data_nef_c18678_2lxi 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 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 SER start . . 2 A 2 ASN middle . . 3 A 3 ILE middle . . 4 A 4 VAL middle . . 5 A 5 MET middle . . 6 A 6 LEU middle . . 7 A 7 ARG middle . . 8 A 8 MET middle . . 9 A 9 LEU middle . . 10 A 10 PRO middle . false 11 A 11 GLN middle . . 12 A 12 ALA middle . . 13 A 13 ALA middle . . 14 A 14 THR middle . . 15 A 15 GLU middle . . 16 A 16 ASP middle . . 17 A 17 ASP middle . . 18 A 18 ILE middle . . 19 A 19 ARG middle . . 20 A 20 GLY middle . false 21 A 21 GLN middle . . 22 A 22 LEU middle . . 23 A 23 GLN middle . . 24 A 24 SER middle . . 25 A 25 HIS middle . . 26 A 26 GLY middle . false 27 A 27 VAL middle . . 28 A 28 GLN middle . . 29 A 29 ALA middle . . 30 A 30 ARG middle . . 31 A 31 GLU middle . . 32 A 32 VAL middle . . 33 A 33 ARG middle . . 34 A 34 LEU middle . . 35 A 35 MET middle . . 36 A 36 ARG middle . . 37 A 37 ASN middle . . 38 A 38 LYS middle . . 39 A 39 SER middle . . 40 A 40 SER middle . . 41 A 41 GLY middle . false 42 A 42 GLN middle . . 43 A 43 SER middle . . 44 A 44 ARG middle . . 45 A 45 GLY middle . false 46 A 46 PHE middle . . 47 A 47 ALA middle . . 48 A 48 PHE middle . . 49 A 49 VAL middle . . 50 A 50 GLU middle . . 51 A 51 PHE middle . . 52 A 52 SER middle . . 53 A 53 HIS middle . . 54 A 54 LEU middle . . 55 A 55 GLN middle . . 56 A 56 ASP middle . . 57 A 57 ALA middle . . 58 A 58 THR middle . . 59 A 59 ARG middle . . 60 A 60 TRP middle . . 61 A 61 MET middle . . 62 A 62 GLU middle . . 63 A 63 ALA middle . . 64 A 64 ASN middle . . 65 A 65 GLN middle . . 66 A 66 HIS middle . . 67 A 67 SER middle . . 68 A 68 LEU middle . . 69 A 69 ASN middle . . 70 A 70 ILE middle . . 71 A 71 LEU middle . . 72 A 72 GLY middle . false 73 A 73 GLN middle . . 74 A 74 LYS middle . . 75 A 75 VAL middle . . 76 A 76 SER middle . . 77 A 77 MET middle . . 78 A 78 HIS middle . . 79 A 79 TYR middle . . 80 A 80 SER middle . . 81 A 81 ASP middle . . 82 A 82 PRO middle . false 83 A 83 LYS middle . . 84 A 84 PRO middle . false 85 A 85 LYS middle . . 86 A 86 ILE middle . . 87 A 87 ASN middle . . 88 A 88 GLU middle . . 89 A 89 ASP middle . . 90 A 90 TRP middle . . 91 A 91 LEU 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 SER HBx H 1 3.907 0.008 A 1 SER HBy H 1 4.072 0.008 A 1 SER CB C 13 65.353 0.18 A 2 ASN H H 1 8.371 0.008 A 2 ASN HA H 1 4.732 0.008 A 2 ASN HBx H 1 2.560 0.008 A 2 ASN HBy H 1 3.208 0.008 A 2 ASN HD2x H 1 7.126 0.008 A 2 ASN HD2y H 1 7.754 0.008 A 2 ASN CA C 13 54.037 0.18 A 2 ASN CB C 13 36.851 0.18 A 2 ASN N N 15 114.260 0.12 A 2 ASN ND2 N 15 112.909 0.12 A 3 ILE H H 1 8.684 0.008 A 3 ILE HA H 1 5.154 0.008 A 3 ILE HB H 1 2.023 0.008 A 3 ILE HD1% H 1 0.844 0.008 A 3 ILE HG1y H 1 1.687 0.008 A 3 ILE HG1x H 1 0.945 0.008 A 3 ILE HG2% H 1 0.980 0.008 A 3 ILE C C 13 175.062 0.18 A 3 ILE CA C 13 60.507 0.18 A 3 ILE CB C 13 39.122 0.18 A 3 ILE CD1 C 13 13.606 0.18 A 3 ILE CG1 C 13 27.798 0.18 A 3 ILE CG2 C 13 18.777 0.18 A 3 ILE N N 15 120.709 0.12 A 4 VAL H H 1 9.484 0.008 A 4 VAL HA H 1 4.799 0.008 A 4 VAL HB H 1 2.398 0.008 A 4 VAL HGx% H 1 1.274 0.008 A 4 VAL HGy% H 1 1.000 0.008 A 4 VAL C C 13 175.169 0.18 A 4 VAL CA C 13 60.526 0.18 A 4 VAL CB C 13 35.363 0.18 A 4 VAL CGy C 13 22.158 0.18 A 4 VAL CGx C 13 21.699 0.18 A 4 VAL N N 15 127.219 0.12 A 5 MET H H 1 9.974 0.008 A 5 MET HA H 1 5.259 0.008 A 5 MET HBx H 1 1.922 0.008 A 5 MET HBy H 1 1.922 0.008 A 5 MET HE% H 1 1.706 0.008 A 5 MET HGy H 1 2.148 0.008 A 5 MET HGx H 1 1.915 0.008 A 5 MET C C 13 175.079 0.18 A 5 MET CA C 13 53.419 0.18 A 5 MET CB C 13 35.754 0.18 A 5 MET CE C 13 17.241 0.18 A 5 MET CG C 13 31.528 0.18 A 5 MET N N 15 127.666 0.12 A 6 LEU H H 1 9.074 0.008 A 6 LEU HA H 1 5.467 0.008 A 6 LEU HBy H 1 1.584 0.008 A 6 LEU HBx H 1 1.222 0.008 A 6 LEU HDx% H 1 0.883 0.008 A 6 LEU HDy% H 1 0.788 0.008 A 6 LEU HG H 1 1.709 0.008 A 6 LEU C C 13 176.500 0.18 A 6 LEU CA C 13 52.106 0.18 A 6 LEU CB C 13 43.147 0.18 A 6 LEU CDy C 13 26.109 0.18 A 6 LEU CDx C 13 24.701 0.18 A 6 LEU CG C 13 27.166 0.18 A 6 LEU N N 15 126.088 0.12 A 7 ARG H H 1 8.600 0.008 A 7 ARG HA H 1 4.911 0.008 A 7 ARG HBx H 1 1.876 0.008 A 7 ARG HBy H 1 1.876 0.008 A 7 ARG HDx H 1 2.767 0.008 A 7 ARG HDy H 1 2.842 0.008 A 7 ARG HGx H 1 1.427 0.008 A 7 ARG HGy H 1 1.427 0.008 A 7 ARG C C 13 174.863 0.18 A 7 ARG CA C 13 54.612 0.18 A 7 ARG CB C 13 33.847 0.18 A 7 ARG CD C 13 43.208 0.18 A 7 ARG CG C 13 28.380 0.18 A 7 ARG N N 15 119.197 0.12 A 8 MET H H 1 8.430 0.008 A 8 MET HA H 1 4.057 0.008 A 8 MET HBx H 1 2.380 0.008 A 8 MET HBy H 1 2.770 0.008 A 8 MET HE% H 1 2.144 0.008 A 8 MET HGx H 1 2.512 0.008 A 8 MET HGy H 1 2.625 0.008 A 8 MET C C 13 176.959 0.18 A 8 MET CA C 13 55.822 0.18 A 8 MET CB C 13 28.761 0.18 A 8 MET CE C 13 16.567 0.18 A 8 MET CG C 13 32.814 0.18 A 8 MET N N 15 112.693 0.12 A 9 LEU H H 1 8.003 0.008 A 9 LEU HA H 1 4.104 0.008 A 9 LEU HBx H 1 1.087 0.008 A 9 LEU HBy H 1 1.240 0.008 A 9 LEU HDx% H 1 0.690 0.008 A 9 LEU HDy% H 1 0.583 0.008 A 9 LEU HG H 1 1.398 0.008 A 9 LEU CA C 13 53.197 0.18 A 9 LEU CB C 13 42.065 0.18 A 9 LEU CDx C 13 26.092 0.18 A 9 LEU CDy C 13 26.962 0.18 A 9 LEU CG C 13 26.766 0.18 A 9 LEU N N 15 117.401 0.12 A 10 PRO HA H 1 4.499 0.008 A 10 PRO HBx H 1 1.940 0.008 A 10 PRO HBy H 1 2.402 0.008 A 10 PRO HDx H 1 3.222 0.008 A 10 PRO HDy H 1 3.729 0.008 A 10 PRO HGx H 1 2.018 0.008 A 10 PRO HGy H 1 2.097 0.008 A 10 PRO CA C 13 62.114 0.18 A 10 PRO CB C 13 31.669 0.18 A 10 PRO CD C 13 49.560 0.18 A 10 PRO CG C 13 27.804 0.18 A 11 GLN H H 1 9.111 0.008 A 11 GLN HA H 1 3.884 0.008 A 11 GLN HBx H 1 2.107 0.008 A 11 GLN HBy H 1 2.149 0.008 A 11 GLN HE2y H 1 7.649 0.008 A 11 GLN HE2x H 1 6.999 0.008 A 11 GLN HGx H 1 2.458 0.008 A 11 GLN HGy H 1 2.494 0.008 A 11 GLN CA C 13 58.968 0.18 A 11 GLN CB C 13 28.635 0.18 A 11 GLN CG C 13 34.286 0.18 A 11 GLN N N 15 124.939 0.12 A 11 GLN NE2 N 15 111.566 0.12 A 12 ALA H H 1 8.267 0.008 A 12 ALA HA H 1 4.283 0.008 A 12 ALA HB% H 1 1.377 0.008 A 12 ALA CA C 13 52.044 0.18 A 12 ALA CB C 13 19.155 0.18 A 12 ALA N N 15 115.571 0.12 A 13 ALA H H 1 7.482 0.008 A 13 ALA HA H 1 4.522 0.008 A 13 ALA HB% H 1 1.288 0.008 A 13 ALA C C 13 178.087 0.18 A 13 ALA CA C 13 51.933 0.18 A 13 ALA CB C 13 19.127 0.18 A 13 ALA N N 15 118.599 0.12 A 14 THR H H 1 9.776 0.008 A 14 THR HA H 1 4.666 0.008 A 14 THR HB H 1 4.681 0.008 A 14 THR HG2% H 1 1.335 0.008 A 14 THR C C 13 176.307 0.18 A 14 THR CA C 13 59.492 0.18 A 14 THR CB C 13 72.944 0.18 A 14 THR CG2 C 13 21.272 0.18 A 14 THR N N 15 113.678 0.12 A 15 GLU H H 1 10.146 0.008 A 15 GLU HA H 1 3.693 0.008 A 15 GLU HBx H 1 1.902 0.008 A 15 GLU HBy H 1 2.176 0.008 A 15 GLU HGx H 1 2.161 0.008 A 15 GLU HGy H 1 2.561 0.008 A 15 GLU C C 13 179.066 0.18 A 15 GLU CA C 13 61.151 0.18 A 15 GLU CB C 13 28.889 0.18 A 15 GLU CG C 13 37.878 0.18 A 15 GLU N N 15 119.605 0.12 A 16 ASP H H 1 8.231 0.008 A 16 ASP HA H 1 4.456 0.008 A 16 ASP HBy H 1 2.651 0.008 A 16 ASP HBx H 1 2.559 0.008 A 16 ASP C C 13 179.670 0.18 A 16 ASP CA C 13 57.444 0.18 A 16 ASP CB C 13 40.105 0.18 A 16 ASP N N 15 117.474 0.12 A 17 ASP H H 1 7.731 0.008 A 17 ASP HA H 1 4.512 0.008 A 17 ASP HBy H 1 2.943 0.008 A 17 ASP HBx H 1 2.572 0.008 A 17 ASP C C 13 179.549 0.18 A 17 ASP CA C 13 57.847 0.18 A 17 ASP CB C 13 41.114 0.18 A 17 ASP N N 15 120.300 0.12 A 18 ILE H H 1 7.370 0.008 A 18 ILE HA H 1 3.529 0.008 A 18 ILE HB H 1 1.923 0.008 A 18 ILE HD1% H 1 0.610 0.008 A 18 ILE HG1x H 1 0.731 0.008 A 18 ILE HG1y H 1 1.671 0.008 A 18 ILE HG2% H 1 0.784 0.008 A 18 ILE C C 13 178.112 0.18 A 18 ILE CA C 13 65.179 0.18 A 18 ILE CB C 13 37.794 0.18 A 18 ILE CD1 C 13 13.769 0.18 A 18 ILE CG1 C 13 28.120 0.18 A 18 ILE CG2 C 13 17.812 0.18 A 18 ILE N N 15 118.721 0.12 A 19 ARG H H 1 8.844 0.008 A 19 ARG HA H 1 3.937 0.008 A 19 ARG HBx H 1 1.923 0.008 A 19 ARG HBy H 1 1.969 0.008 A 19 ARG HDx H 1 3.186 0.008 A 19 ARG HDy H 1 3.253 0.008 A 19 ARG HGx H 1 1.537 0.008 A 19 ARG HGy H 1 1.771 0.008 A 19 ARG CA C 13 60.196 0.18 A 19 ARG CB C 13 30.006 0.18 A 19 ARG CD C 13 43.039 0.18 A 19 ARG CG C 13 29.621 0.18 A 19 ARG N N 15 118.476 0.12 A 20 GLY H H 1 8.381 0.008 A 20 GLY HAy H 1 4.115 0.008 A 20 GLY HAx H 1 3.998 0.008 A 20 GLY C C 13 176.842 0.18 A 20 GLY CA C 13 47.053 0.18 A 20 GLY N N 15 106.191 0.12 A 21 GLN H H 1 7.466 0.008 A 21 GLN HA H 1 4.334 0.008 A 21 GLN HBy H 1 2.655 0.008 A 21 GLN HBx H 1 2.338 0.008 A 21 GLN HE2x H 1 7.003 0.008 A 21 GLN HE2y H 1 7.842 0.008 A 21 GLN HGy H 1 2.716 0.008 A 21 GLN HGx H 1 2.404 0.008 A 21 GLN C C 13 178.817 0.18 A 21 GLN CA C 13 57.882 0.18 A 21 GLN CB C 13 27.999 0.18 A 21 GLN CG C 13 33.869 0.18 A 21 GLN N N 15 119.886 0.12 A 21 GLN NE2 N 15 112.913 0.12 A 22 LEU H H 1 7.824 0.008 A 22 LEU HA H 1 3.901 0.008 A 22 LEU HBx H 1 1.479 0.008 A 22 LEU HBy H 1 1.844 0.008 A 22 LEU HDx% H 1 0.464 0.008 A 22 LEU HDy% H 1 -0.408 0.008 A 22 LEU HG H 1 1.304 0.008 A 22 LEU C C 13 178.963 0.18 A 22 LEU CA C 13 58.132 0.18 A 22 LEU CB C 13 40.934 0.18 A 22 LEU CDy C 13 26.650 0.18 A 22 LEU CDx C 13 23.129 0.18 A 22 LEU CG C 13 26.766 0.18 A 22 LEU N N 15 120.793 0.12 A 23 GLN H H 1 8.333 0.008 A 23 GLN HA H 1 4.158 0.008 A 23 GLN HBy H 1 2.230 0.008 A 23 GLN HBx H 1 2.187 0.008 A 23 GLN HE2y H 1 7.500 0.008 A 23 GLN HE2x H 1 6.883 0.008 A 23 GLN HGy H 1 2.505 0.008 A 23 GLN HGx H 1 2.460 0.008 A 23 GLN C C 13 180.302 0.18 A 23 GLN CA C 13 58.672 0.18 A 23 GLN CB C 13 28.401 0.18 A 23 GLN CG C 13 33.675 0.18 A 23 GLN N N 15 117.824 0.12 A 23 GLN NE2 N 15 111.028 0.12 A 24 SER H H 1 8.137 0.008 A 24 SER HA H 1 4.301 0.008 A 24 SER HBx H 1 3.985 0.008 A 24 SER HBy H 1 3.985 0.008 A 24 SER C C 13 175.573 0.18 A 24 SER CA C 13 60.629 0.18 A 24 SER CB C 13 62.664 0.18 A 24 SER N N 15 114.971 0.12 A 25 HIS H H 1 7.760 0.008 A 25 HIS HA H 1 4.825 0.008 A 25 HIS HBx H 1 3.148 0.008 A 25 HIS HBy H 1 3.685 0.008 A 25 HIS HD2 H 1 7.368 0.008 A 25 HIS C C 13 175.931 0.18 A 25 HIS CA C 13 55.941 0.18 A 25 HIS CB C 13 31.091 0.18 A 25 HIS CD2 C 13 117.442 0.18 A 25 HIS N N 15 117.727 0.12 A 26 GLY H H 1 8.012 0.008 A 26 GLY HAx H 1 3.935 0.008 A 26 GLY HAy H 1 4.047 0.008 A 26 GLY C C 13 174.632 0.18 A 26 GLY CA C 13 46.637 0.18 A 26 GLY N N 15 107.792 0.12 A 27 VAL H H 1 7.667 0.008 A 27 VAL HA H 1 4.422 0.008 A 27 VAL HB H 1 1.896 0.008 A 27 VAL HGx% H 1 0.805 0.008 A 27 VAL HGy% H 1 0.805 0.008 A 27 VAL CA C 13 60.117 0.18 A 27 VAL CB C 13 34.301 0.18 A 27 VAL CGx C 13 20.520 0.18 A 27 VAL CGy C 13 21.585 0.18 A 27 VAL N N 15 115.945 0.12 A 28 GLN H H 1 8.530 0.008 A 28 GLN HBx H 1 1.928 0.008 A 28 GLN HBy H 1 1.928 0.008 A 28 GLN HE2x H 1 6.834 0.008 A 28 GLN HE2y H 1 7.516 0.008 A 28 GLN HGx H 1 2.298 0.008 A 28 GLN HGy H 1 2.298 0.008 A 28 GLN CB C 13 30.332 0.18 A 28 GLN CG C 13 33.653 0.18 A 28 GLN N N 15 122.223 0.12 A 28 GLN NE2 N 15 111.845 0.12 A 29 ALA H H 1 8.459 0.008 A 29 ALA HA H 1 4.505 0.008 A 29 ALA HB% H 1 0.525 0.008 A 29 ALA CA C 13 54.144 0.18 A 29 ALA CB C 13 20.111 0.18 A 29 ALA N N 15 125.912 0.12 A 30 ARG H H 1 8.779 0.008 A 30 ARG HA H 1 4.176 0.008 A 30 ARG HBy H 1 1.701 0.008 A 30 ARG HBx H 1 1.540 0.008 A 30 ARG HDy H 1 3.139 0.008 A 30 ARG HDx H 1 3.042 0.008 A 30 ARG HGx H 1 1.493 0.008 A 30 ARG HGy H 1 1.557 0.008 A 30 ARG C C 13 176.971 0.18 A 30 ARG CA C 13 57.634 0.18 A 30 ARG CB C 13 30.814 0.18 A 30 ARG CD C 13 43.373 0.18 A 30 ARG CG C 13 26.911 0.18 A 30 ARG N N 15 122.462 0.12 A 31 GLU H H 1 7.428 0.008 A 31 GLU HA H 1 4.457 0.008 A 31 GLU HBx H 1 1.808 0.008 A 31 GLU HBy H 1 1.879 0.008 A 31 GLU HGx H 1 2.056 0.008 A 31 GLU HGy H 1 2.193 0.008 A 31 GLU C C 13 173.947 0.18 A 31 GLU CA C 13 55.715 0.18 A 31 GLU CB C 13 33.794 0.18 A 31 GLU CG C 13 36.440 0.18 A 31 GLU N N 15 114.711 0.12 A 32 VAL H H 1 8.518 0.008 A 32 VAL HA H 1 4.549 0.008 A 32 VAL HB H 1 1.883 0.008 A 32 VAL HGx% H 1 0.709 0.008 A 32 VAL HGy% H 1 0.794 0.008 A 32 VAL C C 13 174.487 0.18 A 32 VAL CA C 13 61.392 0.18 A 32 VAL CB C 13 34.027 0.18 A 32 VAL CGx C 13 21.322 0.18 A 32 VAL CGy C 13 21.377 0.18 A 32 VAL N N 15 124.293 0.12 A 33 ARG H H 1 9.147 0.008 A 33 ARG HA H 1 4.838 0.008 A 33 ARG HBx H 1 1.792 0.008 A 33 ARG HBy H 1 1.792 0.008 A 33 ARG HDx H 1 3.129 0.008 A 33 ARG HDy H 1 3.129 0.008 A 33 ARG HGx H 1 1.538 0.008 A 33 ARG HGy H 1 1.538 0.008 A 33 ARG C C 13 174.820 0.18 A 33 ARG CA C 13 54.349 0.18 A 33 ARG CB C 13 32.959 0.18 A 33 ARG CD C 13 43.459 0.18 A 33 ARG CG C 13 27.218 0.18 A 33 ARG N N 15 125.840 0.12 A 34 LEU H H 1 9.254 0.008 A 34 LEU HA H 1 4.419 0.008 A 34 LEU HBy H 1 1.871 0.008 A 34 LEU HBx H 1 1.098 0.008 A 34 LEU HDx% H 1 0.735 0.008 A 34 LEU HDy% H 1 0.799 0.008 A 34 LEU HG H 1 1.421 0.008 A 34 LEU CA C 13 54.463 0.18 A 34 LEU CB C 13 44.101 0.18 A 34 LEU CDx C 13 24.772 0.18 A 34 LEU CDy C 13 25.375 0.18 A 34 LEU CG C 13 27.808 0.18 A 34 LEU N N 15 127.869 0.12 A 35 MET H H 1 8.115 0.008 A 35 MET HA H 1 2.988 0.008 A 35 MET HBx H 1 1.456 0.008 A 35 MET HBy H 1 1.602 0.008 A 35 MET HE% H 1 2.060 0.008 A 35 MET HGx H 1 2.149 0.008 A 35 MET HGy H 1 2.278 0.008 A 35 MET C C 13 174.365 0.18 A 35 MET CA C 13 55.155 0.18 A 35 MET CB C 13 34.298 0.18 A 35 MET CE C 13 17.155 0.18 A 35 MET CG C 13 31.787 0.18 A 35 MET N N 15 119.778 0.12 A 36 ARG H H 1 8.608 0.008 A 36 ARG HBy H 1 1.523 0.008 A 36 ARG HBx H 1 1.426 0.008 A 36 ARG HDy H 1 3.146 0.008 A 36 ARG HGx H 1 1.275 0.008 A 36 ARG HGy H 1 1.538 0.008 A 36 ARG C C 13 171.664 0.18 A 36 ARG CA C 13 56.159 0.18 A 36 ARG CB C 13 33.519 0.18 A 36 ARG CD C 13 43.032 0.18 A 36 ARG CG C 13 28.217 0.18 A 36 ARG N N 15 121.714 0.12 A 37 ASN H H 1 8.876 0.008 A 37 ASN HA H 1 4.667 0.008 A 37 ASN HBx H 1 2.708 0.008 A 37 ASN HBy H 1 3.017 0.008 A 37 ASN HD2y H 1 7.790 0.008 A 37 ASN HD2x H 1 7.203 0.008 A 37 ASN C C 13 173.323 0.18 A 37 ASN CA C 13 53.007 0.18 A 37 ASN CB C 13 39.221 0.18 A 37 ASN N N 15 121.222 0.12 A 37 ASN ND2 N 15 113.899 0.12 A 38 LYS H H 1 9.049 0.008 A 38 LYS HA H 1 4.120 0.008 A 38 LYS HBx H 1 1.901 0.008 A 38 LYS HBy H 1 1.901 0.008 A 38 LYS HDx H 1 1.720 0.008 A 38 LYS HDy H 1 1.720 0.008 A 38 LYS HEx H 1 3.025 0.008 A 38 LYS HEy H 1 3.025 0.008 A 38 LYS HGx H 1 1.503 0.008 A 38 LYS HGy H 1 1.503 0.008 A 38 LYS CA C 13 58.305 0.18 A 38 LYS CB C 13 32.350 0.18 A 38 LYS CD C 13 29.004 0.18 A 38 LYS CE C 13 41.944 0.18 A 38 LYS CG C 13 24.824 0.18 A 38 LYS N N 15 126.560 0.12 A 39 SER H H 1 8.440 0.008 A 39 SER HA H 1 4.446 0.008 A 39 SER HBx H 1 3.969 0.008 A 39 SER HBy H 1 3.969 0.008 A 39 SER C C 13 175.727 0.18 A 39 SER CA C 13 59.813 0.18 A 39 SER CB C 13 62.897 0.18 A 39 SER N N 15 113.501 0.12 A 40 SER H H 1 8.103 0.008 A 40 SER HA H 1 4.611 0.008 A 40 SER HBx H 1 3.818 0.008 A 40 SER HBy H 1 4.060 0.008 A 40 SER C C 13 176.331 0.18 A 40 SER CA C 13 57.666 0.18 A 40 SER CB C 13 65.195 0.18 A 40 SER N N 15 114.027 0.12 A 41 GLY H H 1 8.399 0.008 A 41 GLY HAy H 1 4.230 0.008 A 41 GLY HAx H 1 3.873 0.008 A 41 GLY C C 13 174.340 0.18 A 41 GLY CA C 13 45.644 0.18 A 41 GLY N N 15 111.485 0.12 A 42 GLN H H 1 7.973 0.008 A 42 GLN HA H 1 4.281 0.008 A 42 GLN HBy H 1 2.085 0.008 A 42 GLN HBx H 1 1.917 0.008 A 42 GLN HE2x H 1 6.932 0.008 A 42 GLN HE2y H 1 7.573 0.008 A 42 GLN HGx H 1 2.404 0.008 A 42 GLN HGy H 1 2.404 0.008 A 42 GLN C C 13 176.606 0.18 A 42 GLN CA C 13 55.395 0.18 A 42 GLN CB C 13 29.757 0.18 A 42 GLN CG C 13 33.655 0.18 A 42 GLN N N 15 118.745 0.12 A 42 GLN NE2 N 15 112.158 0.12 A 43 SER H H 1 8.977 0.008 A 43 SER HA H 1 4.341 0.008 A 43 SER HBx H 1 3.907 0.008 A 43 SER HBy H 1 4.091 0.008 A 43 SER C C 13 176.599 0.18 A 43 SER CA C 13 58.335 0.18 A 43 SER CB C 13 63.807 0.18 A 43 SER N N 15 116.517 0.12 A 44 ARG H H 1 9.012 0.008 A 44 ARG HA H 1 4.495 0.008 A 44 ARG HBx H 1 1.222 0.008 A 44 ARG HBy H 1 2.257 0.008 A 44 ARG HDy H 1 3.127 0.008 A 44 ARG HDx H 1 2.898 0.008 A 44 ARG HGx H 1 1.558 0.008 A 44 ARG HGy H 1 1.709 0.008 A 44 ARG C C 13 177.596 0.18 A 44 ARG CA C 13 55.765 0.18 A 44 ARG CB C 13 31.307 0.18 A 44 ARG CD C 13 43.723 0.18 A 44 ARG CG C 13 27.439 0.18 A 44 ARG N N 15 123.834 0.12 A 45 GLY H H 1 9.043 0.008 A 45 GLY HAy H 1 4.164 0.008 A 45 GLY HAx H 1 3.692 0.008 A 45 GLY C C 13 172.606 0.18 A 45 GLY CA C 13 45.804 0.18 A 45 GLY N N 15 106.711 0.12 A 46 PHE H H 1 7.288 0.008 A 46 PHE HA H 1 5.477 0.008 A 46 PHE HBy H 1 3.169 0.008 A 46 PHE HBx H 1 3.006 0.008 A 46 PHE HDx H 1 6.872 0.008 A 46 PHE HDy H 1 6.872 0.008 A 46 PHE HEx H 1 7.296 0.008 A 46 PHE HEy H 1 7.296 0.008 A 46 PHE C C 13 173.114 0.18 A 46 PHE CA C 13 54.660 0.18 A 46 PHE CB C 13 41.916 0.18 A 46 PHE CDx C 13 130.404 0.18 A 46 PHE CDy C 13 130.404 0.18 A 46 PHE CEx C 13 129.386 0.18 A 46 PHE CEy C 13 129.386 0.18 A 46 PHE N N 15 112.805 0.12 A 47 ALA H H 1 8.489 0.008 A 47 ALA HA H 1 5.133 0.008 A 47 ALA HB% H 1 1.152 0.008 A 47 ALA C C 13 174.783 0.18 A 47 ALA CA C 13 49.726 0.18 A 47 ALA CB C 13 25.180 0.18 A 47 ALA N N 15 118.618 0.12 A 48 PHE H H 1 9.047 0.008 A 48 PHE HA H 1 5.426 0.008 A 48 PHE HBy H 1 2.906 0.008 A 48 PHE HBx H 1 2.783 0.008 A 48 PHE HDx H 1 7.117 0.008 A 48 PHE HDy H 1 7.117 0.008 A 48 PHE HEx H 1 7.440 0.008 A 48 PHE HEy H 1 7.440 0.008 A 48 PHE HZ H 1 7.245 0.008 A 48 PHE C C 13 174.883 0.18 A 48 PHE CA C 13 56.721 0.18 A 48 PHE CB C 13 42.554 0.18 A 48 PHE CDx C 13 129.488 0.18 A 48 PHE CDy C 13 129.488 0.18 A 48 PHE CEy C 13 129.439 0.18 A 48 PHE CEx C 13 129.435 0.18 A 48 PHE CZ C 13 127.700 0.18 A 48 PHE N N 15 116.577 0.12 A 49 VAL H H 1 9.764 0.008 A 49 VAL HA H 1 4.495 0.008 A 49 VAL HB H 1 2.245 0.008 A 49 VAL HGx% H 1 0.930 0.008 A 49 VAL HGy% H 1 0.184 0.008 A 49 VAL C C 13 173.924 0.18 A 49 VAL CA C 13 61.187 0.18 A 49 VAL CB C 13 33.523 0.18 A 49 VAL CGx C 13 20.918 0.18 A 49 VAL CGy C 13 23.088 0.18 A 49 VAL N N 15 123.523 0.12 A 50 GLU H H 1 8.805 0.008 A 50 GLU HA H 1 4.968 0.008 A 50 GLU HBx H 1 1.900 0.008 A 50 GLU HBy H 1 1.948 0.008 A 50 GLU HGx H 1 1.948 0.008 A 50 GLU HGy H 1 2.200 0.008 A 50 GLU C C 13 175.514 0.18 A 50 GLU CA C 13 54.680 0.18 A 50 GLU CB C 13 31.885 0.18 A 50 GLU CG C 13 36.033 0.18 A 50 GLU N N 15 126.369 0.12 A 51 PHE H H 1 9.202 0.008 A 51 PHE HA H 1 4.700 0.008 A 51 PHE HBy H 1 3.588 0.008 A 51 PHE HBx H 1 3.163 0.008 A 51 PHE HDx H 1 7.523 0.008 A 51 PHE HDy H 1 7.523 0.008 A 51 PHE HEx H 1 6.909 0.008 A 51 PHE HEy H 1 6.909 0.008 A 51 PHE HZ H 1 6.273 0.008 A 51 PHE C C 13 176.349 0.18 A 51 PHE CA C 13 57.777 0.18 A 51 PHE CB C 13 41.013 0.18 A 51 PHE CDx C 13 130.165 0.18 A 51 PHE CDy C 13 130.165 0.18 A 51 PHE CEx C 13 128.381 0.18 A 51 PHE CEy C 13 128.381 0.18 A 51 PHE CZ C 13 127.774 0.18 A 51 PHE N N 15 124.346 0.12 A 52 SER H H 1 9.404 0.008 A 52 SER HA H 1 4.259 0.008 A 52 SER HBx H 1 3.625 0.008 A 52 SER HBy H 1 3.778 0.008 A 52 SER C C 13 174.418 0.18 A 52 SER CA C 13 61.019 0.18 A 52 SER CB C 13 62.689 0.18 A 52 SER N N 15 117.163 0.12 A 53 HIS H H 1 8.344 0.008 A 53 HIS HA H 1 5.082 0.008 A 53 HIS HBx H 1 3.121 0.008 A 53 HIS HBy H 1 3.391 0.008 A 53 HIS HD2 H 1 7.352 0.008 A 53 HIS CA C 13 53.920 0.18 A 53 HIS CB C 13 31.362 0.18 A 53 HIS CD2 C 13 118.395 0.18 A 53 HIS N N 15 115.694 0.12 A 55 GLN H H 1 9.318 0.008 A 55 GLN HA H 1 4.160 0.008 A 55 GLN HBx H 1 2.059 0.008 A 55 GLN HBy H 1 2.090 0.008 A 55 GLN HE2y H 1 7.626 0.008 A 55 GLN HE2x H 1 6.938 0.008 A 55 GLN HGx H 1 2.458 0.008 A 55 GLN HGy H 1 2.458 0.008 A 55 GLN C C 13 178.319 0.18 A 55 GLN CA C 13 58.581 0.18 A 55 GLN CB C 13 27.763 0.18 A 55 GLN CG C 13 33.977 0.18 A 55 GLN N N 15 114.869 0.12 A 55 GLN NE2 N 15 111.852 0.12 A 56 ASP H H 1 7.317 0.008 A 56 ASP HA H 1 4.431 0.008 A 56 ASP HBy H 1 2.961 0.008 A 56 ASP HBx H 1 2.642 0.008 A 56 ASP C C 13 177.264 0.18 A 56 ASP CA C 13 56.687 0.18 A 56 ASP CB C 13 40.770 0.18 A 56 ASP N N 15 118.066 0.12 A 57 ALA H H 1 6.854 0.008 A 57 ALA HA H 1 3.002 0.008 A 57 ALA HB% H 1 1.640 0.008 A 57 ALA C C 13 179.680 0.18 A 57 ALA CA C 13 54.739 0.18 A 57 ALA CB C 13 19.064 0.18 A 57 ALA N N 15 122.367 0.12 A 58 THR H H 1 8.326 0.008 A 58 THR HA H 1 4.374 0.008 A 58 THR HB H 1 4.146 0.008 A 58 THR HG2% H 1 1.334 0.008 A 58 THR C C 13 177.296 0.18 A 58 THR CA C 13 65.121 0.18 A 58 THR CB C 13 68.826 0.18 A 58 THR CG2 C 13 21.787 0.18 A 58 THR N N 15 111.238 0.12 A 59 ARG H H 1 8.023 0.008 A 59 ARG HA H 1 4.104 0.008 A 59 ARG HBy H 1 2.052 0.008 A 59 ARG HBx H 1 1.969 0.008 A 59 ARG HDx H 1 3.293 0.008 A 59 ARG HGy H 1 1.845 0.008 A 59 ARG HGx H 1 1.721 0.008 A 59 ARG C C 13 179.175 0.18 A 59 ARG CA C 13 59.260 0.18 A 59 ARG CB C 13 30.033 0.18 A 59 ARG CD C 13 43.530 0.18 A 59 ARG CG C 13 27.637 0.18 A 59 ARG N N 15 120.821 0.12 A 60 TRP H H 1 7.845 0.008 A 60 TRP HA H 1 4.311 0.008 A 60 TRP HBy H 1 3.227 0.008 A 60 TRP HBx H 1 3.043 0.008 A 60 TRP HD1 H 1 7.070 0.008 A 60 TRP HE1 H 1 10.928 0.008 A 60 TRP HE3 H 1 7.507 0.008 A 60 TRP HH2 H 1 6.892 0.008 A 60 TRP HZ2 H 1 7.166 0.008 A 60 TRP HZ3 H 1 6.885 0.008 A 60 TRP CA C 13 60.560 0.18 A 60 TRP CB C 13 28.317 0.18 A 60 TRP CD1 C 13 124.009 0.18 A 60 TRP CE3 C 13 118.874 0.18 A 60 TRP CH2 C 13 121.307 0.18 A 60 TRP CZ2 C 13 113.077 0.18 A 60 TRP CZ3 C 13 118.366 0.18 A 60 TRP N N 15 120.202 0.12 A 60 TRP NE1 N 15 131.100 0.12 A 61 MET H H 1 8.227 0.008 A 61 MET HA H 1 3.548 0.008 A 61 MET HBx H 1 1.582 0.008 A 61 MET HBy H 1 2.128 0.008 A 61 MET HE% H 1 0.804 0.008 A 61 MET HGx H 1 2.010 0.008 A 61 MET HGy H 1 2.010 0.008 A 61 MET C C 13 179.403 0.18 A 61 MET CA C 13 58.430 0.18 A 61 MET CB C 13 33.321 0.18 A 61 MET CE C 13 15.415 0.18 A 61 MET CG C 13 31.724 0.18 A 61 MET N N 15 117.070 0.12 A 62 GLU H H 1 8.757 0.008 A 62 GLU HA H 1 4.052 0.008 A 62 GLU HBx H 1 2.068 0.008 A 62 GLU HBy H 1 2.120 0.008 A 62 GLU HGx H 1 2.511 0.008 A 62 GLU HGy H 1 2.511 0.008 A 62 GLU C C 13 181.125 0.18 A 62 GLU CA C 13 58.573 0.18 A 62 GLU CB C 13 28.932 0.18 A 62 GLU CG C 13 36.344 0.18 A 62 GLU N N 15 117.320 0.12 A 63 ALA H H 1 8.552 0.008 A 63 ALA HA H 1 4.178 0.008 A 63 ALA HB% H 1 1.497 0.008 A 63 ALA C C 13 178.968 0.18 A 63 ALA CA C 13 54.500 0.18 A 63 ALA CB C 13 18.451 0.18 A 63 ALA N N 15 122.118 0.12 A 64 ASN H H 1 6.670 0.008 A 64 ASN HA H 1 4.651 0.008 A 64 ASN HBx H 1 1.791 0.008 A 64 ASN HBy H 1 3.230 0.008 A 64 ASN HD2x H 1 6.065 0.008 A 64 ASN HD2y H 1 7.123 0.008 A 64 ASN CA C 13 53.258 0.18 A 64 ASN CB C 13 40.313 0.18 A 64 ASN N N 15 110.926 0.12 A 64 ASN ND2 N 15 114.516 0.12 A 65 GLN H H 1 7.924 0.008 A 65 GLN HA H 1 3.906 0.008 A 65 GLN HBx H 1 2.134 0.008 A 65 GLN HBy H 1 2.134 0.008 A 65 GLN HE2x H 1 6.783 0.008 A 65 GLN HE2y H 1 7.586 0.008 A 65 GLN HGx H 1 2.241 0.008 A 65 GLN HGy H 1 2.279 0.008 A 65 GLN C C 13 175.875 0.18 A 65 GLN CA C 13 57.285 0.18 A 65 GLN CB C 13 26.116 0.18 A 65 GLN CG C 13 34.003 0.18 A 65 GLN N N 15 116.841 0.12 A 65 GLN NE2 N 15 112.164 0.12 A 66 HIS H H 1 8.357 0.008 A 66 HIS HA H 1 4.018 0.008 A 66 HIS HBy H 1 3.495 0.008 A 66 HIS HBx H 1 3.366 0.008 A 66 HIS HD2 H 1 6.886 0.008 A 66 HIS HE1 H 1 7.180 0.008 A 66 HIS C C 13 173.889 0.18 A 66 HIS CA C 13 57.146 0.18 A 66 HIS CB C 13 26.461 0.18 A 66 HIS CD2 C 13 116.660 0.18 A 67 SER H H 1 7.668 0.008 A 67 SER HA H 1 5.005 0.008 A 67 SER HBx H 1 3.575 0.008 A 67 SER HBy H 1 3.613 0.008 A 67 SER C C 13 171.719 0.18 A 67 SER CA C 13 57.620 0.18 A 67 SER CB C 13 65.164 0.18 A 67 SER N N 15 115.496 0.12 A 68 LEU H H 1 8.870 0.008 A 68 LEU HA H 1 4.679 0.008 A 68 LEU HBx H 1 1.361 0.008 A 68 LEU HBy H 1 1.361 0.008 A 68 LEU HDx% H 1 0.763 0.008 A 68 LEU HDy% H 1 0.668 0.008 A 68 LEU HG H 1 1.443 0.008 A 68 LEU C C 13 175.783 0.18 A 68 LEU CA C 13 52.686 0.18 A 68 LEU CB C 13 46.117 0.18 A 68 LEU CDy C 13 26.820 0.18 A 68 LEU CDx C 13 23.380 0.18 A 68 LEU CG C 13 26.324 0.18 A 68 LEU N N 15 121.784 0.12 A 69 ASN H H 1 8.814 0.008 A 69 ASN HA H 1 5.335 0.008 A 69 ASN HBy H 1 2.633 0.008 A 69 ASN HBx H 1 2.553 0.008 A 69 ASN HD2x H 1 6.604 0.008 A 69 ASN HD2y H 1 7.373 0.008 A 69 ASN C C 13 175.433 0.18 A 69 ASN CA C 13 52.053 0.18 A 69 ASN CB C 13 39.740 0.18 A 69 ASN N N 15 121.169 0.12 A 69 ASN ND2 N 15 110.957 0.12 A 70 ILE H H 1 8.666 0.008 A 70 ILE HA H 1 4.338 0.008 A 70 ILE HB H 1 1.622 0.008 A 70 ILE HD1% H 1 0.704 0.008 A 70 ILE HG1y H 1 1.333 0.008 A 70 ILE HG1x H 1 1.100 0.008 A 70 ILE HG2% H 1 0.777 0.008 A 70 ILE C C 13 174.972 0.18 A 70 ILE CA C 13 59.046 0.18 A 70 ILE CB C 13 39.594 0.18 A 70 ILE CD1 C 13 12.137 0.18 A 70 ILE CG1 C 13 26.759 0.18 A 70 ILE CG2 C 13 17.095 0.18 A 70 ILE N N 15 123.143 0.12 A 71 LEU H H 1 9.455 0.008 A 71 LEU HA H 1 3.949 0.008 A 71 LEU HBx H 1 1.704 0.008 A 71 LEU HBy H 1 1.825 0.008 A 71 LEU HDx% H 1 0.893 0.008 A 71 LEU HDy% H 1 0.810 0.008 A 71 LEU HG H 1 1.531 0.008 A 71 LEU C C 13 177.516 0.18 A 71 LEU CA C 13 55.122 0.18 A 71 LEU CB C 13 39.364 0.18 A 71 LEU CDx C 13 22.324 0.18 A 71 LEU CDy C 13 25.403 0.18 A 71 LEU CG C 13 27.123 0.18 A 71 LEU N N 15 124.509 0.12 A 72 GLY H H 1 8.277 0.008 A 72 GLY HAx H 1 3.687 0.008 A 72 GLY HAy H 1 4.138 0.008 A 72 GLY CA C 13 45.622 0.18 A 72 GLY N N 15 103.495 0.12 A 73 GLN H H 1 7.942 0.008 A 73 GLN HA H 1 4.594 0.008 A 73 GLN HBx H 1 1.931 0.008 A 73 GLN HBy H 1 2.226 0.008 A 73 GLN HE2y H 1 7.795 0.008 A 73 GLN HE2x H 1 7.050 0.008 A 73 GLN HGy H 1 2.434 0.008 A 73 GLN HGx H 1 2.314 0.008 A 73 GLN CA C 13 53.365 0.18 A 73 GLN CB C 13 31.230 0.18 A 73 GLN CG C 13 33.712 0.18 A 73 GLN N N 15 120.834 0.12 A 73 GLN NE2 N 15 113.593 0.12 A 74 LYS H H 1 8.396 0.008 A 74 LYS HA H 1 4.613 0.008 A 74 LYS HBx H 1 1.700 0.008 A 74 LYS HBy H 1 1.741 0.008 A 74 LYS HDx H 1 1.640 0.008 A 74 LYS HDy H 1 1.640 0.008 A 74 LYS HEx H 1 2.955 0.008 A 74 LYS HEy H 1 2.955 0.008 A 74 LYS HGy H 1 1.430 0.008 A 74 LYS HGx H 1 1.292 0.008 A 74 LYS C C 13 176.266 0.18 A 74 LYS CA C 13 56.633 0.18 A 74 LYS CB C 13 32.247 0.18 A 74 LYS CD C 13 29.103 0.18 A 74 LYS CE C 13 41.759 0.18 A 74 LYS CG C 13 24.735 0.18 A 74 LYS N N 15 123.321 0.12 A 75 VAL H H 1 9.162 0.008 A 75 VAL HA H 1 4.468 0.008 A 75 VAL HB H 1 1.924 0.008 A 75 VAL HGx% H 1 0.913 0.008 A 75 VAL HGy% H 1 0.938 0.008 A 75 VAL C C 13 175.962 0.18 A 75 VAL CA C 13 60.660 0.18 A 75 VAL CB C 13 34.894 0.18 A 75 VAL CGx C 13 21.760 0.18 A 75 VAL CGy C 13 21.913 0.18 A 75 VAL N N 15 129.132 0.12 A 76 SER H H 1 8.170 0.008 A 76 SER HA H 1 4.628 0.008 A 76 SER HBy H 1 4.002 0.008 A 76 SER HBx H 1 3.818 0.008 A 76 SER C C 13 173.163 0.18 A 76 SER CA C 13 57.676 0.18 A 76 SER CB C 13 64.183 0.18 A 76 SER N N 15 120.884 0.12 A 77 MET H H 1 7.189 0.008 A 77 MET HA H 1 5.023 0.008 A 77 MET HBy H 1 1.885 0.008 A 77 MET HBx H 1 1.552 0.008 A 77 MET HE% H 1 0.496 0.008 A 77 MET HGy H 1 1.674 0.008 A 77 MET HGx H 1 1.208 0.008 A 77 MET C C 13 175.582 0.18 A 77 MET CA C 13 53.744 0.18 A 77 MET CB C 13 31.202 0.18 A 77 MET CE C 13 16.577 0.18 A 77 MET CG C 13 37.578 0.18 A 77 MET N N 15 116.658 0.12 A 78 HIS H H 1 8.773 0.008 A 78 HIS HA H 1 4.620 0.008 A 78 HIS HBy H 1 3.255 0.008 A 78 HIS HBx H 1 2.702 0.008 A 78 HIS HD2 H 1 6.652 0.008 A 78 HIS CA C 13 54.280 0.18 A 78 HIS CB C 13 33.116 0.18 A 78 HIS CD2 C 13 123.216 0.18 A 78 HIS N N 15 118.935 0.12 A 79 TYR H H 1 9.173 0.008 A 79 TYR HA H 1 4.936 0.008 A 79 TYR HBy H 1 3.144 0.008 A 79 TYR HBx H 1 2.816 0.008 A 79 TYR HDx H 1 7.380 0.008 A 79 TYR HDy H 1 7.380 0.008 A 79 TYR HEx H 1 6.846 0.008 A 79 TYR HEy H 1 6.846 0.008 A 79 TYR CA C 13 59.776 0.18 A 79 TYR CB C 13 38.656 0.18 A 79 TYR CDx C 13 131.723 0.18 A 79 TYR CDy C 13 131.727 0.18 A 79 TYR CEx C 13 116.679 0.18 A 79 TYR CEy C 13 116.679 0.18 A 79 TYR N N 15 123.286 0.12 A 80 SER H H 1 8.816 0.008 A 80 SER HA H 1 4.774 0.008 A 80 SER HBx H 1 3.777 0.008 A 80 SER HBy H 1 3.812 0.008 A 80 SER CA C 13 59.794 0.18 A 80 SER CB C 13 64.856 0.18 A 80 SER N N 15 116.971 0.12 A 81 ASP H H 1 8.616 0.008 A 81 ASP HA H 1 4.934 0.008 A 81 ASP HBy H 1 2.774 0.008 A 81 ASP HBx H 1 2.527 0.008 A 81 ASP CA C 13 52.846 0.18 A 81 ASP CB C 13 40.937 0.18 A 81 ASP N N 15 126.144 0.12 A 82 PRO HA H 1 4.341 0.008 A 82 PRO HBy H 1 2.265 0.008 A 82 PRO HBx H 1 1.923 0.008 A 82 PRO HDy H 1 3.848 0.008 A 82 PRO HDx H 1 3.780 0.008 A 82 PRO HGy H 1 2.033 0.008 A 82 PRO HGx H 1 2.013 0.008 A 82 PRO CA C 13 63.397 0.18 A 82 PRO CB C 13 31.988 0.18 A 82 PRO CD C 13 50.304 0.18 A 82 PRO CG C 13 27.320 0.18 A 83 LYS H H 1 8.283 0.008 A 83 LYS HA H 1 4.510 0.008 A 83 LYS HBx H 1 1.647 0.008 A 83 LYS HBy H 1 1.745 0.008 A 83 LYS HDx H 1 1.647 0.008 A 83 LYS HDy H 1 1.647 0.008 A 83 LYS HEy H 1 2.953 0.008 A 83 LYS HGx H 1 1.357 0.008 A 83 LYS HGy H 1 1.357 0.008 A 83 LYS CA C 13 53.831 0.18 A 83 LYS CB C 13 32.353 0.18 A 83 LYS CD C 13 28.936 0.18 A 83 LYS CE C 13 41.896 0.18 A 83 LYS CG C 13 24.501 0.18 A 83 LYS N N 15 120.620 0.12 A 84 PRO HA H 1 4.333 0.008 A 84 PRO HBy H 1 2.191 0.008 A 84 PRO HBx H 1 1.808 0.008 A 84 PRO HDy H 1 3.670 0.008 A 84 PRO HDx H 1 3.519 0.008 A 84 PRO HGx H 1 1.898 0.008 A 84 PRO HGy H 1 1.898 0.008 A 84 PRO CA C 13 62.995 0.18 A 84 PRO CB C 13 32.018 0.18 A 84 PRO CD C 13 50.090 0.18 A 84 PRO CG C 13 27.187 0.18 A 85 LYS H H 1 8.381 0.008 A 85 LYS HA H 1 4.285 0.008 A 85 LYS HBy H 1 1.801 0.008 A 85 LYS HBx H 1 1.707 0.008 A 85 LYS CA C 13 55.948 0.18 A 85 LYS CB C 13 32.472 0.18 A 85 LYS CE C 13 41.897 0.18 A 85 LYS CG C 13 24.739 0.18 A 85 LYS N N 15 120.823 0.12 A 86 ILE H H 1 8.079 0.008 A 86 ILE HA H 1 4.102 0.008 A 86 ILE HB H 1 1.843 0.008 A 86 ILE HD1% H 1 0.821 0.008 A 86 ILE HG1y H 1 1.398 0.008 A 86 ILE HG1x H 1 1.137 0.008 A 86 ILE HG2% H 1 0.858 0.008 A 86 ILE C C 13 176.041 0.18 A 86 ILE CA C 13 60.953 0.18 A 86 ILE CB C 13 38.722 0.18 A 86 ILE CD1 C 13 12.918 0.18 A 86 ILE CG1 C 13 27.112 0.18 A 86 ILE CG2 C 13 17.403 0.18 A 86 ILE N N 15 120.360 0.12 A 87 ASN H H 1 8.248 0.008 A 87 ASN HA H 1 4.594 0.008 A 87 ASN HBx H 1 2.666 0.008 A 87 ASN HBy H 1 2.700 0.008 A 87 ASN HD2x H 1 6.892 0.008 A 87 ASN HD2y H 1 7.501 0.008 A 87 ASN C C 13 175.538 0.18 A 87 ASN CA C 13 53.100 0.18 A 87 ASN CB C 13 38.486 0.18 A 87 ASN N N 15 120.781 0.12 A 87 ASN ND2 N 15 112.251 0.12 A 88 GLU H H 1 8.308 0.008 A 88 GLU HA H 1 4.117 0.008 A 88 GLU HBx H 1 1.801 0.008 A 88 GLU HBy H 1 1.875 0.008 A 88 GLU HGx H 1 2.166 0.008 A 88 GLU HGy H 1 2.166 0.008 A 88 GLU C C 13 176.544 0.18 A 88 GLU CA C 13 56.689 0.18 A 88 GLU CB C 13 29.867 0.18 A 88 GLU CG C 13 36.162 0.18 A 88 GLU N N 15 120.312 0.12 A 89 ASP H H 1 8.251 0.008 A 89 ASP HA H 1 4.572 0.008 A 89 ASP HBy H 1 2.615 0.008 A 89 ASP HBx H 1 2.577 0.008 A 89 ASP C C 13 176.214 0.18 A 89 ASP CA C 13 54.299 0.18 A 89 ASP CB C 13 40.903 0.18 A 89 ASP N N 15 119.372 0.12 A 90 TRP H H 1 7.906 0.008 A 90 TRP HA H 1 4.704 0.008 A 90 TRP HBx H 1 3.213 0.008 A 90 TRP HBy H 1 3.306 0.008 A 90 TRP HD1 H 1 7.179 0.008 A 90 TRP HE1 H 1 10.120 0.008 A 90 TRP HE3 H 1 7.558 0.008 A 90 TRP HH2 H 1 7.138 0.008 A 90 TRP HZ2 H 1 7.405 0.008 A 90 TRP HZ3 H 1 7.056 0.008 A 90 TRP C C 13 175.397 0.18 A 90 TRP CA C 13 56.397 0.18 A 90 TRP CB C 13 29.410 0.18 A 90 TRP CD1 C 13 124.705 0.18 A 90 TRP CE3 C 13 118.897 0.18 A 90 TRP CH2 C 13 122.469 0.18 A 90 TRP CZ2 C 13 112.535 0.18 A 90 TRP CZ3 C 13 119.862 0.18 A 90 TRP N N 15 119.715 0.12 A 90 TRP NE1 N 15 128.767 0.12 A 91 LEU H H 1 7.545 0.008 A 91 LEU HA H 1 4.170 0.008 A 91 LEU HBx H 1 1.525 0.008 A 91 LEU HBy H 1 1.525 0.008 A 91 LEU HDx% H 1 0.847 0.008 A 91 LEU HDy% H 1 0.809 0.008 A 91 LEU HG H 1 1.436 0.008 A 91 LEU CA C 13 56.547 0.18 A 91 LEU CB C 13 43.401 0.18 A 91 LEU CDy C 13 25.228 0.18 A 91 LEU CDx C 13 23.566 0.18 A 91 LEU CG C 13 26.939 0.18 A 91 LEU N N 15 127.427 0.12 stop_ save_ save_DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 60 TRP HE1 A 64 ASN HD2x 1.0 . 5.20 2 2 A 67 SER HBy A 75 VAL H 1.0 . 5.50 3 3 A 75 VAL H A 74 LYS HBx 1.0 . 4.66 4 4 A 75 VAL H A 68 LEU HBx 1.0 . 4.33 5 4 A 75 VAL H A 68 LEU HBy 1.0 . 4.33 6 5 A 75 VAL H A 67 SER HA 1.0 . 5.39 7 6 A 89 ASP HBy A 90 TRP HE1 1.0 . 5.50 8 7 A 90 TRP HE1 A 88 GLU HGx 1.0 . 5.50 9 7 A 90 TRP HE1 A 88 GLU HGy 1.0 . 5.50 10 8 A 90 TRP HE1 A 88 GLU HA 1.0 . 5.50 11 9 A 90 TRP HE1 A 91 LEU HDy% 1.0 . 5.50 12 10 A 33 ARG HA A 34 LEU H 1.0 . 2.91 13 11 A 34 LEU H A 15 GLU HGx 1.0 . 4.28 14 12 A 34 LEU H A 34 LEU HBy 1.0 . 3.31 15 13 A 34 LEU H A 34 LEU HBx 1.0 . 3.52 16 14 A 34 LEU H A 32 VAL HGy% 1.0 . 4.50 17 15 A 34 LEU H A 15 GLU H 1.0 . 5.50 18 16 A 4 VAL H A 5 MET H 1.0 . 5.03 19 17 A 5 MET H A 78 HIS H 1.0 . 3.79 20 18 A 5 MET H A 4 VAL HA 1.0 . 3.09 21 19 A 5 MET H A 80 SER HBy 1.0 . 4.43 22 20 A 5 MET H A 4 VAL HB 1.0 . 5.21 23 21 A 5 MET H A 5 MET HBx 1.0 . 3.33 24 21 A 5 MET H A 5 MET HBy 1.0 . 3.33 25 22 A 5 MET H A 6 LEU HDy% 1.0 . 5.50 26 23 A 89 ASP HBy A 91 LEU H 1.0 . 5.50 27 24 A 91 LEU H A 90 TRP HD1 1.0 . 5.50 28 25 A 91 LEU H A 89 ASP HA 1.0 . 5.00 29 26 A 91 LEU H A 91 LEU HBx 1.0 . 3.17 30 26 A 91 LEU H A 91 LEU HBy 1.0 . 3.17 31 27 A 91 LEU HDy% A 91 LEU H 1.0 . 4.76 32 28 A 4 VAL H A 3 ILE H 1.0 . 4.85 33 29 A 4 VAL H A 51 PHE HD% 1.0 . 4.80 34 30 A 4 VAL H A 51 PHE HE% 1.0 . 4.56 35 31 A 4 VAL H A 48 PHE HA 1.0 . 5.50 36 32 A 4 VAL H A 49 VAL HGy% 1.0 . 5.50 37 33 A 38 LYS H A 38 LYS HBx 1.0 . 3.70 38 33 A 38 LYS H A 38 LYS HBy 1.0 . 3.70 39 34 A 38 LYS H A 38 LYS HGx 1.0 . 4.72 40 34 A 38 LYS H A 38 LYS HGy 1.0 . 4.72 41 35 A 50 GLU H A 51 PHE H 1.0 . 5.20 42 36 A 50 GLU H A 31 GLU H 1.0 . 3.87 43 37 A 50 GLU H A 3 ILE HA 1.0 . 5.50 44 38 A 50 GLU H A 50 GLU HGy 1.0 . 4.36 45 39 A 50 GLU H A 50 GLU HBy 1.0 . 3.23 46 40 A 50 GLU H A 29 ALA HB% 1.0 . 4.71 47 41 A 50 GLU H A 49 VAL H 1.0 . 5.13 48 42 A 6 LEU H A 5 MET HBx 1.0 . 3.92 49 42 A 5 MET HBy A 6 LEU H 1.0 . 3.92 50 43 A 3 ILE HD1% A 81 ASP H 1.0 . 5.50 51 44 A 81 ASP H A 80 SER HA 1.0 . 3.11 52 45 A 81 ASP H A 81 ASP HBy 1.0 . 3.64 53 46 A 81 ASP H A 81 ASP HBx 1.0 . 3.27 54 47 A 81 ASP H A 3 ILE HG2% 1.0 . 5.50 55 48 A 49 VAL H A 6 LEU H 1.0 . 5.24 56 49 A 6 LEU H A 7 ARG HGx 1.0 . 5.50 57 49 A 6 LEU H A 7 ARG HGy 1.0 . 5.50 58 50 A 6 LEU H A 6 LEU HBx 1.0 . 3.88 59 51 A 5 MET H A 6 LEU H 1.0 . 5.04 60 52 A 6 LEU H A 46 PHE HD% 1.0 . 5.50 61 53 A 6 LEU H A 46 PHE HBy 1.0 . 5.50 62 54 A 6 LEU H A 6 LEU HBy 1.0 . 3.60 63 55 A 6 LEU H A 48 PHE HD% 1.0 . 5.50 64 56 A 51 PHE HE% A 29 ALA H 1.0 . 5.50 65 57 A 29 ALA H A 27 VAL HGx% 1.0 . 5.36 66 57 A 29 ALA H A 27 VAL HGy% 1.0 . 5.36 67 58 A 49 VAL HGy% A 29 ALA H 1.0 . 5.50 68 59 A 29 ALA H A 30 ARG H 1.0 . 5.30 69 60 A 29 ALA H A 28 GLN HGx 1.0 . 4.60 70 60 A 29 ALA H A 28 GLN HGy 1.0 . 4.60 71 61 A 29 ALA H A 22 LEU HBx 1.0 . 5.35 72 62 A 33 ARG H A 47 ALA HA 1.0 . 5.50 73 63 A 33 ARG H A 48 PHE HBx 1.0 . 5.50 74 64 A 33 ARG H A 32 VAL HA 1.0 . 2.91 75 65 A 33 ARG H A 33 ARG HBx 1.0 . 3.41 76 65 A 33 ARG H A 33 ARG HBy 1.0 . 3.41 77 66 A 33 ARG H A 33 ARG HGx 1.0 . 4.17 78 66 A 33 ARG H A 33 ARG HGy 1.0 . 4.17 79 67 A 33 ARG H A 47 ALA HB% 1.0 . 5.50 80 68 A 49 VAL HGy% A 33 ARG H 1.0 . 5.50 81 69 A 51 PHE HD% A 29 ALA H 1.0 . 5.50 82 70 A 10 PRO HA A 11 GLN H 1.0 . 3.01 83 71 A 11 GLN H A 11 GLN HBx 1.0 . 3.13 84 72 A 11 GLN H A 10 PRO HDy 1.0 . 5.50 85 73 A 11 GLN H A 71 LEU HDy% 1.0 . 5.50 86 74 A 11 GLN H A 10 PRO HDx 1.0 . 5.50 87 75 A 70 ILE H A 71 LEU H 1.0 . 4.68 88 76 A 71 LEU H A 72 GLY HAy 1.0 . 4.93 89 77 A 71 LEU H A 72 GLY HAx 1.0 . 5.28 90 78 A 71 LEU H A 71 LEU HBx 1.0 . 3.98 91 79 A 71 LEU H A 71 LEU HG 1.0 . 3.68 92 80 A 71 LEU H A 70 ILE HG1y 1.0 . 5.03 93 81 A 71 LEU H A 70 ILE HG1x 1.0 . 4.81 94 82 A 51 PHE HE% A 51 PHE H 1.0 . 5.19 95 83 A 51 PHE H A 50 GLU HGy 1.0 . 4.43 96 84 A 49 VAL HGy% A 51 PHE H 1.0 . 5.50 97 85 A 51 PHE H A 53 HIS H 1.0 . 5.20 98 86 A 51 PHE H A 3 ILE HA 1.0 . 4.07 99 87 A 51 PHE H A 51 PHE HBx 1.0 . 3.47 100 88 A 51 PHE H A 50 GLU HBy 1.0 . 3.87 101 89 A 51 PHE H A 3 ILE HG1x 1.0 . 4.57 102 90 A 33 ARG HA A 32 VAL H 1.0 . 5.17 103 91 A 50 GLU H A 32 VAL H 1.0 . 5.50 104 92 A 32 VAL H A 31 GLU HGy 1.0 . 3.87 105 93 A 32 VAL H A 31 GLU HBy 1.0 . 3.51 106 94 A 32 VAL H A 33 ARG HGx 1.0 . 4.90 107 94 A 33 ARG HGy A 32 VAL H 1.0 . 4.90 108 95 A 33 ARG H A 32 VAL H 1.0 . 4.84 109 96 A 29 ALA HB% A 32 VAL H 1.0 . 5.50 110 97 A 44 ARG H A 44 ARG HGx 1.0 . 4.17 111 98 A 44 ARG H A 44 ARG HBx 1.0 . 3.82 112 99 A 44 ARG H A 46 PHE H 1.0 . 5.40 113 100 A 44 ARG H A 43 SER HBy 1.0 . 4.65 114 101 A 44 ARG H A 43 SER HBx 1.0 . 5.05 115 102 A 44 ARG H A 44 ARG HDy 1.0 . 5.50 116 103 A 4 VAL H A 49 VAL H 1.0 . 4.02 117 104 A 49 VAL H A 48 PHE HD% 1.0 . 4.89 118 105 A 49 VAL H A 60 TRP HZ3 1.0 . 5.01 119 106 A 4 VAL HB A 49 VAL H 1.0 . 4.47 120 107 A 49 VAL H A 49 VAL HB 1.0 . 3.50 121 108 A 69 ASN HA A 74 LYS H 1.0 . 5.12 122 109 A 75 VAL H A 74 LYS H 1.0 . 4.46 123 110 A 74 LYS H A 73 GLN H 1.0 . 4.79 124 111 A 74 LYS H A 73 GLN HA 1.0 . 2.65 125 112 A 74 LYS H A 73 GLN HBy 1.0 . 3.63 126 113 A 74 LYS H A 74 LYS HBy 1.0 . 2.85 127 114 A 74 LYS H A 75 VAL HGy% 1.0 . 5.50 128 115 A 1 SER HBx A 79 TYR H 1.0 . 5.50 129 116 A 79 TYR H A 4 VAL HGy% 1.0 . 5.50 130 117 A 5 MET H A 79 TYR H 1.0 . 5.50 131 118 A 78 HIS H A 79 TYR H 1.0 . 4.45 132 119 A 79 TYR H A 78 HIS HA 1.0 . 3.02 133 120 A 79 TYR H A 79 TYR HBy 1.0 . 3.60 134 121 A 79 TYR H A 79 TYR HBx 1.0 . 3.32 135 122 A 10 PRO HDx A 70 ILE H 1.0 . 5.50 136 123 A 74 LYS H A 74 LYS HEx 1.0 . 5.50 137 123 A 74 LYS H A 74 LYS HEy 1.0 . 5.50 138 124 A 75 VAL H A 70 ILE H 1.0 . 5.31 139 125 A 70 ILE H A 69 ASN HD2y 1.0 . 5.50 140 126 A 10 PRO HDy A 70 ILE H 1.0 . 5.50 141 127 A 70 ILE H A 75 VAL HB 1.0 . 4.67 142 128 A 70 ILE H A 70 ILE HB 1.0 . 3.42 143 129 A 70 ILE H A 70 ILE HG2% 1.0 . 4.42 144 130 A 49 VAL HGy% A 30 ARG H 1.0 . 5.50 145 131 A 30 ARG H A 52 SER H 1.0 . 4.58 146 132 A 30 ARG H A 30 ARG HBy 1.0 . 3.58 147 133 A 30 ARG H A 30 ARG HBx 1.0 . 3.35 148 134 A 29 ALA HB% A 30 ARG H 1.0 . 3.79 149 135 A 30 ARG H A 30 ARG HDy 1.0 . 5.36 150 136 A 51 PHE HD% A 57 ALA H 1.0 . 5.50 151 137 A 51 PHE HBx A 57 ALA H 1.0 . 4.77 152 138 A 57 ALA H A 55 GLN HBx 1.0 . 5.50 153 138 A 57 ALA H A 55 GLN HBy 1.0 . 5.50 154 139 A 57 ALA H A 58 THR HG2% 1.0 . 5.50 155 140 A 57 ALA H A 27 VAL HGx% 1.0 . 5.50 156 140 A 27 VAL HGy% A 57 ALA H 1.0 . 5.50 157 141 A 27 VAL H A 28 GLN H 1.0 . 4.73 158 142 A 28 GLN H A 28 GLN HBx 1.0 . 3.23 159 142 A 28 GLN H A 28 GLN HBy 1.0 . 3.23 160 143 A 28 GLN H A 27 VAL HGx% 1.0 . 3.91 161 143 A 27 VAL HGy% A 28 GLN H 1.0 . 3.91 162 144 A 28 GLN H A 28 GLN HE2y 1.0 . 5.50 163 145 A 63 ALA H A 66 HIS H 1.0 . 5.03 164 146 A 51 PHE HE% A 28 GLN H 1.0 . 5.34 165 147 A 63 ALA H A 64 ASN H 1.0 . 3.69 166 148 A 63 ALA H A 61 MET HA 1.0 . 5.50 167 149 A 63 ALA H A 65 GLN H 1.0 . 5.35 168 150 A 63 ALA H A 62 GLU HGx 1.0 . 5.19 169 150 A 63 ALA H A 62 GLU HGy 1.0 . 5.19 170 151 A 63 ALA H A 62 GLU HBx 1.0 . 3.71 171 152 A 58 THR HG2% A 63 ALA H 1.0 . 5.50 172 153 A 64 ASN HBy A 68 LEU H 1.0 . 5.50 173 154 A 68 LEU H A 75 VAL HGx% 1.0 . 4.62 174 155 A 68 LEU H A 70 ILE HD1% 1.0 . 4.77 175 156 A 75 VAL H A 68 LEU H 1.0 . 3.78 176 157 A 75 VAL HB A 68 LEU H 1.0 . 3.74 177 158 A 36 ARG H A 36 ARG HDy 1.0 . 4.57 178 159 A 36 ARG H A 35 MET HGy 1.0 . 5.38 179 160 A 36 ARG H A 42 GLN HBy 1.0 . 4.62 180 161 A 36 ARG H A 36 ARG HGx 1.0 . 4.11 181 162 A 36 ARG H A 34 LEU HDy% 1.0 . 5.50 182 163 A 68 LEU H A 77 MET H 1.0 . 5.14 183 164 A 37 ASN H A 38 LYS HDx 1.0 . 5.50 184 164 A 37 ASN H A 38 LYS HDy 1.0 . 5.50 185 165 A 38 LYS H A 37 ASN H 1.0 . 4.20 186 166 A 36 ARG H A 37 ASN H 1.0 . 5.01 187 167 A 37 ASN H A 37 ASN HD2y 1.0 . 5.48 188 168 A 37 ASN H A 37 ASN HBy 1.0 . 3.28 189 169 A 37 ASN H A 37 ASN HBx 1.0 . 3.32 190 170 A 37 ASN H A 36 ARG HBy 1.0 . 3.53 191 171 A 43 SER HBx A 37 ASN H 1.0 . 5.50 192 172 A 42 GLN HBy A 37 ASN H 1.0 . 5.50 193 173 A 75 VAL HB A 69 ASN H 1.0 . 5.28 194 174 A 75 VAL HGy% A 69 ASN H 1.0 . 5.50 195 175 A 69 ASN H A 68 LEU HBx 1.0 . 3.22 196 175 A 68 LEU HBy A 69 ASN H 1.0 . 3.22 197 176 A 84 PRO HA A 85 LYS H 1.0 . 2.73 198 177 A 85 LYS H A 84 PRO HDx 1.0 . 5.15 199 178 A 85 LYS H A 84 PRO HBy 1.0 . 4.10 200 179 A 85 LYS H A 86 ILE HG1y 1.0 . 3.92 201 180 A 85 LYS H A 86 ILE HG2% 1.0 . 5.50 202 181 A 85 LYS H A 83 LYS HA 1.0 . 5.47 203 182 A 7 ARG H A 76 SER H 1.0 . 3.82 204 183 A 76 SER H A 8 MET H 1.0 . 5.50 205 184 A 77 MET H A 76 SER H 1.0 . 5.02 206 185 A 76 SER H A 6 LEU HA 1.0 . 4.93 207 186 A 76 SER H A 75 VAL HA 1.0 . 2.82 208 187 A 76 SER H A 76 SER HBy 1.0 . 3.90 209 188 A 76 SER H A 76 SER HBx 1.0 . 3.66 210 189 A 75 VAL HB A 76 SER H 1.0 . 4.01 211 190 A 75 VAL HGx% A 76 SER H 1.0 . 3.60 212 191 A 75 VAL H A 76 SER H 1.0 . 4.78 213 192 A 76 SER H A 8 MET HBy 1.0 . 4.02 214 193 A 57 ALA HA A 59 ARG H 1.0 . 4.58 215 194 A 57 ALA H A 59 ARG H 1.0 . 4.64 216 195 A 59 ARG H A 59 ARG HBy 1.0 . 3.01 217 196 A 69 ASN HA A 73 GLN H 1.0 . 4.41 218 197 A 71 LEU H A 73 GLN H 1.0 . 4.86 219 198 A 70 ILE H A 73 GLN H 1.0 . 3.53 220 199 A 73 GLN H A 70 ILE HA 1.0 . 5.12 221 200 A 73 GLN H A 71 LEU HA 1.0 . 4.94 222 201 A 73 GLN H A 73 GLN HGy 1.0 . 4.16 223 202 A 73 GLN H A 73 GLN HBy 1.0 . 3.42 224 203 A 73 GLN H A 73 GLN HBx 1.0 . 3.29 225 204 A 73 GLN H A 75 VAL HGy% 1.0 . 5.08 226 205 A 73 GLN H A 70 ILE HG2% 1.0 . 5.30 227 206 A 60 TRP HE1 A 22 LEU H 1.0 . 5.50 228 207 A 3 ILE H A 79 TYR HD% 1.0 . 5.33 229 208 A 3 ILE H A 79 TYR HE% 1.0 . 5.50 230 209 A 3 ILE H A 2 ASN HBy 1.0 . 4.89 231 210 A 3 ILE H A 2 ASN HBx 1.0 . 4.95 232 211 A 3 ILE H A 4 VAL HGx% 1.0 . 5.50 233 212 A 85 LYS H A 84 PRO HDy 1.0 . 5.50 234 213 A 86 ILE HA A 87 ASN H 1.0 . 3.03 235 214 A 87 ASN H A 87 ASN HBy 1.0 . 3.39 236 214 A 87 ASN H A 87 ASN HBx 1.0 . 3.39 237 215 A 87 ASN H A 86 ILE HB 1.0 . 3.91 238 216 A 86 ILE HG1y A 87 ASN H 1.0 . 4.94 239 217 A 59 ARG H A 56 ASP H 1.0 . 5.39 240 218 A 59 ARG H A 56 ASP HA 1.0 . 3.74 241 219 A 59 ARG H A 55 GLN HGx 1.0 . 5.50 242 219 A 59 ARG H A 55 GLN HGy 1.0 . 5.50 243 220 A 59 ARG H A 27 VAL HGx% 1.0 . 5.50 244 220 A 27 VAL HGy% A 59 ARG H 1.0 . 5.50 245 221 A 22 LEU H A 20 GLY HAy 1.0 . 4.85 246 222 A 22 LEU H A 18 ILE HA 1.0 . 5.27 247 223 A 22 LEU H A 21 GLN HBy 1.0 . 4.08 248 224 A 22 LEU H A 22 LEU HBy 1.0 . 3.28 249 225 A 22 LEU HBx A 22 LEU H 1.0 . 3.59 250 226 A 22 LEU H A 22 LEU HG 1.0 . 3.38 251 227 A 22 LEU H A 18 ILE HG2% 1.0 . 4.78 252 228 A 22 LEU H A 19 ARG H 1.0 . 5.50 253 229 A 3 ILE H A 2 ASN H 1.0 . 3.28 254 230 A 3 ILE H A 1 SER HBy 1.0 . 4.16 255 231 A 3 ILE H A 1 SER HBx 1.0 . 3.92 256 232 A 3 ILE H A 3 ILE HB 1.0 . 3.32 257 233 A 3 ILE H A 3 ILE HG1y 1.0 . 3.79 258 234 A 3 ILE H A 3 ILE HG2% 1.0 . 4.10 259 235 A 82 PRO HDx A 83 LYS H 1.0 . 4.20 260 236 A 81 ASP HBy A 83 LYS H 1.0 . 4.45 261 237 A 81 ASP HBx A 83 LYS H 1.0 . 5.13 262 238 A 83 LYS H A 82 PRO HBy 1.0 . 4.15 263 239 A 83 LYS H A 82 PRO HBx 1.0 . 3.80 264 240 A 83 LYS H A 83 LYS HBx 1.0 . 3.22 265 241 A 83 LYS H A 83 LYS HGx 1.0 . 3.78 266 241 A 83 LYS H A 83 LYS HGy 1.0 . 3.78 267 242 A 3 ILE HD1% A 83 LYS H 1.0 . 4.96 268 243 A 85 LYS H A 86 ILE H 1.0 . 3.73 269 244 A 86 ILE HB A 86 ILE H 1.0 . 3.10 270 245 A 86 ILE HG1y A 86 ILE H 1.0 . 3.79 271 246 A 86 ILE H A 86 ILE HG1x 1.0 . 3.77 272 247 A 87 ASN HA A 88 GLU H 1.0 . 3.10 273 248 A 88 GLU H A 87 ASN HBy 1.0 . 3.66 274 248 A 87 ASN HBx A 88 GLU H 1.0 . 3.66 275 249 A 88 GLU H A 88 GLU HGx 1.0 . 3.74 276 249 A 88 GLU HGy A 88 GLU H 1.0 . 3.74 277 250 A 88 GLU H A 88 GLU HBx 1.0 . 3.26 278 251 A 88 GLU H A 90 TRP H 1.0 . 5.50 279 252 A 86 ILE HG2% A 88 GLU H 1.0 . 5.09 280 253 A 84 PRO HBy A 86 ILE H 1.0 . 5.46 281 254 A 15 GLU H A 17 ASP H 1.0 . 4.84 282 255 A 17 ASP H A 14 THR H 1.0 . 3.73 283 256 A 17 ASP H A 16 ASP H 1.0 . 3.26 284 257 A 17 ASP H A 18 ILE H 1.0 . 3.24 285 258 A 17 ASP H A 14 THR HB 1.0 . 4.27 286 259 A 17 ASP H A 15 GLU HA 1.0 . 4.69 287 260 A 17 ASP H A 17 ASP HBy 1.0 . 3.27 288 261 A 17 ASP H A 17 ASP HBx 1.0 . 3.59 289 262 A 17 ASP H A 18 ILE HB 1.0 . 5.17 290 263 A 17 ASP H A 14 THR HG2% 1.0 . 4.65 291 264 A 19 ARG H A 17 ASP H 1.0 . 4.52 292 265 A 18 ILE HA A 17 ASP H 1.0 . 5.33 293 266 A 60 TRP H A 62 GLU H 1.0 . 5.03 294 267 A 59 ARG H A 60 TRP H 1.0 . 3.46 295 268 A 60 TRP H A 60 TRP HE3 1.0 . 5.50 296 269 A 60 TRP H A 60 TRP HBy 1.0 . 3.20 297 270 A 60 TRP H A 60 TRP HBx 1.0 . 3.08 298 271 A 51 PHE HE% A 60 TRP H 1.0 . 5.05 299 272 A 60 TRP H A 51 PHE HZ 1.0 . 5.50 300 273 A 60 TRP H A 27 VAL HGx% 1.0 . 4.73 301 273 A 27 VAL HGy% A 60 TRP H 1.0 . 4.73 302 274 A 20 GLY H A 21 GLN H 1.0 . 3.51 303 275 A 22 LEU H A 21 GLN H 1.0 . 3.29 304 276 A 18 ILE HA A 21 GLN H 1.0 . 4.12 305 277 A 21 GLN H A 21 GLN HGy 1.0 . 3.42 306 278 A 21 GLN H A 21 GLN HBx 1.0 . 3.24 307 279 A 22 LEU HG A 21 GLN H 1.0 . 4.88 308 280 A 18 ILE HG2% A 21 GLN H 1.0 . 4.61 309 281 A 21 GLN H A 22 LEU HDx% 1.0 . 5.50 310 282 A 43 SER HBx A 35 MET H 1.0 . 5.50 311 283 A 35 MET HGy A 35 MET H 1.0 . 3.85 312 284 A 35 MET H A 35 MET HGx 1.0 . 4.36 313 285 A 35 MET H A 35 MET HBy 1.0 . 3.50 314 286 A 35 MET H A 35 MET HBx 1.0 . 4.00 315 287 A 35 MET H A 34 LEU HDy% 1.0 . 5.50 316 288 A 19 ARG H A 21 GLN H 1.0 . 4.81 317 289 A 21 GLN H A 17 ASP HA 1.0 . 5.14 318 290 A 22 LEU HBy A 21 GLN H 1.0 . 5.47 319 291 A 21 GLN H A 22 LEU HDy% 1.0 . 5.50 320 292 A 90 TRP HE1 A 90 TRP H 1.0 . 5.50 321 293 A 90 TRP H A 89 ASP H 1.0 . 3.43 322 294 A 91 LEU H A 90 TRP H 1.0 . 3.52 323 295 A 88 GLU HA A 90 TRP H 1.0 . 4.60 324 296 A 90 TRP H A 90 TRP HBx 1.0 . 3.35 325 297 A 89 ASP HBy A 90 TRP H 1.0 . 3.84 326 298 A 90 TRP H A 88 GLU HGx 1.0 . 5.50 327 298 A 88 GLU HGy A 90 TRP H 1.0 . 5.50 328 299 A 90 TRP H A 88 GLU HBy 1.0 . 5.06 329 300 A 90 TRP H A 91 LEU HDx% 1.0 . 5.50 330 301 A 15 GLU H A 14 THR HA 1.0 . 2.87 331 302 A 15 GLU H A 15 GLU HBy 1.0 . 3.33 332 303 A 34 LEU HBx A 15 GLU H 1.0 . 5.50 333 304 A 15 GLU H A 34 LEU HDy% 1.0 . 4.41 334 305 A 91 LEU H A 89 ASP H 1.0 . 5.11 335 306 A 90 TRP HD1 A 89 ASP H 1.0 . 5.50 336 307 A 89 ASP HBy A 89 ASP H 1.0 . 3.11 337 308 A 89 ASP H A 88 GLU HGx 1.0 . 4.56 338 308 A 88 GLU HGy A 89 ASP H 1.0 . 4.56 339 309 A 89 ASP H A 88 GLU HBy 1.0 . 4.18 340 310 A 86 ILE HG2% A 89 ASP H 1.0 . 5.50 341 311 A 7 ARG H A 8 MET H 1.0 . 4.68 342 312 A 7 ARG H A 78 HIS HD2 1.0 . 4.61 343 313 A 7 ARG H A 76 SER HBx 1.0 . 5.50 344 314 A 6 LEU HBy A 7 ARG H 1.0 . 4.43 345 315 A 6 LEU HBx A 7 ARG H 1.0 . 4.09 346 316 A 6 LEU H A 7 ARG H 1.0 . 5.37 347 317 A 7 ARG H A 6 LEU HA 1.0 . 2.99 348 318 A 7 ARG H A 75 VAL HA 1.0 . 5.50 349 319 A 7 ARG H A 7 ARG HBx 1.0 . 3.47 350 319 A 7 ARG H A 7 ARG HBy 1.0 . 3.47 351 320 A 7 ARG H A 7 ARG HGx 1.0 . 4.01 352 320 A 7 ARG HGy A 7 ARG H 1.0 . 4.01 353 321 A 78 HIS H A 7 ARG H 1.0 . 5.23 354 322 A 77 MET H A 7 ARG H 1.0 . 5.50 355 323 A 78 HIS H A 77 MET HA 1.0 . 3.04 356 324 A 78 HIS H A 4 VAL HA 1.0 . 4.58 357 325 A 78 HIS H A 78 HIS HBx 1.0 . 3.73 358 326 A 78 HIS H A 77 MET HBy 1.0 . 4.13 359 327 A 78 HIS H A 77 MET HGx 1.0 . 4.75 360 328 A 78 HIS H A 6 LEU HDy% 1.0 . 4.37 361 329 A 78 HIS H A 77 MET H 1.0 . 5.07 362 330 A 37 ASN H A 42 GLN H 1.0 . 4.86 363 331 A 37 ASN HD2y A 42 GLN H 1.0 . 4.79 364 332 A 42 GLN H A 40 SER HA 1.0 . 5.34 365 333 A 42 GLN H A 40 SER HBy 1.0 . 4.17 366 334 A 37 ASN HBy A 42 GLN H 1.0 . 3.73 367 335 A 42 GLN H A 42 GLN HGx 1.0 . 3.65 368 335 A 42 GLN H A 42 GLN HGy 1.0 . 3.65 369 336 A 42 GLN HBy A 42 GLN H 1.0 . 3.62 370 337 A 15 GLU H A 18 ILE H 1.0 . 5.50 371 338 A 14 THR H A 18 ILE H 1.0 . 4.99 372 339 A 16 ASP H A 18 ILE H 1.0 . 4.84 373 340 A 18 ILE H A 19 ARG HA 1.0 . 5.50 374 341 A 18 ILE H A 17 ASP HBy 1.0 . 3.75 375 342 A 18 ILE H A 18 ILE HB 1.0 . 3.19 376 343 A 18 ILE H A 18 ILE HG1y 1.0 . 3.44 377 344 A 18 ILE H A 18 ILE HG1x 1.0 . 3.94 378 345 A 6 LEU H A 47 ALA H 1.0 . 3.65 379 346 A 46 PHE H A 47 ALA H 1.0 . 4.90 380 347 A 47 ALA H A 46 PHE HBx 1.0 . 3.57 381 348 A 47 ALA H A 5 MET HGy 1.0 . 5.28 382 349 A 6 LEU HBy A 47 ALA H 1.0 . 3.94 383 350 A 47 ALA H A 7 ARG HA 1.0 . 5.50 384 351 A 12 ALA H A 13 ALA H 1.0 . 3.21 385 352 A 13 ALA H A 11 GLN HA 1.0 . 4.25 386 353 A 10 PRO HDy A 13 ALA H 1.0 . 5.50 387 354 A 10 PRO HDx A 13 ALA H 1.0 . 5.02 388 355 A 18 ILE H A 20 GLY H 1.0 . 4.99 389 356 A 18 ILE H A 13 ALA HB% 1.0 . 5.50 390 357 A 20 GLY HAy A 19 ARG H 1.0 . 5.18 391 358 A 19 ARG H A 19 ARG HGx 1.0 . 4.10 392 359 A 47 ALA H A 34 LEU HA 1.0 . 5.50 393 360 A 11 GLN H A 13 ALA H 1.0 . 4.96 394 361 A 19 ARG H A 18 ILE H 1.0 . 3.32 395 362 A 19 ARG H A 17 ASP HBx 1.0 . 5.50 396 363 A 19 ARG H A 19 ARG HBx 1.0 . 2.87 397 364 A 19 ARG H A 19 ARG HGy 1.0 . 3.49 398 365 A 18 ILE HG2% A 19 ARG H 1.0 . 3.90 399 366 A 56 ASP H A 53 HIS HA 1.0 . 5.42 400 367 A 56 ASP H A 53 HIS HBx 1.0 . 3.79 401 368 A 56 ASP H A 56 ASP HBx 1.0 . 3.73 402 369 A 56 ASP H A 55 GLN HBx 1.0 . 3.73 403 369 A 55 GLN HBy A 56 ASP H 1.0 . 3.73 404 370 A 56 ASP H A 27 VAL HGx% 1.0 . 5.46 405 370 A 27 VAL HGy% A 56 ASP H 1.0 . 5.46 406 371 A 56 ASP H A 55 GLN H 1.0 . 3.66 407 372 A 51 PHE HD% A 56 ASP H 1.0 . 5.50 408 373 A 57 ALA H A 56 ASP H 1.0 . 3.18 409 374 A 56 ASP H A 56 ASP HBy 1.0 . 3.29 410 375 A 56 ASP H A 57 ALA HB% 1.0 . 4.77 411 376 A 23 GLN H A 24 SER H 1.0 . 3.69 412 377 A 22 LEU H A 23 GLN H 1.0 . 3.41 413 378 A 21 GLN H A 23 GLN H 1.0 . 4.93 414 379 A 23 GLN H A 23 GLN HGx 1.0 . 3.91 415 379 A 23 GLN H A 23 GLN HGy 1.0 . 3.91 416 380 A 23 GLN H A 23 GLN HBy 1.0 . 2.95 417 381 A 22 LEU HBy A 23 GLN H 1.0 . 3.38 418 382 A 22 LEU HG A 23 GLN H 1.0 . 4.52 419 383 A 22 LEU HDx% A 23 GLN H 1.0 . 4.88 420 384 A 23 GLN H A 21 GLN HA 1.0 . 4.84 421 385 A 23 GLN H A 27 VAL HGx% 1.0 . 5.50 422 385 A 27 VAL HGy% A 23 GLN H 1.0 . 5.50 423 386 A 22 LEU HDy% A 23 GLN H 1.0 . 5.30 424 387 A 25 HIS H A 27 VAL HB 1.0 . 5.50 425 388 A 25 HIS H A 23 GLN HBy 1.0 . 5.50 426 389 A 25 HIS H A 27 VAL HGx% 1.0 . 5.32 427 389 A 27 VAL HGy% A 25 HIS H 1.0 . 5.32 428 390 A 25 HIS H A 26 GLY H 1.0 . 3.50 429 391 A 25 HIS H A 23 GLN HA 1.0 . 4.94 430 392 A 25 HIS H A 24 SER HBx 1.0 . 3.87 431 392 A 25 HIS H A 24 SER HBy 1.0 . 3.87 432 393 A 25 HIS H A 25 HIS HBy 1.0 . 3.94 433 394 A 25 HIS H A 25 HIS HBx 1.0 . 3.55 434 395 A 8 MET HBy A 9 LEU H 1.0 . 5.35 435 396 A 63 ALA H A 62 GLU H 1.0 . 3.48 436 397 A 64 ASN H A 62 GLU H 1.0 . 5.05 437 398 A 62 GLU H A 58 THR HA 1.0 . 4.47 438 399 A 62 GLU H A 62 GLU HGx 1.0 . 3.29 439 399 A 62 GLU HGy A 62 GLU H 1.0 . 3.29 440 400 A 62 GLU HBx A 62 GLU H 1.0 . 2.93 441 401 A 62 GLU H A 61 MET HBx 1.0 . 3.66 442 402 A 62 GLU H A 61 MET HE% 1.0 . 5.50 443 403 A 15 GLU H A 16 ASP H 1.0 . 3.44 444 404 A 16 ASP H A 14 THR HB 1.0 . 3.36 445 405 A 16 ASP H A 16 ASP HBx 1.0 . 3.02 446 406 A 16 ASP H A 14 THR HG2% 1.0 . 4.48 447 407 A 8 MET H A 9 LEU H 1.0 . 3.36 448 408 A 46 PHE H A 9 LEU H 1.0 . 5.50 449 409 A 7 ARG HA A 9 LEU H 1.0 . 4.38 450 410 A 75 VAL HA A 9 LEU H 1.0 . 5.50 451 411 A 9 LEU H A 8 MET HA 1.0 . 3.16 452 412 A 9 LEU H A 45 GLY HAx 1.0 . 4.08 453 413 A 10 PRO HDx A 9 LEU H 1.0 . 4.93 454 414 A 9 LEU H A 8 MET HBx 1.0 . 5.13 455 415 A 9 LEU H A 9 LEU HBy 1.0 . 3.50 456 416 A 9 LEU H A 9 LEU HBx 1.0 . 3.19 457 417 A 75 VAL HGx% A 9 LEU H 1.0 . 4.44 458 418 A 62 GLU H A 66 HIS HD2 1.0 . 5.50 459 419 A 51 PHE H A 52 SER H 1.0 . 5.02 460 420 A 51 PHE HD% A 52 SER H 1.0 . 4.85 461 421 A 52 SER H A 52 SER HBy 1.0 . 3.73 462 422 A 52 SER H A 52 SER HBx 1.0 . 3.70 463 423 A 51 PHE HBx A 52 SER H 1.0 . 4.45 464 424 A 52 SER H A 30 ARG HBy 1.0 . 4.84 465 425 A 52 SER H A 30 ARG HBx 1.0 . 4.96 466 426 A 62 GLU H A 61 MET H 1.0 . 3.58 467 427 A 60 TRP H A 61 MET H 1.0 . 3.46 468 428 A 60 TRP HBy A 61 MET H 1.0 . 3.69 469 429 A 60 TRP HBx A 61 MET H 1.0 . 3.88 470 430 A 61 MET H A 61 MET HBy 1.0 . 3.74 471 431 A 5 MET H A 80 SER H 1.0 . 4.64 472 432 A 81 ASP H A 80 SER H 1.0 . 4.37 473 433 A 80 SER HBy A 80 SER H 1.0 . 3.26 474 434 A 79 TYR HBy A 80 SER H 1.0 . 4.43 475 435 A 79 TYR H A 80 SER H 1.0 . 5.16 476 436 A 1 SER HBy A 80 SER H 1.0 . 5.38 477 437 A 3 ILE HB A 80 SER H 1.0 . 4.58 478 438 A 4 VAL HGx% A 80 SER H 1.0 . 5.50 479 439 A 3 ILE HD1% A 80 SER H 1.0 . 5.50 480 440 A 66 HIS H A 65 GLN H 1.0 . 3.55 481 441 A 64 ASN H A 65 GLN H 1.0 . 3.21 482 442 A 65 GLN H A 65 GLN HA 1.0 . 2.85 483 443 A 61 MET HA A 65 GLN H 1.0 . 5.12 484 444 A 65 GLN H A 64 ASN HBy 1.0 . 4.76 485 445 A 65 GLN H A 65 GLN HGy 1.0 . 3.52 486 445 A 65 GLN H A 65 GLN HGx 1.0 . 3.52 487 446 A 65 GLN H A 65 GLN HBx 1.0 . 3.44 488 446 A 65 GLN H A 65 GLN HBy 1.0 . 3.44 489 447 A 65 GLN H A 64 ASN HBx 1.0 . 4.45 490 448 A 65 GLN H A 63 ALA HB% 1.0 . 5.07 491 449 A 65 GLN H A 77 MET HE% 1.0 . 5.50 492 450 A 65 GLN H A 64 ASN HD2y 1.0 . 5.50 493 451 A 6 LEU HDy% A 77 MET H 1.0 . 5.50 494 452 A 77 MET H A 76 SER HBx 1.0 . 4.45 495 453 A 49 VAL H A 48 PHE H 1.0 . 4.85 496 454 A 47 ALA H A 48 PHE H 1.0 . 4.99 497 455 A 34 LEU HA A 48 PHE H 1.0 . 4.50 498 456 A 48 PHE HBx A 48 PHE H 1.0 . 3.60 499 457 A 48 PHE H A 33 ARG HBx 1.0 . 4.01 500 457 A 33 ARG HBy A 48 PHE H 1.0 . 4.01 501 458 A 48 PHE H A 49 VAL HGx% 1.0 . 5.20 502 459 A 42 GLN H A 43 SER H 1.0 . 5.07 503 460 A 43 SER HBx A 43 SER H 1.0 . 3.45 504 461 A 42 GLN HBy A 43 SER H 1.0 . 4.06 505 462 A 43 SER H A 42 GLN HBx 1.0 . 4.69 506 463 A 27 VAL H A 22 LEU HDy% 1.0 . 5.50 507 464 A 27 VAL H A 26 GLY H 1.0 . 3.56 508 465 A 27 VAL H A 27 VAL HB 1.0 . 3.60 509 466 A 53 HIS H A 52 SER HBy 1.0 . 3.98 510 467 A 53 HIS H A 52 SER H 1.0 . 3.59 511 468 A 51 PHE HD% A 53 HIS H 1.0 . 4.97 512 469 A 53 HIS H A 53 HIS HD2 1.0 . 4.72 513 470 A 53 HIS H A 57 ALA H 1.0 . 5.50 514 471 A 53 HIS H A 51 PHE HBy 1.0 . 3.56 515 472 A 53 HIS H A 53 HIS HBx 1.0 . 3.44 516 473 A 53 HIS H A 56 ASP HBy 1.0 . 4.50 517 474 A 10 PRO HDx A 12 ALA H 1.0 . 5.50 518 475 A 11 GLN H A 12 ALA H 1.0 . 3.62 519 476 A 10 PRO HA A 12 ALA H 1.0 . 4.23 520 477 A 12 ALA H A 11 GLN HBx 1.0 . 4.37 521 478 A 12 ALA H A 10 PRO HBx 1.0 . 3.68 522 479 A 66 HIS HD2 A 67 SER H 1.0 . 5.50 523 480 A 27 VAL H A 25 HIS HA 1.0 . 5.01 524 481 A 68 LEU H A 67 SER H 1.0 . 4.15 525 482 A 66 HIS H A 67 SER H 1.0 . 3.55 526 483 A 64 ASN HBy A 67 SER H 1.0 . 3.75 527 484 A 64 ASN H A 67 SER H 1.0 . 5.38 528 485 A 67 SER H A 64 ASN HA 1.0 . 4.38 529 486 A 67 SER H A 65 GLN HBx 1.0 . 4.83 530 486 A 65 GLN HBy A 67 SER H 1.0 . 4.83 531 487 A 64 ASN HBx A 67 SER H 1.0 . 4.15 532 488 A 77 MET HE% A 67 SER H 1.0 . 5.48 533 489 A 24 SER H A 23 GLN HGx 1.0 . 5.40 534 489 A 24 SER H A 23 GLN HGy 1.0 . 5.40 535 490 A 24 SER H A 25 HIS H 1.0 . 3.83 536 491 A 24 SER H A 25 HIS HBx 1.0 . 5.50 537 492 A 24 SER H A 23 GLN HBy 1.0 . 3.82 538 493 A 57 ALA H A 55 GLN H 1.0 . 5.26 539 494 A 53 HIS HA A 55 GLN H 1.0 . 5.08 540 495 A 55 GLN H A 53 HIS HBy 1.0 . 4.18 541 496 A 53 HIS HBx A 55 GLN H 1.0 . 4.56 542 497 A 55 GLN H A 55 GLN HBx 1.0 . 3.26 543 497 A 55 GLN HBy A 55 GLN H 1.0 . 3.26 544 498 A 31 GLU H A 51 PHE HA 1.0 . 4.93 545 499 A 31 GLU H A 30 ARG H 1.0 . 2.99 546 500 A 31 GLU H A 32 VAL H 1.0 . 4.52 547 501 A 31 GLU H A 31 GLU HGy 1.0 . 4.62 548 502 A 31 GLU H A 30 ARG HBx 1.0 . 3.43 549 503 A 49 VAL HGy% A 31 GLU H 1.0 . 5.50 550 504 A 61 MET HA A 64 ASN HD2y 1.0 . 5.50 551 505 A 60 TRP HE1 A 64 ASN HD2y 1.0 . 5.01 552 506 A 63 ALA H A 64 ASN HD2y 1.0 . 5.50 553 507 A 64 ASN HD2y A 64 ASN HA 1.0 . 5.50 554 508 A 64 ASN HD2y A 60 TRP HA 1.0 . 4.98 555 509 A 64 ASN HD2y A 68 LEU HDy% 1.0 . 5.41 556 510 A 51 PHE H A 2 ASN H 1.0 . 5.50 557 511 A 2 ASN H A 2 ASN HD2y 1.0 . 5.45 558 512 A 1 SER HBx A 2 ASN H 1.0 . 3.85 559 513 A 3 ILE HA A 2 ASN H 1.0 . 5.50 560 514 A 2 ASN H A 1 SER HBy 1.0 . 3.44 561 515 A 2 ASN HBy A 2 ASN H 1.0 . 3.85 562 516 A 2 ASN HBx A 2 ASN H 1.0 . 3.66 563 517 A 2 ASN H A 3 ILE HB 1.0 . 5.07 564 518 A 2 ASN H A 3 ILE HG1y 1.0 . 5.05 565 519 A 37 ASN HD2x A 40 SER H 1.0 . 4.51 566 520 A 40 SER H A 39 SER HBx 1.0 . 3.69 567 520 A 40 SER H A 39 SER HBy 1.0 . 3.69 568 521 A 37 ASN HBx A 40 SER H 1.0 . 5.06 569 522 A 40 SER H A 38 LYS HBx 1.0 . 5.49 570 522 A 38 LYS HBy A 40 SER H 1.0 . 5.49 571 523 A 38 LYS H A 40 SER H 1.0 . 5.50 572 524 A 40 SER H A 41 GLY H 1.0 . 3.16 573 525 A 40 SER H A 41 GLY HAy 1.0 . 5.38 574 526 A 40 SER H A 40 SER HBx 1.0 . 3.80 575 527 A 37 ASN HBy A 40 SER H 1.0 . 4.59 576 528 A 37 ASN HD2x A 37 ASN HA 1.0 . 5.50 577 529 A 37 ASN HD2y A 40 SER H 1.0 . 3.91 578 530 A 37 ASN HD2y A 37 ASN HA 1.0 . 4.95 579 531 A 37 ASN HD2y A 37 ASN HBx 1.0 . 3.96 580 532 A 15 GLU H A 14 THR H 1.0 . 5.50 581 533 A 14 THR H A 16 ASP H 1.0 . 5.00 582 534 A 71 LEU HDx% A 73 GLN HE2y 1.0 . 5.50 583 535 A 37 ASN HD2y A 41 GLY H 1.0 . 4.71 584 536 A 14 THR H A 17 ASP HBy 1.0 . 3.57 585 537 A 14 THR H A 34 LEU HDy% 1.0 . 4.33 586 538 A 11 GLN H A 73 GLN HE2x 1.0 . 5.50 587 539 A 10 PRO HA A 73 GLN HE2x 1.0 . 4.75 588 540 A 10 PRO HDy A 73 GLN HE2x 1.0 . 5.50 589 541 A 73 GLN HE2x A 10 PRO HBy 1.0 . 4.98 590 542 A 73 GLN HE2x A 9 LEU HA 1.0 . 5.50 591 543 A 38 LYS H A 39 SER H 1.0 . 4.12 592 544 A 40 SER H A 39 SER H 1.0 . 3.51 593 545 A 37 ASN HD2y A 39 SER H 1.0 . 5.50 594 546 A 37 ASN HD2x A 39 SER H 1.0 . 5.50 595 547 A 37 ASN HA A 39 SER H 1.0 . 4.47 596 548 A 39 SER H A 39 SER HBx 1.0 . 3.16 597 548 A 39 SER HBy A 39 SER H 1.0 . 3.16 598 549 A 40 SER HBx A 39 SER H 1.0 . 5.19 599 550 A 37 ASN HBy A 39 SER H 1.0 . 4.91 600 551 A 37 ASN HBx A 39 SER H 1.0 . 5.35 601 552 A 39 SER H A 38 LYS HBx 1.0 . 3.76 602 552 A 38 LYS HBy A 39 SER H 1.0 . 3.76 603 553 A 39 SER H A 38 LYS HGx 1.0 . 4.93 604 553 A 38 LYS HGy A 39 SER H 1.0 . 4.93 605 554 A 39 SER H A 38 LYS HDx 1.0 . 5.50 606 554 A 38 LYS HDy A 39 SER H 1.0 . 5.50 607 555 A 71 LEU HBx A 73 GLN HE2y 1.0 . 5.50 608 556 A 10 PRO HDy A 73 GLN HE2y 1.0 . 5.50 609 557 A 73 GLN HBx A 73 GLN HE2y 1.0 . 5.50 610 558 A 71 LEU HDx% A 73 GLN HE2x 1.0 . 5.42 611 559 A 69 ASN H A 21 GLN HE2y 1.0 . 5.50 612 560 A 21 GLN HA A 21 GLN HE2y 1.0 . 4.40 613 561 A 21 GLN HGy A 21 GLN HE2y 1.0 . 3.75 614 562 A 21 GLN HE2y A 68 LEU HBx 1.0 . 4.98 615 562 A 68 LEU HBy A 21 GLN HE2y 1.0 . 4.98 616 563 A 70 ILE HG1x A 21 GLN HE2y 1.0 . 4.90 617 564 A 70 ILE HD1% A 21 GLN HE2y 1.0 . 4.74 618 565 A 51 PHE H A 2 ASN HD2y 1.0 . 4.99 619 566 A 2 ASN HD2y A 2 ASN HA 1.0 . 5.37 620 567 A 2 ASN HBy A 2 ASN HD2y 1.0 . 3.71 621 568 A 50 GLU HBy A 2 ASN HD2y 1.0 . 5.05 622 569 A 3 ILE HG1y A 2 ASN HD2y 1.0 . 5.50 623 570 A 50 GLU HGy A 2 ASN HD2y 1.0 . 5.07 624 571 A 3 ILE HD1% A 2 ASN HD2y 1.0 . 5.50 625 572 A 2 ASN H A 2 ASN HD2x 1.0 . 5.50 626 573 A 3 ILE HG1y A 2 ASN HD2x 1.0 . 5.36 627 574 A 51 PHE H A 2 ASN HD2x 1.0 . 5.42 628 575 A 2 ASN HA A 2 ASN HD2x 1.0 . 5.50 629 576 A 50 GLU HGy A 2 ASN HD2x 1.0 . 4.94 630 577 A 2 ASN HD2x A 52 SER HA 1.0 . 5.50 631 578 A 21 GLN HE2x A 60 TRP HZ2 1.0 . 5.50 632 579 A 69 ASN H A 21 GLN HE2x 1.0 . 5.50 633 580 A 24 SER H A 21 GLN HE2x 1.0 . 5.50 634 581 A 21 GLN HA A 21 GLN HE2x 1.0 . 4.61 635 582 A 21 GLN HE2x A 24 SER HBx 1.0 . 5.50 636 582 A 24 SER HBy A 21 GLN HE2x 1.0 . 5.50 637 583 A 70 ILE HG1x A 21 GLN HE2x 1.0 . 5.31 638 584 A 70 ILE HD1% A 21 GLN HE2x 1.0 . 5.19 639 585 A 51 PHE HBy A 2 ASN HD2y 1.0 . 5.50 640 586 A 46 PHE HD% A 46 PHE H 1.0 . 5.16 641 587 A 44 ARG HBx A 46 PHE H 1.0 . 5.50 642 588 A 46 PHE HD% A 8 MET H 1.0 . 5.50 643 589 A 8 MET H A 46 PHE HA 1.0 . 4.71 644 590 A 46 PHE HBy A 8 MET H 1.0 . 5.34 645 591 A 8 MET H A 7 ARG HBx 1.0 . 3.41 646 591 A 8 MET H A 7 ARG HBy 1.0 . 3.41 647 592 A 8 MET H A 7 ARG HGx 1.0 . 4.29 648 592 A 7 ARG HGy A 8 MET H 1.0 . 4.29 649 593 A 8 MET H A 9 LEU HBx 1.0 . 5.36 650 594 A 75 VAL HGx% A 8 MET H 1.0 . 5.50 651 595 A 87 ASN H A 87 ASN HD2y 1.0 . 5.00 652 596 A 87 ASN HA A 87 ASN HD2y 1.0 . 5.25 653 597 A 87 ASN HD2y A 87 ASN HBy 1.0 . 3.50 654 597 A 87 ASN HBx A 87 ASN HD2y 1.0 . 3.50 655 598 A 86 ILE HB A 87 ASN HD2y 1.0 . 5.50 656 599 A 87 ASN H A 87 ASN HD2x 1.0 . 5.50 657 600 A 87 ASN HA A 87 ASN HD2x 1.0 . 5.50 658 601 A 86 ILE HG2% A 87 ASN HD2x 1.0 . 5.50 659 602 A 63 ALA HA A 65 GLN HE2y 1.0 . 5.50 660 603 A 64 ASN HA A 65 GLN HE2y 1.0 . 5.50 661 604 A 65 GLN HA A 65 GLN HE2y 1.0 . 5.49 662 605 A 42 GLN H A 42 GLN HE2y 1.0 . 5.17 663 606 A 33 ARG HA A 42 GLN HE2y 1.0 . 4.13 664 607 A 42 GLN HE2y A 42 GLN HA 1.0 . 5.31 665 608 A 42 GLN HE2y A 42 GLN HGx 1.0 . 3.78 666 608 A 42 GLN HGy A 42 GLN HE2y 1.0 . 3.78 667 609 A 40 SER HBy A 42 GLN HE2y 1.0 . 5.50 668 610 A 42 GLN HBx A 42 GLN HE2y 1.0 . 5.50 669 611 A 33 ARG HA A 42 GLN HE2x 1.0 . 4.22 670 612 A 55 GLN H A 55 GLN HE2y 1.0 . 5.27 671 613 A 59 ARG H A 55 GLN HE2y 1.0 . 5.42 672 614 A 55 GLN HE2y A 55 GLN HA 1.0 . 5.50 673 615 A 55 GLN HE2y A 55 GLN HGx 1.0 . 3.65 674 615 A 55 GLN HGy A 55 GLN HE2y 1.0 . 3.65 675 616 A 55 GLN HE2y A 55 GLN HBx 1.0 . 5.21 676 616 A 55 GLN HBy A 55 GLN HE2y 1.0 . 5.21 677 617 A 55 GLN HE2y A 27 VAL HGx% 1.0 . 5.50 678 617 A 27 VAL HGy% A 55 GLN HE2y 1.0 . 5.50 679 618 A 28 GLN HE2y A 28 GLN HBx 1.0 . 5.50 680 618 A 28 GLN HBy A 28 GLN HE2y 1.0 . 5.50 681 619 A 28 GLN HE2y A 27 VAL HGx% 1.0 . 5.50 682 619 A 27 VAL HGy% A 28 GLN HE2y 1.0 . 5.50 683 620 A 37 ASN HD2y A 42 GLN HE2x 1.0 . 5.46 684 621 A 56 ASP H A 55 GLN HE2x 1.0 . 5.12 685 622 A 55 GLN HE2x A 27 VAL HGx% 1.0 . 5.50 686 622 A 27 VAL HGy% A 55 GLN HE2x 1.0 . 5.50 687 623 A 53 HIS HBy A 55 GLN HE2x 1.0 . 5.50 688 624 A 11 GLN HE2y A 12 ALA HA 1.0 . 5.50 689 625 A 11 GLN HA A 11 GLN HE2x 1.0 . 4.62 690 626 A 11 GLN HE2x A 11 GLN HBx 1.0 . 5.11 691 627 A 37 ASN H A 41 GLY H 1.0 . 5.50 692 628 A 42 GLN H A 41 GLY H 1.0 . 3.42 693 629 A 41 GLY H A 39 SER HA 1.0 . 5.15 694 630 A 37 ASN HBy A 41 GLY H 1.0 . 4.40 695 631 A 41 GLY H A 42 GLN HGx 1.0 . 5.50 696 631 A 42 GLN HGy A 41 GLY H 1.0 . 5.50 697 632 A 42 GLN HBx A 41 GLY H 1.0 . 5.50 698 633 A 43 SER HBy A 11 GLN HE2y 1.0 . 5.50 699 634 A 11 GLN HA A 11 GLN HE2y 1.0 . 4.50 700 635 A 11 GLN HE2y A 11 GLN HBx 1.0 . 4.21 701 636 A 43 SER HBy A 11 GLN HE2x 1.0 . 5.50 702 637 A 55 GLN H A 58 THR H 1.0 . 5.50 703 638 A 59 ARG H A 58 THR H 1.0 . 3.40 704 639 A 60 TRP H A 58 THR H 1.0 . 5.26 705 640 A 56 ASP H A 58 THR H 1.0 . 4.51 706 641 A 57 ALA H A 58 THR H 1.0 . 3.22 707 642 A 58 THR H A 58 THR HB 1.0 . 3.29 708 643 A 58 THR H A 55 GLN HGx 1.0 . 5.50 709 643 A 55 GLN HGy A 58 THR H 1.0 . 5.50 710 644 A 59 ARG HBy A 58 THR H 1.0 . 4.91 711 645 A 23 GLN HA A 23 GLN HE2y 1.0 . 5.50 712 646 A 23 GLN HE2y A 23 GLN HBy 1.0 . 5.37 713 647 A 69 ASN HD2y A 74 LYS HEx 1.0 . 5.50 714 647 A 74 LYS HEy A 69 ASN HD2y 1.0 . 5.50 715 648 A 69 ASN HA A 69 ASN HD2x 1.0 . 5.50 716 649 A 69 ASN HD2y A 69 ASN H 1.0 . 5.26 717 650 A 69 ASN HA A 69 ASN HD2y 1.0 . 5.07 718 651 A 69 ASN HD2y A 74 LYS HA 1.0 . 5.17 719 652 A 72 GLY HAx A 69 ASN HD2y 1.0 . 5.50 720 653 A 69 ASN HD2y A 69 ASN HBx 1.0 . 4.09 721 654 A 69 ASN HD2y A 74 LYS HBx 1.0 . 5.50 722 655 A 64 ASN H A 77 MET HE% 1.0 . 5.50 723 656 A 64 ASN H A 64 ASN HD2y 1.0 . 4.49 724 657 A 64 ASN HD2x A 64 ASN H 1.0 . 5.05 725 658 A 69 ASN HD2x A 74 LYS HA 1.0 . 5.50 726 659 A 69 ASN HD2x A 74 LYS HBx 1.0 . 5.50 727 660 A 26 GLY H A 25 HIS HBy 1.0 . 4.59 728 661 A 26 GLY H A 25 HIS HBx 1.0 . 4.40 729 662 A 27 VAL HB A 26 GLY H 1.0 . 5.30 730 663 A 26 GLY H A 27 VAL HGx% 1.0 . 4.90 731 663 A 27 VAL HGy% A 26 GLY H 1.0 . 4.90 732 664 A 26 GLY H A 24 SER HA 1.0 . 4.70 733 665 A 22 LEU HBx A 26 GLY H 1.0 . 5.50 734 666 A 9 LEU H A 45 GLY H 1.0 . 5.50 735 667 A 45 GLY H A 43 SER HA 1.0 . 4.44 736 668 A 46 PHE H A 45 GLY H 1.0 . 3.87 737 669 A 45 GLY H A 44 ARG HBy 1.0 . 5.00 738 670 A 44 ARG HBx A 45 GLY H 1.0 . 4.58 739 671 A 19 ARG H A 20 GLY H 1.0 . 3.64 740 672 A 22 LEU H A 20 GLY H 1.0 . 5.40 741 673 A 20 GLY H A 17 ASP HA 1.0 . 4.02 742 674 A 18 ILE HA A 20 GLY H 1.0 . 5.49 743 675 A 20 GLY H A 19 ARG HBx 1.0 . 3.69 744 676 A 18 ILE HG2% A 20 GLY H 1.0 . 5.49 745 677 A 20 GLY H A 16 ASP HBy 1.0 . 5.50 746 678 A 20 GLY H A 22 LEU HDx% 1.0 . 5.50 747 679 A 66 HIS H A 64 ASN HA 1.0 . 5.27 748 680 A 66 HIS H A 77 MET HGx 1.0 . 4.97 749 681 A 66 HIS H A 61 MET HE% 1.0 . 5.50 750 682 A 66 HIS H A 64 ASN H 1.0 . 4.68 751 683 A 67 SER HA A 66 HIS H 1.0 . 5.50 752 684 A 66 HIS H A 61 MET HA 1.0 . 4.07 753 685 A 66 HIS H A 65 GLN HBx 1.0 . 4.49 754 685 A 66 HIS H A 65 GLN HBy 1.0 . 4.49 755 686 A 71 LEU H A 72 GLY H 1.0 . 3.45 756 687 A 70 ILE H A 72 GLY H 1.0 . 5.12 757 688 A 73 GLN H A 72 GLY H 1.0 . 3.32 758 689 A 69 ASN HD2y A 72 GLY H 1.0 . 5.50 759 690 A 69 ASN HA A 72 GLY H 1.0 . 5.44 760 691 A 70 ILE HA A 72 GLY H 1.0 . 4.20 761 692 A 71 LEU HA A 72 GLY H 1.0 . 3.33 762 693 A 72 GLY H A 69 ASN HBy 1.0 . 5.08 763 694 A 71 LEU HBx A 72 GLY H 1.0 . 4.92 764 695 A 71 LEU HG A 72 GLY H 1.0 . 5.50 765 696 A 69 ASN HD2x A 72 GLY H 1.0 . 5.50 766 697 A 20 GLY HAy A 19 ARG HBx 1.0 . 4.90 767 698 A 20 GLY HAy A 23 GLN HBy 1.0 . 4.55 768 698 A 20 GLY HAy A 23 GLN HBx 1.0 . 4.55 769 699 A 20 GLY HAx A 23 GLN HBy 1.0 . 4.09 770 699 A 23 GLN HBx A 20 GLY HAx 1.0 . 4.09 771 700 A 26 GLY HAy A 27 VAL HGx% 1.0 . 5.19 772 700 A 27 VAL HGy% A 26 GLY HAy 1.0 . 5.19 773 701 A 21 GLN HGx A 68 LEU HBx 1.0 . 5.50 774 701 A 68 LEU HBy A 21 GLN HGx 1.0 . 5.50 775 702 A 75 VAL HB A 68 LEU HBx 1.0 . 3.31 776 702 A 68 LEU HBy A 75 VAL HB 1.0 . 3.31 777 703 A 75 VAL HGx% A 68 LEU HBx 1.0 . 3.97 778 703 A 68 LEU HBy A 75 VAL HGx% 1.0 . 3.97 779 704 A 70 ILE HD1% A 68 LEU HBx 1.0 . 3.29 780 704 A 68 LEU HBy A 70 ILE HD1% 1.0 . 3.29 781 705 A 77 MET HE% A 68 LEU HBx 1.0 . 5.50 782 705 A 68 LEU HBy A 77 MET HE% 1.0 . 5.50 783 706 A 67 SER HA A 68 LEU HBx 1.0 . 5.06 784 706 A 68 LEU HBy A 67 SER HA 1.0 . 5.06 785 707 A 44 ARG HBx A 45 GLY HAy 1.0 . 5.50 786 708 A 72 GLY HAy A 69 ASN HD2x 1.0 . 5.50 787 709 A 72 GLY HAx A 69 ASN HD2x 1.0 . 5.19 788 710 A 34 LEU HBy A 15 GLU HA 1.0 . 5.01 789 711 A 34 LEU HBy A 35 MET H 1.0 . 4.79 790 712 A 34 LEU HBy A 15 GLU HGy 1.0 . 4.99 791 713 A 15 GLU HGx A 34 LEU HBy 1.0 . 4.16 792 714 A 34 LEU HBy A 34 LEU HDy% 1.0 . 3.98 793 714 A 34 LEU HBy A 34 LEU HDx% 1.0 . 3.98 794 715 A 34 LEU HBx A 35 MET H 1.0 . 4.83 795 716 A 33 ARG HA A 34 LEU HBx 1.0 . 4.86 796 717 A 34 LEU HBx A 34 LEU HDy% 1.0 . 3.83 797 717 A 34 LEU HBx A 34 LEU HDx% 1.0 . 3.83 798 718 A 59 ARG H A 59 ARG HDx 1.0 . 5.26 799 719 A 44 ARG H A 44 ARG HDx 1.0 . 5.38 800 720 A 44 ARG HDx A 46 PHE HE% 1.0 . 5.33 801 721 A 44 ARG HBx A 44 ARG HDx 1.0 . 3.97 802 722 A 59 ARG HDx A 27 VAL HGx% 1.0 . 4.88 803 722 A 27 VAL HGy% A 59 ARG HDx 1.0 . 4.88 804 723 A 59 ARG HDx A 55 GLN HGx 1.0 . 5.50 805 723 A 55 GLN HGy A 59 ARG HDx 1.0 . 5.50 806 724 A 44 ARG HDy A 46 PHE HE% 1.0 . 4.39 807 725 A 30 ARG H A 30 ARG HDx 1.0 . 5.16 808 726 A 30 ARG HBy A 30 ARG HDx 1.0 . 3.87 809 727 A 30 ARG HBx A 30 ARG HDx 1.0 . 3.20 810 728 A 88 GLU HBx A 91 LEU HBx 1.0 . 3.70 811 728 A 91 LEU HBy A 88 GLU HBx 1.0 . 3.70 812 729 A 91 LEU HDy% A 91 LEU HBx 1.0 . 3.32 813 729 A 91 LEU HDy% A 91 LEU HBy 1.0 . 3.32 814 730 A 31 GLU H A 30 ARG HDx 1.0 . 5.37 815 731 A 8 MET H A 7 ARG HDy 1.0 . 5.50 816 732 A 78 HIS HD2 A 7 ARG HDy 1.0 . 5.29 817 733 A 7 ARG HDy A 7 ARG HBx 1.0 . 3.52 818 733 A 7 ARG HBy A 7 ARG HDy 1.0 . 3.52 819 734 A 7 ARG H A 7 ARG HDy 1.0 . 5.50 820 735 A 16 ASP HA A 19 ARG HDy 1.0 . 4.28 821 736 A 19 ARG HBx A 19 ARG HDy 1.0 . 3.38 822 737 A 19 ARG HDy A 32 VAL HGx% 1.0 . 5.01 823 738 A 36 ARG HDy A 34 LEU HDy% 1.0 . 4.88 824 738 A 36 ARG HDy A 34 LEU HDx% 1.0 . 4.88 825 739 A 6 LEU HBy A 5 MET HA 1.0 . 5.26 826 740 A 6 LEU HBy A 6 LEU HDx% 1.0 . 3.71 827 741 A 6 LEU HBx A 6 LEU HDx% 1.0 . 3.52 828 742 A 19 ARG H A 19 ARG HDy 1.0 . 4.86 829 743 A 19 ARG HA A 19 ARG HDy 1.0 . 4.76 830 744 A 22 LEU HDx% A 19 ARG HDy 1.0 . 5.50 831 745 A 16 ASP HBx A 19 ARG HDy 1.0 . 5.50 832 746 A 19 ARG HBx A 19 ARG HDx 1.0 . 3.44 833 747 A 32 VAL HGx% A 19 ARG HDx 1.0 . 5.01 834 748 A 19 ARG H A 19 ARG HDx 1.0 . 4.97 835 749 A 19 ARG HA A 19 ARG HDx 1.0 . 4.68 836 750 A 49 VAL H A 48 PHE HBy 1.0 . 4.24 837 751 A 48 PHE H A 48 PHE HBy 1.0 . 3.93 838 752 A 48 PHE HBy A 33 ARG HBx 1.0 . 4.02 839 752 A 33 ARG HBy A 48 PHE HBy 1.0 . 4.02 840 753 A 48 PHE HBy A 33 ARG HGx 1.0 . 5.38 841 753 A 33 ARG HGy A 48 PHE HBy 1.0 . 5.38 842 754 A 49 VAL H A 48 PHE HBx 1.0 . 4.50 843 755 A 6 LEU H A 46 PHE HBx 1.0 . 5.26 844 756 A 83 LYS HEy A 83 LYS HGx 1.0 . 3.33 845 756 A 83 LYS HGy A 83 LYS HEy 1.0 . 3.33 846 757 A 9 LEU HBy A 45 GLY H 1.0 . 5.31 847 758 A 45 GLY HAx A 9 LEU HBy 1.0 . 3.92 848 759 A 10 PRO HDx A 9 LEU HBy 1.0 . 4.40 849 760 A 9 LEU HBy A 9 LEU HDy% 1.0 . 3.91 850 761 A 9 LEU HBx A 45 GLY H 1.0 . 5.14 851 762 A 45 GLY HAx A 9 LEU HBx 1.0 . 3.87 852 763 A 9 LEU HBx A 9 LEU HDy% 1.0 . 3.90 853 764 A 46 PHE HBy A 47 ALA H 1.0 . 3.77 854 765 A 46 PHE HBy A 7 ARG HBx 1.0 . 4.97 855 765 A 46 PHE HBy A 7 ARG HBy 1.0 . 4.97 856 766 A 46 PHE HBy A 9 LEU HDy% 1.0 . 5.50 857 767 A 38 LYS HBx A 38 LYS HEx 1.0 . 4.21 858 767 A 38 LYS HBy A 38 LYS HEx 1.0 . 4.21 859 767 A 38 LYS HEy A 38 LYS HBx 1.0 . 4.21 860 767 A 38 LYS HBy A 38 LYS HEy 1.0 . 4.21 861 768 A 38 LYS HEx A 38 LYS HGx 1.0 . 3.60 862 768 A 38 LYS HGy A 38 LYS HEx 1.0 . 3.60 863 768 A 38 LYS HGy A 38 LYS HEy 1.0 . 3.60 864 768 A 38 LYS HEy A 38 LYS HGx 1.0 . 3.60 865 769 A 46 PHE HBx A 7 ARG HA 1.0 . 4.10 866 770 A 9 LEU HBx A 46 PHE HA 1.0 . 5.11 867 771 A 30 ARG H A 51 PHE HBy 1.0 . 5.40 868 772 A 70 ILE HG2% A 17 ASP HBy 1.0 . 3.95 869 773 A 17 ASP HBy A 14 THR HA 1.0 . 5.25 870 774 A 14 THR H A 17 ASP HBx 1.0 . 3.88 871 775 A 18 ILE H A 17 ASP HBx 1.0 . 3.99 872 776 A 17 ASP HBx A 13 ALA HB% 1.0 . 4.44 873 777 A 70 ILE HG2% A 17 ASP HBx 1.0 . 3.70 874 778 A 52 SER H A 51 PHE HBy 1.0 . 4.22 875 779 A 51 PHE H A 51 PHE HBy 1.0 . 3.92 876 780 A 57 ALA H A 51 PHE HBy 1.0 . 4.40 877 781 A 53 HIS H A 51 PHE HBx 1.0 . 4.42 878 782 A 51 PHE HD% A 56 ASP HBy 1.0 . 3.96 879 783 A 57 ALA H A 56 ASP HBy 1.0 . 4.00 880 784 A 56 ASP HBy A 51 PHE HBy 1.0 . 4.08 881 785 A 81 ASP HBy A 82 PRO HA 1.0 . 5.21 882 786 A 81 ASP HBy A 82 PRO HDx 1.0 . 3.64 883 787 A 56 ASP HBx A 51 PHE HBy 1.0 . 4.24 884 788 A 56 ASP HBx A 27 VAL HGx% 1.0 . 4.34 885 788 A 27 VAL HGy% A 56 ASP HBx 1.0 . 4.34 886 789 A 57 ALA H A 56 ASP HBx 1.0 . 4.01 887 790 A 56 ASP HBx A 27 VAL HB 1.0 . 5.12 888 791 A 90 TRP H A 89 ASP HBx 1.0 . 4.40 889 792 A 81 ASP HBx A 82 PRO HDx 1.0 . 3.78 890 793 A 22 LEU HBy A 29 ALA HA 1.0 . 5.38 891 794 A 22 LEU HBy A 23 GLN HA 1.0 . 5.28 892 795 A 22 LEU HBy A 27 VAL HGx% 1.0 . 4.80 893 795 A 27 VAL HGy% A 22 LEU HBy 1.0 . 4.80 894 796 A 22 LEU HBx A 23 GLN H 1.0 . 4.03 895 797 A 22 LEU HBx A 22 LEU HDy% 1.0 . 4.02 896 798 A 22 LEU HBx A 29 ALA HA 1.0 . 5.32 897 799 A 89 ASP H A 89 ASP HBx 1.0 . 3.46 898 800 A 64 ASN HBx A 77 MET HE% 1.0 . 4.53 899 801 A 66 HIS H A 64 ASN HBy 1.0 . 5.50 900 802 A 64 ASN H A 64 ASN HBy 1.0 . 3.88 901 803 A 64 ASN HBy A 77 MET HE% 1.0 . 4.84 902 804 A 16 ASP H A 16 ASP HBy 1.0 . 3.41 903 805 A 17 ASP H A 16 ASP HBy 1.0 . 4.06 904 806 A 17 ASP H A 16 ASP HBx 1.0 . 4.06 905 807 A 19 ARG HBx A 16 ASP HBx 1.0 . 5.10 906 808 A 15 GLU H A 16 ASP HBx 1.0 . 5.19 907 809 A 63 ALA H A 64 ASN HBx 1.0 . 5.45 908 810 A 64 ASN HBx A 64 ASN HD2y 1.0 . 3.76 909 811 A 64 ASN H A 64 ASN HBx 1.0 . 3.53 910 812 A 64 ASN HBx A 68 LEU HDy% 1.0 . 4.61 911 813 A 66 HIS H A 64 ASN HBx 1.0 . 5.04 912 814 A 14 THR HG2% A 16 ASP HBy 1.0 . 5.16 913 815 A 69 ASN HBx A 68 LEU HBx 1.0 . 4.59 914 815 A 68 LEU HBy A 69 ASN HBx 1.0 . 4.59 915 816 A 69 ASN HBx A 68 LEU HA 1.0 . 4.16 916 817 A 69 ASN H A 69 ASN HBy 1.0 . 3.32 917 818 A 69 ASN H A 69 ASN HBx 1.0 . 3.27 918 819 A 70 ILE H A 69 ASN HBx 1.0 . 4.66 919 820 A 70 ILE HD1% A 69 ASN HBx 1.0 . 5.50 920 821 A 71 LEU H A 70 ILE HB 1.0 . 4.59 921 822 A 69 ASN HA A 70 ILE HB 1.0 . 4.69 922 823 A 70 ILE HB A 9 LEU HA 1.0 . 5.21 923 824 A 73 GLN H A 71 LEU HBy 1.0 . 5.44 924 825 A 71 LEU HBx A 70 ILE HA 1.0 . 5.50 925 826 A 71 LEU HDy% A 71 LEU HBx 1.0 . 3.47 926 827 A 38 LYS H A 37 ASN HBy 1.0 . 4.86 927 828 A 38 LYS H A 37 ASN HBx 1.0 . 4.84 928 829 A 37 ASN HBx A 41 GLY H 1.0 . 5.15 929 830 A 37 ASN HBx A 42 GLN H 1.0 . 4.68 930 831 A 37 ASN HBx A 38 LYS HDx 1.0 . 5.50 931 831 A 38 LYS HDy A 37 ASN HBx 1.0 . 5.50 932 832 A 37 ASN HBx A 36 ARG HBy 1.0 . 5.50 933 833 A 42 GLN HBy A 37 ASN HBx 1.0 . 5.48 934 834 A 4 VAL H A 3 ILE HB 1.0 . 4.79 935 835 A 3 ILE HB A 81 ASP HA 1.0 . 4.99 936 836 A 3 ILE HB A 80 SER HBx 1.0 . 3.60 937 837 A 1 SER HBx A 79 TYR HBy 1.0 . 4.09 938 838 A 79 TYR HBy A 61 MET HE% 1.0 . 5.50 939 839 A 78 HIS HA A 79 TYR HBx 1.0 . 4.92 940 840 A 79 TYR HBx A 80 SER H 1.0 . 4.52 941 841 A 1 SER HBx A 79 TYR HBx 1.0 . 4.42 942 842 A 79 TYR HBx A 61 MET HE% 1.0 . 5.50 943 843 A 87 ASN H A 87 ASN HBy 1.0 . 3.63 944 844 A 87 ASN HD2y A 87 ASN HBy 1.0 . 3.98 945 845 A 86 ILE HG2% A 87 ASN HBy 1.0 . 5.30 946 846 A 87 ASN HBx A 87 ASN HD2y 1.0 . 4.03 947 847 A 87 ASN H A 87 ASN HBx 1.0 . 3.67 948 848 A 88 GLU HGy A 87 ASN HBy 1.0 . 5.50 949 848 A 87 ASN HBy A 88 GLU HGx 1.0 . 5.50 950 849 A 15 GLU HGx A 34 LEU HBx 1.0 . 4.09 951 850 A 15 GLU HGx A 16 ASP HA 1.0 . 5.44 952 851 A 15 GLU H A 15 GLU HGy 1.0 . 4.26 953 852 A 34 LEU H A 15 GLU HGy 1.0 . 4.45 954 853 A 16 ASP H A 15 GLU HGy 1.0 . 5.37 955 854 A 33 ARG HA A 15 GLU HGy 1.0 . 4.59 956 855 A 34 LEU HBx A 15 GLU HGy 1.0 . 4.55 957 856 A 15 GLU HGy A 34 LEU HDy% 1.0 . 4.15 958 856 A 15 GLU HGy A 34 LEU HDx% 1.0 . 4.15 959 857 A 15 GLU HGx A 16 ASP H 1.0 . 5.19 960 858 A 19 ARG H A 18 ILE HB 1.0 . 3.49 961 859 A 15 GLU HA A 18 ILE HB 1.0 . 3.74 962 860 A 17 ASP HBy A 18 ILE HB 1.0 . 5.28 963 861 A 78 HIS HA A 77 MET HGy 1.0 . 5.50 964 862 A 78 HIS H A 77 MET HGy 1.0 . 4.63 965 863 A 61 MET HE% A 77 MET HGy 1.0 . 4.68 966 864 A 77 MET HE% A 77 MET HGy 1.0 . 4.48 967 865 A 77 MET H A 77 MET HGy 1.0 . 4.45 968 866 A 77 MET HGy A 66 HIS HA 1.0 . 4.33 969 867 A 77 MET HGy A 66 HIS HBx 1.0 . 5.19 970 868 A 6 LEU HDy% A 77 MET HGx 1.0 . 4.75 971 869 A 77 MET H A 77 MET HGx 1.0 . 4.17 972 870 A 4 VAL HGy% A 77 MET HGx 1.0 . 5.02 973 871 A 51 PHE H A 2 ASN HBy 1.0 . 4.41 974 872 A 2 ASN HBy A 2 ASN HD2x 1.0 . 3.99 975 873 A 2 ASN HBy A 57 ALA HB% 1.0 . 5.26 976 874 A 51 PHE HD% A 2 ASN HBx 1.0 . 5.50 977 875 A 51 PHE H A 2 ASN HBx 1.0 . 4.69 978 876 A 2 ASN HBx A 2 ASN HD2y 1.0 . 3.95 979 877 A 61 MET HE% A 62 GLU HGx 1.0 . 5.50 980 877 A 62 GLU HGy A 61 MET HE% 1.0 . 5.50 981 878 A 32 VAL H A 31 GLU HGx 1.0 . 3.95 982 879 A 31 GLU HGx A 31 GLU HA 1.0 . 3.74 983 880 A 31 GLU H A 31 GLU HGx 1.0 . 5.03 984 881 A 62 GLU HBx A 62 GLU HGx 1.0 . 2.90 985 881 A 62 GLU HGy A 62 GLU HBx 1.0 . 2.90 986 882 A 61 MET HBx A 62 GLU HGx 1.0 . 4.69 987 882 A 62 GLU HGy A 61 MET HBx 1.0 . 4.69 988 883 A 50 GLU HGy A 50 GLU HA 1.0 . 4.07 989 884 A 50 GLU HGy A 3 ILE HG1x 1.0 . 4.10 990 885 A 3 ILE HA A 50 GLU HGy 1.0 . 5.22 991 886 A 50 GLU H A 50 GLU HGx 1.0 . 4.40 992 887 A 2 ASN HD2y A 50 GLU HGx 1.0 . 5.50 993 888 A 48 PHE HE% A 5 MET HBx 1.0 . 4.60 994 888 A 5 MET HBy A 48 PHE HE% 1.0 . 4.60 995 889 A 80 SER HBx A 5 MET HBx 1.0 . 3.93 996 889 A 5 MET HBy A 80 SER HBx 1.0 . 3.93 997 890 A 4 VAL HB A 51 PHE HZ 1.0 . 5.50 998 891 A 4 VAL H A 4 VAL HB 1.0 . 3.46 999 892 A 4 VAL HB A 60 TRP HZ3 1.0 . 3.44 1000 893 A 4 VAL HB A 3 ILE HA 1.0 . 4.85 1001 894 A 4 VAL HB A 49 VAL HGy% 1.0 . 4.75 1002 895 A 75 VAL H A 75 VAL HB 1.0 . 3.38 1003 896 A 67 SER HA A 75 VAL HB 1.0 . 5.40 1004 897 A 75 VAL HB A 74 LYS HA 1.0 . 4.68 1005 898 A 27 VAL HB A 22 LEU HA 1.0 . 4.17 1006 899 A 22 LEU HDy% A 27 VAL HB 1.0 . 4.25 1007 900 A 35 MET HBy A 34 LEU HDy% 1.0 . 4.15 1008 900 A 35 MET HBy A 34 LEU HDx% 1.0 . 4.15 1009 901 A 35 MET HBy A 14 THR HA 1.0 . 5.11 1010 902 A 35 MET HBx A 34 LEU HDy% 1.0 . 4.17 1011 902 A 35 MET HBx A 34 LEU HDx% 1.0 . 4.17 1012 903 A 11 GLN H A 11 GLN HGx 1.0 . 4.44 1013 903 A 11 GLN H A 11 GLN HGy 1.0 . 4.44 1014 904 A 12 ALA HB% A 11 GLN HGx 1.0 . 5.50 1015 904 A 11 GLN HGy A 12 ALA HB% 1.0 . 5.50 1016 905 A 65 GLN H A 65 GLN HGy 1.0 . 3.89 1017 906 A 65 GLN HA A 65 GLN HGy 1.0 . 3.62 1018 907 A 65 GLN H A 65 GLN HGx 1.0 . 4.03 1019 908 A 65 GLN HGx A 64 ASN HA 1.0 . 5.50 1020 909 A 21 GLN HGy A 21 GLN HA 1.0 . 3.94 1021 910 A 18 ILE HA A 21 GLN HGy 1.0 . 4.85 1022 911 A 70 ILE HG1y A 21 GLN HGy 1.0 . 5.50 1023 912 A 70 ILE HG1x A 21 GLN HGy 1.0 . 5.50 1024 913 A 55 GLN H A 55 GLN HGx 1.0 . 4.18 1025 913 A 55 GLN HGy A 55 GLN H 1.0 . 4.18 1026 914 A 56 ASP H A 55 GLN HGx 1.0 . 4.42 1027 914 A 56 ASP H A 55 GLN HGy 1.0 . 4.42 1028 915 A 55 GLN HBy A 55 GLN HGx 1.0 . 2.82 1029 915 A 55 GLN HBx A 55 GLN HGx 1.0 . 2.82 1030 915 A 55 GLN HGy A 55 GLN HBx 1.0 . 2.82 1031 915 A 55 GLN HBy A 55 GLN HGy 1.0 . 2.82 1032 916 A 10 PRO HDy A 73 GLN HGy 1.0 . 4.75 1033 917 A 21 GLN H A 21 GLN HGx 1.0 . 4.01 1034 918 A 70 ILE HG1y A 21 GLN HGx 1.0 . 5.14 1035 919 A 70 ILE HD1% A 21 GLN HGx 1.0 . 3.77 1036 920 A 18 ILE HA A 21 GLN HGx 1.0 . 5.04 1037 921 A 7 ARG HDx A 7 ARG HBx 1.0 . 4.06 1038 921 A 7 ARG HBy A 7 ARG HDx 1.0 . 4.06 1039 922 A 50 GLU H A 31 GLU HBx 1.0 . 4.66 1040 923 A 31 GLU H A 31 GLU HBx 1.0 . 4.01 1041 924 A 23 GLN H A 23 GLN HGy 1.0 . 4.09 1042 925 A 23 GLN HGy A 23 GLN HA 1.0 . 3.76 1043 926 A 23 GLN H A 23 GLN HGx 1.0 . 5.18 1044 927 A 73 GLN HA A 73 GLN HGy 1.0 . 4.04 1045 928 A 43 SER H A 42 GLN HGx 1.0 . 4.38 1046 928 A 42 GLN HGy A 43 SER H 1.0 . 4.38 1047 929 A 33 ARG HA A 42 GLN HGx 1.0 . 4.23 1048 929 A 33 ARG HA A 42 GLN HGy 1.0 . 4.23 1049 930 A 42 GLN HA A 42 GLN HGx 1.0 . 3.39 1050 930 A 42 GLN HGy A 42 GLN HA 1.0 . 3.39 1051 931 A 40 SER HBy A 42 GLN HGx 1.0 . 4.09 1052 931 A 40 SER HBy A 42 GLN HGy 1.0 . 4.09 1053 932 A 10 PRO HDy A 73 GLN HGx 1.0 . 4.63 1054 933 A 28 GLN HBy A 28 GLN HGx 1.0 . 2.93 1055 933 A 28 GLN HGy A 28 GLN HBx 1.0 . 2.93 1056 933 A 28 GLN HGy A 28 GLN HBy 1.0 . 2.93 1057 933 A 28 GLN HBx A 28 GLN HGx 1.0 . 2.93 1058 934 A 51 PHE HD% A 49 VAL HB 1.0 . 5.18 1059 935 A 28 GLN H A 28 GLN HGx 1.0 . 3.64 1060 935 A 28 GLN HGy A 28 GLN H 1.0 . 3.64 1061 936 A 4 VAL H A 49 VAL HB 1.0 . 4.43 1062 937 A 50 GLU H A 49 VAL HB 1.0 . 5.34 1063 938 A 49 VAL HB A 4 VAL HGx% 1.0 . 5.08 1064 939 A 36 ARG H A 36 ARG HBy 1.0 . 3.98 1065 940 A 36 ARG HDy A 36 ARG HBy 1.0 . 3.68 1066 941 A 37 ASN H A 36 ARG HBx 1.0 . 4.34 1067 942 A 37 ASN HA A 36 ARG HBx 1.0 . 5.31 1068 943 A 36 ARG HDy A 36 ARG HBx 1.0 . 3.85 1069 944 A 66 HIS HD2 A 61 MET HBy 1.0 . 4.82 1070 945 A 62 GLU H A 61 MET HBy 1.0 . 3.77 1071 946 A 4 VAL HGy% A 61 MET HBy 1.0 . 5.50 1072 947 A 61 MET HE% A 61 MET HBy 1.0 . 4.39 1073 948 A 61 MET HBy A 77 MET HE% 1.0 . 5.50 1074 949 A 61 MET HBx A 61 MET HE% 1.0 . 4.25 1075 950 A 61 MET HBx A 77 MET HE% 1.0 . 5.34 1076 951 A 5 MET H A 78 HIS HBy 1.0 . 4.98 1077 952 A 61 MET HBx A 62 GLU HA 1.0 . 4.83 1078 953 A 61 MET HBx A 61 MET H 1.0 . 3.82 1079 954 A 79 TYR H A 78 HIS HBy 1.0 . 4.01 1080 955 A 78 HIS H A 78 HIS HBy 1.0 . 3.99 1081 956 A 78 HIS HBy A 5 MET HE% 1.0 . 5.36 1082 957 A 61 MET HE% A 78 HIS HBy 1.0 . 5.50 1083 958 A 79 TYR H A 78 HIS HBx 1.0 . 4.46 1084 959 A 78 HIS HBx A 5 MET HBx 1.0 . 3.84 1085 959 A 5 MET HBy A 78 HIS HBx 1.0 . 3.84 1086 960 A 5 MET H A 78 HIS HBx 1.0 . 4.74 1087 961 A 78 HIS HBx A 5 MET HGy 1.0 . 5.50 1088 962 A 78 HIS HBx A 5 MET HE% 1.0 . 5.06 1089 963 A 33 ARG HBx A 33 ARG HDx 1.0 . 3.90 1090 963 A 33 ARG HBy A 33 ARG HDx 1.0 . 3.90 1091 963 A 33 ARG HDy A 33 ARG HBx 1.0 . 3.90 1092 963 A 33 ARG HBy A 33 ARG HDy 1.0 . 3.90 1093 964 A 48 PHE HBx A 33 ARG HBx 1.0 . 3.78 1094 964 A 48 PHE HBx A 33 ARG HBy 1.0 . 3.78 1095 965 A 8 MET HA A 8 MET HGy 1.0 . 3.77 1096 966 A 75 VAL HGx% A 8 MET HGy 1.0 . 5.50 1097 967 A 76 SER H A 8 MET HGx 1.0 . 5.26 1098 968 A 48 PHE HD% A 33 ARG HBx 1.0 . 4.48 1099 968 A 48 PHE HD% A 33 ARG HBy 1.0 . 4.48 1100 969 A 47 ALA HB% A 33 ARG HBx 1.0 . 5.39 1101 969 A 33 ARG HBy A 47 ALA HB% 1.0 . 5.39 1102 970 A 75 VAL HA A 8 MET HGy 1.0 . 4.95 1103 971 A 8 MET H A 8 MET HGy 1.0 . 4.24 1104 972 A 76 SER H A 8 MET HGy 1.0 . 5.30 1105 973 A 8 MET HGy A 7 ARG HBx 1.0 . 4.28 1106 973 A 7 ARG HBy A 8 MET HGy 1.0 . 4.28 1107 974 A 8 MET HGy A 7 ARG HGx 1.0 . 5.22 1108 974 A 7 ARG HGy A 8 MET HGy 1.0 . 5.22 1109 975 A 8 MET HGx A 7 ARG HGx 1.0 . 5.50 1110 975 A 7 ARG HGy A 8 MET HGx 1.0 . 5.50 1111 976 A 8 MET H A 8 MET HGx 1.0 . 4.25 1112 977 A 7 ARG HA A 8 MET HGx 1.0 . 5.41 1113 978 A 75 VAL HA A 8 MET HGx 1.0 . 5.12 1114 979 A 8 MET HGx A 7 ARG HBx 1.0 . 4.37 1115 979 A 7 ARG HBy A 8 MET HGx 1.0 . 4.37 1116 980 A 75 VAL HGx% A 8 MET HGx 1.0 . 5.50 1117 981 A 32 VAL H A 33 ARG HBx 1.0 . 5.50 1118 981 A 33 ARG HBy A 32 VAL H 1.0 . 5.50 1119 982 A 86 ILE H A 85 LYS HBy 1.0 . 4.21 1120 983 A 86 ILE H A 85 LYS HBx 1.0 . 4.47 1121 984 A 85 LYS H A 85 LYS HBy 1.0 . 3.57 1122 985 A 74 LYS H A 74 LYS HBy 1.0 . 3.06 1123 985 A 74 LYS H A 74 LYS HBx 1.0 . 3.06 1124 986 A 69 ASN HA A 74 LYS HBy 1.0 . 5.16 1125 986 A 69 ASN HA A 74 LYS HBx 1.0 . 5.16 1126 987 A 83 LYS HBx A 82 PRO HA 1.0 . 5.01 1127 988 A 84 PRO HDy A 83 LYS HBy 1.0 . 4.35 1128 989 A 84 PRO HDx A 83 LYS HBy 1.0 . 4.18 1129 990 A 83 LYS HEy A 83 LYS HBy 1.0 . 4.63 1130 991 A 75 VAL H A 74 LYS HBy 1.0 . 4.19 1131 991 A 75 VAL H A 74 LYS HBx 1.0 . 4.19 1132 992 A 84 PRO HDy A 83 LYS HBx 1.0 . 4.58 1133 993 A 84 PRO HDx A 83 LYS HBx 1.0 . 4.36 1134 994 A 50 GLU HBy A 2 ASN HD2x 1.0 . 5.50 1135 995 A 84 PRO HBx A 86 ILE HD1% 1.0 . 5.11 1136 996 A 3 ILE HD1% A 82 PRO HBy 1.0 . 4.48 1137 997 A 80 SER HBx A 5 MET HGx 1.0 . 4.31 1138 998 A 50 GLU H A 50 GLU HBx 1.0 . 3.86 1139 999 A 46 PHE HD% A 44 ARG HBy 1.0 . 4.35 1140 1000 A 46 PHE HD% A 5 MET HGy 1.0 . 4.36 1141 1001 A 35 MET HGx A 35 MET HA 1.0 . 3.75 1142 1002 A 35 MET HGx A 34 LEU HDy% 1.0 . 4.88 1143 1002 A 35 MET HGx A 34 LEU HDx% 1.0 . 4.88 1144 1003 A 62 GLU H A 61 MET HGx 1.0 . 4.31 1145 1003 A 62 GLU H A 61 MET HGy 1.0 . 4.31 1146 1004 A 61 MET H A 61 MET HGx 1.0 . 3.55 1147 1004 A 61 MET H A 61 MET HGy 1.0 . 3.55 1148 1005 A 60 TRP H A 61 MET HGx 1.0 . 5.46 1149 1005 A 60 TRP H A 61 MET HGy 1.0 . 5.46 1150 1006 A 60 TRP HE3 A 61 MET HGx 1.0 . 4.96 1151 1006 A 60 TRP HE3 A 61 MET HGy 1.0 . 4.96 1152 1007 A 60 TRP HBy A 61 MET HGx 1.0 . 5.15 1153 1007 A 60 TRP HBy A 61 MET HGy 1.0 . 5.15 1154 1008 A 4 VAL HGx% A 61 MET HGx 1.0 . 4.24 1155 1008 A 4 VAL HGx% A 61 MET HGy 1.0 . 4.24 1156 1009 A 4 VAL HGy% A 61 MET HGx 1.0 . 4.84 1157 1009 A 4 VAL HGy% A 61 MET HGy 1.0 . 4.84 1158 1010 A 61 MET HE% A 61 MET HGx 1.0 . 4.04 1159 1010 A 61 MET HE% A 61 MET HGy 1.0 . 4.04 1160 1011 A 77 MET HE% A 61 MET HGx 1.0 . 4.34 1161 1011 A 77 MET HE% A 61 MET HGy 1.0 . 4.34 1162 1012 A 79 TYR HE% A 61 MET HGx 1.0 . 4.07 1163 1012 A 79 TYR HE% A 61 MET HGy 1.0 . 4.07 1164 1013 A 58 THR HA A 61 MET HGx 1.0 . 4.42 1165 1013 A 58 THR HA A 61 MET HGy 1.0 . 4.42 1166 1014 A 57 ALA HA A 61 MET HGx 1.0 . 5.13 1167 1014 A 57 ALA HA A 61 MET HGy 1.0 . 5.13 1168 1015 A 13 ALA H A 10 PRO HBx 1.0 . 3.67 1169 1016 A 5 MET H A 5 MET HGx 1.0 . 4.80 1170 1017 A 48 PHE HD% A 5 MET HGx 1.0 . 5.50 1171 1018 A 11 GLN H A 10 PRO HBy 1.0 . 4.26 1172 1019 A 12 ALA H A 10 PRO HBy 1.0 . 4.47 1173 1020 A 13 ALA H A 10 PRO HBy 1.0 . 4.57 1174 1021 A 13 ALA HB% A 10 PRO HBy 1.0 . 5.38 1175 1022 A 71 LEU HDy% A 10 PRO HBy 1.0 . 4.53 1176 1023 A 6 LEU H A 5 MET HGy 1.0 . 3.97 1177 1024 A 5 MET HGy A 5 MET HA 1.0 . 3.92 1178 1025 A 5 MET H A 5 MET HGy 1.0 . 4.76 1179 1026 A 48 PHE HA A 5 MET HGy 1.0 . 5.25 1180 1027 A 71 LEU HDy% A 10 PRO HBx 1.0 . 3.93 1181 1028 A 11 GLN H A 10 PRO HBx 1.0 . 3.97 1182 1029 A 46 PHE HD% A 5 MET HGx 1.0 . 5.32 1183 1030 A 5 MET HA A 5 MET HGx 1.0 . 4.13 1184 1031 A 53 HIS HBy A 55 GLN HBx 1.0 . 4.54 1185 1031 A 55 GLN HBy A 53 HIS HBy 1.0 . 4.54 1186 1032 A 56 ASP H A 53 HIS HBy 1.0 . 3.92 1187 1033 A 53 HIS HBy A 55 GLN HGx 1.0 . 4.91 1188 1033 A 55 GLN HGy A 53 HIS HBy 1.0 . 4.91 1189 1034 A 53 HIS HBx A 55 GLN HGx 1.0 . 5.30 1190 1034 A 55 GLN HGy A 53 HIS HBx 1.0 . 5.30 1191 1035 A 53 HIS HBx A 55 GLN HBx 1.0 . 4.91 1192 1035 A 55 GLN HBy A 53 HIS HBx 1.0 . 4.91 1193 1036 A 44 ARG H A 44 ARG HBy 1.0 . 4.18 1194 1037 A 46 PHE HBy A 5 MET HGy 1.0 . 5.09 1195 1038 A 80 SER HBy A 5 MET HGy 1.0 . 5.37 1196 1039 A 14 THR HB A 34 LEU HDy% 1.0 . 5.22 1197 1039 A 14 THR HB A 34 LEU HDx% 1.0 . 5.22 1198 1040 A 53 HIS H A 53 HIS HBy 1.0 . 3.93 1199 1041 A 10 PRO HDy A 73 GLN HBy 1.0 . 4.22 1200 1042 A 10 PRO HDx A 73 GLN HBy 1.0 . 5.28 1201 1043 A 73 GLN HBy A 75 VAL HGy% 1.0 . 5.09 1202 1044 A 74 LYS H A 73 GLN HBx 1.0 . 4.14 1203 1045 A 14 THR HB A 15 GLU HBy 1.0 . 4.82 1204 1046 A 15 GLU H A 14 THR HB 1.0 . 3.07 1205 1047 A 60 TRP HE1 A 25 HIS HBy 1.0 . 5.14 1206 1048 A 60 TRP HE1 A 25 HIS HBx 1.0 . 4.88 1207 1049 A 25 HIS HBx A 22 LEU HA 1.0 . 4.15 1208 1050 A 25 HIS HBx A 27 VAL HGx% 1.0 . 4.07 1209 1050 A 27 VAL HGy% A 25 HIS HBx 1.0 . 4.07 1210 1051 A 22 LEU HDy% A 25 HIS HBx 1.0 . 5.50 1211 1052 A 77 MET H A 77 MET HBy 1.0 . 3.91 1212 1053 A 77 MET HBy A 66 HIS HA 1.0 . 4.83 1213 1054 A 77 MET HBy A 77 MET HE% 1.0 . 4.85 1214 1055 A 77 MET HE% A 77 MET HBx 1.0 . 4.14 1215 1056 A 14 THR HB A 16 ASP HBx 1.0 . 4.48 1216 1057 A 30 ARG HBy A 51 PHE HA 1.0 . 4.84 1217 1058 A 66 HIS HA A 77 MET HBx 1.0 . 4.79 1218 1059 A 4 VAL HA A 77 MET HBx 1.0 . 5.41 1219 1060 A 31 GLU H A 30 ARG HBy 1.0 . 4.03 1220 1061 A 59 ARG HBy A 27 VAL HGx% 1.0 . 5.22 1221 1061 A 27 VAL HGy% A 59 ARG HBy 1.0 . 5.22 1222 1062 A 42 GLN HBy A 37 ASN HBy 1.0 . 4.84 1223 1063 A 59 ARG HBy A 60 TRP H 1.0 . 3.98 1224 1064 A 59 ARG HBy A 59 ARG HDx 1.0 . 3.80 1225 1065 A 59 ARG H A 59 ARG HBx 1.0 . 3.39 1226 1066 A 19 ARG HDy A 19 ARG HBy 1.0 . 3.57 1227 1067 A 19 ARG H A 19 ARG HBy 1.0 . 3.77 1228 1068 A 20 GLY H A 19 ARG HBy 1.0 . 4.26 1229 1069 A 60 TRP H A 59 ARG HBx 1.0 . 3.96 1230 1070 A 56 ASP HA A 59 ARG HBx 1.0 . 3.41 1231 1071 A 22 LEU HDx% A 19 ARG HBy 1.0 . 5.50 1232 1072 A 18 ILE HG2% A 19 ARG HBx 1.0 . 5.29 1233 1073 A 37 ASN HBy A 42 GLN HBx 1.0 . 4.70 1234 1074 A 42 GLN H A 42 GLN HBx 1.0 . 3.55 1235 1075 A 33 ARG HA A 42 GLN HBx 1.0 . 3.74 1236 1076 A 19 ARG HA A 19 ARG HGy 1.0 . 3.92 1237 1077 A 20 GLY H A 19 ARG HGx 1.0 . 5.25 1238 1078 A 19 ARG HGx A 16 ASP HA 1.0 . 4.66 1239 1079 A 19 ARG HGy A 32 VAL HGx% 1.0 . 4.53 1240 1080 A 22 LEU HDx% A 19 ARG HGy 1.0 . 5.17 1241 1081 A 22 LEU HDx% A 19 ARG HGx 1.0 . 4.73 1242 1082 A 90 TRP H A 90 TRP HBy 1.0 . 3.69 1243 1083 A 90 TRP HBy A 90 TRP HE3 1.0 . 3.84 1244 1084 A 91 LEU HDy% A 90 TRP HBy 1.0 . 5.31 1245 1085 A 91 LEU HDy% A 90 TRP HBx 1.0 . 5.49 1246 1086 A 38 LYS HBx A 38 LYS HDx 1.0 . 3.06 1247 1086 A 38 LYS HBy A 38 LYS HDx 1.0 . 3.06 1248 1086 A 38 LYS HDy A 38 LYS HBx 1.0 . 3.06 1249 1086 A 38 LYS HBy A 38 LYS HDy 1.0 . 3.06 1250 1087 A 74 LYS HA A 74 LYS HDx 1.0 . 4.72 1251 1087 A 74 LYS HA A 74 LYS HDy 1.0 . 4.72 1252 1088 A 74 LYS H A 74 LYS HDx 1.0 . 4.59 1253 1088 A 74 LYS H A 74 LYS HDy 1.0 . 4.59 1254 1089 A 63 ALA H A 62 GLU HBy 1.0 . 4.01 1255 1090 A 37 ASN HA A 38 LYS HDx 1.0 . 5.50 1256 1090 A 38 LYS HDy A 37 ASN HA 1.0 . 5.50 1257 1091 A 38 LYS HDy A 38 LYS HGx 1.0 . 2.63 1258 1091 A 38 LYS HDx A 38 LYS HGx 1.0 . 2.63 1259 1091 A 38 LYS HGy A 38 LYS HDx 1.0 . 2.63 1260 1091 A 38 LYS HGy A 38 LYS HDy 1.0 . 2.63 1261 1092 A 85 LYS HA A 83 LYS HDx 1.0 . 4.38 1262 1092 A 83 LYS HDy A 85 LYS HA 1.0 . 4.38 1263 1093 A 8 MET HBy A 8 MET HE% 1.0 . 5.01 1264 1094 A 75 VAL HGx% A 8 MET HBy 1.0 . 4.71 1265 1095 A 8 MET HBx A 8 MET HE% 1.0 . 3.98 1266 1096 A 75 VAL HGx% A 8 MET HBx 1.0 . 5.11 1267 1097 A 76 SER H A 8 MET HBx 1.0 . 4.80 1268 1098 A 75 VAL HA A 8 MET HBx 1.0 . 4.16 1269 1099 A 15 GLU HBy A 34 LEU HDy% 1.0 . 5.36 1270 1099 A 15 GLU HBy A 34 LEU HDx% 1.0 . 5.36 1271 1100 A 58 THR HG2% A 62 GLU HBy 1.0 . 5.25 1272 1101 A 11 GLN H A 11 GLN HBx 1.0 . 3.60 1273 1101 A 11 GLN H A 11 GLN HBy 1.0 . 3.60 1274 1102 A 12 ALA H A 11 GLN HBx 1.0 . 3.83 1275 1102 A 12 ALA H A 11 GLN HBy 1.0 . 3.83 1276 1103 A 15 GLU H A 15 GLU HBx 1.0 . 3.76 1277 1104 A 16 ASP H A 15 GLU HBx 1.0 . 4.23 1278 1105 A 14 THR HB A 15 GLU HBx 1.0 . 4.61 1279 1106 A 16 ASP HA A 15 GLU HBx 1.0 . 5.19 1280 1107 A 15 GLU HBx A 34 LEU HDy% 1.0 . 4.28 1281 1107 A 34 LEU HDx% A 15 GLU HBx 1.0 . 4.28 1282 1108 A 11 GLN HE2y A 11 GLN HBx 1.0 . 5.26 1283 1108 A 11 GLN HE2y A 11 GLN HBy 1.0 . 5.26 1284 1109 A 4 VAL HGx% A 60 TRP HBy 1.0 . 5.50 1285 1110 A 59 ARG H A 60 TRP HBy 1.0 . 5.49 1286 1111 A 4 VAL HGx% A 60 TRP HBx 1.0 . 5.50 1287 1112 A 59 ARG H A 60 TRP HBx 1.0 . 4.91 1288 1113 A 46 PHE HE% A 7 ARG HGx 1.0 . 5.50 1289 1113 A 7 ARG HGy A 46 PHE HE% 1.0 . 5.50 1290 1114 A 46 PHE HD% A 7 ARG HGx 1.0 . 5.25 1291 1114 A 7 ARG HGy A 46 PHE HD% 1.0 . 5.25 1292 1115 A 46 PHE HBx A 7 ARG HGx 1.0 . 4.90 1293 1115 A 7 ARG HGy A 46 PHE HBx 1.0 . 4.90 1294 1116 A 51 PHE HE% A 60 TRP HBy 1.0 . 4.70 1295 1117 A 60 TRP HBy A 27 VAL HGx% 1.0 . 4.60 1296 1117 A 27 VAL HGy% A 60 TRP HBy 1.0 . 4.60 1297 1118 A 51 PHE HE% A 60 TRP HBx 1.0 . 4.74 1298 1119 A 60 TRP HBx A 61 MET HGx 1.0 . 5.46 1299 1119 A 60 TRP HBx A 61 MET HGy 1.0 . 5.46 1300 1120 A 60 TRP HBx A 22 LEU HDy% 1.0 . 5.49 1301 1121 A 23 GLN HE2y A 23 GLN HBy 1.0 . 5.50 1302 1121 A 23 GLN HE2y A 23 GLN HBx 1.0 . 5.50 1303 1122 A 23 GLN H A 23 GLN HBy 1.0 . 3.23 1304 1122 A 23 GLN H A 23 GLN HBx 1.0 . 3.23 1305 1123 A 24 SER H A 23 GLN HBy 1.0 . 4.12 1306 1123 A 24 SER H A 23 GLN HBx 1.0 . 4.12 1307 1124 A 23 GLN HBy A 24 SER HBx 1.0 . 4.54 1308 1124 A 23 GLN HBx A 24 SER HBx 1.0 . 4.54 1309 1124 A 24 SER HBy A 23 GLN HBy 1.0 . 4.54 1310 1124 A 24 SER HBy A 23 GLN HBx 1.0 . 4.54 1311 1125 A 36 ARG H A 36 ARG HGy 1.0 . 4.48 1312 1126 A 46 PHE HBy A 7 ARG HGx 1.0 . 4.43 1313 1126 A 7 ARG HGy A 46 PHE HBy 1.0 . 4.43 1314 1127 A 5 MET HGy A 7 ARG HGx 1.0 . 4.59 1315 1127 A 7 ARG HGy A 5 MET HGy 1.0 . 4.59 1316 1128 A 36 ARG HGx A 37 ASN H 1.0 . 4.97 1317 1129 A 36 ARG HGx A 34 LEU HDy% 1.0 . 5.09 1318 1129 A 36 ARG HGx A 34 LEU HDx% 1.0 . 5.09 1319 1130 A 19 ARG H A 18 ILE HG1x 1.0 . 5.50 1320 1131 A 20 GLY H A 21 GLN HBx 1.0 . 5.18 1321 1132 A 19 ARG H A 18 ILE HG1y 1.0 . 4.81 1322 1133 A 17 ASP HBx A 18 ILE HG1y 1.0 . 5.30 1323 1134 A 37 ASN H A 36 ARG HGy 1.0 . 5.09 1324 1135 A 60 TRP HE1 A 21 GLN HBy 1.0 . 5.50 1325 1136 A 21 GLN HBy A 21 GLN H 1.0 . 3.89 1326 1137 A 18 ILE HA A 21 GLN HBy 1.0 . 4.67 1327 1138 A 21 GLN HBy A 21 GLN HE2y 1.0 . 4.27 1328 1139 A 22 LEU H A 21 GLN HBx 1.0 . 3.87 1329 1140 A 22 LEU HG A 21 GLN HBx 1.0 . 5.04 1330 1141 A 17 ASP H A 18 ILE HG1y 1.0 . 4.88 1331 1142 A 13 ALA H A 10 PRO HGy 1.0 . 4.75 1332 1143 A 13 ALA HB% A 10 PRO HGy 1.0 . 4.45 1333 1144 A 70 ILE HG2% A 10 PRO HGy 1.0 . 4.04 1334 1145 A 73 GLN H A 10 PRO HGx 1.0 . 5.14 1335 1146 A 71 LEU HDy% A 10 PRO HGx 1.0 . 3.87 1336 1147 A 13 ALA H A 10 PRO HGx 1.0 . 4.64 1337 1148 A 60 TRP H A 59 ARG HGx 1.0 . 4.97 1338 1149 A 4 VAL H A 3 ILE HG1y 1.0 . 5.30 1339 1150 A 3 ILE HA A 3 ILE HG1y 1.0 . 4.07 1340 1151 A 3 ILE HG1y A 50 GLU HA 1.0 . 4.60 1341 1152 A 34 LEU H A 34 LEU HG 1.0 . 4.77 1342 1153 A 34 LEU HA A 34 LEU HG 1.0 . 4.02 1343 1154 A 4 VAL H A 3 ILE HG1x 1.0 . 5.07 1344 1155 A 3 ILE H A 3 ILE HG1x 1.0 . 4.57 1345 1156 A 3 ILE HG1x A 2 ASN HD2x 1.0 . 5.44 1346 1157 A 3 ILE HA A 3 ILE HG1x 1.0 . 4.00 1347 1158 A 3 ILE HG1x A 50 GLU HGx 1.0 . 3.90 1348 1159 A 60 TRP H A 59 ARG HGy 1.0 . 5.20 1349 1160 A 56 ASP HA A 59 ARG HGy 1.0 . 4.99 1350 1161 A 59 ARG HGy A 27 VAL HGx% 1.0 . 5.42 1351 1161 A 27 VAL HGy% A 59 ARG HGy 1.0 . 5.42 1352 1162 A 59 ARG H A 59 ARG HGx 1.0 . 4.62 1353 1163 A 83 LYS H A 82 PRO HGy 1.0 . 4.57 1354 1163 A 83 LYS H A 82 PRO HGx 1.0 . 4.57 1355 1164 A 81 ASP HA A 82 PRO HGy 1.0 . 4.60 1356 1164 A 81 ASP HA A 82 PRO HGx 1.0 . 4.60 1357 1165 A 6 LEU HG A 60 TRP HH2 1.0 . 4.92 1358 1166 A 6 LEU H A 6 LEU HG 1.0 . 4.72 1359 1167 A 33 ARG HA A 33 ARG HGx 1.0 . 3.33 1360 1167 A 33 ARG HA A 33 ARG HGy 1.0 . 3.33 1361 1168 A 85 LYS H A 84 PRO HGx 1.0 . 5.16 1362 1168 A 85 LYS H A 84 PRO HGy 1.0 . 5.16 1363 1169 A 83 LYS HA A 84 PRO HGx 1.0 . 4.46 1364 1169 A 83 LYS HA A 84 PRO HGy 1.0 . 4.46 1365 1170 A 59 ARG H A 58 THR HB 1.0 . 3.82 1366 1171 A 59 ARG HBy A 58 THR HB 1.0 . 4.56 1367 1172 A 61 MET HBx A 58 THR HB 1.0 . 4.93 1368 1173 A 10 PRO HDx A 9 LEU HG 1.0 . 5.29 1369 1174 A 86 ILE HG1y A 86 ILE HA 1.0 . 3.77 1370 1175 A 46 PHE HD% A 9 LEU HDy% 1.0 . 5.50 1371 1176 A 47 ALA H A 9 LEU HDy% 1.0 . 4.16 1372 1177 A 9 LEU H A 9 LEU HDy% 1.0 . 4.02 1373 1178 A 46 PHE H A 9 LEU HDy% 1.0 . 4.80 1374 1179 A 46 PHE HA A 9 LEU HDy% 1.0 . 3.78 1375 1180 A 9 LEU HA A 9 LEU HDy% 1.0 . 4.07 1376 1181 A 45 GLY HAx A 9 LEU HDy% 1.0 . 5.44 1377 1182 A 10 PRO HDx A 9 LEU HDy% 1.0 . 4.49 1378 1183 A 46 PHE HBx A 9 LEU HDy% 1.0 . 5.32 1379 1184 A 6 LEU HBy A 9 LEU HDy% 1.0 . 4.25 1380 1185 A 6 LEU HDx% A 9 LEU HDy% 1.0 . 3.97 1381 1186 A 58 THR HB A 62 GLU HGx 1.0 . 5.40 1382 1186 A 62 GLU HGy A 58 THR HB 1.0 . 5.40 1383 1187 A 46 PHE HA A 9 LEU HG 1.0 . 4.77 1384 1188 A 45 GLY HAx A 9 LEU HG 1.0 . 5.50 1385 1189 A 22 LEU HG A 60 TRP HH2 1.0 . 5.49 1386 1190 A 70 ILE HG1x A 69 ASN H 1.0 . 5.35 1387 1191 A 69 ASN H A 68 LEU HDx% 1.0 . 4.21 1388 1192 A 60 TRP HH2 A 68 LEU HDx% 1.0 . 3.97 1389 1193 A 68 LEU HA A 68 LEU HDx% 1.0 . 4.00 1390 1194 A 21 GLN HBy A 68 LEU HDx% 1.0 . 4.20 1391 1195 A 21 GLN HGx A 68 LEU HDx% 1.0 . 4.10 1392 1196 A 77 MET HE% A 68 LEU HDx% 1.0 . 4.51 1393 1197 A 60 TRP HE1 A 68 LEU HDx% 1.0 . 5.38 1394 1198 A 21 GLN HE2y A 68 LEU HDx% 1.0 . 5.50 1395 1199 A 75 VAL HB A 68 LEU HDx% 1.0 . 4.30 1396 1200 A 22 LEU HDy% A 68 LEU HDx% 1.0 . 5.50 1397 1201 A 70 ILE H A 70 ILE HG1y 1.0 . 4.34 1398 1202 A 70 ILE HG1y A 69 ASN H 1.0 . 5.12 1399 1203 A 70 ILE HG1y A 70 ILE HA 1.0 . 4.00 1400 1204 A 49 VAL HGy% A 22 LEU HG 1.0 . 5.50 1401 1205 A 70 ILE H A 70 ILE HG1x 1.0 . 4.53 1402 1206 A 70 ILE HG1x A 21 GLN HGx 1.0 . 4.85 1403 1207 A 70 ILE HG1x A 69 ASN HA 1.0 . 5.50 1404 1208 A 22 LEU HBy A 22 LEU HDx% 1.0 . 3.19 1405 1209 A 22 LEU HBx A 22 LEU HDx% 1.0 . 3.16 1406 1210 A 49 VAL HGy% A 22 LEU HDx% 1.0 . 3.91 1407 1211 A 19 ARG H A 22 LEU HDx% 1.0 . 4.94 1408 1212 A 29 ALA H A 22 LEU HDx% 1.0 . 4.17 1409 1213 A 22 LEU H A 22 LEU HDx% 1.0 . 3.80 1410 1214 A 22 LEU HDx% A 60 TRP HZ2 1.0 . 5.05 1411 1215 A 22 LEU HDx% A 29 ALA HA 1.0 . 4.48 1412 1216 A 22 LEU HDx% A 19 ARG HA 1.0 . 3.20 1413 1217 A 61 MET HE% A 66 HIS HBy 1.0 . 5.50 1414 1218 A 77 MET HGx A 66 HIS HBy 1.0 . 4.79 1415 1219 A 77 MET H A 66 HIS HBx 1.0 . 5.09 1416 1220 A 61 MET HE% A 66 HIS HBx 1.0 . 5.50 1417 1221 A 77 MET HGx A 66 HIS HBx 1.0 . 4.79 1418 1222 A 22 LEU HDx% A 19 ARG HDx 1.0 . 5.50 1419 1223 A 67 SER H A 66 HIS HBx 1.0 . 5.30 1420 1224 A 68 LEU H A 68 LEU HG 1.0 . 4.12 1421 1225 A 67 SER HA A 68 LEU HG 1.0 . 5.46 1422 1226 A 77 MET HE% A 68 LEU HG 1.0 . 5.01 1423 1227 A 6 LEU H A 6 LEU HDx% 1.0 . 4.49 1424 1228 A 60 TRP HZ2 A 6 LEU HDx% 1.0 . 4.76 1425 1229 A 6 LEU HA A 6 LEU HDx% 1.0 . 4.30 1426 1230 A 47 ALA HB% A 6 LEU HDx% 1.0 . 3.47 1427 1231 A 47 ALA H A 9 LEU HDx% 1.0 . 5.30 1428 1232 A 9 LEU H A 9 LEU HDx% 1.0 . 4.42 1429 1233 A 46 PHE HA A 9 LEU HDx% 1.0 . 4.82 1430 1234 A 9 LEU HA A 9 LEU HDx% 1.0 . 3.36 1431 1235 A 10 PRO HDy A 9 LEU HDx% 1.0 . 4.16 1432 1236 A 10 PRO HDx A 9 LEU HDx% 1.0 . 3.95 1433 1237 A 9 LEU HBy A 9 LEU HDx% 1.0 . 3.23 1434 1238 A 75 VAL HGx% A 9 LEU HDx% 1.0 . 3.25 1435 1239 A 47 ALA H A 6 LEU HDx% 1.0 . 5.35 1436 1240 A 4 VAL HB A 6 LEU HDx% 1.0 . 5.46 1437 1241 A 75 VAL HA A 9 LEU HDx% 1.0 . 5.20 1438 1242 A 71 LEU HDy% A 73 GLN HE2x 1.0 . 4.74 1439 1243 A 71 LEU HDy% A 71 LEU H 1.0 . 4.55 1440 1244 A 71 LEU HDy% A 12 ALA H 1.0 . 4.43 1441 1245 A 71 LEU HDy% A 13 ALA HA 1.0 . 3.25 1442 1246 A 71 LEU HDy% A 13 ALA H 1.0 . 3.87 1443 1247 A 71 LEU HDy% A 71 LEU HA 1.0 . 3.97 1444 1248 A 71 LEU HDy% A 71 LEU HBy 1.0 . 3.27 1445 1249 A 47 ALA HB% A 46 PHE H 1.0 . 5.50 1446 1250 A 46 PHE HD% A 47 ALA HB% 1.0 . 5.50 1447 1251 A 48 PHE HBx A 47 ALA HB% 1.0 . 5.50 1448 1252 A 47 ALA HB% A 9 LEU HDy% 1.0 . 3.19 1449 1253 A 47 ALA HB% A 48 PHE H 1.0 . 3.33 1450 1254 A 47 ALA HB% A 47 ALA H 1.0 . 3.75 1451 1255 A 47 ALA HB% A 46 PHE HA 1.0 . 4.29 1452 1256 A 47 ALA HB% A 34 LEU HA 1.0 . 3.38 1453 1257 A 91 LEU H A 91 LEU HDx% 1.0 . 5.13 1454 1258 A 91 LEU HDx% A 91 LEU HBx 1.0 . 3.36 1455 1258 A 91 LEU HBy A 91 LEU HDx% 1.0 . 3.36 1456 1259 A 75 VAL H A 74 LYS HGy 1.0 . 4.80 1457 1260 A 6 LEU HDy% A 6 LEU H 1.0 . 4.62 1458 1261 A 6 LEU HDy% A 7 ARG H 1.0 . 4.41 1459 1262 A 6 LEU HDy% A 60 TRP HZ2 1.0 . 4.74 1460 1263 A 6 LEU HDy% A 6 LEU HBx 1.0 . 3.56 1461 1264 A 74 LYS HGy A 74 LYS HDx 1.0 . 2.94 1462 1264 A 74 LYS HDy A 74 LYS HGy 1.0 . 2.94 1463 1265 A 74 LYS HGy A 74 LYS HEx 1.0 . 4.22 1464 1265 A 74 LYS HEy A 74 LYS HGy 1.0 . 4.22 1465 1266 A 86 ILE H A 83 LYS HGx 1.0 . 5.43 1466 1266 A 83 LYS HGy A 86 ILE H 1.0 . 5.43 1467 1267 A 74 LYS HA A 74 LYS HGx 1.0 . 3.93 1468 1268 A 74 LYS HGx A 67 SER HBx 1.0 . 4.65 1469 1269 A 75 VAL H A 74 LYS HGx 1.0 . 4.66 1470 1270 A 74 LYS H A 74 LYS HGx 1.0 . 4.45 1471 1271 A 6 LEU HDy% A 60 TRP HZ3 1.0 . 3.60 1472 1272 A 6 LEU HDy% A 6 LEU HA 1.0 . 3.22 1473 1273 A 6 LEU HDy% A 77 MET HA 1.0 . 3.67 1474 1274 A 6 LEU HDy% A 77 MET HE% 1.0 . 4.12 1475 1275 A 83 LYS HDx A 83 LYS HGx 1.0 . 2.86 1476 1275 A 83 LYS HDy A 83 LYS HGx 1.0 . 2.86 1477 1275 A 83 LYS HGy A 83 LYS HDx 1.0 . 2.86 1478 1275 A 83 LYS HGy A 83 LYS HDy 1.0 . 2.86 1479 1276 A 86 ILE HD1% A 83 LYS HGx 1.0 . 5.28 1480 1276 A 83 LYS HGy A 86 ILE HD1% 1.0 . 5.28 1481 1277 A 6 LEU HDy% A 77 MET HBx 1.0 . 3.08 1482 1278 A 84 PRO HDy A 83 LYS HGx 1.0 . 5.21 1483 1278 A 84 PRO HDy A 83 LYS HGy 1.0 . 5.21 1484 1279 A 91 LEU HDy% A 90 TRP HA 1.0 . 5.50 1485 1280 A 79 TYR HBy A 1 SER HBy 1.0 . 4.31 1486 1281 A 1 SER HBy A 3 ILE HB 1.0 . 5.36 1487 1282 A 79 TYR HBx A 1 SER HBy 1.0 . 4.98 1488 1283 A 91 LEU HDy% A 91 LEU HA 1.0 . 3.32 1489 1284 A 40 SER HBx A 42 GLN HGx 1.0 . 5.00 1490 1284 A 42 GLN HGy A 40 SER HBx 1.0 . 5.00 1491 1285 A 67 SER HBy A 68 LEU H 1.0 . 3.99 1492 1286 A 67 SER HBy A 67 SER H 1.0 . 3.86 1493 1287 A 67 SER HBy A 74 LYS HEx 1.0 . 5.16 1494 1287 A 67 SER HBy A 74 LYS HEy 1.0 . 5.16 1495 1288 A 67 SER HBy A 74 LYS HDx 1.0 . 5.15 1496 1288 A 67 SER HBy A 74 LYS HDy 1.0 . 5.15 1497 1289 A 67 SER HBy A 74 LYS HGy 1.0 . 5.50 1498 1290 A 67 SER HBy A 74 LYS HGx 1.0 . 5.50 1499 1291 A 67 SER HBx A 74 LYS HEx 1.0 . 5.46 1500 1291 A 74 LYS HEy A 67 SER HBx 1.0 . 5.46 1501 1292 A 68 LEU H A 67 SER HBx 1.0 . 4.02 1502 1293 A 67 SER H A 67 SER HBx 1.0 . 4.01 1503 1294 A 67 SER HBx A 76 SER HA 1.0 . 4.54 1504 1295 A 74 LYS HGy A 67 SER HBx 1.0 . 5.50 1505 1296 A 18 ILE HA A 22 LEU HG 1.0 . 5.50 1506 1297 A 18 ILE HA A 21 GLN HBx 1.0 . 4.17 1507 1298 A 18 ILE HA A 18 ILE HG1y 1.0 . 3.76 1508 1299 A 18 ILE HA A 18 ILE HG1x 1.0 . 3.01 1509 1300 A 60 TRP HE1 A 68 LEU HDy% 1.0 . 4.77 1510 1301 A 69 ASN H A 68 LEU HDy% 1.0 . 3.89 1511 1302 A 68 LEU HDy% A 60 TRP HZ2 1.0 . 3.85 1512 1303 A 64 ASN HD2x A 68 LEU HDy% 1.0 . 4.76 1513 1304 A 68 LEU HDy% A 68 LEU HA 1.0 . 3.17 1514 1305 A 64 ASN HBy A 68 LEU HDy% 1.0 . 4.02 1515 1306 A 21 GLN HBy A 68 LEU HDy% 1.0 . 3.98 1516 1307 A 77 MET HE% A 68 LEU HDy% 1.0 . 3.74 1517 1308 A 58 THR HA A 61 MET HBy 1.0 . 4.36 1518 1309 A 58 THR HA A 61 MET HBx 1.0 . 3.99 1519 1310 A 22 LEU HDy% A 29 ALA HA 1.0 . 5.04 1520 1311 A 80 SER HBy A 81 ASP H 1.0 . 4.72 1521 1312 A 80 SER HBy A 80 SER HA 1.0 . 2.96 1522 1313 A 80 SER HBy A 5 MET HBx 1.0 . 3.64 1523 1313 A 80 SER HBy A 5 MET HBy 1.0 . 3.64 1524 1314 A 80 SER HBy A 3 ILE HD1% 1.0 . 5.31 1525 1315 A 80 SER HBy A 3 ILE HG2% 1.0 . 3.88 1526 1316 A 81 ASP H A 80 SER HBx 1.0 . 4.57 1527 1317 A 80 SER H A 80 SER HBx 1.0 . 3.65 1528 1318 A 49 VAL HGy% A 49 VAL H 1.0 . 4.52 1529 1319 A 49 VAL HGy% A 50 GLU H 1.0 . 3.68 1530 1320 A 49 VAL HGy% A 49 VAL HA 1.0 . 3.24 1531 1321 A 49 VAL HGy% A 32 VAL HB 1.0 . 4.95 1532 1322 A 49 VAL HGy% A 4 VAL HGx% 1.0 . 4.95 1533 1323 A 49 VAL HGy% A 32 VAL HGx% 1.0 . 3.45 1534 1324 A 49 VAL HGy% A 29 ALA HB% 1.0 . 3.12 1535 1325 A 49 VAL HGy% A 22 LEU HDy% 1.0 . 3.81 1536 1326 A 60 TRP HE1 A 22 LEU HDy% 1.0 . 4.71 1537 1327 A 29 ALA H A 22 LEU HDy% 1.0 . 4.97 1538 1328 A 22 LEU H A 22 LEU HDy% 1.0 . 4.45 1539 1329 A 22 LEU HDy% A 22 LEU HA 1.0 . 3.27 1540 1330 A 22 LEU HBy A 22 LEU HDy% 1.0 . 3.90 1541 1331 A 5 MET H A 80 SER HBx 1.0 . 5.04 1542 1332 A 77 MET H A 76 SER HBy 1.0 . 3.90 1543 1333 A 67 SER HA A 76 SER HBy 1.0 . 4.95 1544 1334 A 76 SER HBy A 7 ARG HBx 1.0 . 4.96 1545 1334 A 76 SER HBy A 7 ARG HBy 1.0 . 4.96 1546 1335 A 76 SER HBx A 8 MET HBy 1.0 . 5.35 1547 1336 A 71 LEU H A 71 LEU HDx% 1.0 . 3.45 1548 1337 A 71 LEU HDx% A 72 GLY H 1.0 . 4.42 1549 1338 A 70 ILE HA A 71 LEU HDx% 1.0 . 4.39 1550 1339 A 71 LEU HA A 71 LEU HDx% 1.0 . 2.90 1551 1340 A 71 LEU HBx A 71 LEU HDx% 1.0 . 3.41 1552 1341 A 75 VAL HA A 76 SER HBx 1.0 . 4.98 1553 1342 A 5 MET H A 4 VAL HGx% 1.0 . 4.50 1554 1343 A 4 VAL H A 4 VAL HGx% 1.0 . 3.68 1555 1344 A 4 VAL HGx% A 60 TRP HE3 1.0 . 3.47 1556 1345 A 3 ILE HA A 4 VAL HGx% 1.0 . 4.58 1557 1346 A 4 VAL HA A 4 VAL HGx% 1.0 . 3.29 1558 1347 A 57 ALA HA A 4 VAL HGx% 1.0 . 3.94 1559 1348 A 4 VAL HGx% A 77 MET HE% 1.0 . 5.00 1560 1349 A 71 LEU HDx% A 71 LEU HBy 1.0 . 3.80 1561 1350 A 43 SER HBx A 11 GLN HE2x 1.0 . 5.37 1562 1351 A 43 SER HBx A 42 GLN HBy 1.0 . 4.65 1563 1352 A 43 SER HBx A 36 ARG HGx 1.0 . 5.50 1564 1353 A 58 THR HG2% A 62 GLU H 1.0 . 5.01 1565 1354 A 58 THR HG2% A 59 ARG H 1.0 . 4.20 1566 1355 A 58 THR HG2% A 79 TYR HE% 1.0 . 4.18 1567 1356 A 75 VAL H A 75 VAL HGy% 1.0 . 3.57 1568 1357 A 75 VAL HGy% A 68 LEU H 1.0 . 4.63 1569 1358 A 70 ILE H A 75 VAL HGy% 1.0 . 3.88 1570 1359 A 75 VAL HGy% A 9 LEU H 1.0 . 4.88 1571 1360 A 69 ASN HA A 75 VAL HGy% 1.0 . 4.53 1572 1361 A 75 VAL HGy% A 74 LYS HA 1.0 . 4.04 1573 1362 A 75 VAL HGy% A 75 VAL HA 1.0 . 3.23 1574 1363 A 75 VAL HGy% A 9 LEU HA 1.0 . 3.24 1575 1364 A 10 PRO HDy A 75 VAL HGy% 1.0 . 3.62 1576 1365 A 10 PRO HDx A 75 VAL HGy% 1.0 . 3.88 1577 1366 A 75 VAL HGy% A 8 MET HBy 1.0 . 5.16 1578 1367 A 75 VAL HGy% A 70 ILE HB 1.0 . 3.20 1579 1368 A 58 THR HG2% A 58 THR H 1.0 . 3.50 1580 1369 A 58 THR HG2% A 58 THR HA 1.0 . 3.23 1581 1370 A 58 THR HG2% A 62 GLU HGx 1.0 . 3.66 1582 1370 A 58 THR HG2% A 62 GLU HGy 1.0 . 3.66 1583 1371 A 58 THR HG2% A 62 GLU HBx 1.0 . 3.85 1584 1372 A 58 THR HG2% A 61 MET HBx 1.0 . 3.70 1585 1373 A 4 VAL HGy% A 60 TRP HBy 1.0 . 5.50 1586 1374 A 5 MET H A 4 VAL HGy% 1.0 . 3.61 1587 1375 A 4 VAL H A 4 VAL HGy% 1.0 . 4.43 1588 1376 A 6 LEU H A 4 VAL HGy% 1.0 . 5.50 1589 1377 A 78 HIS H A 4 VAL HGy% 1.0 . 3.71 1590 1378 A 60 TRP HZ3 A 4 VAL HGy% 1.0 . 3.47 1591 1379 A 4 VAL HGy% A 6 LEU HA 1.0 . 4.94 1592 1380 A 4 VAL HGy% A 77 MET HA 1.0 . 4.16 1593 1381 A 4 VAL HA A 4 VAL HGy% 1.0 . 3.46 1594 1382 A 4 VAL HGy% A 77 MET HGy 1.0 . 3.47 1595 1383 A 6 LEU HDy% A 4 VAL HGy% 1.0 . 3.34 1596 1384 A 4 VAL HGy% A 77 MET HE% 1.0 . 3.69 1597 1385 A 75 VAL HGx% A 7 ARG H 1.0 . 3.82 1598 1386 A 75 VAL HGx% A 6 LEU HA 1.0 . 4.04 1599 1387 A 3 ILE HD1% A 82 PRO HA 1.0 . 3.87 1600 1388 A 49 VAL H A 4 VAL HGy% 1.0 . 5.50 1601 1389 A 4 VAL HGy% A 61 MET HA 1.0 . 5.50 1602 1390 A 49 VAL HGy% A 4 VAL HGy% 1.0 . 5.50 1603 1391 A 32 VAL HGy% A 33 ARG H 1.0 . 3.76 1604 1392 A 33 ARG HA A 32 VAL HGy% 1.0 . 4.44 1605 1393 A 32 VAL HGy% A 32 VAL HA 1.0 . 3.31 1606 1394 A 32 VAL HGy% A 15 GLU HA 1.0 . 3.66 1607 1395 A 32 VAL HGy% A 15 GLU HGy 1.0 . 4.14 1608 1396 A 32 VAL HGy% A 49 VAL HGy% 1.0 . 4.72 1609 1397 A 32 VAL HGy% A 19 ARG H 1.0 . 5.05 1610 1398 A 15 GLU HGx A 32 VAL HGy% 1.0 . 3.80 1611 1399 A 33 ARG H A 32 VAL HGx% 1.0 . 4.31 1612 1400 A 31 GLU H A 32 VAL HGx% 1.0 . 4.92 1613 1401 A 32 VAL HA A 32 VAL HGx% 1.0 . 3.15 1614 1402 A 19 ARG HA A 32 VAL HGx% 1.0 . 4.34 1615 1403 A 15 GLU HGx A 32 VAL HGx% 1.0 . 4.62 1616 1404 A 84 PRO HA A 83 LYS HGx 1.0 . 4.74 1617 1404 A 84 PRO HA A 83 LYS HGy 1.0 . 4.74 1618 1405 A 14 THR HG2% A 13 ALA HA 1.0 . 3.95 1619 1406 A 15 GLU H A 14 THR HG2% 1.0 . 3.88 1620 1407 A 14 THR H A 14 THR HG2% 1.0 . 3.37 1621 1408 A 50 GLU H A 32 VAL HGx% 1.0 . 4.27 1622 1409 A 32 VAL H A 32 VAL HGx% 1.0 . 3.61 1623 1410 A 15 GLU HA A 32 VAL HGx% 1.0 . 5.18 1624 1411 A 19 ARG HGx A 32 VAL HGx% 1.0 . 3.90 1625 1412 A 15 GLU HGy A 32 VAL HGx% 1.0 . 5.50 1626 1413 A 84 PRO HA A 86 ILE H 1.0 . 5.50 1627 1414 A 37 ASN HD2x A 39 SER HBx 1.0 . 5.02 1628 1414 A 37 ASN HD2x A 39 SER HBy 1.0 . 5.02 1629 1415 A 38 LYS HBy A 39 SER HBx 1.0 . 4.60 1630 1415 A 39 SER HBy A 38 LYS HBx 1.0 . 4.60 1631 1415 A 38 LYS HBy A 39 SER HBy 1.0 . 4.60 1632 1415 A 38 LYS HBx A 39 SER HBx 1.0 . 4.60 1633 1416 A 28 GLN HE2y A 52 SER HBy 1.0 . 5.50 1634 1417 A 53 HIS HBx A 52 SER HBy 1.0 . 5.29 1635 1418 A 52 SER HBx A 30 ARG HGy 1.0 . 5.15 1636 1419 A 49 VAL H A 49 VAL HGx% 1.0 . 3.62 1637 1420 A 50 GLU H A 49 VAL HGx% 1.0 . 4.35 1638 1421 A 60 TRP HE3 A 49 VAL HGx% 1.0 . 5.31 1639 1422 A 60 TRP HZ3 A 49 VAL HGx% 1.0 . 3.28 1640 1423 A 49 VAL HGx% A 49 VAL HA 1.0 . 3.20 1641 1424 A 49 VAL HGx% A 6 LEU HG 1.0 . 4.02 1642 1425 A 18 ILE HG2% A 49 VAL HGx% 1.0 . 3.00 1643 1426 A 29 ALA HB% A 49 VAL HGx% 1.0 . 4.17 1644 1427 A 22 LEU HDy% A 49 VAL HGx% 1.0 . 4.72 1645 1428 A 23 GLN H A 24 SER HBx 1.0 . 4.97 1646 1428 A 23 GLN H A 24 SER HBy 1.0 . 4.97 1647 1429 A 24 SER H A 24 SER HBx 1.0 . 3.30 1648 1429 A 24 SER H A 24 SER HBy 1.0 . 3.30 1649 1430 A 25 HIS HD2 A 24 SER HBx 1.0 . 4.75 1650 1430 A 24 SER HBy A 25 HIS HD2 1.0 . 4.75 1651 1431 A 24 SER HBy A 27 VAL HGx% 1.0 . 5.50 1652 1431 A 27 VAL HGy% A 24 SER HBx 1.0 . 5.50 1653 1431 A 27 VAL HGy% A 24 SER HBy 1.0 . 5.50 1654 1431 A 24 SER HBx A 27 VAL HGx% 1.0 . 5.50 1655 1432 A 52 SER HBy A 30 ARG HGy 1.0 . 5.34 1656 1433 A 53 HIS H A 52 SER HBx 1.0 . 4.18 1657 1434 A 30 ARG HBy A 52 SER HBx 1.0 . 5.01 1658 1435 A 25 HIS HBy A 27 VAL HGx% 1.0 . 3.93 1659 1435 A 27 VAL HGy% A 25 HIS HBy 1.0 . 3.93 1660 1436 A 60 TRP HBx A 27 VAL HGx% 1.0 . 4.05 1661 1436 A 27 VAL HGy% A 60 TRP HBx 1.0 . 4.05 1662 1437 A 22 LEU HDy% A 27 VAL HGx% 1.0 . 3.66 1663 1437 A 27 VAL HGy% A 22 LEU HDy% 1.0 . 3.66 1664 1438 A 60 TRP HE1 A 27 VAL HGx% 1.0 . 4.93 1665 1438 A 60 TRP HE1 A 27 VAL HGy% 1.0 . 4.93 1666 1439 A 27 VAL H A 27 VAL HGx% 1.0 . 3.51 1667 1439 A 27 VAL HGy% A 27 VAL H 1.0 . 3.51 1668 1440 A 22 LEU HA A 27 VAL HGx% 1.0 . 3.89 1669 1440 A 27 VAL HGy% A 22 LEU HA 1.0 . 3.89 1670 1441 A 22 LEU HBx A 27 VAL HGx% 1.0 . 4.42 1671 1441 A 27 VAL HGy% A 22 LEU HBx 1.0 . 4.42 1672 1442 A 27 VAL HGx% A 28 GLN HGx 1.0 . 4.84 1673 1442 A 27 VAL HGy% A 28 GLN HGx 1.0 . 4.84 1674 1442 A 28 GLN HGy A 27 VAL HGx% 1.0 . 4.84 1675 1442 A 27 VAL HGy% A 28 GLN HGy 1.0 . 4.84 1676 1443 A 10 PRO HA A 11 GLN HA 1.0 . 4.66 1677 1444 A 29 ALA HB% A 29 ALA H 1.0 . 3.25 1678 1445 A 31 GLU H A 29 ALA HB% 1.0 . 3.69 1679 1446 A 51 PHE HE% A 29 ALA HB% 1.0 . 4.47 1680 1447 A 29 ALA HB% A 51 PHE HZ 1.0 . 5.18 1681 1448 A 29 ALA HB% A 51 PHE HA 1.0 . 5.20 1682 1449 A 29 ALA HB% A 49 VAL HB 1.0 . 5.28 1683 1450 A 29 ALA HB% A 32 VAL HB 1.0 . 4.85 1684 1451 A 29 ALA HB% A 22 LEU HBx 1.0 . 4.62 1685 1452 A 29 ALA HB% A 32 VAL HGx% 1.0 . 3.26 1686 1453 A 29 ALA HB% A 22 LEU HDy% 1.0 . 4.13 1687 1454 A 31 GLU H A 32 VAL HA 1.0 . 5.13 1688 1455 A 29 ALA HB% A 32 VAL HA 1.0 . 5.50 1689 1456 A 49 VAL H A 32 VAL HA 1.0 . 5.05 1690 1457 A 32 VAL HA A 31 GLU HGy 1.0 . 4.94 1691 1458 A 31 GLU H A 49 VAL HA 1.0 . 4.97 1692 1459 A 50 GLU H A 49 VAL HA 1.0 . 2.89 1693 1460 A 32 VAL HGx% A 49 VAL HA 1.0 . 4.24 1694 1461 A 29 ALA HB% A 49 VAL HA 1.0 . 5.29 1695 1462 A 34 LEU H A 15 GLU HA 1.0 . 5.40 1696 1463 A 19 ARG H A 15 GLU HA 1.0 . 4.55 1697 1464 A 15 GLU HA A 14 THR HA 1.0 . 4.25 1698 1465 A 15 GLU HA A 15 GLU HGy 1.0 . 3.83 1699 1466 A 15 GLU HGx A 15 GLU HA 1.0 . 3.11 1700 1467 A 15 GLU HA A 15 GLU HBx 1.0 . 2.95 1701 1468 A 15 GLU HA A 18 ILE HG1y 1.0 . 4.60 1702 1469 A 15 GLU HA A 34 LEU HDy% 1.0 . 3.43 1703 1469 A 15 GLU HA A 34 LEU HDx% 1.0 . 3.43 1704 1470 A 18 ILE H A 15 GLU HA 1.0 . 4.00 1705 1471 A 34 LEU HBx A 15 GLU HA 1.0 . 4.75 1706 1472 A 75 VAL HA A 68 LEU HBx 1.0 . 5.10 1707 1472 A 68 LEU HBy A 75 VAL HA 1.0 . 5.10 1708 1473 A 2 ASN HD2y A 52 SER HA 1.0 . 5.04 1709 1474 A 30 ARG HDy A 52 SER HA 1.0 . 4.15 1710 1475 A 30 ARG HBy A 52 SER HA 1.0 . 4.66 1711 1476 A 30 ARG HBx A 52 SER HA 1.0 . 5.18 1712 1477 A 86 ILE HA A 87 ASN HBx 1.0 . 4.57 1713 1478 A 86 ILE HA A 86 ILE HG1x 1.0 . 3.91 1714 1479 A 86 ILE HG2% A 86 ILE HA 1.0 . 3.39 1715 1480 A 4 VAL H A 57 ALA HB% 1.0 . 5.36 1716 1481 A 51 PHE H A 57 ALA HB% 1.0 . 4.82 1717 1482 A 57 ALA HB% A 58 THR H 1.0 . 3.41 1718 1483 A 57 ALA H A 57 ALA HB% 1.0 . 3.03 1719 1484 A 57 ALA HB% A 2 ASN HA 1.0 . 3.33 1720 1485 A 57 ALA HB% A 58 THR HA 1.0 . 5.50 1721 1486 A 57 ALA HB% A 58 THR HB 1.0 . 5.13 1722 1487 A 1 SER HBx A 57 ALA HB% 1.0 . 3.88 1723 1488 A 57 ALA HB% A 51 PHE HBy 1.0 . 4.39 1724 1489 A 51 PHE HBx A 57 ALA HB% 1.0 . 3.68 1725 1490 A 2 ASN HBx A 57 ALA HB% 1.0 . 5.33 1726 1491 A 4 VAL HGx% A 57 ALA HB% 1.0 . 3.54 1727 1492 A 3 ILE HG2% A 57 ALA HB% 1.0 . 5.50 1728 1493 A 11 GLN H A 12 ALA HB% 1.0 . 5.21 1729 1494 A 12 ALA H A 12 ALA HB% 1.0 . 2.99 1730 1495 A 13 ALA H A 12 ALA HB% 1.0 . 3.81 1731 1496 A 12 ALA HB% A 13 ALA HA 1.0 . 4.29 1732 1497 A 10 PRO HBy A 12 ALA HB% 1.0 . 4.61 1733 1498 A 12 ALA HB% A 11 GLN HBx 1.0 . 4.35 1734 1498 A 12 ALA HB% A 11 GLN HBy 1.0 . 4.35 1735 1499 A 10 PRO HBx A 12 ALA HB% 1.0 . 4.74 1736 1500 A 71 LEU HDy% A 12 ALA HB% 1.0 . 3.42 1737 1501 A 14 THR H A 13 ALA HB% 1.0 . 3.54 1738 1502 A 12 ALA H A 13 ALA HB% 1.0 . 4.71 1739 1503 A 13 ALA H A 13 ALA HB% 1.0 . 3.00 1740 1504 A 13 ALA HB% A 12 ALA HA 1.0 . 5.03 1741 1505 A 13 ALA HB% A 9 LEU HA 1.0 . 4.52 1742 1506 A 11 GLN HA A 13 ALA HB% 1.0 . 5.50 1743 1507 A 10 PRO HDy A 13 ALA HB% 1.0 . 4.21 1744 1508 A 10 PRO HDx A 13 ALA HB% 1.0 . 3.69 1745 1509 A 17 ASP HBy A 13 ALA HB% 1.0 . 4.28 1746 1510 A 13 ALA HB% A 10 PRO HGx 1.0 . 3.83 1747 1511 A 70 ILE HG2% A 13 ALA HB% 1.0 . 3.02 1748 1512 A 15 GLU H A 13 ALA HB% 1.0 . 5.50 1749 1513 A 75 VAL HA A 8 MET HBy 1.0 . 3.55 1750 1514 A 75 VAL HGx% A 75 VAL HA 1.0 . 3.12 1751 1515 A 64 ASN H A 60 TRP HA 1.0 . 5.18 1752 1516 A 51 PHE HE% A 60 TRP HA 1.0 . 5.50 1753 1517 A 60 TRP HE1 A 60 TRP HA 1.0 . 4.98 1754 1518 A 24 SER HA A 24 SER HBx 1.0 . 2.80 1755 1518 A 24 SER HBy A 24 SER HA 1.0 . 2.80 1756 1519 A 24 SER HA A 23 GLN HBy 1.0 . 4.80 1757 1519 A 24 SER HA A 23 GLN HBx 1.0 . 4.80 1758 1520 A 49 VAL H A 3 ILE HG2% 1.0 . 4.13 1759 1521 A 4 VAL H A 3 ILE HG2% 1.0 . 3.52 1760 1522 A 3 ILE HG2% A 80 SER H 1.0 . 4.49 1761 1523 A 48 PHE HA A 3 ILE HG2% 1.0 . 4.35 1762 1524 A 3 ILE HA A 3 ILE HG2% 1.0 . 3.33 1763 1525 A 3 ILE HG2% A 50 GLU HA 1.0 . 4.05 1764 1526 A 4 VAL HA A 3 ILE HG2% 1.0 . 3.93 1765 1527 A 3 ILE HG2% A 80 SER HBx 1.0 . 3.37 1766 1528 A 3 ILE HG2% A 48 PHE HBy 1.0 . 3.50 1767 1529 A 50 GLU HGy A 3 ILE HG2% 1.0 . 4.75 1768 1530 A 3 ILE HG2% A 3 ILE HG1y 1.0 . 3.76 1769 1531 A 4 VAL H A 3 ILE HA 1.0 . 2.98 1770 1532 A 3 ILE HA A 50 GLU HA 1.0 . 3.11 1771 1533 A 51 PHE HD% A 3 ILE HA 1.0 . 4.82 1772 1534 A 64 ASN HD2x A 60 TRP HA 1.0 . 4.95 1773 1535 A 63 ALA HB% A 60 TRP HA 1.0 . 3.93 1774 1536 A 60 TRP HA A 27 VAL HGx% 1.0 . 4.69 1775 1536 A 27 VAL HGy% A 60 TRP HA 1.0 . 4.69 1776 1537 A 62 GLU H A 63 ALA HB% 1.0 . 4.45 1777 1538 A 63 ALA H A 63 ALA HB% 1.0 . 2.98 1778 1539 A 63 ALA HB% A 64 ASN HD2y 1.0 . 3.97 1779 1540 A 64 ASN H A 63 ALA HB% 1.0 . 3.63 1780 1541 A 64 ASN HD2x A 63 ALA HB% 1.0 . 4.46 1781 1542 A 63 ALA HB% A 64 ASN HA 1.0 . 4.66 1782 1543 A 25 HIS HBy A 63 ALA HB% 1.0 . 5.27 1783 1544 A 28 GLN H A 27 VAL HA 1.0 . 2.84 1784 1545 A 27 VAL HA A 28 GLN HGx 1.0 . 5.15 1785 1545 A 28 GLN HGy A 27 VAL HA 1.0 . 5.15 1786 1546 A 27 VAL HA A 27 VAL HGx% 1.0 . 3.34 1787 1546 A 27 VAL HGy% A 27 VAL HA 1.0 . 3.34 1788 1547 A 21 GLN H A 19 ARG HA 1.0 . 5.24 1789 1548 A 22 LEU H A 19 ARG HA 1.0 . 3.96 1790 1549 A 19 ARG HA A 19 ARG HGx 1.0 . 3.38 1791 1550 A 22 LEU HG A 19 ARG HA 1.0 . 4.20 1792 1551 A 22 LEU HDy% A 19 ARG HA 1.0 . 4.98 1793 1552 A 61 MET HE% A 79 TYR HA 1.0 . 4.78 1794 1553 A 39 SER HA A 38 LYS HGx 1.0 . 4.74 1795 1553 A 38 LYS HGy A 39 SER HA 1.0 . 4.74 1796 1554 A 4 VAL HGx% A 79 TYR HA 1.0 . 4.45 1797 1555 A 80 SER H A 79 TYR HA 1.0 . 3.08 1798 1556 A 39 SER HA A 39 SER HBx 1.0 . 2.85 1799 1556 A 39 SER HBy A 39 SER HA 1.0 . 2.85 1800 1557 A 34 LEU HBy A 14 THR HA 1.0 . 4.94 1801 1558 A 18 ILE HG2% A 18 ILE H 1.0 . 4.62 1802 1559 A 18 ILE HG2% A 60 TRP HH2 1.0 . 3.98 1803 1560 A 18 ILE HA A 18 ILE HG2% 1.0 . 3.24 1804 1561 A 18 ILE HG2% A 18 ILE HD1% 1.0 . 3.17 1805 1562 A 18 ILE HG2% A 22 LEU HDx% 1.0 . 3.71 1806 1563 A 49 VAL HGy% A 18 ILE HG2% 1.0 . 4.59 1807 1564 A 18 ILE HG2% A 22 LEU HDy% 1.0 . 4.69 1808 1565 A 18 ILE HG2% A 19 ARG HA 1.0 . 4.60 1809 1566 A 14 THR HG2% A 14 THR HA 1.0 . 3.31 1810 1567 A 14 THR HA A 34 LEU HDy% 1.0 . 3.55 1811 1567 A 14 THR HA A 34 LEU HDx% 1.0 . 3.55 1812 1568 A 59 ARG HA A 27 VAL HGx% 1.0 . 5.50 1813 1568 A 27 VAL HGy% A 59 ARG HA 1.0 . 5.50 1814 1569 A 59 ARG HBy A 59 ARG HA 1.0 . 2.87 1815 1570 A 59 ARG HGy A 59 ARG HA 1.0 . 3.60 1816 1571 A 59 ARG HGx A 59 ARG HA 1.0 . 3.74 1817 1572 A 58 THR HG2% A 59 ARG HA 1.0 . 4.90 1818 1573 A 63 ALA H A 59 ARG HA 1.0 . 4.43 1819 1574 A 59 ARG HDx A 59 ARG HA 1.0 . 4.28 1820 1575 A 86 ILE HG2% A 87 ASN HD2y 1.0 . 5.45 1821 1576 A 86 ILE HG2% A 87 ASN HBx 1.0 . 4.56 1822 1577 A 86 ILE HG2% A 87 ASN H 1.0 . 4.00 1823 1578 A 86 ILE HG2% A 86 ILE H 1.0 . 3.89 1824 1579 A 86 ILE HG1y A 86 ILE HG2% 1.0 . 4.10 1825 1580 A 86 ILE HG2% A 86 ILE HG1x 1.0 . 3.44 1826 1581 A 59 ARG HA A 62 GLU HGx 1.0 . 4.46 1827 1581 A 62 GLU HGy A 59 ARG HA 1.0 . 4.46 1828 1582 A 48 PHE HE% A 5 MET HE% 1.0 . 4.13 1829 1583 A 78 HIS HD2 A 5 MET HE% 1.0 . 5.50 1830 1584 A 5 MET HA A 5 MET HE% 1.0 . 4.94 1831 1585 A 80 SER HBy A 5 MET HE% 1.0 . 4.57 1832 1586 A 46 PHE HBy A 5 MET HE% 1.0 . 4.73 1833 1587 A 5 MET HE% A 7 ARG HGx 1.0 . 4.05 1834 1587 A 7 ARG HGy A 5 MET HE% 1.0 . 4.05 1835 1588 A 46 PHE HBx A 5 MET HE% 1.0 . 4.64 1836 1589 A 71 LEU H A 70 ILE HA 1.0 . 2.76 1837 1590 A 69 ASN HA A 70 ILE HA 1.0 . 4.69 1838 1591 A 70 ILE HG1x A 70 ILE HA 1.0 . 3.57 1839 1592 A 11 GLN HA A 11 GLN HGx 1.0 . 3.50 1840 1592 A 11 GLN HA A 11 GLN HGy 1.0 . 3.50 1841 1593 A 11 GLN HA A 11 GLN HBx 1.0 . 2.89 1842 1593 A 11 GLN HA A 11 GLN HBy 1.0 . 2.89 1843 1594 A 35 MET H A 35 MET HE% 1.0 . 5.18 1844 1595 A 35 MET HBy A 35 MET HE% 1.0 . 3.28 1845 1596 A 43 SER HBx A 35 MET HE% 1.0 . 5.32 1846 1597 A 6 LEU H A 5 MET HE% 1.0 . 5.12 1847 1598 A 71 LEU H A 70 ILE HG2% 1.0 . 3.55 1848 1599 A 70 ILE HG2% A 13 ALA HA 1.0 . 4.14 1849 1600 A 70 ILE HG2% A 70 ILE HA 1.0 . 3.30 1850 1601 A 10 PRO HDy A 70 ILE HG2% 1.0 . 4.67 1851 1602 A 10 PRO HDx A 70 ILE HG2% 1.0 . 4.10 1852 1603 A 70 ILE HG2% A 14 THR H 1.0 . 4.98 1853 1604 A 26 GLY H A 23 GLN HA 1.0 . 3.89 1854 1605 A 57 ALA H A 55 GLN HA 1.0 . 4.44 1855 1606 A 23 GLN HA A 23 GLN HGx 1.0 . 3.14 1856 1607 A 55 GLN HA A 55 GLN HBx 1.0 . 2.81 1857 1607 A 55 GLN HBy A 55 GLN HA 1.0 . 2.81 1858 1608 A 23 GLN HA A 27 VAL HGx% 1.0 . 4.38 1859 1608 A 27 VAL HGy% A 23 GLN HA 1.0 . 4.38 1860 1609 A 23 GLN HA A 24 SER HBx 1.0 . 5.15 1861 1609 A 23 GLN HA A 24 SER HBy 1.0 . 5.15 1862 1610 A 23 GLN HA A 23 GLN HBy 1.0 . 2.89 1863 1610 A 23 GLN HA A 23 GLN HBx 1.0 . 2.89 1864 1611 A 27 VAL H A 23 GLN HA 1.0 . 4.39 1865 1612 A 64 ASN H A 62 GLU HA 1.0 . 4.69 1866 1613 A 66 HIS H A 62 GLU HA 1.0 . 4.74 1867 1614 A 65 GLN H A 62 GLU HA 1.0 . 3.89 1868 1615 A 66 HIS HD2 A 62 GLU HA 1.0 . 4.16 1869 1616 A 61 MET HA A 62 GLU HA 1.0 . 5.02 1870 1617 A 62 GLU HA A 62 GLU HGx 1.0 . 3.41 1871 1617 A 62 GLU HGy A 62 GLU HA 1.0 . 3.41 1872 1618 A 62 GLU HA A 62 GLU HBy 1.0 . 2.90 1873 1619 A 64 ASN H A 61 MET HA 1.0 . 4.81 1874 1620 A 61 MET HA A 66 HIS HD2 1.0 . 5.07 1875 1621 A 61 MET HA A 66 HIS HA 1.0 . 3.99 1876 1622 A 61 MET HA A 60 TRP HBy 1.0 . 4.85 1877 1623 A 61 MET HA A 61 MET HGx 1.0 . 3.46 1878 1623 A 61 MET HA A 61 MET HGy 1.0 . 3.46 1879 1624 A 61 MET HA A 64 ASN HBx 1.0 . 4.47 1880 1625 A 61 MET HA A 61 MET HE% 1.0 . 4.88 1881 1626 A 61 MET HA A 68 LEU HDy% 1.0 . 5.50 1882 1627 A 8 MET HE% A 74 LYS HDx 1.0 . 4.33 1883 1627 A 74 LYS HDy A 8 MET HE% 1.0 . 4.33 1884 1628 A 8 MET H A 8 MET HE% 1.0 . 5.44 1885 1629 A 76 SER H A 8 MET HE% 1.0 . 4.31 1886 1630 A 8 MET HE% A 76 SER HA 1.0 . 5.17 1887 1631 A 75 VAL HA A 8 MET HE% 1.0 . 4.32 1888 1632 A 8 MET HA A 8 MET HE% 1.0 . 4.78 1889 1633 A 75 VAL HGx% A 8 MET HE% 1.0 . 5.37 1890 1634 A 60 TRP HE1 A 77 MET HE% 1.0 . 5.46 1891 1635 A 77 MET HE% A 64 ASN HD2y 1.0 . 4.07 1892 1636 A 60 TRP HZ3 A 77 MET HE% 1.0 . 3.88 1893 1637 A 64 ASN HD2x A 77 MET HE% 1.0 . 5.07 1894 1638 A 77 MET HA A 77 MET HE% 1.0 . 4.41 1895 1639 A 77 MET HE% A 64 ASN HA 1.0 . 5.44 1896 1640 A 61 MET HA A 77 MET HE% 1.0 . 3.31 1897 1641 A 60 TRP HBy A 77 MET HE% 1.0 . 4.22 1898 1642 A 44 ARG H A 43 SER HA 1.0 . 3.00 1899 1643 A 37 ASN HBy A 38 LYS HA 1.0 . 5.37 1900 1644 A 38 LYS HA A 38 LYS HBx 1.0 . 2.93 1901 1644 A 38 LYS HBy A 38 LYS HA 1.0 . 2.93 1902 1645 A 38 LYS HA A 38 LYS HDx 1.0 . 4.32 1903 1645 A 38 LYS HDy A 38 LYS HA 1.0 . 4.32 1904 1646 A 8 MET HE% A 7 ARG HBx 1.0 . 4.33 1905 1646 A 7 ARG HBy A 8 MET HE% 1.0 . 4.33 1906 1647 A 76 SER HBx A 8 MET HE% 1.0 . 4.41 1907 1648 A 66 HIS H A 77 MET HE% 1.0 . 5.40 1908 1649 A 61 MET H A 77 MET HE% 1.0 . 4.83 1909 1650 A 4 VAL HA A 77 MET HE% 1.0 . 5.34 1910 1651 A 77 MET HE% A 66 HIS HA 1.0 . 5.06 1911 1652 A 38 LYS HA A 38 LYS HGx 1.0 . 3.67 1912 1652 A 38 LYS HGy A 38 LYS HA 1.0 . 3.67 1913 1653 A 60 TRP HE1 A 22 LEU HA 1.0 . 4.22 1914 1654 A 22 LEU HG A 22 LEU HA 1.0 . 3.73 1915 1655 A 22 LEU HDx% A 22 LEU HA 1.0 . 4.55 1916 1656 A 52 SER H A 51 PHE HA 1.0 . 3.38 1917 1657 A 30 ARG HBx A 51 PHE HA 1.0 . 4.52 1918 1658 A 14 THR H A 17 ASP HA 1.0 . 4.81 1919 1659 A 70 ILE HG2% A 17 ASP HA 1.0 . 4.84 1920 1660 A 67 SER HA A 68 LEU H 1.0 . 2.96 1921 1661 A 67 SER HA A 77 MET H 1.0 . 3.94 1922 1662 A 67 SER HA A 66 HIS HA 1.0 . 4.81 1923 1663 A 30 ARG H A 51 PHE HA 1.0 . 3.44 1924 1664 A 53 HIS H A 51 PHE HA 1.0 . 4.98 1925 1665 A 77 MET H A 76 SER HA 1.0 . 2.97 1926 1666 A 67 SER HA A 76 SER HA 1.0 . 3.44 1927 1667 A 77 MET HGx A 76 SER HA 1.0 . 4.95 1928 1668 A 68 LEU H A 76 SER HA 1.0 . 4.51 1929 1669 A 19 ARG H A 17 ASP HA 1.0 . 5.18 1930 1670 A 24 SER H A 21 GLN HA 1.0 . 4.86 1931 1671 A 29 ALA HB% A 30 ARG HA 1.0 . 5.01 1932 1672 A 67 SER HA A 75 VAL HGx% 1.0 . 5.50 1933 1673 A 16 ASP HA A 19 ARG HDx 1.0 . 4.05 1934 1674 A 19 ARG H A 16 ASP HA 1.0 . 3.75 1935 1675 A 20 GLY H A 16 ASP HA 1.0 . 4.24 1936 1676 A 19 ARG HBx A 16 ASP HA 1.0 . 3.07 1937 1677 A 19 ARG HGy A 16 ASP HA 1.0 . 4.40 1938 1678 A 65 GLN H A 66 HIS HA 1.0 . 5.02 1939 1679 A 77 MET HGx A 66 HIS HA 1.0 . 3.74 1940 1680 A 61 MET HE% A 66 HIS HA 1.0 . 5.36 1941 1681 A 66 HIS HD2 A 65 GLN HA 1.0 . 4.07 1942 1682 A 64 ASN H A 65 GLN HA 1.0 . 4.71 1943 1683 A 65 GLN HA A 65 GLN HGx 1.0 . 3.24 1944 1684 A 65 GLN HA A 65 GLN HBx 1.0 . 2.89 1945 1684 A 65 GLN HA A 65 GLN HBy 1.0 . 2.89 1946 1685 A 65 GLN HA A 67 SER H 1.0 . 5.11 1947 1686 A 58 THR HA A 61 MET HE% 1.0 . 4.55 1948 1687 A 79 TYR H A 61 MET HE% 1.0 . 3.67 1949 1688 A 61 MET HE% A 61 MET H 1.0 . 4.49 1950 1689 A 78 HIS HA A 61 MET HE% 1.0 . 3.49 1951 1690 A 77 MET H A 66 HIS HA 1.0 . 4.88 1952 1691 A 88 GLU HBy A 91 LEU HA 1.0 . 4.72 1953 1692 A 48 PHE HA A 49 VAL H 1.0 . 2.97 1954 1693 A 48 PHE HA A 5 MET HGx 1.0 . 4.75 1955 1694 A 48 PHE HA A 49 VAL HGx% 1.0 . 4.17 1956 1695 A 48 PHE HA A 49 VAL HB 1.0 . 4.97 1957 1696 A 74 LYS HA A 74 LYS HGy 1.0 . 3.90 1958 1697 A 56 ASP HA A 59 ARG HGx 1.0 . 5.50 1959 1698 A 56 ASP HA A 27 VAL HGx% 1.0 . 4.39 1960 1698 A 27 VAL HGy% A 56 ASP HA 1.0 . 4.39 1961 1699 A 56 ASP HA A 58 THR H 1.0 . 5.50 1962 1700 A 91 LEU HA A 88 GLU HGx 1.0 . 5.49 1963 1700 A 88 GLU HGy A 91 LEU HA 1.0 . 5.49 1964 1701 A 88 GLU HA A 89 ASP H 1.0 . 3.08 1965 1702 A 88 GLU HA A 91 LEU H 1.0 . 5.22 1966 1703 A 88 GLU HA A 88 GLU HGx 1.0 . 3.44 1967 1703 A 88 GLU HGy A 88 GLU HA 1.0 . 3.44 1968 1704 A 88 GLU HA A 91 LEU HDy% 1.0 . 4.65 1969 1705 A 90 TRP HD1 A 90 TRP HA 1.0 . 4.56 1970 1706 A 70 ILE H A 74 LYS HA 1.0 . 4.48 1971 1707 A 75 VAL H A 74 LYS HA 1.0 . 2.74 1972 1708 A 74 LYS HA A 69 ASN HBx 1.0 . 4.78 1973 1709 A 91 LEU HA A 91 LEU HBx 1.0 . 3.00 1974 1709 A 91 LEU HBy A 91 LEU HA 1.0 . 3.00 1975 1710 A 89 ASP HBy A 88 GLU HA 1.0 . 4.92 1976 1711 A 91 LEU H A 90 TRP HA 1.0 . 3.06 1977 1712 A 44 ARG HDy A 44 ARG HA 1.0 . 4.68 1978 1713 A 44 ARG HDx A 44 ARG HA 1.0 . 4.82 1979 1714 A 86 ILE H A 85 LYS HA 1.0 . 2.87 1980 1715 A 85 LYS HA A 83 LYS HGx 1.0 . 3.54 1981 1715 A 83 LYS HGy A 85 LYS HA 1.0 . 3.54 1982 1716 A 86 ILE HD1% A 85 LYS HA 1.0 . 5.31 1983 1717 A 8 MET H A 8 MET HA 1.0 . 2.91 1984 1718 A 8 MET HA A 8 MET HGx 1.0 . 3.74 1985 1719 A 8 MET HA A 7 ARG HBx 1.0 . 4.71 1986 1719 A 7 ARG HBy A 8 MET HA 1.0 . 4.71 1987 1720 A 44 ARG HA A 44 ARG HGy 1.0 . 3.52 1988 1721 A 44 ARG HGx A 44 ARG HA 1.0 . 3.76 1989 1722 A 30 ARG H A 31 GLU HA 1.0 . 5.30 1990 1723 A 29 ALA HB% A 31 GLU HA 1.0 . 5.10 1991 1724 A 32 VAL H A 31 GLU HA 1.0 . 2.69 1992 1725 A 31 GLU HGy A 31 GLU HA 1.0 . 3.52 1993 1726 A 31 GLU HBy A 31 GLU HA 1.0 . 2.99 1994 1727 A 32 VAL HGx% A 31 GLU HA 1.0 . 4.73 1995 1728 A 60 TRP HH2 A 18 ILE HD1% 1.0 . 5.50 1996 1729 A 17 ASP HBy A 18 ILE HD1% 1.0 . 5.16 1997 1730 A 4 VAL H A 3 ILE HD1% 1.0 . 4.98 1998 1731 A 3 ILE H A 3 ILE HD1% 1.0 . 4.98 1999 1732 A 3 ILE HD1% A 2 ASN HD2x 1.0 . 4.58 2000 1733 A 3 ILE HA A 3 ILE HD1% 1.0 . 4.25 2001 1734 A 3 ILE HD1% A 81 ASP HA 1.0 . 4.15 2002 1735 A 3 ILE HD1% A 82 PRO HDx 1.0 . 4.81 2003 1736 A 50 GLU HGy A 3 ILE HD1% 1.0 . 4.02 2004 1737 A 3 ILE HD1% A 3 ILE HB 1.0 . 3.19 2005 1738 A 19 ARG H A 18 ILE HD1% 1.0 . 5.00 2006 1739 A 18 ILE H A 18 ILE HD1% 1.0 . 3.94 2007 1740 A 47 ALA HA A 18 ILE HD1% 1.0 . 5.50 2008 1741 A 15 GLU HA A 18 ILE HD1% 1.0 . 3.55 2009 1742 A 18 ILE HA A 18 ILE HD1% 1.0 . 3.95 2010 1743 A 15 GLU HGx A 18 ILE HD1% 1.0 . 4.81 2011 1744 A 18 ILE HB A 18 ILE HD1% 1.0 . 3.28 2012 1745 A 47 ALA HB% A 18 ILE HD1% 1.0 . 3.71 2013 1746 A 43 SER H A 42 GLN HA 1.0 . 3.05 2014 1747 A 42 GLN HA A 41 GLY HAx 1.0 . 4.76 2015 1748 A 71 LEU H A 71 LEU HA 1.0 . 2.85 2016 1749 A 43 SER HBx A 35 MET HA 1.0 . 5.11 2017 1750 A 35 MET HGy A 35 MET HA 1.0 . 4.13 2018 1751 A 70 ILE HA A 71 LEU HA 1.0 . 4.33 2019 1752 A 71 LEU HG A 71 LEU HA 1.0 . 3.73 2020 1753 A 35 MET HA A 34 LEU HDy% 1.0 . 4.84 2021 1753 A 34 LEU HDx% A 35 MET HA 1.0 . 4.84 2022 1754 A 43 SER HBy A 35 MET HA 1.0 . 5.21 2023 1755 A 57 ALA HA A 51 PHE HZ 1.0 . 5.10 2024 1756 A 6 LEU H A 46 PHE HA 1.0 . 4.60 2025 1757 A 9 LEU H A 46 PHE HA 1.0 . 4.47 2026 1758 A 4 VAL H A 50 GLU HA 1.0 . 4.09 2027 1759 A 51 PHE H A 50 GLU HA 1.0 . 3.04 2028 1760 A 3 ILE HG1x A 50 GLU HA 1.0 . 3.71 2029 1761 A 7 ARG HA A 7 ARG HGx 1.0 . 3.68 2030 1761 A 7 ARG HGy A 7 ARG HA 1.0 . 3.68 2031 1762 A 46 PHE HBy A 7 ARG HA 1.0 . 3.82 2032 1763 A 51 PHE HD% A 57 ALA HA 1.0 . 4.00 2033 1764 A 57 ALA HA A 60 TRP H 1.0 . 4.57 2034 1765 A 86 ILE H A 86 ILE HD1% 1.0 . 4.96 2035 1766 A 86 ILE HA A 86 ILE HD1% 1.0 . 4.19 2036 1767 A 86 ILE HB A 86 ILE HD1% 1.0 . 3.59 2037 1768 A 47 ALA H A 46 PHE HA 1.0 . 3.01 2038 1769 A 7 ARG HA A 46 PHE HA 1.0 . 3.66 2039 1770 A 45 GLY HAx A 46 PHE HA 1.0 . 5.34 2040 1771 A 8 MET H A 7 ARG HA 1.0 . 3.21 2041 1772 A 89 ASP HA A 89 ASP HBx 1.0 . 2.92 2042 1773 A 35 MET H A 34 LEU HA 1.0 . 3.10 2043 1774 A 65 GLN H A 63 ALA HA 1.0 . 4.65 2044 1775 A 63 ALA HA A 62 GLU HBy 1.0 . 4.61 2045 1776 A 78 HIS HA A 77 MET HBy 1.0 . 4.62 2046 1777 A 78 HIS HA A 79 TYR HD% 1.0 . 5.04 2047 1778 A 89 ASP HA A 86 ILE HB 1.0 . 4.52 2048 1779 A 29 ALA H A 29 ALA HA 1.0 . 2.68 2049 1780 A 29 ALA HA A 28 GLN HGx 1.0 . 3.60 2050 1780 A 28 GLN HGy A 29 ALA HA 1.0 . 3.60 2051 1781 A 29 ALA HA A 27 VAL HGx% 1.0 . 4.93 2052 1781 A 27 VAL HGy% A 29 ALA HA 1.0 . 4.93 2053 1782 A 84 PRO HA A 83 LYS HA 1.0 . 4.39 2054 1783 A 70 ILE HD1% A 69 ASN H 1.0 . 5.04 2055 1784 A 70 ILE H A 70 ILE HD1% 1.0 . 4.86 2056 1785 A 10 PRO HDy A 70 ILE HD1% 1.0 . 5.01 2057 1786 A 53 HIS HA A 53 HIS HD2 1.0 . 4.84 2058 1787 A 7 ARG H A 77 MET HA 1.0 . 4.51 2059 1788 A 57 ALA HA A 2 ASN HA 1.0 . 4.35 2060 1789 A 70 ILE HD1% A 70 ILE HA 1.0 . 3.74 2061 1790 A 75 VAL HB A 70 ILE HD1% 1.0 . 4.49 2062 1791 A 70 ILE HB A 70 ILE HD1% 1.0 . 3.53 2063 1792 A 6 LEU HA A 77 MET HA 1.0 . 3.91 2064 1793 A 77 MET HA A 77 MET HGx 1.0 . 3.99 2065 1794 A 83 LYS HA A 84 PRO HDy 1.0 . 3.04 2066 1795 A 83 LYS HA A 83 LYS HGx 1.0 . 3.66 2067 1795 A 83 LYS HA A 83 LYS HGy 1.0 . 3.66 2068 1796 A 47 ALA H A 5 MET HA 1.0 . 5.11 2069 1797 A 49 VAL H A 5 MET HA 1.0 . 4.33 2070 1798 A 6 LEU H A 5 MET HA 1.0 . 2.95 2071 1799 A 48 PHE HD% A 5 MET HA 1.0 . 4.57 2072 1800 A 48 PHE HA A 5 MET HA 1.0 . 3.49 2073 1801 A 3 ILE HG2% A 5 MET HA 1.0 . 4.81 2074 1802 A 64 ASN HA A 63 ALA HA 1.0 . 4.52 2075 1803 A 72 GLY HAx A 73 GLN HA 1.0 . 5.01 2076 1804 A 86 ILE HA A 87 ASN HA 1.0 . 4.60 2077 1805 A 86 ILE HG2% A 87 ASN HA 1.0 . 5.46 2078 1806 A 10 PRO HDy A 9 LEU HA 1.0 . 3.09 2079 1807 A 10 PRO HDx A 9 LEU HA 1.0 . 3.19 2080 1808 A 10 PRO HBy A 9 LEU HA 1.0 . 5.02 2081 1809 A 9 LEU HA A 10 PRO HGx 1.0 . 4.74 2082 1810 A 9 LEU HA A 9 LEU HG 1.0 . 4.03 2083 1811 A 38 LYS H A 37 ASN HA 1.0 . 3.43 2084 1812 A 87 ASN HBx A 87 ASN HA 1.0 . 2.95 2085 1813 A 37 ASN HA A 39 SER HBx 1.0 . 5.12 2086 1813 A 39 SER HBy A 37 ASN HA 1.0 . 5.12 2087 1814 A 69 ASN H A 68 LEU HA 1.0 . 2.84 2088 1815 A 6 LEU HA A 7 ARG HBx 1.0 . 4.42 2089 1815 A 6 LEU HA A 7 ARG HBy 1.0 . 4.42 2090 1816 A 78 HIS H A 6 LEU HA 1.0 . 4.46 2091 1817 A 6 LEU HA A 7 ARG HGx 1.0 . 4.78 2092 1817 A 7 ARG HGy A 6 LEU HA 1.0 . 4.78 2093 1818 A 75 VAL H A 69 ASN HA 1.0 . 3.88 2094 1819 A 70 ILE H A 69 ASN HA 1.0 . 2.73 2095 1820 A 69 ASN HA A 74 LYS HA 1.0 . 3.33 2096 1821 A 12 ALA H A 13 ALA HA 1.0 . 5.49 2097 1822 A 12 ALA HA A 11 GLN HBx 1.0 . 4.64 2098 1822 A 12 ALA HA A 11 GLN HBy 1.0 . 4.64 2099 1823 A 71 LEU HDy% A 12 ALA HA 1.0 . 5.31 2100 1824 A 14 THR H A 13 ALA HA 1.0 . 2.77 2101 1825 A 17 ASP HBy A 13 ALA HA 1.0 . 4.22 2102 1826 A 17 ASP HBx A 13 ALA HA 1.0 . 4.81 2103 1827 A 83 LYS H A 82 PRO HDy 1.0 . 4.64 2104 1828 A 81 ASP HA A 82 PRO HDy 1.0 . 3.16 2105 1829 A 81 ASP HBy A 82 PRO HDy 1.0 . 4.03 2106 1830 A 81 ASP HBx A 82 PRO HDy 1.0 . 4.67 2107 1831 A 3 ILE HD1% A 82 PRO HDy 1.0 . 5.49 2108 1832 A 82 PRO HDx A 81 ASP HA 1.0 . 3.13 2109 1833 A 84 PRO HDx A 83 LYS HA 1.0 . 3.10 2110 1834 A 84 PRO HDy A 86 ILE HD1% 1.0 . 5.50 2111 1835 A 84 PRO HDx A 86 ILE HD1% 1.0 . 5.50 2112 1836 A 84 PRO HDx A 83 LYS H 1.0 . 4.94 2113 1837 A 84 PRO HDx A 83 LYS HGx 1.0 . 4.71 2114 1837 A 84 PRO HDx A 83 LYS HGy 1.0 . 4.71 2115 1838 A 47 ALA HA A 9 LEU HDy% 1.0 . 5.02 2116 1839 A 47 ALA HA A 48 PHE H 1.0 . 3.02 2117 1840 A 48 PHE HD% A 47 ALA HA 1.0 . 4.93 2118 1841 A 47 ALA HA A 34 LEU HA 1.0 . 3.30 2119 1842 A 10 PRO HDy A 70 ILE HB 1.0 . 4.41 2120 1843 A 10 PRO HDy A 9 LEU HBx 1.0 . 5.06 2121 1844 A 10 PRO HDy A 9 LEU H 1.0 . 4.97 2122 1845 A 10 PRO HDx A 70 ILE HB 1.0 . 4.20 2123 1846 A 10 PRO HDx A 9 LEU HBx 1.0 . 4.36 2124 1847 A 79 TYR H A 79 TYR HD% 1.0 . 3.41 2125 1848 A 79 TYR HD% A 79 TYR HA 1.0 . 2.96 2126 1849 A 79 TYR HD% A 1 SER HBy 1.0 . 4.58 2127 1850 A 1 SER HBx A 79 TYR HD% 1.0 . 3.46 2128 1851 A 79 TYR HD% A 57 ALA HB% 1.0 . 3.97 2129 1852 A 79 TYR HD% A 61 MET HE% 1.0 . 3.50 2130 1853 A 79 TYR HD% A 4 VAL HGx% 1.0 . 3.55 2131 1854 A 46 PHE HD% A 47 ALA HA 1.0 . 5.01 2132 1855 A 46 PHE HD% A 47 ALA H 1.0 . 4.13 2133 1856 A 46 PHE HD% A 46 PHE HA 1.0 . 3.87 2134 1857 A 46 PHE HD% A 7 ARG HA 1.0 . 4.08 2135 1858 A 46 PHE HD% A 5 MET HE% 1.0 . 3.76 2136 1859 A 46 PHE HD% A 44 ARG HBx 1.0 . 4.44 2137 1860 A 51 PHE HD% A 51 PHE H 1.0 . 3.10 2138 1861 A 51 PHE HD% A 51 PHE HA 1.0 . 3.34 2139 1862 A 51 PHE HD% A 56 ASP HBx 1.0 . 3.82 2140 1863 A 51 PHE HD% A 57 ALA HB% 1.0 . 3.04 2141 1864 A 51 PHE HD% A 4 VAL HGx% 1.0 . 3.47 2142 1865 A 51 PHE HD% A 30 ARG H 1.0 . 5.07 2143 1866 A 46 PHE HD% A 45 GLY H 1.0 . 5.50 2144 1867 A 51 PHE HD% A 27 VAL HGx% 1.0 . 3.91 2145 1867 A 51 PHE HD% A 27 VAL HGy% 1.0 . 3.91 2146 1868 A 51 PHE HD% A 49 VAL HGy% 1.0 . 4.04 2147 1869 A 48 PHE HD% A 48 PHE H 1.0 . 3.73 2148 1870 A 48 PHE HA A 48 PHE HD% 1.0 . 3.88 2149 1871 A 48 PHE HD% A 80 SER HBx 1.0 . 3.96 2150 1872 A 3 ILE HG2% A 48 PHE HD% 1.0 . 3.30 2151 1873 A 80 SER HBx A 48 PHE HE% 1.0 . 4.08 2152 1874 A 48 PHE HE% A 5 MET HGx 1.0 . 3.86 2153 1875 A 3 ILE HG2% A 48 PHE HE% 1.0 . 3.87 2154 1876 A 44 ARG HBy A 46 PHE HE% 1.0 . 3.23 2155 1877 A 46 PHE HE% A 44 ARG HGy 1.0 . 4.42 2156 1878 A 44 ARG HBx A 46 PHE HE% 1.0 . 3.77 2157 1879 A 51 PHE HE% A 4 VAL HGy% 1.0 . 4.86 2158 1880 A 51 PHE HE% A 57 ALA HB% 1.0 . 5.26 2159 1881 A 51 PHE HE% A 57 ALA HA 1.0 . 3.60 2160 1882 A 4 VAL HB A 51 PHE HE% 1.0 . 3.67 2161 1883 A 51 PHE HE% A 4 VAL HGx% 1.0 . 3.33 2162 1884 A 51 PHE HE% A 27 VAL HGx% 1.0 . 3.28 2163 1884 A 51 PHE HE% A 27 VAL HGy% 1.0 . 3.28 2164 1885 A 51 PHE HE% A 49 VAL HGy% 1.0 . 3.42 2165 1886 A 51 PHE HE% A 49 VAL HB 1.0 . 3.96 2166 1887 A 51 PHE HE% A 27 VAL HB 1.0 . 3.97 2167 1888 A 51 PHE HE% A 22 LEU HDy% 1.0 . 3.50 2168 1889 A 4 VAL HGx% A 51 PHE HZ 1.0 . 4.49 2169 1890 A 60 TRP HE3 A 51 PHE HZ 1.0 . 3.52 2170 1891 A 51 PHE HZ A 22 LEU HDx% 1.0 . 5.21 2171 1892 A 60 TRP HBy A 51 PHE HZ 1.0 . 4.56 2172 1893 A 51 PHE HZ A 27 VAL HGx% 1.0 . 4.10 2173 1893 A 27 VAL HGy% A 51 PHE HZ 1.0 . 4.10 2174 1894 A 49 VAL HGy% A 51 PHE HZ 1.0 . 3.89 2175 1895 A 51 PHE HZ A 22 LEU HDy% 1.0 . 3.49 2176 1896 A 5 MET HGx A 48 PHE HZ 1.0 . 4.23 2177 1897 A 60 TRP HBx A 51 PHE HZ 1.0 . 4.69 2178 1898 A 88 GLU HA A 90 TRP HD1 1.0 . 4.44 2179 1899 A 90 TRP HD1 A 90 TRP H 1.0 . 3.43 2180 1900 A 90 TRP HD1 A 90 TRP HBx 1.0 . 3.34 2181 1901 A 89 ASP HBy A 90 TRP HD1 1.0 . 4.70 2182 1902 A 91 LEU HDy% A 90 TRP HD1 1.0 . 4.43 2183 1903 A 60 TRP HA A 60 TRP HD1 1.0 . 2.87 2184 1904 A 22 LEU HA A 60 TRP HD1 1.0 . 5.18 2185 1905 A 25 HIS HBy A 60 TRP HD1 1.0 . 4.00 2186 1906 A 25 HIS HBx A 60 TRP HD1 1.0 . 3.64 2187 1907 A 60 TRP HBx A 60 TRP HD1 1.0 . 3.71 2188 1908 A 63 ALA HB% A 60 TRP HD1 1.0 . 4.27 2189 1909 A 60 TRP HD1 A 27 VAL HGx% 1.0 . 3.40 2190 1909 A 27 VAL HGy% A 60 TRP HD1 1.0 . 3.40 2191 1910 A 22 LEU HDy% A 60 TRP HD1 1.0 . 4.92 2192 1911 A 60 TRP H A 60 TRP HD1 1.0 . 4.93 2193 1912 A 78 HIS HD2 A 78 HIS HBx 1.0 . 3.59 2194 1913 A 78 HIS H A 78 HIS HD2 1.0 . 3.52 2195 1914 A 6 LEU HA A 78 HIS HD2 1.0 . 4.10 2196 1915 A 78 HIS HD2 A 77 MET HA 1.0 . 3.75 2197 1916 A 78 HIS HD2 A 7 ARG HBx 1.0 . 3.75 2198 1916 A 78 HIS HD2 A 7 ARG HBy 1.0 . 3.75 2199 1917 A 78 HIS HD2 A 7 ARG HGx 1.0 . 3.30 2200 1917 A 7 ARG HGy A 78 HIS HD2 1.0 . 3.30 2201 1918 A 91 LEU HDy% A 90 TRP HH2 1.0 . 4.56 2202 1919 A 6 LEU HDx% A 60 TRP HH2 1.0 . 2.89 2203 1920 A 49 VAL HGy% A 60 TRP HH2 1.0 . 4.37 2204 1921 A 49 VAL HB A 60 TRP HH2 1.0 . 4.41 2205 1922 A 22 LEU HDy% A 60 TRP HH2 1.0 . 4.17 2206 1923 A 91 LEU HDy% A 90 TRP HZ3 1.0 . 4.88 2207 1924 A 91 LEU HDy% A 90 TRP HE3 1.0 . 4.79 2208 1925 A 60 TRP HE3 A 77 MET HE% 1.0 . 4.02 2209 1926 A 60 TRP HE3 A 60 TRP HBy 1.0 . 3.25 2210 1927 A 60 TRP HE3 A 60 TRP HBx 1.0 . 3.77 2211 1928 A 4 VAL HGy% A 60 TRP HE3 1.0 . 3.77 2212 1929 A 6 LEU HDy% A 60 TRP HE3 1.0 . 4.89 2213 1930 A 49 VAL HGy% A 60 TRP HE3 1.0 . 5.23 2214 1931 A 60 TRP HE3 A 22 LEU HDy% 1.0 . 5.15 2215 1932 A 4 VAL HB A 60 TRP HE3 1.0 . 4.21 2216 1933 A 28 GLN HE2y A 53 HIS HD2 1.0 . 3.44 2217 1934 A 52 SER HBy A 53 HIS HD2 1.0 . 3.76 2218 1935 A 52 SER HBx A 53 HIS HD2 1.0 . 4.42 2219 1936 A 53 HIS HBx A 53 HIS HD2 1.0 . 3.69 2220 1937 A 60 TRP HZ3 A 4 VAL HGx% 1.0 . 4.71 2221 1938 A 49 VAL HGy% A 60 TRP HZ3 1.0 . 4.13 2222 1939 A 60 TRP HZ3 A 49 VAL HB 1.0 . 3.78 2223 1940 A 25 HIS HD2 A 27 VAL HGx% 1.0 . 4.00 2224 1940 A 27 VAL HGy% A 25 HIS HD2 1.0 . 4.00 2225 1941 A 25 HIS H A 25 HIS HD2 1.0 . 3.48 2226 1942 A 25 HIS HBx A 25 HIS HD2 1.0 . 3.79 2227 1943 A 65 GLN H A 66 HIS HD2 1.0 . 4.09 2228 1944 A 66 HIS HD2 A 66 HIS HA 1.0 . 3.23 2229 1945 A 66 HIS HD2 A 66 HIS HBy 1.0 . 3.85 2230 1946 A 61 MET HE% A 66 HIS HD2 1.0 . 3.93 2231 1947 A 61 MET HBx A 66 HIS HD2 1.0 . 3.72 2232 1948 A 79 TYR HE% A 61 MET HE% 1.0 . 3.29 2233 1949 A 79 TYR HE% A 58 THR HA 1.0 . 3.64 2234 1950 A 79 TYR HE% A 57 ALA HB% 1.0 . 3.15 2235 1951 A 66 HIS H A 66 HIS HD2 1.0 . 3.02 2236 1952 A 79 TYR HE% A 58 THR H 1.0 . 3.99 2237 1953 A 60 TRP HZ2 A 22 LEU HA 1.0 . 4.26 2238 1954 A 21 GLN HBy A 60 TRP HZ2 1.0 . 4.22 2239 1955 A 21 GLN HBx A 60 TRP HZ2 1.0 . 3.64 2240 1956 A 22 LEU HG A 60 TRP HZ2 1.0 . 3.72 2241 1957 A 60 TRP HZ2 A 68 LEU HDx% 1.0 . 3.38 2242 1958 A 22 LEU HDy% A 60 TRP HZ2 1.0 . 3.73 2243 1959 A 90 TRP HZ2 A 88 GLU HGx 1.0 . 5.26 2244 1959 A 88 GLU HGy A 90 TRP HZ2 1.0 . 5.26 2245 1960 A 91 LEU HDy% A 90 TRP HZ2 1.0 . 5.01 stop_ save_