A 47 ILE HG21 A 51 ASN HD2y 1.0 1.8 3.6 883 585 A 47 ILE HG21 A 51 ASN H 1.0 1.8 5.5 884 586 A 49 PHE H A 47 ILE H 1.0 1.8 5.5 885 587 A 48 TRP HA A 49 PHE H 1.0 1.8 3.6 886 588 A 48 TRP HA A 51 ASN HBy 1.0 1.8 3.6 887 588 A 48 TRP HA A 51 ASN HBx 1.0 1.8 3.6 888 589 A 48 TRP HA A 51 ASN HD2x 1.0 1.8 5.5 889 589 A 48 TRP HA A 51 ASN HD2y 1.0 1.8 5.5 890 590 A 48 TRP HA A 51 ASN H 1.0 1.8 3.6 891 591 A 48 TRP HA A 52 LYS H 1.0 1.8 5.5 892 592 A 49 PHE HD% A 48 TRP HBx 1.0 1.8 5.5 893 592 A 48 TRP HBy A 49 PHE HD% 1.0 1.8 5.5 894 593 A 49 PHE H A 48 TRP HBx 1.0 1.8 3.6 895 593 A 48 TRP HBy A 49 PHE H 1.0 1.8 3.6 896 594 A 48 TRP HE3 A 49 PHE HA 1.0 1.8 3.6 897 595 A 48 TRP HE3 A 49 PHE HBy 1.0 1.8 5.5 898 595 A 48 TRP HE3 A 49 PHE HBx 1.0 1.8 5.5 899 596 A 48 TRP HE3 A 49 PHE HD% 1.0 1.8 2.7 900 597 A 48 TRP HE3 A 49 PHE HE% 1.0 1.8 5.5 901 598 A 48 TRP HE3 A 49 PHE H 1.0 1.8 3.6 902 599 A 48 TRP HE3 A 52 LYS HBy 1.0 1.8 5.5 903 599 A 48 TRP HE3 A 52 LYS HBx 1.0 1.8 5.5 904 600 A 48 TRP HH2 A 52 LYS HDx 1.0 1.8 5.5 905 600 A 48 TRP HH2 A 52 LYS HDy 1.0 1.8 5.5 906 601 A 48 TRP HH2 A 52 LYS HEx 1.0 1.8 5.5 907 601 A 48 TRP HH2 A 52 LYS HEy 1.0 1.8 5.5 908 602 A 48 TRP H A 49 PHE H 1.0 1.8 3.6 909 603 A 48 TRP HZ2 A 52 LYS HDx 1.0 1.8 5.5 910 603 A 48 TRP HZ2 A 52 LYS HDy 1.0 1.8 5.5 911 604 A 48 TRP HZ2 A 52 LYS HEx 1.0 1.8 5.5 912 604 A 48 TRP HZ2 A 52 LYS HEy 1.0 1.8 5.5 913 605 A 48 TRP HZ2 A 52 LYS HGy 1.0 1.8 3.6 914 605 A 48 TRP HZ2 A 52 LYS HGx 1.0 1.8 3.6 915 606 A 48 TRP HZ3 A 49 PHE HD% 1.0 1.8 5.5 916 607 A 48 TRP HZ3 A 49 PHE HE% 1.0 1.8 5.5 917 608 A 49 PHE HZ A 48 TRP HZ3 1.0 1.8 5.5 918 609 A 49 PHE HA A 50 GLN H 1.0 1.8 3.6 919 610 A 49 PHE HA A 51 ASN H 1.0 1.8 5.5 920 611 A 49 PHE HA A 52 LYS HBy 1.0 1.8 3.6 921 611 A 52 LYS HBx A 49 PHE HA 1.0 1.8 3.6 922 612 A 49 PHE HA A 52 LYS H 1.0 1.8 3.6 923 613 A 49 PHE HA A 53 ARG H 1.0 1.8 5.5 924 614 A 50 GLN HA A 49 PHE HBy 1.0 1.8 5.5 925 614 A 49 PHE HBx A 50 GLN HA 1.0 1.8 5.5 926 615 A 50 GLN H A 49 PHE HBy 1.0 1.8 3.6 927 615 A 49 PHE HBx A 50 GLN H 1.0 1.8 3.6 928 616 A 49 PHE H A 50 GLN H 1.0 1.8 3.6 929 617 A 49 PHE H A 51 ASN H 1.0 1.8 5.5 930 618 A 51 ASN H A 50 GLN HA 1.0 1.8 3.6 931 619 A 52 LYS H A 50 GLN HA 1.0 1.8 5.5 932 620 A 53 ARG H A 50 GLN HA 1.0 1.8 3.6 933 621 A 50 GLN HA A 54 ALA HB1 1.0 1.8 5.5 934 622 A 50 GLN HA A 54 ALA H 1.0 1.8 5.5 935 623 A 51 ASN H A 50 GLN HBy 1.0 1.8 2.7 936 623 A 50 GLN HBx A 51 ASN H 1.0 1.8 2.7 937 624 A 52 LYS H A 50 GLN HBy 1.0 1.8 5.5 938 624 A 50 GLN HBx A 52 LYS H 1.0 1.8 5.5 939 625 A 53 ARG H A 50 GLN HBy 1.0 1.8 5.5 940 625 A 53 ARG H A 50 GLN HBx 1.0 1.8 5.5 941 626 A 50 GLN HE2y A 51 ASN HD2x 1.0 1.8 5.5 942 626 A 50 GLN HE2x A 51 ASN HD2x 1.0 1.8 5.5 943 626 A 51 ASN HD2y A 50 GLN HE2y 1.0 1.8 5.5 944 626 A 50 GLN HE2x A 51 ASN HD2y 1.0 1.8 5.5 945 627 A 50 GLN H A 51 ASN H 1.0 1.8 2.7 946 628 A 51 ASN HA A 52 LYS HA 1.0 1.8 5.5 947 629 A 52 LYS H A 51 ASN HA 1.0 1.8 3.6 948 630 A 53 ARG H A 51 ASN HA 1.0 1.8 5.5 949 631 A 54 ALA H A 51 ASN HA 1.0 1.8 3.6 950 632 A 51 ASN HA A 55 LYS H 1.0 1.8 5.5 951 633 A 52 LYS H A 51 ASN HBy 1.0 1.8 3.6 952 633 A 51 ASN HBx A 52 LYS H 1.0 1.8 3.6 953 634 A 53 ARG H A 51 ASN HBy 1.0 1.8 5.5 954 634 A 53 ARG H A 51 ASN HBx 1.0 1.8 5.5 955 635 A 54 ALA H A 51 ASN HBy 1.0 1.8 5.5 956 635 A 51 ASN HBx A 54 ALA H 1.0 1.8 5.5 957 636 A 51 ASN HBy A 55 LYS HGx 1.0 1.8 5.5 958 636 A 51 ASN HBx A 55 LYS HGx 1.0 1.8 5.5 959 636 A 55 LYS HGy A 51 ASN HBy 1.0 1.8 5.5 960 636 A 51 ASN HBx A 55 LYS HGy 1.0 1.8 5.5 961 637 A 51 ASN H A 52 LYS HA 1.0 1.8 5.5 962 638 A 51 ASN H A 52 LYS H 1.0 1.8 3.6 963 639 A 53 ARG H A 51 ASN H 1.0 1.8 5.5 964 640 A 53 ARG H A 52 LYS HA 1.0 1.8 3.6 965 641 A 52 LYS HA A 55 LYS HBx 1.0 1.8 5.5 966 641 A 52 LYS HA A 55 LYS HBy 1.0 1.8 5.5 967 642 A 52 LYS HA A 55 LYS H 1.0 1.8 3.6 968 643 A 52 LYS HA A 56 ILE H 1.0 1.8 5.5 969 644 A 53 ARG H A 52 LYS HBy 1.0 1.8 3.6 970 644 A 52 LYS HBx A 53 ARG H 1.0 1.8 3.6 971 645 A 56 ILE HD11 A 52 LYS HBy 1.0 1.8 5.5 972 645 A 52 LYS HBx A 56 ILE HD11 1.0 1.8 5.5 973 646 A 53 ARG HA A 52 LYS HGy 1.0 1.8 5.5 974 646 A 52 LYS HGx A 53 ARG HA 1.0 1.8 5.5 975 647 A 53 ARG H A 52 LYS HGy 1.0 1.8 5.5 976 647 A 52 LYS HGx A 53 ARG H 1.0 1.8 5.5 977 648 A 52 LYS H A 53 ARG HBy 1.0 1.8 5.5 978 648 A 53 ARG HBx A 52 LYS H 1.0 1.8 5.5 979 649 A 53 ARG H A 52 LYS H 1.0 1.8 2.7 980 650 A 52 LYS H A 54 ALA HB1 1.0 1.8 5.5 981 651 A 53 ARG HA A 54 ALA H 1.0 1.8 3.6 982 652 A 54 ALA H A 53 ARG HBy 1.0 1.8 3.6 983 652 A 53 ARG HBx A 54 ALA H 1.0 1.8 3.6 984 653 A 53 ARG H A 54 ALA H 1.0 1.8 2.7 985 654 A 53 ARG H A 55 LYS HEx 1.0 1.8 5.5 986 654 A 53 ARG H A 55 LYS HEy 1.0 1.8 5.5 987 655 A 53 ARG H A 56 ILE H 1.0 1.8 5.5 988 656 A 56 ILE H A 55 LYS HA 1.0 1.8 3.6 989 657 A 55 LYS HA A 57 LYS H 1.0 1.8 5.5 990 658 A 56 ILE HD11 A 55 LYS HBx 1.0 1.8 5.5 991 658 A 56 ILE HD11 A 55 LYS HBy 1.0 1.8 5.5 992 659 A 56 ILE H A 55 LYS HBx 1.0 1.8 5.5 993 659 A 55 LYS HBy A 56 ILE H 1.0 1.8 5.5 994 660 A 56 ILE H A 55 LYS HEx 1.0 1.8 5.5 995 660 A 56 ILE H A 55 LYS HEy 1.0 1.8 5.5 996 661 A 56 ILE H A 55 LYS HGx 1.0 1.8 5.5 997 661 A 55 LYS HGy A 56 ILE H 1.0 1.8 5.5 998 662 A 55 LYS H A 56 ILE H 1.0 1.8 2.7 999 663 A 55 LYS H A 57 LYS H 1.0 1.8 5.5 1000 664 A 57 LYS H A 56 ILE HA 1.0 1.8 3.6 1001 665 A 56 ILE HB A 57 LYS H 1.0 1.8 5.5 1002 666 A 57 LYS H A 56 ILE HG13 1.0 1.8 5.5 1003 667 A 56 ILE HG12 A 57 LYS H 1.0 1.8 5.5 1004 668 A 57 LYS H A 56 ILE HG21 1.0 1.8 3.6 1005 669 A 56 ILE HG21 A 58 LYS H 1.0 1.8 5.5 1006 670 A 56 ILE H A 57 LYS H 1.0 1.8 3.6 1007 671 A 58 LYS H A 57 LYS HA 1.0 1.8 2.7 1008 672 A 57 LYS H A 58 LYS H 1.0 1.8 5.5 1009 673 A 58 LYS HA A 59 SER H 1.0 1.8 3.6 1010 674 A 59 SER H A 58 LYS HGx 1.0 1.8 5.5 1011 674 A 59 SER H A 58 LYS HGy 1.0 1.8 5.5 1012 675 A 58 LYS H A 59 SER H 1.0 1.8 5.5 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 9 SER H A 12 GLN OE1 1.0 1.8 2.1 2 2 A 12 GLN OE1 A 9 SER N 1.0 2.7 3.1 3 3 A 12 GLN H A 9 SER OG 1.0 1.8 2.1 4 4 A 9 SER OG A 12 GLN N 1.0 2.7 3.1 5 5 A 13 LEU H A 9 SER O 1.0 1.8 2.1 6 6 A 9 SER O A 13 LEU N 1.0 2.7 3.1 7 7 A 14 ALA H A 10 SER O 1.0 1.8 2.1 8 8 A 10 SER O A 14 ALA N 1.0 2.7 3.1 9 9 A 15 ARG H A 11 GLU O 1.0 1.8 2.1 10 10 A 11 GLU O A 15 ARG N 1.0 2.7 3.1 11 11 A 16 LEU H A 12 GLN O 1.0 1.8 2.1 12 12 A 12 GLN O A 16 LEU N 1.0 2.7 3.1 13 13 A 17 LYS H A 13 LEU O 1.0 1.8 2.1 14 14 A 13 LEU O A 17 LYS N 1.0 2.7 3.1 15 15 A 18 ARG H A 14 ALA O 1.0 1.8 2.1 16 16 A 14 ALA O A 18 ARG N 1.0 2.7 3.1 17 17 A 19 GLU H A 15 ARG O 1.0 1.8 2.1 18 18 A 15 ARG O A 19 GLU N 1.0 2.7 3.1 19 19 A 20 PHE H A 16 LEU O 1.0 1.8 2.1 20 20 A 16 LEU O A 20 PHE N 1.0 2.7 3.1 21 21 A 21 ASN H A 17 LYS O 1.0 1.8 2.1 22 22 A 17 LYS O A 21 ASN N 1.0 2.7 3.1 23 23 A 23 ASN H A 19 GLU O 1.0 1.8 2.1 24 24 A 19 GLU O A 23 ASN N 1.0 2.7 3.1 25 25 A 30 ARG H A 27 THR OG1 1.0 1.8 2.1 26 26 A 27 THR OG1 A 30 ARG N 1.0 2.7 3.1 27 27 A 31 ARG H A 27 THR O 1.0 1.8 2.1 28 28 A 27 THR O A 31 ARG N 1.0 2.7 3.1 29 29 A 32 GLN H A 28 GLU O 1.0 1.8 2.1 30 30 A 28 GLU O A 32 GLN N 1.0 2.7 3.1 31 31 A 33 GLN H A 29 ARG O 1.0 1.8 2.1 32 32 A 29 ARG O A 33 GLN N 1.0 2.7 3.1 33 33 A 34 LEU H A 30 ARG O 1.0 1.8 2.1 34 34 A 30 ARG O A 34 LEU N 1.0 2.7 3.1 35 35 A 35 SER H A 31 ARG O 1.0 1.8 2.1 36 36 A 31 ARG O A 35 SER N 1.0 2.7 3.1 37 37 A 36 SER H A 32 GLN O 1.0 1.8 2.1 38 38 A 32 GLN O A 36 SER N 1.0 2.7 3.1 39 39 A 37 GLU H A 33 GLN O 1.0 1.8 2.1 40 40 A 33 GLN O A 37 GLU N 1.0 2.7 3.1 41 41 A 38 LEU H A 34 LEU O 1.0 1.8 2.1 42 42 A 34 LEU O A 38 LEU N 1.0 2.7 3.1 43 43 A 39 GLY H A 35 SER O 1.0 1.8 2.1 44 44 A 35 SER O A 39 GLY N 1.0 2.7 3.1 45 45 A 40 LEU H A 35 SER O 1.0 1.8 2.1 46 46 A 35 SER O A 40 LEU N 1.0 2.7 3.1 47 47 A 44 GLN H A 41 ASN O 1.0 1.8 2.1 48 48 A 41 ASN O A 44 GLN N 1.0 2.7 3.1 49 49 A 45 ILE H A 41 ASN O 1.0 1.8 2.1 50 50 A 41 ASN O A 45 ILE N 1.0 2.7 3.1 51 51 A 46 LYS H A 42 GLU O 1.0 1.8 2.1 52 52 A 42 GLU O A 46 LYS N 1.0 2.7 3.1 53 53 A 47 ILE H A 43 ALA O 1.0 1.8 2.1 54 54 A 43 ALA O A 47 ILE N 1.0 2.7 3.1 55 55 A 48 TRP H A 44 GLN O 1.0 1.8 2.1 56 56 A 44 GLN O A 48 TRP N 1.0 2.7 3.1 57 57 A 49 PHE H A 45 ILE O 1.0 1.8 2.1 58 58 A 45 ILE O A 49 PHE N 1.0 2.7 3.1 59 59 A 50 GLN H A 46 LYS O 1.0 1.8 2.1 60 60 A 46 LYS O A 50 GLN N 1.0 2.7 3.1 stop_ save_