data_nef_c30241_5up1 save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code BMRB 30240 BMRB 30242 PDB 5UP1 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 2 GLY middle . false 3 A 3 SER middle . . 4 A 4 SER middle . . 5 A 5 HIS middle . . 6 A 6 HIS middle . . 7 A 7 HIS middle . . 8 A 8 HIS middle . . 9 A 9 HIS middle . . 10 A 10 HIS middle . . 11 A 11 SER middle . . 12 A 12 SER middle . . 13 A 13 GLY middle . false 14 A 14 LEU middle . . 15 A 15 VAL middle . . 16 A 16 PRO middle . false 17 A 17 ARG middle . . 18 A 18 GLY middle . false 19 A 19 SER middle . . 20 A 20 HIS middle . . 21 A 21 MET middle . . 22 A 22 THR middle . . 23 A 23 THR middle . . 24 A 24 VAL middle . . 25 A 25 LYS middle . . 26 A 26 LEU middle . . 27 A 27 GLY middle . false 28 A 28 ASP middle . . 29 A 29 ILE middle . . 30 A 30 LYS middle . . 31 A 31 VAL middle . . 32 A 32 THR middle . . 33 A 33 PHE middle . . 34 A 34 ASP middle . . 35 A 35 ASN middle . . 36 A 36 PRO middle . false 37 A 37 GLU middle . . 38 A 38 LYS middle . . 39 A 39 ALA middle . . 40 A 40 LYS middle . . 41 A 41 LYS middle . . 42 A 42 TYR middle . . 43 A 43 ALA middle . . 44 A 44 GLN middle . . 45 A 45 LYS middle . . 46 A 46 LEU middle . . 47 A 47 ALA middle . . 48 A 48 LYS middle . . 49 A 49 ILE middle . . 50 A 50 TYR middle . . 51 A 51 GLN middle . . 52 A 52 LEU middle . . 53 A 53 THR middle . . 54 A 54 VAL middle . . 55 A 55 HIS middle . . 56 A 56 VAL middle . . 57 A 57 HIS middle . . 58 A 58 GLY middle . false 59 A 59 ASP middle . . 60 A 60 THR middle . . 61 A 61 ILE middle . . 62 A 62 HIS middle . . 63 A 63 VAL middle . . 64 A 64 LYS end . . stop_ save_ save_assigned_chemical_shifts_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chemical_shifts_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 14 LEU HA H 1 4.249 0.04 A 14 LEU HBx H 1 1.441 0.04 A 14 LEU HBy H 1 1.497 0.04 A 14 LEU HDx% H 1 0.787 0.04 A 14 LEU HDy% H 1 0.734 0.04 A 14 LEU C C 13 177.015 0.40 A 14 LEU CA C 13 55.036 0.40 A 14 LEU CB C 13 42.331 0.40 A 14 LEU CDy C 13 24.774 0.40 A 14 LEU CDx C 13 23.379 0.40 A 15 VAL H H 1 7.978 0.04 A 15 VAL N N 15 122.552 0.40 A 16 PRO HA H 1 4.293 0.04 A 16 PRO HBx H 1 1.769 0.04 A 16 PRO HBy H 1 2.177 0.04 A 16 PRO HDx H 1 3.540 0.04 A 16 PRO HDy H 1 3.742 0.04 A 16 PRO HGx H 1 1.833 0.04 A 16 PRO HGy H 1 1.933 0.04 A 16 PRO C C 13 176.858 0.40 A 16 PRO CA C 13 63.113 0.40 A 16 PRO CB C 13 32.012 0.40 A 16 PRO CD C 13 50.991 0.40 A 16 PRO CG C 13 27.314 0.40 A 17 ARG H H 1 8.385 0.04 A 17 ARG N N 15 122.013 0.40 A 18 GLY HAx H 1 3.491 0.04 A 18 GLY HAy H 1 3.894 0.04 A 18 GLY C C 13 174.112 0.40 A 18 GLY CA C 13 47.407 0.40 A 19 SER H H 1 8.502 0.04 A 19 SER N N 15 126.324 0.40 A 20 HIS HA H 1 4.610 0.04 A 20 HIS HBx H 1 2.997 0.04 A 20 HIS HBy H 1 3.076 0.04 A 20 HIS C C 13 174.509 0.40 A 20 HIS CA C 13 55.778 0.40 A 20 HIS CB C 13 30.353 0.40 A 21 MET H H 1 8.115 0.04 A 21 MET HA H 1 4.663 0.04 A 21 MET HBx H 1 1.732 0.04 A 21 MET HBy H 1 1.840 0.04 A 21 MET HGx H 1 2.303 0.04 A 21 MET HGy H 1 2.442 0.04 A 21 MET C C 13 176.283 0.40 A 21 MET CA C 13 55.260 0.40 A 21 MET CB C 13 33.259 0.40 A 21 MET CG C 13 32.075 0.40 A 21 MET N N 15 121.856 0.40 A 22 THR H H 1 8.692 0.04 A 22 THR HA H 1 4.942 0.04 A 22 THR HB H 1 3.553 0.04 A 22 THR HG2% H 1 1.003 0.04 A 22 THR C C 13 173.571 0.40 A 22 THR CA C 13 62.356 0.40 A 22 THR CB C 13 71.308 0.40 A 22 THR CG2 C 13 21.507 0.40 A 22 THR N N 15 120.352 0.40 A 23 THR H H 1 8.731 0.04 A 23 THR HA H 1 4.921 0.04 A 23 THR HB H 1 3.916 0.04 A 23 THR HG2% H 1 0.961 0.04 A 23 THR C C 13 172.818 0.40 A 23 THR CA C 13 62.454 0.40 A 23 THR CB C 13 70.676 0.40 A 23 THR CG2 C 13 20.961 0.40 A 23 THR N N 15 124.393 0.40 A 24 VAL H H 1 9.496 0.04 A 24 VAL HA H 1 4.939 0.04 A 24 VAL HB H 1 2.170 0.04 A 24 VAL HGx% H 1 1.083 0.04 A 24 VAL HGy% H 1 0.881 0.04 A 24 VAL C C 13 174.331 0.40 A 24 VAL CA C 13 61.465 0.40 A 24 VAL CB C 13 33.420 0.40 A 24 VAL CGy C 13 23.474 0.40 A 24 VAL CGx C 13 21.112 0.40 A 24 VAL N N 15 126.953 0.40 A 25 LYS H H 1 9.064 0.04 A 25 LYS HA H 1 5.172 0.04 A 25 LYS HBx H 1 1.120 0.04 A 25 LYS HBy H 1 1.565 0.04 A 25 LYS HDx H 1 1.377 0.04 A 25 LYS HDy H 1 1.377 0.04 A 25 LYS HEx H 1 2.784 0.04 A 25 LYS HEy H 1 2.784 0.04 A 25 LYS HGx H 1 1.056 0.04 A 25 LYS HGy H 1 1.149 0.04 A 25 LYS C C 13 173.369 0.40 A 25 LYS CA C 13 55.005 0.40 A 25 LYS CB C 13 36.499 0.40 A 25 LYS CD C 13 29.622 0.40 A 25 LYS CE C 13 41.795 0.40 A 25 LYS CG C 13 25.332 0.40 A 25 LYS N N 15 129.569 0.40 A 26 LEU H H 1 8.315 0.04 A 26 LEU HA H 1 4.774 0.04 A 26 LEU HBx H 1 1.138 0.04 A 26 LEU HBy H 1 1.646 0.04 A 26 LEU HDx% H 1 0.489 0.04 A 26 LEU HDy% H 1 0.513 0.04 A 26 LEU HG H 1 1.299 0.04 A 26 LEU C C 13 176.618 0.40 A 26 LEU CA C 13 54.110 0.40 A 26 LEU CB C 13 43.898 0.40 A 26 LEU CDy C 13 25.756 0.40 A 26 LEU CDx C 13 25.035 0.40 A 26 LEU CG C 13 27.663 0.40 A 26 LEU N N 15 128.345 0.40 A 27 GLY H H 1 9.489 0.04 A 27 GLY HAx H 1 3.578 0.04 A 27 GLY HAy H 1 3.823 0.04 A 27 GLY C C 13 174.645 0.40 A 27 GLY CA C 13 47.372 0.40 A 27 GLY N N 15 118.500 0.40 A 28 ASP H H 1 8.731 0.04 A 28 ASP HA H 1 4.633 0.04 A 28 ASP HBx H 1 2.488 0.04 A 28 ASP HBy H 1 2.729 0.04 A 28 ASP C C 13 175.933 0.40 A 28 ASP CA C 13 54.566 0.40 A 28 ASP CB C 13 41.118 0.40 A 28 ASP N N 15 126.414 0.40 A 29 ILE H H 1 8.212 0.04 A 29 ILE HA H 1 4.035 0.04 A 29 ILE HB H 1 2.130 0.04 A 29 ILE HD1% H 1 0.791 0.04 A 29 ILE HG1x H 1 1.125 0.04 A 29 ILE HG1y H 1 1.557 0.04 A 29 ILE HG2% H 1 0.818 0.04 A 29 ILE C C 13 175.386 0.40 A 29 ILE CA C 13 61.302 0.40 A 29 ILE CB C 13 38.183 0.40 A 29 ILE CD1 C 13 12.549 0.40 A 29 ILE CG1 C 13 27.471 0.40 A 29 ILE CG2 C 13 17.234 0.40 A 29 ILE N N 15 122.440 0.40 A 30 LYS H H 1 8.398 0.04 A 30 LYS HA H 1 5.151 0.04 A 30 LYS HBx H 1 1.448 0.04 A 30 LYS HBy H 1 1.530 0.04 A 30 LYS HDx H 1 1.526 0.04 A 30 LYS HDy H 1 1.526 0.04 A 30 LYS HEx H 1 2.791 0.04 A 30 LYS HEy H 1 2.791 0.04 A 30 LYS HGx H 1 1.028 0.04 A 30 LYS HGy H 1 1.216 0.04 A 30 LYS C C 13 175.395 0.40 A 30 LYS CA C 13 54.857 0.40 A 30 LYS CB C 13 35.146 0.40 A 30 LYS CD C 13 29.285 0.40 A 30 LYS CE C 13 41.864 0.40 A 30 LYS CG C 13 25.018 0.40 A 30 LYS N N 15 127.335 0.40 A 31 VAL H H 1 8.784 0.04 A 31 VAL HA H 1 4.228 0.04 A 31 VAL HB H 1 1.762 0.04 A 31 VAL HGx% H 1 0.388 0.04 A 31 VAL HGy% H 1 0.829 0.04 A 31 VAL C C 13 174.566 0.40 A 31 VAL CA C 13 61.209 0.40 A 31 VAL CB C 13 35.136 0.40 A 31 VAL CGy C 13 22.199 0.40 A 31 VAL CGx C 13 20.984 0.40 A 31 VAL N N 15 123.989 0.40 A 32 THR H H 1 8.228 0.04 A 32 THR HA H 1 5.002 0.04 A 32 THR HB H 1 3.822 0.04 A 32 THR HG2% H 1 1.022 0.04 A 32 THR C C 13 173.407 0.40 A 32 THR CA C 13 61.177 0.40 A 32 THR CB C 13 70.785 0.40 A 32 THR CG2 C 13 22.088 0.40 A 32 THR N N 15 118.825 0.40 A 33 PHE H H 1 8.919 0.04 A 33 PHE HA H 1 4.617 0.04 A 33 PHE HBx H 1 2.633 0.04 A 33 PHE HBy H 1 3.142 0.04 A 33 PHE HDx H 1 7.101 0.04 A 33 PHE HDy H 1 7.101 0.04 A 33 PHE CA C 13 56.973 0.40 A 33 PHE CB C 13 44.428 0.40 A 33 PHE CDx C 13 131.925 0.40 A 33 PHE CDy C 13 131.925 0.40 A 33 PHE N N 15 119.993 0.40 A 36 PRO HA H 1 4.094 0.04 A 36 PRO HBx H 1 1.905 0.04 A 36 PRO HBy H 1 2.283 0.04 A 36 PRO HDx H 1 3.851 0.04 A 36 PRO HDy H 1 3.851 0.04 A 36 PRO HGx H 1 1.942 0.04 A 36 PRO HGy H 1 1.996 0.04 A 36 PRO C C 13 178.604 0.40 A 36 PRO CA C 13 64.785 0.40 A 36 PRO CB C 13 32.092 0.40 A 36 PRO CD C 13 51.409 0.40 A 36 PRO CG C 13 27.023 0.40 A 37 GLU H H 1 7.922 0.04 A 37 GLU HA H 1 3.954 0.04 A 37 GLU HBx H 1 1.945 0.04 A 37 GLU HBy H 1 2.036 0.04 A 37 GLU HGx H 1 2.197 0.04 A 37 GLU HGy H 1 2.197 0.04 A 37 GLU C C 13 179.494 0.40 A 37 GLU CA C 13 59.412 0.40 A 37 GLU CB C 13 28.704 0.40 A 37 GLU CG C 13 36.365 0.40 A 37 GLU N N 15 119.431 0.40 A 38 LYS H H 1 7.663 0.04 A 38 LYS HA H 1 3.759 0.04 A 38 LYS HBx H 1 1.797 0.04 A 38 LYS HBy H 1 1.797 0.04 A 38 LYS HDx H 1 1.740 0.04 A 38 LYS HDy H 1 1.796 0.04 A 38 LYS HEx H 1 2.962 0.04 A 38 LYS HEy H 1 2.962 0.04 A 38 LYS HGx H 1 1.349 0.04 A 38 LYS HGy H 1 1.480 0.04 A 38 LYS C C 13 179.004 0.40 A 38 LYS CA C 13 59.017 0.40 A 38 LYS CB C 13 32.250 0.40 A 38 LYS CD C 13 29.430 0.40 A 38 LYS CE C 13 42.132 0.40 A 38 LYS CG C 13 25.803 0.40 A 38 LYS N N 15 119.919 0.40 A 39 ALA H H 1 6.970 0.04 A 39 ALA HA H 1 2.355 0.04 A 39 ALA HB% H 1 1.037 0.04 A 39 ALA C C 13 178.042 0.40 A 39 ALA CA C 13 54.017 0.40 A 39 ALA CB C 13 19.368 0.40 A 39 ALA N N 15 121.205 0.40 A 40 LYS H H 1 7.815 0.04 A 40 LYS HA H 1 3.538 0.04 A 40 LYS HBx H 1 1.712 0.04 A 40 LYS HBy H 1 1.777 0.04 A 40 LYS HDx H 1 1.564 0.04 A 40 LYS HDy H 1 1.564 0.04 A 40 LYS HEx H 1 2.729 0.04 A 40 LYS HEy H 1 2.729 0.04 A 40 LYS HGx H 1 1.225 0.04 A 40 LYS HGy H 1 1.318 0.04 A 40 LYS CA C 13 60.141 0.40 A 40 LYS CB C 13 31.965 0.40 A 40 LYS CD C 13 29.209 0.40 A 40 LYS CE C 13 41.766 0.40 A 40 LYS CG C 13 25.663 0.40 A 40 LYS N N 15 117.658 0.40 A 41 LYS H H 1 7.563 0.04 A 41 LYS HA H 1 3.916 0.04 A 41 LYS HBx H 1 1.724 0.04 A 41 LYS HBy H 1 1.767 0.04 A 41 LYS HDx H 1 1.573 0.04 A 41 LYS HDy H 1 1.606 0.04 A 41 LYS HEx H 1 2.875 0.04 A 41 LYS HEy H 1 2.875 0.04 A 41 LYS HGx H 1 1.370 0.04 A 41 LYS HGy H 1 1.508 0.04 A 41 LYS CA C 13 59.356 0.40 A 41 LYS CB C 13 32.290 0.40 A 41 LYS CD C 13 29.103 0.40 A 41 LYS CE C 13 41.969 0.40 A 41 LYS CG C 13 25.373 0.40 A 41 LYS N N 15 118.107 0.40 A 42 TYR H H 1 7.577 0.04 A 42 TYR HA H 1 4.216 0.04 A 42 TYR HBx H 1 2.653 0.04 A 42 TYR HBy H 1 2.927 0.04 A 42 TYR HDx H 1 7.061 0.04 A 42 TYR HDy H 1 7.061 0.04 A 42 TYR C C 13 177.077 0.40 A 42 TYR CA C 13 61.211 0.40 A 42 TYR CB C 13 39.005 0.40 A 42 TYR CDx C 13 132.875 0.40 A 42 TYR CDy C 13 132.875 0.40 A 42 TYR N N 15 121.519 0.40 A 43 ALA H H 1 8.468 0.04 A 43 ALA HA H 1 3.611 0.04 A 43 ALA HB% H 1 1.324 0.04 A 43 ALA C C 13 178.658 0.40 A 43 ALA CA C 13 55.118 0.40 A 43 ALA CB C 13 19.240 0.40 A 43 ALA N N 15 120.397 0.40 A 44 GLN H H 1 8.149 0.04 A 44 GLN HA H 1 3.727 0.04 A 44 GLN HBx H 1 1.932 0.04 A 44 GLN HBy H 1 2.096 0.04 A 44 GLN HGx H 1 2.336 0.04 A 44 GLN HGy H 1 2.468 0.04 A 44 GLN C C 13 178.631 0.40 A 44 GLN CA C 13 58.612 0.40 A 44 GLN CB C 13 28.163 0.40 A 44 GLN CG C 13 34.023 0.40 A 44 GLN N N 15 114.829 0.40 A 45 LYS H H 1 7.565 0.04 A 45 LYS HA H 1 3.939 0.04 A 45 LYS HBx H 1 1.815 0.04 A 45 LYS HBy H 1 1.914 0.04 A 45 LYS HDx H 1 1.602 0.04 A 45 LYS HDy H 1 1.648 0.04 A 45 LYS HEx H 1 2.878 0.04 A 45 LYS HEy H 1 2.878 0.04 A 45 LYS HGx H 1 1.171 0.04 A 45 LYS HGy H 1 1.436 0.04 A 45 LYS C C 13 178.768 0.40 A 45 LYS CA C 13 59.484 0.40 A 45 LYS CB C 13 31.651 0.40 A 45 LYS CD C 13 29.465 0.40 A 45 LYS CE C 13 42.039 0.40 A 45 LYS CG C 13 24.826 0.40 A 45 LYS N N 15 121.901 0.40 A 46 LEU H H 1 7.817 0.04 A 46 LEU HA H 1 3.810 0.04 A 46 LEU HBx H 1 1.219 0.04 A 46 LEU HBy H 1 1.780 0.04 A 46 LEU HDx% H 1 0.620 0.04 A 46 LEU HDy% H 1 0.672 0.04 A 46 LEU HG H 1 1.240 0.04 A 46 LEU C C 13 178.797 0.40 A 46 LEU CA C 13 57.455 0.40 A 46 LEU CB C 13 42.556 0.40 A 46 LEU CDy C 13 25.745 0.40 A 46 LEU CDx C 13 22.210 0.40 A 46 LEU CG C 13 25.838 0.40 A 46 LEU N N 15 118.309 0.40 A 47 ALA H H 1 8.452 0.04 A 47 ALA HA H 1 3.483 0.04 A 47 ALA HB% H 1 1.228 0.04 A 47 ALA C C 13 179.644 0.40 A 47 ALA CA C 13 55.507 0.40 A 47 ALA CB C 13 17.571 0.40 A 47 ALA N N 15 119.791 0.40 A 48 LYS H H 1 7.476 0.04 A 48 LYS HA H 1 4.026 0.04 A 48 LYS HBx H 1 1.836 0.04 A 48 LYS HBy H 1 1.890 0.04 A 48 LYS HDx H 1 1.606 0.04 A 48 LYS HDy H 1 1.606 0.04 A 48 LYS HEx H 1 2.870 0.04 A 48 LYS HEy H 1 2.870 0.04 A 48 LYS HGx H 1 1.321 0.04 A 48 LYS HGy H 1 1.448 0.04 A 48 LYS C C 13 179.412 0.40 A 48 LYS CA C 13 58.789 0.40 A 48 LYS CB C 13 32.276 0.40 A 48 LYS CD C 13 29.099 0.40 A 48 LYS CE C 13 42.050 0.40 A 48 LYS CG C 13 24.760 0.40 A 48 LYS N N 15 116.625 0.40 A 49 ILE H H 1 7.806 0.04 A 49 ILE HA H 1 3.498 0.04 A 49 ILE HB H 1 1.404 0.04 A 49 ILE HD1% H 1 0.603 0.04 A 49 ILE HG1x H 1 0.885 0.04 A 49 ILE HG1y H 1 1.387 0.04 A 49 ILE HG2% H 1 0.124 0.04 A 49 ILE C C 13 177.987 0.40 A 49 ILE CA C 13 64.935 0.40 A 49 ILE CB C 13 38.535 0.40 A 49 ILE CD1 C 13 13.595 0.40 A 49 ILE CG1 C 13 28.245 0.40 A 49 ILE CG2 C 13 16.083 0.40 A 49 ILE N N 15 119.162 0.40 A 50 TYR H H 1 7.783 0.04 A 50 TYR HA H 1 4.369 0.04 A 50 TYR HBx H 1 2.346 0.04 A 50 TYR HBy H 1 3.158 0.04 A 50 TYR HDx H 1 7.141 0.04 A 50 TYR HDy H 1 7.141 0.04 A 50 TYR C C 13 178.426 0.40 A 50 TYR CA C 13 58.606 0.40 A 50 TYR CB C 13 38.551 0.40 A 50 TYR CDx C 13 132.945 0.40 A 50 TYR CDy C 13 132.945 0.40 A 50 TYR N N 15 114.705 0.40 A 51 GLN H H 1 7.565 0.04 A 51 GLN HA H 1 3.959 0.04 A 51 GLN HBy H 1 2.260 0.04 A 51 GLN HBx H 1 2.123 0.04 A 51 GLN HGx H 1 2.171 0.04 A 51 GLN HGy H 1 2.223 0.04 A 51 GLN C C 13 174.995 0.40 A 51 GLN CA C 13 56.920 0.40 A 51 GLN CB C 13 25.700 0.40 A 51 GLN CG C 13 34.487 0.40 A 51 GLN N N 15 118.084 0.40 A 52 LEU H H 1 8.340 0.04 A 52 LEU HA H 1 4.783 0.04 A 52 LEU HBx H 1 1.079 0.04 A 52 LEU HBy H 1 1.619 0.04 A 52 LEU HDx% H 1 0.606 0.04 A 52 LEU HDy% H 1 0.772 0.04 A 52 LEU HG H 1 1.458 0.04 A 52 LEU C C 13 175.310 0.40 A 52 LEU CA C 13 52.851 0.40 A 52 LEU CB C 13 45.829 0.40 A 52 LEU CDy C 13 26.686 0.40 A 52 LEU CDx C 13 21.867 0.40 A 52 LEU CG C 13 26.192 0.40 A 52 LEU N N 15 120.262 0.40 A 53 THR H H 1 8.695 0.04 A 53 THR HA H 1 4.587 0.04 A 53 THR HB H 1 3.972 0.04 A 53 THR HG2% H 1 0.962 0.04 A 53 THR C C 13 172.715 0.40 A 53 THR CA C 13 61.459 0.40 A 53 THR CB C 13 71.638 0.40 A 53 THR CG2 C 13 21.577 0.40 A 53 THR N N 15 113.639 0.40 A 54 VAL H H 1 8.252 0.04 A 54 VAL HA H 1 4.261 0.04 A 54 VAL HB H 1 1.801 0.04 A 54 VAL HGy% H 1 0.671 0.04 A 54 VAL C C 13 175.536 0.40 A 54 VAL CA C 13 63.034 0.40 A 54 VAL CB C 13 32.514 0.40 A 54 VAL CGy C 13 22.170 0.40 A 54 VAL N N 15 122.339 0.40 A 55 HIS H H 1 9.072 0.04 A 55 HIS HA H 1 4.651 0.04 A 55 HIS HBx H 1 2.879 0.04 A 55 HIS HBy H 1 3.018 0.04 A 55 HIS HD2 H 1 6.791 0.04 A 55 HIS C C 13 173.982 0.40 A 55 HIS CA C 13 54.900 0.40 A 55 HIS CB C 13 32.845 0.40 A 55 HIS CD2 C 13 120.125 0.40 A 55 HIS N N 15 128.076 0.40 A 56 VAL H H 1 8.847 0.04 A 56 VAL HA H 1 4.128 0.04 A 56 VAL HB H 1 1.952 0.04 A 56 VAL HGy% H 1 0.817 0.04 A 56 VAL C C 13 175.167 0.40 A 56 VAL CA C 13 63.114 0.40 A 56 VAL CB C 13 32.513 0.40 A 56 VAL CGy C 13 20.984 0.40 A 56 VAL N N 15 125.898 0.40 A 57 HIS H H 1 8.888 0.04 A 57 HIS HA H 1 4.838 0.04 A 57 HIS HBx H 1 2.926 0.04 A 57 HIS HBy H 1 3.112 0.04 A 57 HIS HD2 H 1 6.801 0.04 A 57 HIS CA C 13 54.630 0.40 A 57 HIS CB C 13 30.965 0.40 A 57 HIS CD2 C 13 119.695 0.40 A 57 HIS N N 15 129.333 0.40 A 59 ASP HA H 1 4.727 0.04 A 59 ASP HBx H 1 2.818 0.04 A 59 ASP HBy H 1 3.028 0.04 A 59 ASP C C 13 174.646 0.40 A 59 ASP CA C 13 54.675 0.40 A 59 ASP CB C 13 41.022 0.40 A 60 THR H H 1 7.835 0.04 A 60 THR HA H 1 4.989 0.04 A 60 THR HB H 1 3.994 0.04 A 60 THR HG2% H 1 0.661 0.04 A 60 THR C C 13 171.887 0.40 A 60 THR CA C 13 61.728 0.40 A 60 THR CB C 13 70.936 0.40 A 60 THR CG2 C 13 20.926 0.40 A 60 THR N N 15 116.131 0.40 A 61 ILE H H 1 9.314 0.04 A 61 ILE HA H 1 4.524 0.04 A 61 ILE HB H 1 1.733 0.04 A 61 ILE HD1% H 1 0.556 0.04 A 61 ILE HG1x H 1 0.818 0.04 A 61 ILE HG1y H 1 1.446 0.04 A 61 ILE HG2% H 1 0.628 0.04 A 61 ILE C C 13 174.255 0.40 A 61 ILE CA C 13 60.432 0.40 A 61 ILE CB C 13 39.086 0.40 A 61 ILE CD1 C 13 13.619 0.40 A 61 ILE CG1 C 13 26.831 0.40 A 61 ILE CG2 C 13 19.013 0.40 A 61 ILE N N 15 126.728 0.40 A 62 HIS H H 1 9.321 0.04 A 62 HIS HA H 1 5.069 0.04 A 62 HIS HBx H 1 2.883 0.04 A 62 HIS HBy H 1 2.965 0.04 A 62 HIS HD2 H 1 6.811 0.04 A 62 HIS C C 13 174.830 0.40 A 62 HIS CA C 13 55.105 0.40 A 62 HIS CB C 13 33.868 0.40 A 62 HIS CD2 C 13 119.605 0.40 A 62 HIS N N 15 127.745 0.40 A 63 VAL H H 1 8.692 0.04 A 63 VAL HA H 1 4.912 0.04 A 63 VAL HB H 1 2.030 0.04 A 63 VAL HGx% H 1 0.671 0.04 A 63 VAL HGy% H 1 0.842 0.04 A 63 VAL C C 13 174.591 0.40 A 63 VAL CA C 13 61.665 0.40 A 63 VAL CB C 13 31.273 0.40 A 63 VAL CGy C 13 22.518 0.40 A 63 VAL CGx C 13 21.495 0.40 A 63 VAL N N 15 126.010 0.40 A 64 LYS H H 1 8.879 0.04 A 64 LYS HA H 1 4.363 0.04 A 64 LYS HBx H 1 1.630 0.04 A 64 LYS HBy H 1 1.688 0.04 A 64 LYS HDx H 1 1.103 0.04 A 64 LYS HDy H 1 1.213 0.04 A 64 LYS HEx H 1 2.247 0.04 A 64 LYS HEy H 1 2.247 0.04 A 64 LYS HGx H 1 0.897 0.04 A 64 LYS HGy H 1 1.025 0.04 A 64 LYS CA C 13 57.676 0.40 A 64 LYS CB C 13 34.046 0.40 A 64 LYS CD C 13 29.340 0.40 A 64 LYS CE C 13 41.341 0.40 A 64 LYS CG C 13 23.629 0.40 A 64 LYS N N 15 128.345 0.40 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 22 THR HG2% A 33 PHE H 1.0 1.8 6.0 2 2 A 33 PHE H A 32 THR HB 1.0 1.8 5.0 3 3 A 33 PHE H A 32 THR HA 1.0 1.8 3.5 4 4 A 33 PHE H A 33 PHE HDy 1.0 1.8 5.0 5 5 A 21 MET HA A 22 THR H 1.0 1.8 3.5 6 6 A 22 THR H A 22 THR HB 1.0 1.8 5.0 7 7 A 22 THR H A 39 ALA HB% 1.0 1.8 6.0 8 8 A 33 PHE H A 22 THR H 1.0 1.8 5.0 9 9 A 53 THR H A 52 LEU HDy% 1.0 1.8 5.0 10 10 A 53 THR H A 53 THR HG2% 1.0 1.8 5.0 11 11 A 53 THR H A 52 LEU HBy 1.0 1.8 5.0 12 12 A 53 THR H A 52 LEU HG 1.0 1.8 5.0 13 13 A 53 THR H A 52 LEU HBx 1.0 1.8 5.0 14 14 A 53 THR H A 63 VAL HB 1.0 1.8 6.0 15 15 A 53 THR H A 53 THR HB 1.0 1.8 5.0 16 16 A 53 THR H A 64 LYS HA 1.0 1.8 5.0 17 17 A 53 THR H A 63 VAL HA 1.0 1.8 5.0 18 18 A 53 THR H A 52 LEU H 1.0 1.8 5.0 19 19 A 42 TYR H A 43 ALA H 1.0 1.8 5.0 20 20 A 43 ALA H A 42 TYR HDx 1.0 1.8 5.0 21 21 A 43 ALA H A 42 TYR HBx 1.0 1.8 5.0 22 22 A 43 ALA H A 42 TYR HBy 1.0 1.8 5.0 23 23 A 43 ALA H A 41 LYS HBx 1.0 1.8 6.0 24 24 A 43 ALA H A 41 LYS HBy 1.0 1.8 6.0 25 25 A 43 ALA H A 43 ALA HB% 1.0 1.8 3.5 26 26 A 39 ALA HB% A 43 ALA H 1.0 1.8 5.0 27 27 A 43 ALA H A 24 VAL HGy% 1.0 1.8 6.0 28 28 A 43 ALA H A 61 ILE HD1% 1.0 1.8 5.0 29 29 A 47 ALA H A 47 ALA HB% 1.0 1.8 3.5 30 30 A 47 ALA H A 46 LEU HBx 1.0 1.8 5.0 31 31 A 47 ALA H A 44 GLN HA 1.0 1.8 5.0 32 32 A 47 ALA H A 48 LYS H 1.0 1.8 5.0 33 33 A 47 ALA H A 46 LEU H 1.0 1.8 5.0 34 34 A 52 LEU H A 51 GLN HA 1.0 1.8 3.5 35 35 A 52 LEU H A 47 ALA HA 1.0 1.8 5.0 36 36 A 52 LEU HG A 52 LEU H 1.0 1.8 5.0 37 37 A 52 LEU H A 47 ALA HB% 1.0 1.8 5.0 38 38 A 52 LEU H A 52 LEU HDy% 1.0 1.8 5.0 39 39 A 52 LEU H A 52 LEU HDx% 1.0 1.8 5.0 40 40 A 30 LYS HA A 31 VAL H 1.0 1.8 3.5 41 41 A 31 VAL H A 24 VAL HB 1.0 1.8 5.0 42 42 A 31 VAL H A 31 VAL HB 1.0 1.8 5.0 43 43 A 31 VAL H A 23 THR HG2% 1.0 1.8 5.0 44 44 A 31 VAL H A 24 VAL H 1.0 1.8 5.0 45 45 A 31 VAL H A 26 LEU H 1.0 1.8 5.0 46 46 A 22 THR HA A 23 THR H 1.0 1.8 3.5 47 47 A 23 THR H A 23 THR HB 1.0 1.8 5.0 48 48 A 22 THR HG2% A 23 THR H 1.0 1.8 5.0 49 49 A 24 VAL H A 23 THR HA 1.0 1.8 3.5 50 50 A 24 VAL HB A 24 VAL H 1.0 1.8 5.0 51 51 A 24 VAL H A 24 VAL HGx% 1.0 1.8 5.0 52 52 A 24 VAL HGy% A 24 VAL H 1.0 1.8 5.0 53 53 A 60 THR HG2% A 61 ILE H 1.0 1.8 5.0 54 54 A 22 THR HG2% A 61 ILE H 1.0 1.8 6.0 55 55 A 24 VAL HGx% A 61 ILE H 1.0 1.8 6.0 56 56 A 61 ILE H A 61 ILE HB 1.0 1.8 5.0 57 57 A 61 ILE H A 60 THR HB 1.0 1.8 5.0 58 58 A 61 ILE H A 60 THR HA 1.0 1.8 3.5 59 59 A 61 ILE HA A 62 HIS H 1.0 1.8 3.5 60 60 A 62 HIS H A 61 ILE HG2% 1.0 1.8 5.0 61 61 A 61 ILE HB A 25 LYS H 1.0 1.8 5.0 62 62 A 24 VAL HGx% A 25 LYS H 1.0 1.8 5.0 63 63 A 60 THR HG2% A 25 LYS H 1.0 1.8 5.0 64 64 A 25 LYS H A 24 VAL HA 1.0 1.8 3.5 65 65 A 25 LYS H A 62 HIS HA 1.0 1.8 5.0 66 66 A 61 ILE H A 25 LYS H 1.0 1.8 5.0 67 67 A 62 HIS H A 25 LYS H 1.0 1.8 6.0 68 68 A 62 HIS H A 55 HIS H 1.0 1.8 5.0 69 69 A 55 HIS H A 55 HIS HD2 1.0 1.8 6.0 70 70 A 55 HIS H A 62 HIS HD2 1.0 1.8 6.0 71 71 A 63 VAL HA A 55 HIS H 1.0 1.8 5.0 72 72 A 55 HIS H A 54 VAL HA 1.0 1.8 3.5 73 73 A 55 HIS H A 56 VAL HA 1.0 1.8 5.0 74 74 A 61 ILE HG2% A 55 HIS H 1.0 1.8 5.0 75 75 A 56 VAL HA A 57 HIS H 1.0 1.8 3.5 76 76 A 57 HIS H A 57 HIS HBx 1.0 1.8 5.0 77 77 A 57 HIS H A 57 HIS HBy 1.0 1.8 5.0 78 78 A 64 LYS H A 64 LYS HGx 1.0 1.8 5.0 79 79 A 64 LYS H A 63 VAL HGy% 1.0 1.8 5.0 80 80 A 64 LYS H A 63 VAL HGx% 1.0 1.8 5.0 81 81 A 54 VAL HA A 64 LYS H 1.0 1.8 5.0 82 82 A 63 VAL HA A 64 LYS H 1.0 1.8 3.5 83 83 A 62 HIS HD2 A 64 LYS H 1.0 1.8 5.0 84 84 A 53 THR H A 64 LYS H 1.0 1.8 5.0 85 85 A 63 VAL HB A 63 VAL H 1.0 1.8 5.0 86 86 A 63 VAL H A 62 HIS HBy 1.0 1.8 5.0 87 87 A 63 VAL H A 26 LEU HA 1.0 1.8 5.0 88 88 A 62 HIS HA A 63 VAL H 1.0 1.8 3.5 89 89 A 62 HIS HD2 A 63 VAL H 1.0 1.8 5.0 90 90 A 25 LYS H A 63 VAL H 1.0 1.8 5.0 91 91 A 55 HIS H A 63 VAL H 1.0 1.8 6.0 92 92 A 63 VAL H A 63 VAL HGx% 1.0 1.8 5.0 93 93 A 63 VAL H A 63 VAL HGy% 1.0 1.8 5.0 94 94 A 24 VAL HGx% A 63 VAL H 1.0 1.8 6.0 95 95 A 29 ILE HA A 30 LYS H 1.0 1.8 3.5 96 96 A 30 LYS H A 29 ILE HG1x 1.0 1.8 5.0 97 97 A 30 LYS H A 29 ILE HG2% 1.0 1.8 5.0 98 98 A 26 LEU H A 26 LEU HDx% 1.0 1.8 6.0 99 99 A 26 LEU H A 26 LEU HDy% 1.0 1.8 6.0 100 100 A 26 LEU H A 29 ILE HG2% 1.0 1.8 6.0 101 101 A 26 LEU H A 26 LEU HBy 1.0 1.8 5.0 102 102 A 26 LEU H A 26 LEU HBx 1.0 1.8 5.0 103 103 A 26 LEU H A 29 ILE HB 1.0 1.8 5.0 104 104 A 26 LEU H A 25 LYS HA 1.0 1.8 3.5 105 105 A 53 THR HA A 54 VAL H 1.0 1.8 3.5 106 106 A 53 THR HB A 54 VAL H 1.0 1.8 5.0 107 107 A 54 VAL H A 54 VAL HB 1.0 1.8 5.0 108 108 A 47 ALA HB% A 54 VAL H 1.0 1.8 5.0 109 109 A 53 THR HG2% A 54 VAL H 1.0 1.8 5.0 110 110 A 29 ILE HG2% A 29 ILE H 1.0 1.8 5.0 111 111 A 29 ILE HG1x A 29 ILE H 1.0 1.8 5.0 112 112 A 29 ILE H A 29 ILE HG1y 1.0 1.8 5.0 113 113 A 29 ILE HB A 29 ILE H 1.0 1.8 3.5 114 114 A 29 ILE H A 28 ASP H 1.0 1.8 5.0 115 115 A 30 LYS H A 29 ILE H 1.0 1.8 5.0 116 116 A 31 VAL HA A 32 THR H 1.0 1.8 3.5 117 117 A 32 THR HB A 32 THR H 1.0 1.8 5.0 118 118 A 31 VAL HB A 32 THR H 1.0 1.8 5.0 119 119 A 32 THR H A 32 THR HG2% 1.0 1.8 5.0 120 120 A 14 LEU HA A 15 VAL H 1.0 1.8 3.5 121 121 A 15 VAL H A 14 LEU HBx 1.0 1.8 6.0 122 122 A 15 VAL H A 14 LEU HBy 1.0 1.8 6.0 123 123 A 50 TYR H A 50 TYR HBx 1.0 1.8 5.0 124 124 A 50 TYR H A 50 TYR HBy 1.0 1.8 5.0 125 125 A 50 TYR H A 49 ILE HB 1.0 1.8 5.0 126 126 A 50 TYR H A 49 ILE HG2% 1.0 1.8 5.0 127 127 A 50 TYR H A 50 TYR HDy 1.0 1.8 5.0 128 128 A 37 GLU H A 38 LYS H 1.0 1.8 3.5 129 129 A 37 GLU H A 36 PRO HDx 1.0 1.8 5.0 130 129 A 37 GLU H A 36 PRO HDy 1.0 1.8 5.0 131 130 A 37 GLU H A 38 LYS HBx 1.0 1.8 6.0 132 130 A 37 GLU H A 38 LYS HBy 1.0 1.8 6.0 133 131 A 37 GLU H A 36 PRO HGy 1.0 1.8 6.0 134 132 A 37 GLU H A 36 PRO HGx 1.0 1.8 5.0 135 133 A 37 GLU H A 37 GLU HBx 1.0 1.8 5.0 136 134 A 37 GLU H A 37 GLU HGx 1.0 1.8 5.0 137 134 A 37 GLU H A 37 GLU HGy 1.0 1.8 5.0 138 135 A 49 ILE HG2% A 49 ILE H 1.0 1.8 5.0 139 136 A 49 ILE HB A 49 ILE H 1.0 1.8 5.0 140 137 A 49 ILE H A 46 LEU HA 1.0 1.8 5.0 141 138 A 46 LEU H A 46 LEU HDx% 1.0 1.8 6.0 142 139 A 46 LEU H A 46 LEU HDy% 1.0 1.8 6.0 143 140 A 46 LEU H A 46 LEU HBy 1.0 1.8 5.0 144 141 A 46 LEU H A 46 LEU HBx 1.0 1.8 5.0 145 142 A 46 LEU H A 45 LYS H 1.0 1.8 5.0 146 143 A 40 LYS H A 40 LYS HBx 1.0 1.8 5.0 147 144 A 40 LYS H A 40 LYS HBy 1.0 1.8 5.0 148 145 A 40 LYS H A 40 LYS HGx 1.0 1.8 6.0 149 146 A 39 ALA HB% A 40 LYS H 1.0 1.8 5.0 150 147 A 61 ILE HD1% A 40 LYS H 1.0 1.8 5.0 151 148 A 38 LYS H A 38 LYS HBx 1.0 1.8 5.0 152 148 A 38 LYS H A 38 LYS HBy 1.0 1.8 5.0 153 149 A 38 LYS H A 37 GLU HBx 1.0 1.8 5.0 154 150 A 42 TYR H A 41 LYS HBx 1.0 1.8 5.0 155 151 A 42 TYR H A 41 LYS HBy 1.0 1.8 5.0 156 152 A 42 TYR H A 42 TYR HBy 1.0 1.8 5.0 157 153 A 42 TYR H A 42 TYR HBx 1.0 1.8 5.0 158 154 A 42 TYR H A 42 TYR HDx 1.0 1.8 5.0 159 155 A 45 LYS H A 45 LYS HBx 1.0 1.8 5.0 160 156 A 41 LYS H A 41 LYS HGy 1.0 1.8 5.0 161 157 A 41 LYS H A 41 LYS HGx 1.0 1.8 5.0 162 158 A 40 LYS H A 41 LYS H 1.0 1.8 3.5 163 159 A 50 TYR H A 51 GLN H 1.0 1.8 5.0 164 160 A 52 LEU H A 51 GLN H 1.0 1.8 5.0 165 161 A 60 THR HB A 60 THR H 1.0 1.8 3.5 166 162 A 60 THR HG2% A 60 THR H 1.0 1.8 5.0 167 163 A 43 ALA HB% A 44 GLN H 1.0 1.8 5.0 168 164 A 44 GLN H A 44 GLN HGx 1.0 1.8 5.0 169 165 A 44 GLN H A 44 GLN HGy 1.0 1.8 5.0 170 166 A 44 GLN H A 44 GLN HBx 1.0 1.8 5.0 171 167 A 44 GLN H A 44 GLN HBy 1.0 1.8 5.0 172 168 A 44 GLN H A 41 LYS HA 1.0 1.8 5.0 173 169 A 43 ALA H A 44 GLN H 1.0 1.8 5.0 174 170 A 45 LYS H A 44 GLN H 1.0 1.8 3.5 175 171 A 40 LYS H A 39 ALA H 1.0 1.8 5.0 176 172 A 38 LYS H A 39 ALA H 1.0 1.8 3.5 177 173 A 39 ALA H A 36 PRO HA 1.0 1.8 5.0 178 174 A 39 ALA HB% A 39 ALA H 1.0 1.8 3.5 179 175 A 39 ALA H A 38 LYS HBx 1.0 1.8 5.0 180 175 A 38 LYS HBy A 39 ALA H 1.0 1.8 5.0 181 176 A 47 ALA HB% A 48 LYS H 1.0 1.8 5.0 182 177 A 48 LYS H A 48 LYS HBx 1.0 1.8 5.0 183 178 A 48 LYS H A 48 LYS HBy 1.0 1.8 5.0 184 179 A 48 LYS H A 49 ILE H 1.0 1.8 3.5 185 180 A 51 GLN H A 52 LEU HA 1.0 1.8 6.0 186 181 A 42 TYR HDx A 41 LYS H 1.0 1.8 6.0 187 182 A 41 LYS H A 39 ALA H 1.0 1.8 5.0 188 183 A 42 TYR H A 39 ALA HA 1.0 1.8 5.0 189 184 A 29 ILE HB A 29 ILE HD1% 1.0 1.8 5.0 190 185 A 29 ILE HA A 29 ILE HD1% 1.0 1.8 5.0 191 186 A 49 ILE HB A 49 ILE HD1% 1.0 1.8 5.0 192 187 A 49 ILE HD1% A 45 LYS HDx 1.0 1.8 6.0 193 188 A 49 ILE HD1% A 45 LYS HDy 1.0 1.8 6.0 194 189 A 49 ILE H A 49 ILE HD1% 1.0 1.8 5.0 195 190 A 49 ILE HG2% A 49 ILE HD1% 1.0 1.8 3.5 196 191 A 26 LEU HDx% A 26 LEU HBy 1.0 1.8 5.0 197 192 A 26 LEU HBx A 26 LEU HDx% 1.0 1.8 5.0 198 193 A 26 LEU HBy A 26 LEU HDy% 1.0 1.8 5.0 199 194 A 26 LEU HBx A 26 LEU HDy% 1.0 1.8 5.0 200 195 A 63 VAL HB A 26 LEU HDy% 1.0 1.8 5.0 201 196 A 41 LYS HA A 42 TYR HA 1.0 1.8 5.0 202 197 A 42 TYR HA A 45 LYS HBx 1.0 1.8 5.0 203 198 A 42 TYR HA A 45 LYS HBy 1.0 1.8 5.0 204 199 A 31 VAL HA A 31 VAL HGy% 1.0 1.8 5.0 205 200 A 31 VAL HA A 31 VAL HGx% 1.0 1.8 5.0 206 201 A 42 TYR HDx A 42 TYR HA 1.0 1.8 5.0 207 202 A 42 TYR HA A 42 TYR HDy 1.0 1.8 5.0 208 203 A 45 LYS H A 42 TYR HA 1.0 1.8 5.0 209 204 A 32 THR HA A 32 THR HG2% 1.0 1.8 3.5 210 205 A 60 THR HG2% A 60 THR HA 1.0 1.8 5.0 211 206 A 22 THR HG2% A 22 THR HA 1.0 1.8 5.0 212 207 A 23 THR HG2% A 23 THR HA 1.0 1.8 5.0 213 208 A 52 LEU HG A 50 TYR HBx 1.0 1.8 5.0 214 209 A 52 LEU HG A 50 TYR HBy 1.0 1.8 5.0 215 210 A 43 ALA HA A 46 LEU HG 1.0 1.8 6.0 216 211 A 61 ILE HG2% A 43 ALA HA 1.0 1.8 5.0 217 212 A 46 LEU H A 43 ALA HA 1.0 1.8 5.0 218 213 A 43 ALA HB% A 61 ILE HB 1.0 1.8 6.0 219 214 A 43 ALA HB% A 24 VAL HGy% 1.0 1.8 3.5 220 215 A 43 ALA HB% A 61 ILE HG2% 1.0 1.8 3.5 221 216 A 42 TYR HDx A 39 ALA HA 1.0 1.8 5.0 222 217 A 39 ALA HB% A 33 PHE HBy 1.0 1.8 5.0 223 218 A 22 THR HB A 39 ALA HB% 1.0 1.8 5.0 224 219 A 47 ALA HA A 48 LYS HA 1.0 1.8 6.0 225 220 A 51 GLN HA A 47 ALA HA 1.0 1.8 6.0 226 221 A 49 ILE HB A 46 LEU HA 1.0 1.8 5.0 227 222 A 46 LEU HA A 46 LEU HG 1.0 1.8 5.0 228 223 A 46 LEU HA A 49 ILE HD1% 1.0 1.8 5.0 229 224 A 50 TYR HDy A 46 LEU HA 1.0 1.8 5.0 230 225 A 47 ALA H A 46 LEU HBy 1.0 1.8 5.0 231 226 A 40 LYS H A 40 LYS HGy 1.0 1.8 6.0 232 227 A 46 LEU H A 46 LEU HG 1.0 1.8 6.0 233 228 A 45 LYS H A 45 LYS HBy 1.0 1.8 5.0 234 229 A 47 ALA HB% A 44 GLN HA 1.0 1.8 3.5 235 230 A 45 LYS H A 44 GLN HBx 1.0 1.8 5.0 236 231 A 45 LYS H A 44 GLN HBy 1.0 1.8 5.0 237 232 A 41 LYS H A 38 LYS HA 1.0 1.8 5.0 238 233 A 38 LYS HA A 38 LYS HGy 1.0 1.8 5.0 239 234 A 38 LYS HA A 38 LYS HGx 1.0 1.8 5.0 240 235 A 37 GLU H A 37 GLU HBy 1.0 1.8 5.0 241 236 A 38 LYS H A 37 GLU HBy 1.0 1.8 5.0 242 237 A 38 LYS H A 37 GLU HGx 1.0 1.8 5.0 243 237 A 38 LYS H A 37 GLU HGy 1.0 1.8 5.0 244 238 A 22 THR HB A 36 PRO HA 1.0 1.8 5.0 245 239 A 39 ALA HB% A 36 PRO HA 1.0 1.8 3.5 246 240 A 33 PHE H A 32 THR HG2% 1.0 1.8 5.0 247 241 A 61 ILE HB A 24 VAL HA 1.0 1.8 5.0 248 242 A 24 VAL HGx% A 61 ILE HB 1.0 1.8 5.0 249 243 A 22 THR HG2% A 61 ILE HD1% 1.0 1.8 3.5 250 244 A 43 ALA HB% A 61 ILE HD1% 1.0 1.8 5.0 251 245 A 61 ILE HD1% A 61 ILE HB 1.0 1.8 5.0 252 246 A 61 ILE HD1% A 61 ILE HA 1.0 1.8 5.0 253 247 A 61 ILE HD1% A 22 THR HA 1.0 1.8 6.0 254 248 A 61 ILE HD1% A 24 VAL HA 1.0 1.8 6.0 255 249 A 61 ILE HG2% A 61 ILE HG1y 1.0 1.8 5.0 256 250 A 61 ILE HG2% A 61 ILE HG1x 1.0 1.8 5.0 257 251 A 61 ILE HG2% A 40 LYS HA 1.0 1.8 6.0 258 252 A 61 ILE HA A 61 ILE HG2% 1.0 1.8 5.0 259 253 A 61 ILE HG2% A 24 VAL HA 1.0 1.8 5.0 260 254 A 61 ILE HG2% A 25 LYS H 1.0 1.8 6.0 261 255 A 62 HIS H A 56 VAL HA 1.0 1.8 5.0 262 256 A 61 ILE HA A 56 VAL HA 1.0 1.8 5.0 263 257 A 61 ILE HG2% A 56 VAL HA 1.0 1.8 5.0 264 258 A 61 ILE HD1% A 40 LYS HA 1.0 1.8 5.0 265 259 A 43 ALA HB% A 40 LYS HA 1.0 1.8 5.0 266 260 A 43 ALA H A 40 LYS HA 1.0 1.8 5.0 267 261 A 53 THR HG2% A 53 THR HA 1.0 1.8 5.0 268 262 A 52 LEU HBx A 52 LEU HDx% 1.0 1.8 5.0 269 263 A 52 LEU HA A 52 LEU HDy% 1.0 1.8 5.0 270 264 A 52 LEU HBx A 52 LEU HDy% 1.0 1.8 5.0 271 265 A 52 LEU HBy A 52 LEU HDy% 1.0 1.8 5.0 272 266 A 52 LEU HDx% A 52 LEU HBy 1.0 1.8 5.0 273 267 A 52 LEU HA A 52 LEU HDx% 1.0 1.8 5.0 274 268 A 53 THR H A 52 LEU HDx% 1.0 1.8 5.0 275 269 A 51 GLN HA A 51 GLN HGy 1.0 1.8 5.0 276 270 A 51 GLN HA A 51 GLN HGx 1.0 1.8 5.0 277 271 A 49 ILE HG2% A 49 ILE HA 1.0 1.8 5.0 278 272 A 49 ILE HD1% A 49 ILE HA 1.0 1.8 5.0 279 273 A 49 ILE HA A 49 ILE HG1y 1.0 1.8 5.0 280 274 A 49 ILE HA A 49 ILE HG1x 1.0 1.8 5.0 281 275 A 49 ILE HG2% A 46 LEU HA 1.0 1.8 5.0 282 276 A 49 ILE HG2% A 50 TYR HDy 1.0 1.8 5.0 283 277 A 49 ILE H A 49 ILE HG1x 1.0 1.8 5.0 284 278 A 49 ILE H A 49 ILE HG1y 1.0 1.8 5.0 285 279 A 60 THR HG2% A 25 LYS HDx 1.0 1.8 5.0 286 279 A 60 THR HG2% A 25 LYS HDy 1.0 1.8 5.0 287 280 A 49 ILE HB A 50 TYR HDy 1.0 1.8 5.0 288 281 A 44 GLN HA A 54 VAL HB 1.0 1.8 5.0 289 282 A 48 LYS HA A 48 LYS HDx 1.0 1.8 5.0 290 282 A 48 LYS HA A 48 LYS HDy 1.0 1.8 5.0 291 283 A 41 LYS H A 41 LYS HDx 1.0 1.8 6.0 292 284 A 41 LYS H A 41 LYS HDy 1.0 1.8 6.0 293 285 A 25 LYS HEy A 25 LYS HGy 1.0 1.8 5.0 294 285 A 25 LYS HGy A 25 LYS HEx 1.0 1.8 5.0 295 286 A 25 LYS HEx A 25 LYS HGx 1.0 1.8 5.0 296 286 A 25 LYS HEy A 25 LYS HGx 1.0 1.8 5.0 297 287 A 29 ILE HA A 29 ILE HG1y 1.0 1.8 5.0 298 288 A 29 ILE HA A 29 ILE HG1x 1.0 1.8 5.0 299 289 A 29 ILE HA A 29 ILE HG2% 1.0 1.8 5.0 300 290 A 30 LYS H A 29 ILE HB 1.0 1.8 5.0 301 291 A 29 ILE H A 29 ILE HD1% 1.0 1.8 5.0 302 292 A 29 ILE HG1x A 29 ILE HG2% 1.0 1.8 5.0 303 293 A 29 ILE HG2% A 29 ILE HG1y 1.0 1.8 5.0 304 294 A 29 ILE HG2% A 31 VAL HA 1.0 1.8 5.0 305 295 A 29 ILE HG2% A 26 LEU HBx 1.0 1.8 6.0 306 296 A 29 ILE HG2% A 26 LEU HBy 1.0 1.8 6.0 307 297 A 63 VAL HB A 26 LEU HG 1.0 1.8 5.0 308 298 A 25 LYS HDy A 25 LYS HBy 1.0 1.8 5.0 309 298 A 25 LYS HBy A 25 LYS HDx 1.0 1.8 5.0 310 299 A 25 LYS HDy A 25 LYS HBx 1.0 1.8 5.0 311 299 A 25 LYS HBx A 25 LYS HDx 1.0 1.8 5.0 312 300 A 33 PHE HDy A 24 VAL HB 1.0 1.8 6.0 313 301 A 24 VAL HB A 31 VAL HB 1.0 1.8 5.0 314 302 A 33 PHE HDy A 24 VAL HGy% 1.0 1.8 5.0 315 303 A 24 VAL HGy% A 25 LYS H 1.0 1.8 5.0 316 304 A 24 VAL HGy% A 24 VAL HA 1.0 1.8 5.0 317 305 A 24 VAL HGy% A 43 ALA HA 1.0 1.8 5.0 318 306 A 24 VAL HGy% A 31 VAL HB 1.0 1.8 5.0 319 307 A 24 VAL HGy% A 61 ILE HB 1.0 1.8 5.0 320 308 A 24 VAL HGy% A 61 ILE HG2% 1.0 1.8 5.0 321 309 A 24 VAL HGx% A 61 ILE HG2% 1.0 1.8 5.0 322 310 A 43 ALA HB% A 24 VAL HGx% 1.0 1.8 5.0 323 311 A 31 VAL HB A 24 VAL HGx% 1.0 1.8 5.0 324 312 A 24 VAL HGx% A 24 VAL HA 1.0 1.8 5.0 325 313 A 22 THR HG2% A 22 THR H 1.0 1.8 5.0 326 314 A 63 VAL HB A 26 LEU HA 1.0 1.8 5.0 327 315 A 63 VAL HB A 62 HIS HA 1.0 1.8 6.0 328 316 A 63 VAL HB A 26 LEU HDx% 1.0 1.8 5.0 329 317 A 63 VAL HA A 54 VAL HA 1.0 1.8 5.0 330 318 A 63 VAL H A 62 HIS HBx 1.0 1.8 5.0 331 319 A 64 LYS H A 64 LYS HGy 1.0 1.8 5.0 332 320 A 39 ALA HB% A 33 PHE HBx 1.0 1.8 5.0 333 321 A 62 HIS HD2 A 55 HIS HBx 1.0 1.8 6.0 334 322 A 62 HIS HD2 A 55 HIS HBy 1.0 1.8 6.0 335 323 A 14 LEU HA A 14 LEU HDx% 1.0 1.8 5.0 336 323 A 14 LEU HA A 14 LEU HDy% 1.0 1.8 5.0 337 324 A 15 VAL H A 14 LEU HDx% 1.0 1.8 5.0 338 324 A 15 VAL H A 14 LEU HDy% 1.0 1.8 5.0 339 325 A 21 MET H A 21 MET HGx 1.0 1.8 5.0 340 325 A 21 MET H A 21 MET HGy 1.0 1.8 5.0 341 326 A 22 THR H A 21 MET HBx 1.0 1.8 5.0 342 326 A 22 THR H A 21 MET HBy 1.0 1.8 5.0 343 327 A 33 PHE H A 21 MET HBx 1.0 1.8 5.0 344 327 A 33 PHE H A 21 MET HBy 1.0 1.8 5.0 345 328 A 21 MET HBx A 33 PHE HBx 1.0 1.8 5.0 346 328 A 21 MET HBy A 33 PHE HBx 1.0 1.8 5.0 347 328 A 33 PHE HBy A 21 MET HBx 1.0 1.8 5.0 348 328 A 21 MET HBy A 33 PHE HBy 1.0 1.8 5.0 349 329 A 22 THR H A 33 PHE HBx 1.0 1.8 5.0 350 329 A 22 THR H A 33 PHE HBy 1.0 1.8 5.0 351 330 A 22 THR HB A 33 PHE HBx 1.0 1.8 5.0 352 330 A 22 THR HB A 33 PHE HBy 1.0 1.8 5.0 353 331 A 22 THR HG2% A 61 ILE HG1y 1.0 1.8 5.0 354 331 A 22 THR HG2% A 61 ILE HG1x 1.0 1.8 5.0 355 332 A 24 VAL HA A 31 VAL HGy% 1.0 1.8 5.0 356 332 A 24 VAL HA A 31 VAL HGx% 1.0 1.8 5.0 357 333 A 24 VAL HB A 31 VAL HGy% 1.0 1.8 5.0 358 333 A 24 VAL HB A 31 VAL HGx% 1.0 1.8 5.0 359 334 A 24 VAL HGy% A 31 VAL HGy% 1.0 1.8 3.5 360 334 A 24 VAL HGy% A 31 VAL HGx% 1.0 1.8 3.5 361 335 A 25 LYS H A 62 HIS HBx 1.0 1.8 5.0 362 335 A 25 LYS H A 62 HIS HBy 1.0 1.8 5.0 363 336 A 25 LYS H A 63 VAL HGy% 1.0 1.8 5.0 364 336 A 25 LYS H A 63 VAL HGx% 1.0 1.8 5.0 365 337 A 25 LYS HBx A 25 LYS HDx 1.0 1.8 3.5 366 337 A 25 LYS HBy A 25 LYS HDx 1.0 1.8 3.5 367 337 A 25 LYS HDy A 25 LYS HBy 1.0 1.8 3.5 368 337 A 25 LYS HDy A 25 LYS HBx 1.0 1.8 3.5 369 338 A 60 THR HG2% A 25 LYS HBy 1.0 1.8 5.0 370 338 A 60 THR HG2% A 25 LYS HBx 1.0 1.8 5.0 371 339 A 63 VAL H A 25 LYS HBy 1.0 1.8 5.0 372 339 A 63 VAL H A 25 LYS HBx 1.0 1.8 5.0 373 340 A 25 LYS HEx A 25 LYS HGx 1.0 1.8 3.5 374 340 A 25 LYS HEy A 25 LYS HGx 1.0 1.8 3.5 375 340 A 25 LYS HGy A 25 LYS HEx 1.0 1.8 3.5 376 340 A 25 LYS HEy A 25 LYS HGy 1.0 1.8 3.5 377 341 A 60 THR HG2% A 25 LYS HGx 1.0 1.8 5.0 378 341 A 60 THR HG2% A 25 LYS HGy 1.0 1.8 5.0 379 342 A 26 LEU H A 26 LEU HBy 1.0 1.8 3.5 380 342 A 26 LEU H A 26 LEU HBx 1.0 1.8 3.5 381 343 A 26 LEU H A 26 LEU HDy% 1.0 1.8 5.0 382 343 A 26 LEU H A 26 LEU HDx% 1.0 1.8 5.0 383 344 A 26 LEU H A 31 VAL HGy% 1.0 1.8 6.0 384 344 A 26 LEU H A 31 VAL HGx% 1.0 1.8 6.0 385 345 A 26 LEU HA A 26 LEU HDy% 1.0 1.8 5.0 386 345 A 26 LEU HA A 26 LEU HDx% 1.0 1.8 5.0 387 346 A 29 ILE HG2% A 26 LEU HBy 1.0 1.8 5.0 388 346 A 29 ILE HG2% A 26 LEU HBx 1.0 1.8 5.0 389 347 A 29 ILE HD1% A 26 LEU HBy 1.0 1.8 6.0 390 347 A 29 ILE HD1% A 26 LEU HBx 1.0 1.8 6.0 391 348 A 26 LEU HBy A 46 LEU HDy% 1.0 1.8 5.0 392 348 A 26 LEU HBx A 46 LEU HDy% 1.0 1.8 5.0 393 348 A 46 LEU HDx% A 26 LEU HBy 1.0 1.8 5.0 394 348 A 26 LEU HBx A 46 LEU HDx% 1.0 1.8 5.0 395 349 A 63 VAL HB A 26 LEU HBy 1.0 1.8 5.0 396 349 A 63 VAL HB A 26 LEU HBx 1.0 1.8 5.0 397 350 A 26 LEU HBy A 63 VAL HGy% 1.0 1.8 6.0 398 350 A 26 LEU HBx A 63 VAL HGy% 1.0 1.8 6.0 399 350 A 63 VAL HGx% A 26 LEU HBy 1.0 1.8 6.0 400 350 A 63 VAL HGx% A 26 LEU HBx 1.0 1.8 6.0 401 351 A 26 LEU HDx% A 46 LEU HBy 1.0 1.8 5.0 402 351 A 26 LEU HDy% A 46 LEU HBy 1.0 1.8 5.0 403 351 A 46 LEU HBx A 26 LEU HDy% 1.0 1.8 5.0 404 351 A 26 LEU HDx% A 46 LEU HBx 1.0 1.8 5.0 405 352 A 63 VAL HB A 26 LEU HDy% 1.0 1.8 5.0 406 352 A 63 VAL HB A 26 LEU HDx% 1.0 1.8 5.0 407 353 A 30 LYS H A 30 LYS HBx 1.0 1.8 3.5 408 353 A 30 LYS H A 30 LYS HBy 1.0 1.8 3.5 409 354 A 30 LYS H A 30 LYS HGx 1.0 1.8 5.0 410 354 A 30 LYS H A 30 LYS HGy 1.0 1.8 5.0 411 355 A 30 LYS HA A 30 LYS HGx 1.0 1.8 5.0 412 355 A 30 LYS HA A 30 LYS HGy 1.0 1.8 5.0 413 356 A 31 VAL H A 31 VAL HGy% 1.0 1.8 5.0 414 356 A 31 VAL H A 31 VAL HGx% 1.0 1.8 5.0 415 357 A 32 THR H A 31 VAL HGy% 1.0 1.8 5.0 416 357 A 32 THR H A 31 VAL HGx% 1.0 1.8 5.0 417 358 A 33 PHE H A 33 PHE HBx 1.0 1.8 5.0 418 358 A 33 PHE H A 33 PHE HBy 1.0 1.8 5.0 419 359 A 39 ALA HB% A 33 PHE HBx 1.0 1.8 5.0 420 359 A 39 ALA HB% A 33 PHE HBy 1.0 1.8 5.0 421 360 A 37 GLU H A 37 GLU HBx 1.0 1.8 3.5 422 360 A 37 GLU H A 37 GLU HBy 1.0 1.8 3.5 423 361 A 38 LYS H A 37 GLU HBx 1.0 1.8 5.0 424 361 A 38 LYS H A 37 GLU HBy 1.0 1.8 5.0 425 362 A 38 LYS H A 38 LYS HGx 1.0 1.8 5.0 426 362 A 38 LYS H A 38 LYS HGy 1.0 1.8 5.0 427 363 A 38 LYS HA A 38 LYS HGx 1.0 1.8 5.0 428 363 A 38 LYS HA A 38 LYS HGy 1.0 1.8 5.0 429 364 A 38 LYS HA A 41 LYS HBy 1.0 1.8 5.0 430 364 A 38 LYS HA A 41 LYS HBx 1.0 1.8 5.0 431 365 A 39 ALA HA A 42 TYR HBy 1.0 1.8 5.0 432 365 A 39 ALA HA A 42 TYR HBx 1.0 1.8 5.0 433 366 A 40 LYS H A 40 LYS HBy 1.0 1.8 3.5 434 366 A 40 LYS H A 40 LYS HBx 1.0 1.8 3.5 435 367 A 40 LYS H A 40 LYS HGx 1.0 1.8 5.0 436 367 A 40 LYS H A 40 LYS HGy 1.0 1.8 5.0 437 368 A 40 LYS HA A 40 LYS HGx 1.0 1.8 5.0 438 368 A 40 LYS HA A 40 LYS HGy 1.0 1.8 5.0 439 369 A 41 LYS H A 41 LYS HBy 1.0 1.8 3.5 440 369 A 41 LYS H A 41 LYS HBx 1.0 1.8 3.5 441 370 A 41 LYS H A 41 LYS HGx 1.0 1.8 5.0 442 370 A 41 LYS H A 41 LYS HGy 1.0 1.8 5.0 443 371 A 41 LYS HA A 44 GLN HBy 1.0 1.8 5.0 444 371 A 41 LYS HA A 44 GLN HBx 1.0 1.8 5.0 445 372 A 42 TYR H A 41 LYS HBy 1.0 1.8 3.5 446 372 A 42 TYR H A 41 LYS HBx 1.0 1.8 3.5 447 373 A 41 LYS HBx A 42 TYR HBy 1.0 1.8 5.0 448 373 A 42 TYR HBx A 41 LYS HBy 1.0 1.8 5.0 449 373 A 41 LYS HBx A 42 TYR HBx 1.0 1.8 5.0 450 373 A 41 LYS HBy A 42 TYR HBy 1.0 1.8 5.0 451 374 A 42 TYR H A 41 LYS HGx 1.0 1.8 6.0 452 374 A 42 TYR H A 41 LYS HGy 1.0 1.8 6.0 453 375 A 42 TYR HA A 45 LYS HBy 1.0 1.8 5.0 454 375 A 42 TYR HA A 45 LYS HBx 1.0 1.8 5.0 455 376 A 43 ALA H A 42 TYR HBy 1.0 1.8 5.0 456 376 A 43 ALA H A 42 TYR HBx 1.0 1.8 5.0 457 377 A 43 ALA H A 46 LEU HBy 1.0 1.8 6.0 458 377 A 43 ALA H A 46 LEU HBx 1.0 1.8 6.0 459 378 A 43 ALA HA A 46 LEU HBy 1.0 1.8 5.0 460 378 A 43 ALA HA A 46 LEU HBx 1.0 1.8 5.0 461 379 A 43 ALA HA A 46 LEU HDy% 1.0 1.8 5.0 462 379 A 43 ALA HA A 46 LEU HDx% 1.0 1.8 5.0 463 380 A 43 ALA HB% A 46 LEU HBy 1.0 1.8 5.0 464 380 A 43 ALA HB% A 46 LEU HBx 1.0 1.8 5.0 465 381 A 44 GLN H A 44 GLN HBy 1.0 1.8 3.5 466 381 A 44 GLN H A 44 GLN HBx 1.0 1.8 3.5 467 382 A 44 GLN H A 44 GLN HGx 1.0 1.8 3.5 468 382 A 44 GLN H A 44 GLN HGy 1.0 1.8 3.5 469 383 A 44 GLN H A 54 VAL HG11 1.0 1.8 5.0 470 383 A 44 GLN H A 54 VAL HGy% 1.0 1.8 5.0 471 384 A 44 GLN HA A 44 GLN HGx 1.0 1.8 5.0 472 384 A 44 GLN HA A 44 GLN HGy 1.0 1.8 5.0 473 385 A 44 GLN HA A 54 VAL HG11 1.0 1.8 5.0 474 385 A 44 GLN HA A 54 VAL HGy% 1.0 1.8 5.0 475 386 A 45 LYS H A 44 GLN HBy 1.0 1.8 5.0 476 386 A 45 LYS H A 44 GLN HBx 1.0 1.8 5.0 477 387 A 45 LYS HA A 44 GLN HBy 1.0 1.8 6.0 478 387 A 44 GLN HBx A 45 LYS HA 1.0 1.8 6.0 479 388 A 44 GLN HGy A 54 VAL HG11 1.0 1.8 5.0 480 388 A 44 GLN HGx A 54 VAL HG11 1.0 1.8 5.0 481 388 A 54 VAL HGy% A 44 GLN HGx 1.0 1.8 5.0 482 388 A 44 GLN HGy A 54 VAL HGy% 1.0 1.8 5.0 483 389 A 45 LYS H A 45 LYS HBy 1.0 1.8 3.5 484 389 A 45 LYS H A 45 LYS HBx 1.0 1.8 3.5 485 390 A 45 LYS H A 45 LYS HDy 1.0 1.8 6.0 486 390 A 45 LYS H A 45 LYS HDx 1.0 1.8 6.0 487 391 A 46 LEU H A 45 LYS HBy 1.0 1.8 5.0 488 391 A 46 LEU H A 45 LYS HBx 1.0 1.8 5.0 489 392 A 49 ILE HD1% A 45 LYS HGx 1.0 1.8 5.0 490 392 A 49 ILE HD1% A 45 LYS HGy 1.0 1.8 5.0 491 393 A 49 ILE HD1% A 45 LYS HDy 1.0 1.8 5.0 492 393 A 49 ILE HD1% A 45 LYS HDx 1.0 1.8 5.0 493 394 A 46 LEU H A 46 LEU HDy% 1.0 1.8 5.0 494 394 A 46 LEU H A 46 LEU HDx% 1.0 1.8 5.0 495 395 A 46 LEU HA A 46 LEU HDy% 1.0 1.8 3.5 496 395 A 46 LEU HA A 46 LEU HDx% 1.0 1.8 3.5 497 396 A 46 LEU HA A 49 ILE HG1y 1.0 1.8 5.0 498 396 A 46 LEU HA A 49 ILE HG1x 1.0 1.8 5.0 499 397 A 47 ALA H A 46 LEU HBy 1.0 1.8 5.0 500 397 A 47 ALA H A 46 LEU HBx 1.0 1.8 5.0 501 398 A 50 TYR HDy A 46 LEU HBy 1.0 1.8 6.0 502 398 A 50 TYR HDy A 46 LEU HBx 1.0 1.8 6.0 503 399 A 47 ALA H A 46 LEU HDy% 1.0 1.8 5.0 504 399 A 47 ALA H A 46 LEU HDx% 1.0 1.8 5.0 505 400 A 63 VAL HB A 46 LEU HDy% 1.0 1.8 5.0 506 400 A 63 VAL HB A 46 LEU HDx% 1.0 1.8 5.0 507 401 A 46 LEU HDx% A 63 VAL HGy% 1.0 1.8 5.0 508 401 A 46 LEU HDy% A 63 VAL HGy% 1.0 1.8 5.0 509 401 A 63 VAL HGx% A 46 LEU HDy% 1.0 1.8 5.0 510 401 A 63 VAL HGx% A 46 LEU HDx% 1.0 1.8 5.0 511 402 A 47 ALA H A 54 VAL HG11 1.0 1.8 5.0 512 402 A 47 ALA H A 54 VAL HGy% 1.0 1.8 5.0 513 403 A 47 ALA HA A 52 LEU HBy 1.0 1.8 5.0 514 403 A 47 ALA HA A 52 LEU HBx 1.0 1.8 5.0 515 404 A 47 ALA HA A 54 VAL HG11 1.0 1.8 5.0 516 404 A 47 ALA HA A 54 VAL HGy% 1.0 1.8 5.0 517 405 A 47 ALA HA A 63 VAL HGy% 1.0 1.8 6.0 518 405 A 47 ALA HA A 63 VAL HGx% 1.0 1.8 6.0 519 406 A 47 ALA HB% A 52 LEU HBy 1.0 1.8 5.0 520 406 A 47 ALA HB% A 52 LEU HBx 1.0 1.8 5.0 521 407 A 47 ALA HB% A 54 VAL HG11 1.0 1.8 3.5 522 407 A 47 ALA HB% A 54 VAL HGy% 1.0 1.8 3.5 523 408 A 48 LYS H A 48 LYS HBy 1.0 1.8 3.5 524 408 A 48 LYS H A 48 LYS HBx 1.0 1.8 3.5 525 409 A 48 LYS H A 49 ILE HG1y 1.0 1.8 5.0 526 409 A 48 LYS H A 49 ILE HG1x 1.0 1.8 5.0 527 410 A 48 LYS HA A 49 ILE HG1y 1.0 1.8 6.0 528 410 A 48 LYS HA A 49 ILE HG1x 1.0 1.8 6.0 529 411 A 49 ILE H A 48 LYS HBy 1.0 1.8 5.0 530 411 A 49 ILE H A 48 LYS HBx 1.0 1.8 5.0 531 412 A 48 LYS HBx A 49 ILE HG1y 1.0 1.8 5.0 532 412 A 48 LYS HBy A 49 ILE HG1y 1.0 1.8 5.0 533 412 A 49 ILE HG1x A 48 LYS HBy 1.0 1.8 5.0 534 412 A 49 ILE HG1x A 48 LYS HBx 1.0 1.8 5.0 535 413 A 49 ILE H A 49 ILE HG1y 1.0 1.8 5.0 536 413 A 49 ILE H A 49 ILE HG1x 1.0 1.8 5.0 537 414 A 49 ILE HA A 49 ILE HG1y 1.0 1.8 5.0 538 414 A 49 ILE HA A 49 ILE HG1x 1.0 1.8 5.0 539 415 A 50 TYR H A 50 TYR HBy 1.0 1.8 3.5 540 415 A 50 TYR H A 50 TYR HBx 1.0 1.8 3.5 541 416 A 50 TYR HA A 52 LEU HDy% 1.0 1.8 5.0 542 416 A 50 TYR HA A 52 LEU HDx% 1.0 1.8 5.0 543 417 A 50 TYR HBx A 52 LEU HBy 1.0 1.8 5.0 544 417 A 52 LEU HBx A 50 TYR HBy 1.0 1.8 5.0 545 417 A 52 LEU HBx A 50 TYR HBx 1.0 1.8 5.0 546 417 A 50 TYR HBy A 52 LEU HBy 1.0 1.8 5.0 547 418 A 52 LEU HG A 50 TYR HBy 1.0 1.8 5.0 548 418 A 52 LEU HG A 50 TYR HBx 1.0 1.8 5.0 549 419 A 50 TYR HBy A 52 LEU HDy% 1.0 1.8 5.0 550 419 A 50 TYR HBx A 52 LEU HDy% 1.0 1.8 5.0 551 419 A 52 LEU HDx% A 50 TYR HBy 1.0 1.8 5.0 552 419 A 50 TYR HBx A 52 LEU HDx% 1.0 1.8 5.0 553 420 A 50 TYR HDx A 52 LEU HDy% 1.0 1.8 5.0 554 420 A 52 LEU HDx% A 50 TYR HDx 1.0 1.8 5.0 555 421 A 50 TYR HDy A 52 LEU HDy% 1.0 1.8 6.0 556 421 A 50 TYR HDy A 52 LEU HDx% 1.0 1.8 6.0 557 422 A 51 GLN H A 51 GLN HBy 1.0 1.8 5.0 558 422 A 51 GLN H A 51 GLN HBx 1.0 1.8 5.0 559 423 A 51 GLN H A 51 GLN HGx 1.0 1.8 5.0 560 423 A 51 GLN H A 51 GLN HGy 1.0 1.8 5.0 561 424 A 51 GLN HA A 51 GLN HGx 1.0 1.8 5.0 562 424 A 51 GLN HA A 51 GLN HGy 1.0 1.8 5.0 563 425 A 52 LEU H A 52 LEU HBy 1.0 1.8 5.0 564 425 A 52 LEU H A 52 LEU HBx 1.0 1.8 5.0 565 426 A 52 LEU H A 52 LEU HDy% 1.0 1.8 5.0 566 426 A 52 LEU H A 52 LEU HDx% 1.0 1.8 5.0 567 427 A 52 LEU HA A 52 LEU HDy% 1.0 1.8 3.5 568 427 A 52 LEU HA A 52 LEU HDx% 1.0 1.8 3.5 569 428 A 53 THR H A 52 LEU HBy 1.0 1.8 3.5 570 428 A 53 THR H A 52 LEU HBx 1.0 1.8 3.5 571 429 A 63 VAL HB A 52 LEU HBy 1.0 1.8 6.0 572 429 A 63 VAL HB A 52 LEU HBx 1.0 1.8 6.0 573 430 A 52 LEU HBx A 63 VAL HGy% 1.0 1.8 3.5 574 430 A 52 LEU HBy A 63 VAL HGy% 1.0 1.8 3.5 575 430 A 63 VAL HGx% A 52 LEU HBy 1.0 1.8 3.5 576 430 A 63 VAL HGx% A 52 LEU HBx 1.0 1.8 3.5 577 431 A 52 LEU HG A 63 VAL HGy% 1.0 1.8 5.0 578 431 A 52 LEU HG A 63 VAL HGx% 1.0 1.8 5.0 579 432 A 53 THR H A 52 LEU HDy% 1.0 1.8 5.0 580 432 A 53 THR H A 52 LEU HDx% 1.0 1.8 5.0 581 433 A 64 LYS HA A 52 LEU HDy% 1.0 1.8 5.0 582 433 A 64 LYS HA A 52 LEU HDx% 1.0 1.8 5.0 583 434 A 53 THR H A 63 VAL HGy% 1.0 1.8 5.0 584 434 A 53 THR H A 63 VAL HGx% 1.0 1.8 5.0 585 435 A 54 VAL H A 54 VAL HG11 1.0 1.8 5.0 586 435 A 54 VAL H A 54 VAL HGy% 1.0 1.8 5.0 587 436 A 54 VAL HA A 63 VAL HGy% 1.0 1.8 5.0 588 436 A 54 VAL HA A 63 VAL HGx% 1.0 1.8 5.0 589 437 A 55 HIS H A 54 VAL HG11 1.0 1.8 5.0 590 437 A 55 HIS H A 54 VAL HGy% 1.0 1.8 5.0 591 438 A 55 HIS H A 55 HIS HBx 1.0 1.8 5.0 592 438 A 55 HIS H A 55 HIS HBy 1.0 1.8 5.0 593 439 A 55 HIS H A 62 HIS HBx 1.0 1.8 6.0 594 439 A 55 HIS H A 62 HIS HBy 1.0 1.8 6.0 595 440 A 55 HIS H A 63 VAL HGy% 1.0 1.8 6.0 596 440 A 55 HIS H A 63 VAL HGx% 1.0 1.8 6.0 597 441 A 56 VAL H A 56 VAL HG11 1.0 1.8 5.0 598 441 A 56 VAL H A 56 VAL HGy% 1.0 1.8 5.0 599 442 A 56 VAL HA A 57 HIS HBx 1.0 1.8 5.0 600 442 A 56 VAL HA A 57 HIS HBy 1.0 1.8 5.0 601 443 A 56 VAL HA A 61 ILE HG1y 1.0 1.8 5.0 602 443 A 56 VAL HA A 61 ILE HG1x 1.0 1.8 5.0 603 444 A 57 HIS H A 56 VAL HG11 1.0 1.8 5.0 604 444 A 57 HIS H A 56 VAL HGy% 1.0 1.8 5.0 605 445 A 61 ILE HG2% A 56 VAL HG11 1.0 1.8 3.5 606 445 A 61 ILE HG2% A 56 VAL HGy% 1.0 1.8 3.5 607 446 A 62 HIS H A 56 VAL HG11 1.0 1.8 6.0 608 446 A 62 HIS H A 56 VAL HGy% 1.0 1.8 6.0 609 447 A 57 HIS H A 61 ILE HG1y 1.0 1.8 5.0 610 447 A 57 HIS H A 61 ILE HG1x 1.0 1.8 5.0 611 448 A 61 ILE H A 61 ILE HG1y 1.0 1.8 5.0 612 448 A 61 ILE H A 61 ILE HG1x 1.0 1.8 5.0 613 449 A 61 ILE HG2% A 61 ILE HG1y 1.0 1.8 3.5 614 449 A 61 ILE HG2% A 61 ILE HG1x 1.0 1.8 3.5 615 450 A 62 HIS H A 61 ILE HG1y 1.0 1.8 6.0 616 450 A 62 HIS H A 61 ILE HG1x 1.0 1.8 6.0 617 451 A 62 HIS H A 62 HIS HBx 1.0 1.8 3.5 618 451 A 62 HIS H A 62 HIS HBy 1.0 1.8 3.5 619 452 A 62 HIS H A 63 VAL HGy% 1.0 1.8 6.0 620 452 A 62 HIS H A 63 VAL HGx% 1.0 1.8 6.0 621 453 A 62 HIS HA A 63 VAL HGy% 1.0 1.8 5.0 622 453 A 62 HIS HA A 63 VAL HGx% 1.0 1.8 5.0 623 454 A 63 VAL H A 62 HIS HBx 1.0 1.8 5.0 624 454 A 63 VAL H A 62 HIS HBy 1.0 1.8 5.0 625 455 A 63 VAL H A 63 VAL HGy% 1.0 1.8 5.0 626 455 A 63 VAL H A 63 VAL HGx% 1.0 1.8 5.0 627 456 A 64 LYS H A 63 VAL HGy% 1.0 1.8 5.0 628 456 A 64 LYS H A 63 VAL HGx% 1.0 1.8 5.0 629 457 A 64 LYS H A 64 LYS HGx 1.0 1.8 5.0 630 457 A 64 LYS H A 64 LYS HGy 1.0 1.8 5.0 stop_ save_