data_nef_c19327_2ma4 save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code TargetDB StR106 stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 22 ALA start . . 2 A 23 GLU middle . . 3 A 24 ILE middle . . 4 A 25 MET middle . . 5 A 26 LYS middle . . 6 A 27 LYS middle . . 7 A 28 THR middle . . 8 A 29 ASP middle . . 9 A 30 PHE middle . . 10 A 31 ASP middle . . 11 A 32 LYS middle . . 12 A 33 VAL middle . . 13 A 34 ALA middle . . 14 A 35 SER middle . . 15 A 36 GLU middle . . 16 A 37 TYR middle . . 17 A 38 THR middle . . 18 A 39 LYS middle . . 19 A 40 ILE middle . . 20 A 41 GLY middle . false 21 A 42 THR middle . . 22 A 43 ILE middle . . 23 A 44 SER middle . . 24 A 45 THR middle . . 25 A 46 THR middle . . 26 A 47 GLY middle . false 27 A 48 GLU middle . . 28 A 49 MET middle . . 29 A 50 SER middle . . 30 A 51 PRO middle . false 31 A 52 LEU middle . . 32 A 53 ASP middle . . 33 A 54 ALA middle . . 34 A 55 ARG middle . . 35 A 56 GLU middle . . 36 A 57 ASP middle . . 37 A 58 LEU middle . . 38 A 59 ILE middle . . 39 A 60 LYS middle . . 40 A 61 LYS middle . . 41 A 62 ALA middle . . 42 A 63 ASP middle . . 43 A 64 GLU middle . . 44 A 65 LYS middle . . 45 A 66 GLY middle . false 46 A 67 ALA middle . . 47 A 68 ASP middle . . 48 A 69 VAL middle . . 49 A 70 VAL middle . . 50 A 71 VAL middle . . 51 A 72 LEU middle . . 52 A 73 THR middle . . 53 A 74 SER middle . . 54 A 75 GLY middle . false 55 A 76 GLN middle . . 56 A 77 THR middle . . 57 A 78 GLU middle . . 58 A 79 ASN middle . . 59 A 80 LYS middle . . 60 A 81 ILE middle . . 61 A 82 HIS middle . . 62 A 83 GLY middle . false 63 A 84 THR middle . . 64 A 85 ALA middle . . 65 A 86 ASP middle . . 66 A 87 ILE middle . . 67 A 88 TYR middle . . 68 A 89 LYS middle . . 69 A 90 LYS middle . . 70 A 91 LYS middle . . 71 A 92 LEU middle . . 72 A 93 GLU middle . . 73 A 94 HIS middle . . 74 A 95 HIS middle . . 75 A 96 HIS middle . . 76 A 97 HIS middle . . 77 A 98 HIS middle . . 78 A 99 HIS 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 22 ALA HA H 1 4.130 0.02 A 22 ALA HB% H 1 1.184 0.02 A 22 ALA C C 13 172.939 0.20 A 22 ALA CA C 13 50.956 0.20 A 22 ALA CB C 13 20.400 0.20 A 23 GLU H H 1 7.921 0.02 A 23 GLU HA H 1 4.713 0.02 A 23 GLU HBx H 1 1.979 0.02 A 23 GLU HBy H 1 2.050 0.02 A 23 GLU HG2 H 1 2.270 0.02 A 23 GLU HG3 H 1 2.270 0.02 A 23 GLU C C 13 174.825 0.20 A 23 GLU CA C 13 54.363 0.20 A 23 GLU CB C 13 32.640 0.20 A 23 GLU CG C 13 35.103 0.20 A 23 GLU N N 15 117.829 0.20 A 24 ILE H H 1 8.873 0.02 A 24 ILE HA H 1 4.871 0.02 A 24 ILE HB H 1 1.672 0.02 A 24 ILE HD1% H 1 0.785 0.02 A 24 ILE HG1y H 1 1.522 0.02 A 24 ILE HG1x H 1 0.774 0.02 A 24 ILE HG2% H 1 0.847 0.02 A 24 ILE C C 13 176.427 0.20 A 24 ILE CA C 13 60.288 0.20 A 24 ILE CB C 13 38.258 0.20 A 24 ILE CD1 C 13 17.463 0.20 A 24 ILE CG1 C 13 28.133 0.20 A 24 ILE CG2 C 13 13.445 0.20 A 24 ILE N N 15 123.913 0.20 A 25 MET H H 1 8.727 0.02 A 25 MET HA H 1 4.761 0.02 A 25 MET HB2 H 1 1.568 0.02 A 25 MET HB3 H 1 1.911 0.02 A 25 MET HE% H 1 1.973 0.02 A 25 MET HG2 H 1 2.615 0.02 A 25 MET HG3 H 1 2.429 0.02 A 25 MET C C 13 175.735 0.20 A 25 MET CA C 13 54.339 0.20 A 25 MET CB C 13 37.347 0.20 A 25 MET CE C 13 16.745 0.20 A 25 MET CG C 13 32.662 0.20 A 25 MET N N 15 127.256 0.20 A 26 LYS H H 1 9.189 0.02 A 26 LYS HA H 1 4.315 0.02 A 26 LYS HB2 H 1 1.826 0.02 A 26 LYS HB3 H 1 2.028 0.02 A 26 LYS HD2 H 1 1.748 0.02 A 26 LYS HD3 H 1 1.748 0.02 A 26 LYS HE2 H 1 3.025 0.02 A 26 LYS HE3 H 1 3.025 0.02 A 26 LYS HGx H 1 1.588 0.02 A 26 LYS HGy H 1 1.643 0.02 A 26 LYS C C 13 178.259 0.20 A 26 LYS CA C 13 56.725 0.20 A 26 LYS CB C 13 32.963 0.20 A 26 LYS CD C 13 29.336 0.20 A 26 LYS CE C 13 41.884 0.20 A 26 LYS CG C 13 25.504 0.20 A 26 LYS N N 15 123.671 0.20 A 27 LYS H H 1 8.871 0.02 A 27 LYS HA H 1 3.864 0.02 A 27 LYS HB2 H 1 1.965 0.02 A 27 LYS HB3 H 1 1.965 0.02 A 27 LYS HDx H 1 1.626 0.02 A 27 LYS HDy H 1 1.833 0.02 A 27 LYS HE2 H 1 3.089 0.02 A 27 LYS HE3 H 1 3.089 0.02 A 27 LYS HGy H 1 1.520 0.02 A 27 LYS HGx H 1 1.480 0.02 A 27 LYS C C 13 177.241 0.20 A 27 LYS CA C 13 60.587 0.20 A 27 LYS CB C 13 32.359 0.20 A 27 LYS CD C 13 28.777 0.20 A 27 LYS CE C 13 42.149 0.20 A 27 LYS CG C 13 24.800 0.20 A 27 LYS N N 15 126.369 0.20 A 28 THR H H 1 8.110 0.02 A 28 THR HA H 1 4.135 0.02 A 28 THR HB H 1 4.177 0.02 A 28 THR HG2% H 1 1.304 0.02 A 28 THR C C 13 176.847 0.20 A 28 THR CA C 13 64.757 0.20 A 28 THR CB C 13 68.084 0.20 A 28 THR CG2 C 13 22.214 0.20 A 28 THR N N 15 107.099 0.20 A 29 ASP H H 1 6.779 0.02 A 29 ASP HA H 1 4.586 0.02 A 29 ASP HB2 H 1 2.730 0.02 A 29 ASP HB3 H 1 2.730 0.02 A 29 ASP C C 13 178.416 0.20 A 29 ASP CA C 13 56.656 0.20 A 29 ASP CB C 13 40.727 0.20 A 29 ASP N N 15 119.543 0.20 A 30 PHE H H 1 8.633 0.02 A 30 PHE HA H 1 3.936 0.02 A 30 PHE HB2 H 1 2.665 0.02 A 30 PHE HB3 H 1 2.769 0.02 A 30 PHE HD1 H 1 6.732 0.02 A 30 PHE HD2 H 1 6.732 0.02 A 30 PHE HE1 H 1 6.043 0.02 A 30 PHE HE2 H 1 6.043 0.02 A 30 PHE HZ H 1 5.944 0.02 A 30 PHE C C 13 177.257 0.20 A 30 PHE CA C 13 60.862 0.20 A 30 PHE CB C 13 39.030 0.20 A 30 PHE CD1 C 13 130.158 0.20 A 30 PHE CE1 C 13 129.275 0.20 A 30 PHE CZ C 13 128.457 0.20 A 30 PHE N N 15 123.437 0.20 A 31 ASP H H 1 8.650 0.02 A 31 ASP HA H 1 4.150 0.02 A 31 ASP HB2 H 1 2.593 0.02 A 31 ASP HB3 H 1 2.593 0.02 A 31 ASP C C 13 178.427 0.20 A 31 ASP CA C 13 57.075 0.20 A 31 ASP CB C 13 39.986 0.20 A 31 ASP N N 15 117.040 0.20 A 32 LYS H H 1 6.927 0.02 A 32 LYS HA H 1 4.114 0.02 A 32 LYS HB2 H 1 1.909 0.02 A 32 LYS HB3 H 1 1.993 0.02 A 32 LYS HD2 H 1 1.766 0.02 A 32 LYS HD3 H 1 1.766 0.02 A 32 LYS HE2 H 1 3.046 0.02 A 32 LYS HE3 H 1 3.046 0.02 A 32 LYS HG2 H 1 1.511 0.02 A 32 LYS HG3 H 1 1.715 0.02 A 32 LYS C C 13 178.076 0.20 A 32 LYS CA C 13 58.387 0.20 A 32 LYS CB C 13 33.255 0.20 A 32 LYS CD C 13 29.323 0.20 A 32 LYS CE C 13 42.197 0.20 A 32 LYS CG C 13 25.285 0.20 A 32 LYS N N 15 114.800 0.20 A 33 VAL H H 1 7.404 0.02 A 33 VAL HA H 1 4.619 0.02 A 33 VAL HB H 1 2.643 0.02 A 33 VAL HG1% H 1 0.824 0.02 A 33 VAL HG2% H 1 0.689 0.02 A 33 VAL C C 13 176.414 0.20 A 33 VAL CA C 13 60.060 0.20 A 33 VAL CB C 13 32.434 0.20 A 33 VAL CG1 C 13 21.586 0.20 A 33 VAL CG2 C 13 18.975 0.20 A 33 VAL N N 15 109.380 0.20 A 34 ALA H H 1 6.714 0.02 A 34 ALA HA H 1 3.016 0.02 A 34 ALA HB% H 1 1.049 0.02 A 34 ALA C C 13 179.434 0.20 A 34 ALA CA C 13 55.264 0.20 A 34 ALA CB C 13 19.394 0.20 A 34 ALA N N 15 124.530 0.20 A 35 SER H H 1 8.121 0.02 A 35 SER HA H 1 4.324 0.02 A 35 SER HBy H 1 4.010 0.02 A 35 SER HBx H 1 3.885 0.02 A 35 SER C C 13 175.490 0.20 A 35 SER CA C 13 60.456 0.20 A 35 SER CB C 13 62.536 0.20 A 35 SER N N 15 110.547 0.20 A 36 GLU H H 1 8.305 0.02 A 36 GLU HA H 1 4.273 0.02 A 36 GLU HBx H 1 1.966 0.02 A 36 GLU HBy H 1 2.032 0.02 A 36 GLU HGy H 1 2.267 0.02 A 36 GLU HGx H 1 2.170 0.02 A 36 GLU C C 13 174.975 0.20 A 36 GLU CA C 13 55.787 0.20 A 36 GLU CB C 13 29.085 0.20 A 36 GLU CG C 13 35.223 0.20 A 36 GLU N N 15 119.216 0.20 A 37 TYR H H 1 7.922 0.02 A 37 TYR HA H 1 5.150 0.02 A 37 TYR HB2 H 1 2.882 0.02 A 37 TYR HB3 H 1 3.141 0.02 A 37 TYR HD1 H 1 6.902 0.02 A 37 TYR HD2 H 1 6.902 0.02 A 37 TYR HE1 H 1 6.630 0.02 A 37 TYR HE2 H 1 6.630 0.02 A 37 TYR C C 13 174.389 0.20 A 37 TYR CA C 13 57.956 0.20 A 37 TYR CB C 13 44.240 0.20 A 37 TYR CD2 C 13 132.471 0.20 A 37 TYR CE2 C 13 117.735 0.20 A 37 TYR N N 15 117.179 0.20 A 38 THR H H 1 9.483 0.02 A 38 THR HA H 1 4.843 0.02 A 38 THR HB H 1 3.958 0.02 A 38 THR HG2% H 1 1.262 0.02 A 38 THR C C 13 173.863 0.20 A 38 THR CA C 13 60.454 0.20 A 38 THR CB C 13 71.300 0.20 A 38 THR CG2 C 13 21.601 0.20 A 38 THR N N 15 115.546 0.20 A 39 LYS H H 1 9.290 0.02 A 39 LYS HA H 1 3.883 0.02 A 39 LYS HBx H 1 1.694 0.02 A 39 LYS HBy H 1 1.841 0.02 A 39 LYS HD2 H 1 1.503 0.02 A 39 LYS HD3 H 1 1.503 0.02 A 39 LYS HE2 H 1 2.695 0.02 A 39 LYS HE3 H 1 2.695 0.02 A 39 LYS HG2 H 1 1.060 0.02 A 39 LYS HG3 H 1 0.786 0.02 A 39 LYS C C 13 176.918 0.20 A 39 LYS CA C 13 57.615 0.20 A 39 LYS CB C 13 32.590 0.20 A 39 LYS CD C 13 29.541 0.20 A 39 LYS CE C 13 41.847 0.20 A 39 LYS CG C 13 25.434 0.20 A 39 LYS N N 15 130.415 0.20 A 40 ILE H H 1 8.819 0.02 A 40 ILE HA H 1 4.558 0.02 A 40 ILE HB H 1 1.950 0.02 A 40 ILE HD1% H 1 0.748 0.02 A 40 ILE HG1x H 1 0.774 0.02 A 40 ILE HG1y H 1 1.140 0.02 A 40 ILE HG2% H 1 0.924 0.02 A 40 ILE C C 13 14.505 0.20 A 40 ILE CA C 13 61.052 0.20 A 40 ILE CB C 13 39.357 0.20 A 40 ILE CD1 C 13 14.505 0.20 A 40 ILE CG1 C 13 26.807 0.20 A 40 ILE CG2 C 13 17.918 0.20 A 40 ILE N N 15 122.004 0.20 A 41 GLY H H 1 7.136 0.02 A 41 GLY HA2 H 1 3.954 0.02 A 41 GLY HA3 H 1 4.261 0.02 A 41 GLY C C 13 170.679 0.20 A 41 GLY CA C 13 45.206 0.20 A 41 GLY N N 15 107.582 0.20 A 42 THR H H 1 8.218 0.02 A 42 THR HA H 1 5.237 0.02 A 42 THR HB H 1 3.902 0.02 A 42 THR HG2% H 1 1.209 0.02 A 42 THR C C 13 173.547 0.20 A 42 THR CA C 13 60.959 0.20 A 42 THR CB C 13 72.255 0.20 A 42 THR CG2 C 13 21.241 0.20 A 42 THR N N 15 115.052 0.20 A 43 ILE H H 1 9.129 0.02 A 43 ILE HA H 1 4.787 0.02 A 43 ILE HB H 1 1.769 0.02 A 43 ILE HD1% H 1 0.709 0.02 A 43 ILE HG1y H 1 1.249 0.02 A 43 ILE HG1x H 1 0.872 0.02 A 43 ILE HG2% H 1 0.759 0.02 A 43 ILE C C 13 16.529 0.20 A 43 ILE CA C 13 59.552 0.20 A 43 ILE CB C 13 42.701 0.20 A 43 ILE CD1 C 13 16.529 0.20 A 43 ILE CG1 C 13 25.322 0.20 A 43 ILE CG2 C 13 18.171 0.20 A 43 ILE N N 15 118.029 0.20 A 44 SER H H 1 8.335 0.02 A 44 SER HA H 1 5.252 0.02 A 44 SER HBy H 1 3.751 0.02 A 44 SER HBx H 1 3.684 0.02 A 44 SER C C 13 173.804 0.20 A 44 SER CA C 13 56.792 0.20 A 44 SER CB C 13 66.063 0.20 A 44 SER N N 15 113.484 0.20 A 45 THR H H 1 8.375 0.02 A 45 THR HA H 1 4.555 0.02 A 45 THR HB H 1 4.305 0.02 A 45 THR HG2% H 1 1.226 0.02 A 45 THR C C 13 174.717 0.20 A 45 THR CA C 13 60.871 0.20 A 45 THR CB C 13 70.060 0.20 A 45 THR CG2 C 13 21.691 0.20 A 45 THR N N 15 113.454 0.20 A 46 THR H H 1 8.542 0.02 A 46 THR HA H 1 4.401 0.02 A 46 THR HB H 1 4.158 0.02 A 46 THR HG2% H 1 1.189 0.02 A 46 THR C C 13 174.729 0.20 A 46 THR CA C 13 62.097 0.20 A 46 THR CB C 13 69.387 0.20 A 46 THR CG2 C 13 21.702 0.20 A 46 THR N N 15 117.848 0.20 A 47 GLY H H 1 8.325 0.02 A 47 GLY HAx H 1 3.897 0.02 A 47 GLY HAy H 1 3.990 0.02 A 47 GLY C C 13 173.664 0.20 A 47 GLY CA C 13 44.883 0.20 A 47 GLY N N 15 111.660 0.20 A 48 GLU H H 1 8.437 0.02 A 48 GLU HA H 1 4.396 0.02 A 48 GLU HB2 H 1 1.856 0.02 A 48 GLU HB3 H 1 1.856 0.02 A 48 GLU HGx H 1 2.117 0.02 A 48 GLU HGy H 1 2.184 0.02 A 48 GLU C C 13 176.169 0.20 A 48 GLU CA C 13 55.704 0.20 A 48 GLU CB C 13 29.594 0.20 A 48 GLU CG C 13 35.381 0.20 A 48 GLU N N 15 120.153 0.20 A 49 MET H H 1 8.390 0.02 A 49 MET HA H 1 4.696 0.02 A 49 MET HBy H 1 2.262 0.02 A 49 MET HBx H 1 1.905 0.02 A 49 MET HE% H 1 2.064 0.02 A 49 MET HG2 H 1 2.518 0.02 A 49 MET HG3 H 1 2.518 0.02 A 49 MET C C 13 175.490 0.20 A 49 MET CA C 13 55.028 0.20 A 49 MET CB C 13 36.079 0.20 A 49 MET CE C 13 17.646 0.20 A 49 MET CG C 13 32.182 0.20 A 49 MET N N 15 120.146 0.20 A 50 SER H H 1 9.023 0.02 A 50 SER HA H 1 4.780 0.02 A 50 SER HBy H 1 4.269 0.02 A 50 SER HBx H 1 4.060 0.02 A 50 SER CA C 13 56.822 0.20 A 50 SER CB C 13 62.631 0.20 A 50 SER N N 15 118.105 0.20 A 51 PRO HA H 1 4.241 0.02 A 51 PRO HBx H 1 1.983 0.02 A 51 PRO HBy H 1 2.402 0.02 A 51 PRO HD2 H 1 3.898 0.02 A 51 PRO HD3 H 1 3.898 0.02 A 51 PRO HGy H 1 2.203 0.02 A 51 PRO HGx H 1 2.018 0.02 A 51 PRO C C 13 178.966 0.20 A 51 PRO CA C 13 66.078 0.20 A 51 PRO CB C 13 32.007 0.20 A 51 PRO CD C 13 50.235 0.20 A 51 PRO CG C 13 28.017 0.20 A 52 LEU H H 1 8.169 0.02 A 52 LEU HA H 1 4.112 0.02 A 52 LEU HBy H 1 1.674 0.02 A 52 LEU HBx H 1 1.575 0.02 A 52 LEU HD1% H 1 0.946 0.02 A 52 LEU HD2% H 1 0.885 0.02 A 52 LEU HG H 1 1.660 0.02 A 52 LEU C C 13 179.024 0.20 A 52 LEU CA C 13 57.948 0.20 A 52 LEU CB C 13 41.592 0.20 A 52 LEU CD1 C 13 24.405 0.20 A 52 LEU CD2 C 13 24.070 0.20 A 52 LEU CG C 13 27.125 0.20 A 52 LEU N N 15 117.624 0.20 A 53 ASP H H 1 7.515 0.02 A 53 ASP HA H 1 4.422 0.02 A 53 ASP HB2 H 1 2.782 0.02 A 53 ASP HB3 H 1 2.782 0.02 A 53 ASP C C 13 178.802 0.20 A 53 ASP CA C 13 56.748 0.20 A 53 ASP CB C 13 39.840 0.20 A 53 ASP N N 15 120.042 0.20 A 54 ALA H H 1 8.806 0.02 A 54 ALA HA H 1 4.210 0.02 A 54 ALA HB% H 1 1.384 0.02 A 54 ALA C C 13 179.059 0.20 A 54 ALA CA C 13 54.800 0.20 A 54 ALA CB C 13 18.442 0.20 A 54 ALA N N 15 123.542 0.20 A 55 ARG H H 1 7.869 0.02 A 55 ARG HA H 1 3.742 0.02 A 55 ARG HB2 H 1 1.972 0.02 A 55 ARG HB3 H 1 1.920 0.02 A 55 ARG HDy H 1 3.251 0.02 A 55 ARG HDx H 1 3.200 0.02 A 55 ARG HE H 1 7.461 0.02 A 55 ARG HG2 H 1 1.805 0.02 A 55 ARG HG3 H 1 1.469 0.02 A 55 ARG C C 13 177.526 0.20 A 55 ARG CA C 13 60.301 0.20 A 55 ARG CB C 13 30.267 0.20 A 55 ARG CD C 13 43.620 0.20 A 55 ARG CG C 13 28.346 0.20 A 55 ARG N N 15 117.281 0.20 A 55 ARG NE N 15 83.920 0.20 A 56 GLU H H 1 7.638 0.02 A 56 GLU HA H 1 4.009 0.02 A 56 GLU HB2 H 1 2.132 0.02 A 56 GLU HB3 H 1 2.132 0.02 A 56 GLU HGy H 1 2.534 0.02 A 56 GLU HGx H 1 2.420 0.02 A 56 GLU C C 13 178.755 0.20 A 56 GLU CA C 13 58.840 0.20 A 56 GLU CB C 13 28.690 0.20 A 56 GLU CG C 13 34.969 0.20 A 56 GLU N N 15 116.048 0.20 A 57 ASP H H 1 8.126 0.02 A 57 ASP HA H 1 4.384 0.02 A 57 ASP HBy H 1 2.782 0.02 A 57 ASP HBx H 1 2.696 0.02 A 57 ASP C C 13 42.532 0.20 A 57 ASP CA C 13 57.474 0.20 A 57 ASP CB C 13 42.532 0.20 A 57 ASP N N 15 120.238 0.20 A 58 LEU H H 1 8.172 0.02 A 58 LEU HA H 1 3.861 0.02 A 58 LEU HB2 H 1 1.915 0.02 A 58 LEU HB3 H 1 1.082 0.02 A 58 LEU HD1% H 1 0.580 0.02 A 58 LEU HD2% H 1 0.530 0.02 A 58 LEU HG H 1 1.800 0.02 A 58 LEU C C 13 178.767 0.20 A 58 LEU CA C 13 57.596 0.20 A 58 LEU CB C 13 41.614 0.20 A 58 LEU CD1 C 13 26.004 0.20 A 58 LEU CD2 C 13 22.431 0.20 A 58 LEU CG C 13 26.179 0.20 A 58 LEU N N 15 117.410 0.20 A 59 ILE H H 1 8.028 0.02 A 59 ILE HA H 1 3.303 0.02 A 59 ILE HB H 1 1.869 0.02 A 59 ILE HD1% H 1 0.808 0.02 A 59 ILE HG12 H 1 0.854 0.02 A 59 ILE HG13 H 1 1.698 0.02 A 59 ILE HG2% H 1 0.891 0.02 A 59 ILE C C 13 177.234 0.20 A 59 ILE CA C 13 65.757 0.20 A 59 ILE CB C 13 37.563 0.20 A 59 ILE CD1 C 13 12.994 0.20 A 59 ILE CG1 C 13 29.743 0.20 A 59 ILE CG2 C 13 17.825 0.20 A 59 ILE N N 15 118.841 0.20 A 60 LYS H H 1 7.895 0.02 A 60 LYS HA H 1 4.094 0.02 A 60 LYS HB2 H 1 1.978 0.02 A 60 LYS HB3 H 1 1.978 0.02 A 60 LYS HD2 H 1 1.737 0.02 A 60 LYS HD3 H 1 1.737 0.02 A 60 LYS HE2 H 1 3.002 0.02 A 60 LYS HE3 H 1 3.002 0.02 A 60 LYS HGy H 1 1.617 0.02 A 60 LYS HGx H 1 1.430 0.02 A 60 LYS C C 13 180.277 0.20 A 60 LYS CA C 13 59.753 0.20 A 60 LYS CB C 13 32.135 0.20 A 60 LYS CD C 13 29.359 0.20 A 60 LYS CE C 13 42.072 0.20 A 60 LYS CG C 13 25.085 0.20 A 60 LYS N N 15 119.525 0.20 A 61 LYS H H 1 8.086 0.02 A 61 LYS HA H 1 3.987 0.02 A 61 LYS HB2 H 1 1.830 0.02 A 61 LYS HB3 H 1 1.695 0.02 A 61 LYS HDy H 1 1.630 0.02 A 61 LYS HDx H 1 1.467 0.02 A 61 LYS HEy H 1 3.088 0.02 A 61 LYS HEx H 1 3.009 0.02 A 61 LYS HG2 H 1 1.415 0.02 A 61 LYS HG3 H 1 1.636 0.02 A 61 LYS C C 13 179.364 0.20 A 61 LYS CA C 13 59.274 0.20 A 61 LYS CB C 13 33.544 0.20 A 61 LYS CD C 13 29.269 0.20 A 61 LYS CE C 13 42.114 0.20 A 61 LYS CG C 13 26.757 0.20 A 61 LYS N N 15 119.257 0.20 A 62 ALA H H 1 8.489 0.02 A 62 ALA HA H 1 3.773 0.02 A 62 ALA HB% H 1 1.197 0.02 A 62 ALA C C 13 179.773 0.20 A 62 ALA CA C 13 55.037 0.20 A 62 ALA CB C 13 19.102 0.20 A 62 ALA N N 15 122.326 0.20 A 63 ASP H H 1 8.855 0.02 A 63 ASP HA H 1 4.595 0.02 A 63 ASP HBy H 1 2.883 0.02 A 63 ASP HBx H 1 2.705 0.02 A 63 ASP C C 13 180.757 0.20 A 63 ASP CA C 13 57.080 0.20 A 63 ASP CB C 13 39.029 0.20 A 63 ASP N N 15 120.381 0.20 A 64 GLU H H 1 8.053 0.02 A 64 GLU HA H 1 4.077 0.02 A 64 GLU HB2 H 1 2.233 0.02 A 64 GLU HB3 H 1 2.132 0.02 A 64 GLU HGx H 1 2.360 0.02 A 64 GLU HGy H 1 2.566 0.02 A 64 GLU C C 13 178.146 0.20 A 64 GLU CA C 13 58.895 0.20 A 64 GLU CB C 13 29.124 0.20 A 64 GLU CG C 13 35.804 0.20 A 64 GLU N N 15 121.428 0.20 A 65 LYS H H 1 7.186 0.02 A 65 LYS HA H 1 4.320 0.02 A 65 LYS HB2 H 1 1.661 0.02 A 65 LYS HB3 H 1 1.944 0.02 A 65 LYS HDx H 1 1.497 0.02 A 65 LYS HDy H 1 1.614 0.02 A 65 LYS HEx H 1 2.958 0.02 A 65 LYS HEy H 1 2.997 0.02 A 65 LYS HGx H 1 1.380 0.02 A 65 LYS HGy H 1 1.529 0.02 A 65 LYS C C 13 176.169 0.20 A 65 LYS CA C 13 54.830 0.20 A 65 LYS CB C 13 33.019 0.20 A 65 LYS CD C 13 28.367 0.20 A 65 LYS CE C 13 42.092 0.20 A 65 LYS CG C 13 24.869 0.20 A 65 LYS N N 15 115.778 0.20 A 66 GLY H H 1 7.873 0.02 A 66 GLY HAx H 1 3.864 0.02 A 66 GLY HAy H 1 3.977 0.02 A 66 GLY C C 13 174.413 0.20 A 66 GLY CA C 13 45.822 0.20 A 66 GLY N N 15 107.578 0.20 A 67 ALA H H 1 7.927 0.02 A 67 ALA HA H 1 4.022 0.02 A 67 ALA HB% H 1 1.266 0.02 A 67 ALA C C 13 175.771 0.20 A 67 ALA CA C 13 51.699 0.20 A 67 ALA CB C 13 21.210 0.20 A 67 ALA N N 15 119.025 0.20 A 68 ASP H H 1 8.793 0.02 A 68 ASP HA H 1 5.071 0.02 A 68 ASP HB2 H 1 3.247 0.02 A 68 ASP HB3 H 1 2.669 0.02 A 68 ASP C C 13 177.117 0.20 A 68 ASP CA C 13 56.601 0.20 A 68 ASP CB C 13 45.008 0.20 A 68 ASP N N 15 116.686 0.20 A 69 VAL H H 1 8.076 0.02 A 69 VAL HA H 1 5.130 0.02 A 69 VAL HB H 1 1.436 0.02 A 69 VAL HG1% H 1 0.575 0.02 A 69 VAL HG2% H 1 0.715 0.02 A 69 VAL C C 13 173.044 0.20 A 69 VAL CA C 13 60.430 0.20 A 69 VAL CB C 13 37.603 0.20 A 69 VAL CG1 C 13 22.506 0.20 A 69 VAL CG2 C 13 23.522 0.20 A 69 VAL N N 15 118.623 0.20 A 70 VAL H H 1 8.724 0.02 A 70 VAL HA H 1 4.560 0.02 A 70 VAL HB H 1 1.738 0.02 A 70 VAL HG1% H 1 0.618 0.02 A 70 VAL HG2% H 1 0.553 0.02 A 70 VAL C C 13 173.336 0.20 A 70 VAL CA C 13 59.943 0.20 A 70 VAL CB C 13 34.433 0.20 A 70 VAL CG1 C 13 21.718 0.20 A 70 VAL CG2 C 13 22.158 0.20 A 70 VAL N N 15 127.358 0.20 A 71 VAL H H 1 8.891 0.02 A 71 VAL HA H 1 4.556 0.02 A 71 VAL HB H 1 1.794 0.02 A 71 VAL HG1% H 1 0.759 0.02 A 71 VAL HG2% H 1 0.025 0.02 A 71 VAL C C 13 175.970 0.20 A 71 VAL CA C 13 60.852 0.20 A 71 VAL CB C 13 34.062 0.20 A 71 VAL CG1 C 13 20.445 0.20 A 71 VAL CG2 C 13 20.712 0.20 A 71 VAL N N 15 126.739 0.20 A 72 LEU H H 1 8.802 0.02 A 72 LEU HA H 1 4.448 0.02 A 72 LEU HB2 H 1 1.739 0.02 A 72 LEU HB3 H 1 1.636 0.02 A 72 LEU HD1% H 1 0.851 0.02 A 72 LEU HD2% H 1 0.765 0.02 A 72 LEU HG H 1 1.680 0.02 A 72 LEU C C 13 178.158 0.20 A 72 LEU CA C 13 55.720 0.20 A 72 LEU CB C 13 41.631 0.20 A 72 LEU CD1 C 13 25.361 0.20 A 72 LEU CD2 C 13 23.512 0.20 A 72 LEU CG C 13 27.748 0.20 A 72 LEU N N 15 127.581 0.20 A 73 THR H H 1 8.631 0.02 A 73 THR HA H 1 4.420 0.02 A 73 THR HB H 1 4.346 0.02 A 73 THR HG2% H 1 1.188 0.02 A 73 THR C C 13 174.951 0.20 A 73 THR CA C 13 61.516 0.20 A 73 THR CB C 13 69.462 0.20 A 73 THR CG2 C 13 21.934 0.20 A 73 THR N N 15 114.207 0.20 A 74 SER H H 1 8.137 0.02 A 74 SER HA H 1 4.542 0.02 A 74 SER HB2 H 1 4.013 0.02 A 74 SER HB3 H 1 4.013 0.02 A 74 SER C C 13 175.057 0.20 A 74 SER CA C 13 58.066 0.20 A 74 SER CB C 13 63.962 0.20 A 74 SER N N 15 116.164 0.20 A 75 GLY H H 1 8.574 0.02 A 75 GLY HA2 H 1 4.034 0.02 A 75 GLY HA3 H 1 4.034 0.02 A 75 GLY C C 13 174.237 0.20 A 75 GLY CA C 13 45.284 0.20 A 75 GLY N N 15 110.048 0.20 A 76 GLN H H 1 8.393 0.02 A 76 GLN HA H 1 4.499 0.02 A 76 GLN HBy H 1 2.198 0.02 A 76 GLN HBx H 1 2.018 0.02 A 76 GLN HE21 H 1 7.522 0.02 A 76 GLN HE22 H 1 6.845 0.02 A 76 GLN HG2 H 1 2.359 0.02 A 76 GLN HG3 H 1 2.359 0.02 A 76 GLN C C 13 176.239 0.20 A 76 GLN CA C 13 55.969 0.20 A 76 GLN CB C 13 29.761 0.20 A 76 GLN CG C 13 34.036 0.20 A 76 GLN N N 15 119.520 0.20 A 76 GLN NE2 N 15 111.980 0.20 A 77 THR H H 1 8.105 0.02 A 77 THR HA H 1 4.432 0.02 A 77 THR HB H 1 4.342 0.02 A 77 THR HG2% H 1 1.184 0.02 A 77 THR C C 13 174.483 0.20 A 77 THR CA C 13 61.408 0.20 A 77 THR CB C 13 69.786 0.20 A 77 THR CG2 C 13 21.672 0.20 A 77 THR N N 15 113.213 0.20 A 78 GLU H H 1 8.454 0.02 A 78 GLU HA H 1 4.248 0.02 A 78 GLU HBy H 1 2.124 0.02 A 78 GLU HBx H 1 1.955 0.02 A 78 GLU HG2 H 1 2.312 0.02 A 78 GLU HG3 H 1 2.312 0.02 A 78 GLU C C 13 175.946 0.20 A 78 GLU CA C 13 56.990 0.20 A 78 GLU CB C 13 29.789 0.20 A 78 GLU CG C 13 35.823 0.20 A 78 GLU N N 15 120.912 0.20 A 79 ASN H H 1 8.329 0.02 A 79 ASN HA H 1 4.605 0.02 A 79 ASN HBy H 1 2.858 0.02 A 79 ASN HBx H 1 2.782 0.02 A 79 ASN HD21 H 1 7.615 0.02 A 79 ASN HD22 H 1 6.964 0.02 A 79 ASN C C 13 174.694 0.20 A 79 ASN CA C 13 53.760 0.20 A 79 ASN CB C 13 38.731 0.20 A 79 ASN N N 15 117.094 0.20 A 79 ASN ND2 N 15 112.901 0.20 A 80 LYS H H 1 7.910 0.02 A 80 LYS HA H 1 4.307 0.02 A 80 LYS HB2 H 1 1.680 0.02 A 80 LYS HB3 H 1 1.680 0.02 A 80 LYS HD2 H 1 1.631 0.02 A 80 LYS HD3 H 1 1.631 0.02 A 80 LYS HE2 H 1 2.958 0.02 A 80 LYS HE3 H 1 2.958 0.02 A 80 LYS HGy H 1 1.385 0.02 A 80 LYS HGx H 1 1.269 0.02 A 80 LYS C C 13 175.501 0.20 A 80 LYS CA C 13 56.116 0.20 A 80 LYS CB C 13 33.378 0.20 A 80 LYS CD C 13 29.315 0.20 A 80 LYS CE C 13 42.065 0.20 A 80 LYS CG C 13 24.902 0.20 A 80 LYS N N 15 118.942 0.20 A 81 ILE H H 1 8.341 0.02 A 81 ILE HA H 1 4.306 0.02 A 81 ILE HB H 1 1.749 0.02 A 81 ILE HD1% H 1 0.809 0.02 A 81 ILE HG1y H 1 1.375 0.02 A 81 ILE HG1x H 1 1.051 0.02 A 81 ILE HG2% H 1 0.766 0.02 A 81 ILE C C 13 175.408 0.20 A 81 ILE CA C 13 60.526 0.20 A 81 ILE CB C 13 40.050 0.20 A 81 ILE CD1 C 13 13.483 0.20 A 81 ILE CG1 C 13 27.116 0.20 A 81 ILE CG2 C 13 17.711 0.20 A 81 ILE N N 15 119.677 0.20 A 82 HIS H H 1 8.472 0.02 A 82 HIS HA H 1 4.776 0.02 A 82 HIS HBy H 1 3.276 0.02 A 82 HIS HBx H 1 3.123 0.02 A 82 HIS HD2 H 1 7.270 0.02 A 82 HIS C C 13 174.015 0.20 A 82 HIS CA C 13 54.684 0.20 A 82 HIS CB C 13 28.930 0.20 A 82 HIS CD2 C 13 119.642 0.20 A 82 HIS N N 15 121.812 0.20 A 83 GLY H H 1 8.334 0.02 A 83 GLY HA2 H 1 4.187 0.02 A 83 GLY HA3 H 1 3.692 0.02 A 83 GLY C C 13 172.903 0.20 A 83 GLY CA C 13 45.124 0.20 A 83 GLY N N 15 111.641 0.20 A 84 THR H H 1 8.125 0.02 A 84 THR HA H 1 5.037 0.02 A 84 THR HB H 1 4.071 0.02 A 84 THR HG2% H 1 1.069 0.02 A 84 THR C C 13 173.676 0.20 A 84 THR CA C 13 60.301 0.20 A 84 THR CB C 13 72.048 0.20 A 84 THR CG2 C 13 21.549 0.20 A 84 THR N N 15 112.460 0.20 A 85 ALA H H 1 8.841 0.02 A 85 ALA HA H 1 4.959 0.02 A 85 ALA HB% H 1 1.099 0.02 A 85 ALA C C 13 175.092 0.20 A 85 ALA CA C 13 51.270 0.20 A 85 ALA CB C 13 23.843 0.20 A 85 ALA N N 15 122.513 0.20 A 86 ASP H H 1 8.506 0.02 A 86 ASP HA H 1 5.198 0.02 A 86 ASP HB2 H 1 2.540 0.02 A 86 ASP HB3 H 1 2.139 0.02 A 86 ASP C C 13 175.139 0.20 A 86 ASP CA C 13 53.477 0.20 A 86 ASP CB C 13 43.329 0.20 A 86 ASP N N 15 121.651 0.20 A 87 ILE H H 1 7.966 0.02 A 87 ILE HA H 1 5.379 0.02 A 87 ILE HB H 1 1.528 0.02 A 87 ILE HD1% H 1 0.635 0.02 A 87 ILE HG12 H 1 0.550 0.02 A 87 ILE HG13 H 1 1.378 0.02 A 87 ILE HG2% H 1 0.757 0.02 A 87 ILE C C 13 175.162 0.20 A 87 ILE CA C 13 58.189 0.20 A 87 ILE CB C 13 41.389 0.20 A 87 ILE CD1 C 13 14.787 0.20 A 87 ILE CG1 C 13 25.917 0.20 A 87 ILE CG2 C 13 19.912 0.20 A 87 ILE N N 15 111.376 0.20 A 88 TYR H H 1 8.754 0.02 A 88 TYR HA H 1 5.443 0.02 A 88 TYR HB2 H 1 2.467 0.02 A 88 TYR HB3 H 1 3.061 0.02 A 88 TYR HD1 H 1 6.505 0.02 A 88 TYR HD2 H 1 6.505 0.02 A 88 TYR C C 13 175.572 0.20 A 88 TYR CA C 13 57.017 0.20 A 88 TYR CB C 13 44.174 0.20 A 88 TYR CD2 C 13 131.921 0.20 A 88 TYR N N 15 118.138 0.20 A 89 LYS H H 1 9.595 0.02 A 89 LYS HA H 1 5.177 0.02 A 89 LYS HBy H 1 2.010 0.02 A 89 LYS HBx H 1 1.746 0.02 A 89 LYS HDy H 1 1.844 0.02 A 89 LYS HDx H 1 1.769 0.02 A 89 LYS HE2 H 1 3.091 0.02 A 89 LYS HE3 H 1 3.091 0.02 A 89 LYS HG2 H 1 1.616 0.02 A 89 LYS HG3 H 1 1.616 0.02 A 89 LYS C C 13 175.197 0.20 A 89 LYS CA C 13 54.466 0.20 A 89 LYS CB C 13 37.138 0.20 A 89 LYS CD C 13 29.436 0.20 A 89 LYS CE C 13 42.090 0.20 A 89 LYS CG C 13 24.831 0.20 A 89 LYS N N 15 123.705 0.20 A 90 LYS H H 1 10.195 0.02 A 90 LYS HA H 1 3.820 0.02 A 90 LYS HB2 H 1 1.572 0.02 A 90 LYS HB3 H 1 1.747 0.02 A 90 LYS HD2 H 1 1.496 0.02 A 90 LYS HD3 H 1 1.496 0.02 A 90 LYS HE2 H 1 2.888 0.02 A 90 LYS HE3 H 1 2.888 0.02 A 90 LYS HGx H 1 1.015 0.02 A 90 LYS HGy H 1 1.349 0.02 A 90 LYS CA C 13 57.666 0.20 A 90 LYS CB C 13 32.827 0.20 A 90 LYS CD C 13 29.107 0.20 A 90 LYS CE C 13 42.204 0.20 A 90 LYS CG C 13 25.572 0.20 A 90 LYS N N 15 129.328 0.20 A 91 LYS H H 1 8.459 0.02 A 91 LYS HA H 1 4.110 0.02 A 91 LYS HBy H 1 1.692 0.02 A 91 LYS HBx H 1 1.464 0.02 A 91 LYS HDy H 1 1.609 0.02 A 91 LYS HDx H 1 1.572 0.02 A 91 LYS HE2 H 1 2.872 0.02 A 91 LYS HE3 H 1 2.872 0.02 A 91 LYS HG2 H 1 1.345 0.02 A 91 LYS HG3 H 1 1.154 0.02 A 91 LYS C C 13 176.953 0.20 A 91 LYS CA C 13 57.325 0.20 A 91 LYS CB C 13 33.325 0.20 A 91 LYS CD C 13 29.574 0.20 A 91 LYS CE C 13 42.130 0.20 A 91 LYS CG C 13 25.984 0.20 A 91 LYS N N 15 126.034 0.20 A 92 LEU H H 1 8.266 0.02 A 92 LEU HA H 1 4.285 0.02 A 92 LEU HBy H 1 1.548 0.02 A 92 LEU HBx H 1 1.465 0.02 A 92 LEU HD1% H 1 0.831 0.02 A 92 LEU HD2% H 1 0.896 0.02 A 92 LEU HG H 1 1.550 0.02 A 92 LEU C C 13 176.742 0.20 A 92 LEU CA C 13 54.817 0.20 A 92 LEU CB C 13 42.315 0.20 A 92 LEU CD1 C 13 23.626 0.20 A 92 LEU CD2 C 13 24.770 0.20 A 92 LEU CG C 13 26.901 0.20 A 92 LEU N N 15 123.360 0.20 A 93 GLU H H 1 8.311 0.02 A 93 GLU HA H 1 4.224 0.02 A 93 GLU HBy H 1 1.869 0.02 A 93 GLU HBx H 1 1.832 0.02 A 93 GLU HGx H 1 2.142 0.02 A 93 GLU HGy H 1 2.177 0.02 A 93 GLU C C 13 175.934 0.20 A 93 GLU CA C 13 55.832 0.20 A 93 GLU CB C 13 30.425 0.20 A 93 GLU CG C 13 35.508 0.20 A 93 GLU N N 15 121.993 0.20 A 94 HIS H H 1 8.567 0.02 A 94 HIS HA H 1 4.636 0.02 A 94 HIS HBx H 1 3.056 0.02 A 94 HIS HBy H 1 3.149 0.02 A 94 HIS HD2 H 1 7.211 0.02 A 94 HIS C C 13 174.261 0.20 A 94 HIS CA C 13 55.059 0.20 A 94 HIS CB C 13 29.131 0.20 A 94 HIS CD2 C 13 119.427 0.20 A 94 HIS N N 15 119.802 0.20 A 95 HIS H H 1 8.600 0.02 A 95 HIS HA H 1 4.637 0.02 A 95 HIS HBx H 1 3.066 0.02 A 95 HIS HBy H 1 3.165 0.02 A 95 HIS CA C 13 55.174 0.20 A 95 HIS CB C 13 29.082 0.20 A 95 HIS N N 15 119.430 0.20 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 22 ALA HA A 23 GLU H 1.0 0.0 3.70 2 2 A 23 GLU HA A 24 ILE H 1.0 0.0 3.53 3 3 A 24 ILE H A 23 GLU HBx 1.0 0.0 4.76 4 4 A 24 ILE H A 23 GLU HBy 1.0 0.0 4.76 5 5 A 24 ILE H A 23 GLU HG2 1.0 0.0 4.79 6 5 A 24 ILE H A 23 GLU HG3 1.0 0.0 4.79 7 6 A 24 ILE HA A 25 MET H 1.0 0.0 3.58 8 7 A 25 MET H A 24 ILE HD1% 1.0 0.0 4.30 9 8 A 24 ILE HD1% A 70 VAL H 1.0 0.0 4.49 10 9 A 25 MET HA A 26 LYS H 1.0 0.0 3.48 11 10 A 26 LYS H A 25 MET HB3 1.0 0.0 4.41 12 11 A 26 LYS H A 25 MET HG2 1.0 0.0 5.02 13 12 A 26 LYS HA A 27 LYS H 1.0 0.0 3.55 14 13 A 27 LYS H A 28 THR H 1.0 0.0 4.56 15 14 A 28 THR H A 27 LYS HB2 1.0 0.0 4.11 16 14 A 28 THR H A 27 LYS HB3 1.0 0.0 4.11 17 15 A 28 THR HB A 29 ASP H 1.0 0.0 4.86 18 16 A 30 PHE H A 29 ASP HB2 1.0 0.0 4.15 19 16 A 29 ASP HB3 A 30 PHE H 1.0 0.0 4.15 20 17 A 30 PHE H A 30 PHE HB3 1.0 0.0 4.38 21 18 A 30 PHE HB3 A 31 ASP H 1.0 0.0 4.33 22 19 A 32 LYS H A 31 ASP HB2 1.0 0.0 4.36 23 19 A 31 ASP HB3 A 32 LYS H 1.0 0.0 4.36 24 20 A 31 ASP HA A 33 VAL H 1.0 0.0 5.38 25 21 A 33 VAL H A 32 LYS HB2 1.0 0.0 5.11 26 22 A 33 VAL H A 32 LYS HB3 1.0 0.0 5.19 27 23 A 33 VAL H A 34 ALA H 1.0 0.0 3.37 28 24 A 34 ALA H A 33 VAL HG1% 1.0 0.0 5.46 29 25 A 34 ALA H A 33 VAL HG2% 1.0 0.0 4.80 30 26 A 34 ALA H A 35 SER H 1.0 0.0 4.18 31 27 A 35 SER H A 34 ALA HB% 1.0 0.0 4.06 32 28 A 36 GLU H A 37 TYR H 1.0 0.0 3.94 33 29 A 37 TYR HA A 38 THR H 1.0 0.0 3.63 34 30 A 38 THR H A 37 TYR HB2 1.0 0.0 5.12 35 31 A 38 THR H A 37 TYR HB3 1.0 0.0 4.38 36 32 A 38 THR HA A 39 LYS H 1.0 0.0 3.51 37 33 A 40 ILE H A 39 LYS HBx 1.0 0.0 6.42 38 34 A 40 ILE H A 39 LYS HBy 1.0 0.0 6.42 39 35 A 40 ILE H A 39 LYS HD2 1.0 0.0 6.62 40 35 A 40 ILE H A 39 LYS HD3 1.0 0.0 6.62 41 36 A 40 ILE H A 87 ILE HB 1.0 0.0 6.83 42 37 A 40 ILE H A 41 GLY H 1.0 0.0 3.66 43 38 A 41 GLY H A 40 ILE HB 1.0 0.0 5.04 44 39 A 41 GLY H A 40 ILE HG2% 1.0 0.0 5.39 45 40 A 41 GLY H A 42 THR H 1.0 0.0 5.44 46 41 A 42 THR H A 41 GLY HA3 1.0 0.0 3.61 47 42 A 42 THR HA A 43 ILE H 1.0 0.0 3.53 48 43 A 43 ILE H A 43 ILE HG1y 1.0 0.0 4.74 49 44 A 43 ILE HA A 44 SER H 1.0 0.0 3.48 50 45 A 44 SER H A 43 ILE HB 1.0 0.0 3.64 51 46 A 44 SER H A 43 ILE HG2% 1.0 0.0 4.56 52 47 A 44 SER H A 43 ILE HG1y 1.0 0.0 5.66 53 48 A 44 SER H A 43 ILE HG1x 1.0 0.0 5.66 54 49 A 44 SER HA A 45 THR H 1.0 0.0 3.48 55 50 A 45 THR H A 44 SER HBy 1.0 0.0 4.82 56 51 A 45 THR H A 44 SER HBx 1.0 0.0 4.82 57 52 A 45 THR H A 83 GLY HA3 1.0 0.0 4.95 58 53 A 45 THR HA A 46 THR H 1.0 0.0 3.48 59 54 A 46 THR H A 45 THR HB 1.0 0.0 4.22 60 55 A 46 THR H A 45 THR HG2% 1.0 0.0 4.80 61 56 A 46 THR H A 46 THR HG2% 1.0 0.0 5.17 62 57 A 46 THR H A 47 GLY H 1.0 0.0 4.25 63 58 A 47 GLY H A 46 THR HA 1.0 0.0 3.55 64 59 A 46 THR HG2% A 47 GLY H 1.0 0.0 4.21 65 60 A 48 GLU HA A 49 MET H 1.0 0.0 3.57 66 61 A 49 MET H A 48 GLU HB2 1.0 0.0 4.34 67 61 A 49 MET H A 48 GLU HB3 1.0 0.0 4.34 68 62 A 50 SER H A 49 MET HBy 1.0 0.0 5.00 69 63 A 50 SER H A 49 MET HBx 1.0 0.0 5.00 70 64 A 50 SER H A 49 MET HG2 1.0 0.0 5.75 71 64 A 50 SER H A 49 MET HG3 1.0 0.0 5.75 72 65 A 52 LEU H A 51 PRO HD2 1.0 0.0 4.42 73 65 A 51 PRO HD3 A 52 LEU H 1.0 0.0 4.42 74 66 A 52 LEU H A 53 ASP H 1.0 0.0 4.02 75 67 A 53 ASP H A 52 LEU HBy 1.0 0.0 4.62 76 68 A 53 ASP H A 52 LEU HBx 1.0 0.0 4.62 77 69 A 54 ALA H A 53 ASP HB2 1.0 0.0 4.47 78 69 A 53 ASP HB3 A 54 ALA H 1.0 0.0 4.47 79 70 A 54 ALA H A 55 ARG H 1.0 0.0 4.03 80 71 A 55 ARG H A 54 ALA HB% 1.0 0.0 4.06 81 72 A 55 ARG HB3 A 56 GLU H 1.0 0.0 4.49 82 73 A 56 GLU H A 55 ARG HB2 1.0 0.0 4.61 83 74 A 56 GLU H A 55 ARG HG2 1.0 0.0 6.35 84 75 A 56 GLU H A 57 ASP H 1.0 0.0 4.02 85 76 A 57 ASP H A 56 GLU HB2 1.0 0.0 4.29 86 76 A 57 ASP H A 56 GLU HB3 1.0 0.0 4.29 87 77 A 58 LEU H A 57 ASP HBy 1.0 0.0 4.92 88 78 A 58 LEU H A 57 ASP HBx 1.0 0.0 4.92 89 79 A 58 LEU HB2 A 59 ILE H 1.0 0.0 4.48 90 80 A 59 ILE H A 58 LEU HB3 1.0 0.0 4.89 91 81 A 59 ILE H A 58 LEU HD1% 1.0 0.0 6.52 92 82 A 59 ILE H A 58 LEU HD2% 1.0 0.0 6.35 93 83 A 59 ILE H A 70 VAL HG2% 1.0 0.0 6.83 94 84 A 59 ILE HB A 60 LYS H 1.0 0.0 4.17 95 85 A 60 LYS H A 59 ILE HG13 1.0 0.0 6.12 96 86 A 61 LYS H A 60 LYS HB2 1.0 0.0 4.01 97 86 A 60 LYS HB3 A 61 LYS H 1.0 0.0 4.01 98 87 A 61 LYS H A 60 LYS HD2 1.0 0.0 5.18 99 87 A 61 LYS H A 60 LYS HD3 1.0 0.0 5.18 100 88 A 61 LYS H A 62 ALA H 1.0 0.0 3.85 101 89 A 62 ALA H A 61 LYS HB2 1.0 0.0 4.41 102 90 A 62 ALA H A 61 LYS HB3 1.0 0.0 4.91 103 91 A 62 ALA H A 61 LYS HG2 1.0 0.0 6.83 104 92 A 62 ALA H A 63 ASP H 1.0 0.0 4.01 105 93 A 63 ASP H A 62 ALA HB% 1.0 0.0 3.89 106 94 A 64 GLU H A 63 ASP HBy 1.0 0.0 5.08 107 95 A 64 GLU H A 63 ASP HBx 1.0 0.0 5.08 108 96 A 64 GLU HB2 A 65 LYS H 1.0 0.0 4.70 109 97 A 65 LYS H A 64 GLU HB3 1.0 0.0 4.79 110 98 A 65 LYS H A 66 GLY H 1.0 0.0 3.72 111 99 A 66 GLY H A 65 LYS HB2 1.0 0.0 5.31 112 100 A 68 ASP H A 69 VAL H 1.0 0.0 3.49 113 101 A 69 VAL H A 68 ASP HB3 1.0 0.0 4.32 114 102 A 70 VAL H A 69 VAL HA 1.0 0.0 3.34 115 103 A 70 VAL HA A 71 VAL H 1.0 0.0 3.51 116 104 A 27 LYS H A 26 LYS HD2 1.0 0.0 5.82 117 104 A 27 LYS H A 26 LYS HD3 1.0 0.0 5.82 118 105 A 71 VAL H A 69 VAL HG1% 1.0 0.0 5.97 119 106 A 71 VAL HA A 72 LEU H 1.0 0.0 3.39 120 107 A 72 LEU H A 71 VAL HB 1.0 0.0 5.03 121 108 A 72 LEU H A 71 VAL HG2% 1.0 0.0 5.09 122 109 A 72 LEU H A 71 VAL HG1% 1.0 0.0 4.20 123 110 A 72 LEU HA A 73 THR H 1.0 0.0 3.49 124 111 A 73 THR H A 72 LEU HB2 1.0 0.0 5.47 125 112 A 73 THR H A 72 LEU HB3 1.0 0.0 4.76 126 113 A 73 THR H A 72 LEU HD1% 1.0 0.0 5.84 127 114 A 73 THR H A 72 LEU HD2% 1.0 0.0 5.07 128 115 A 73 THR H A 74 SER H 1.0 0.0 3.95 129 116 A 74 SER H A 73 THR HB 1.0 0.0 4.77 130 117 A 74 SER H A 73 THR HG2% 1.0 0.0 5.42 131 118 A 74 SER H A 75 GLY H 1.0 0.0 4.70 132 119 A 75 GLY H A 74 SER HA 1.0 0.0 3.64 133 120 A 76 GLN HA A 77 THR H 1.0 0.0 3.52 134 121 A 77 THR H A 76 GLN HBy 1.0 0.0 5.34 135 122 A 77 THR H A 76 GLN HBx 1.0 0.0 5.34 136 123 A 77 THR H A 76 GLN HG2 1.0 0.0 5.47 137 123 A 77 THR H A 76 GLN HG3 1.0 0.0 5.47 138 124 A 79 ASN H A 78 GLU HBy 1.0 0.0 5.01 139 125 A 79 ASN H A 78 GLU HBx 1.0 0.0 5.01 140 126 A 79 ASN H A 78 GLU HG2 1.0 0.0 5.31 141 126 A 79 ASN H A 78 GLU HG3 1.0 0.0 5.31 142 127 A 80 LYS H A 81 ILE H 1.0 0.0 4.62 143 128 A 80 LYS H A 79 ASN HBy 1.0 0.0 5.06 144 129 A 81 ILE H A 80 LYS HB2 1.0 0.0 4.59 145 129 A 81 ILE H A 80 LYS HB3 1.0 0.0 4.59 146 130 A 81 ILE H A 81 ILE HG1y 1.0 0.0 4.66 147 131 A 81 ILE HA A 82 HIS H 1.0 0.0 3.58 148 132 A 82 HIS H A 81 ILE HB 1.0 0.0 4.51 149 133 A 82 HIS HBx A 83 GLY H 1.0 0.0 5.41 150 134 A 83 GLY HA2 A 84 THR H 1.0 0.0 3.69 151 135 A 84 THR HA A 85 ALA H 1.0 0.0 3.52 152 136 A 85 ALA HA A 86 ASP H 1.0 0.0 3.50 153 137 A 86 ASP H A 85 ALA HB% 1.0 0.0 4.11 154 138 A 42 THR HA A 87 ILE H 1.0 0.0 4.12 155 139 A 87 ILE H A 86 ASP HB3 1.0 0.0 5.02 156 140 A 87 ILE HA A 88 TYR H 1.0 0.0 3.44 157 141 A 87 ILE HB A 88 TYR H 1.0 0.0 4.53 158 142 A 88 TYR H A 87 ILE HG2% 1.0 0.0 4.64 159 143 A 70 VAL HG2% A 88 TYR H 1.0 0.0 5.80 160 144 A 88 TYR H A 87 ILE HG13 1.0 0.0 6.83 161 145 A 88 TYR H A 70 VAL HG1% 1.0 0.0 6.18 162 146 A 88 TYR H A 87 ILE HD1% 1.0 0.0 6.58 163 147 A 88 TYR H A 89 LYS H 1.0 0.0 5.90 164 148 A 89 LYS H A 88 TYR HA 1.0 0.0 3.60 165 149 A 89 LYS H A 88 TYR HB3 1.0 0.0 4.71 166 150 A 89 LYS H A 88 TYR HB2 1.0 0.0 5.57 167 151 A 89 LYS HA A 90 LYS H 1.0 0.0 3.53 168 152 A 90 LYS H A 90 LYS HB3 1.0 0.0 4.12 169 153 A 90 LYS H A 90 LYS HB2 1.0 0.0 4.11 170 154 A 90 LYS HA A 91 LYS H 1.0 0.0 3.35 171 155 A 90 LYS HB3 A 91 LYS H 1.0 0.0 5.06 172 156 A 91 LYS H A 90 LYS HGx 1.0 0.0 5.08 173 157 A 91 LYS H A 90 LYS HGy 1.0 0.0 5.08 174 158 A 91 LYS HA A 92 LEU H 1.0 0.0 3.30 175 159 A 92 LEU H A 91 LYS HBy 1.0 0.0 4.80 176 160 A 92 LEU H A 91 LYS HBx 1.0 0.0 4.80 177 161 A 92 LEU H A 91 LYS HG2 1.0 0.0 4.99 178 162 A 92 LEU H A 91 LYS HG3 1.0 0.0 5.38 179 163 A 92 LEU HA A 93 GLU H 1.0 0.0 3.30 180 164 A 93 GLU H A 92 LEU HBy 1.0 0.0 5.30 181 165 A 93 GLU H A 92 LEU HG 1.0 0.0 5.69 182 166 A 93 GLU H A 92 LEU HBx 1.0 0.0 5.30 183 167 A 94 HIS H A 93 GLU HBy 1.0 0.0 6.15 184 168 A 94 HIS H A 93 GLU HBx 1.0 0.0 6.15 185 169 A 23 GLU H A 23 GLU HG2 1.0 0.0 4.51 186 169 A 23 GLU H A 23 GLU HG3 1.0 0.0 4.51 187 170 A 24 ILE H A 24 ILE HB 1.0 0.0 3.69 188 171 A 24 ILE H A 59 ILE HG12 1.0 0.0 5.73 189 172 A 24 ILE H A 24 ILE HG1y 1.0 0.0 4.55 190 173 A 24 ILE H A 24 ILE HG1x 1.0 0.0 4.55 191 174 A 25 MET H A 25 MET HB2 1.0 0.0 4.28 192 175 A 25 MET H A 25 MET HG3 1.0 0.0 5.18 193 176 A 26 LYS H A 26 LYS HB2 1.0 0.0 4.05 194 177 A 26 LYS H A 25 MET HB2 1.0 0.0 5.05 195 178 A 26 LYS H A 26 LYS HGy 1.0 0.0 4.66 196 179 A 27 LYS H A 27 LYS HB2 1.0 0.0 3.65 197 179 A 27 LYS H A 27 LYS HB3 1.0 0.0 3.65 198 180 A 27 LYS H A 27 LYS HGy 1.0 0.0 6.51 199 181 A 29 ASP H A 29 ASP HB2 1.0 0.0 3.73 200 181 A 29 ASP H A 29 ASP HB3 1.0 0.0 3.73 201 182 A 30 PHE H A 30 PHE HB2 1.0 0.0 3.96 202 183 A 31 ASP H A 31 ASP HB2 1.0 0.0 3.64 203 183 A 31 ASP H A 31 ASP HB3 1.0 0.0 3.64 204 184 A 32 LYS H A 32 LYS HB2 1.0 0.0 3.82 205 185 A 32 LYS H A 32 LYS HB3 1.0 0.0 4.23 206 186 A 32 LYS H A 32 LYS HG2 1.0 0.0 4.64 207 187 A 35 SER H A 35 SER HBy 1.0 0.0 4.28 208 188 A 35 SER H A 35 SER HBx 1.0 0.0 4.28 209 189 A 36 GLU H A 36 GLU HGy 1.0 0.0 4.46 210 190 A 36 GLU H A 36 GLU HGx 1.0 0.0 4.46 211 191 A 37 TYR H A 37 TYR HB2 1.0 0.0 3.92 212 192 A 38 THR H A 38 THR HB 1.0 0.0 4.21 213 193 A 39 LYS H A 39 LYS HBx 1.0 0.0 4.01 214 194 A 39 LYS H A 39 LYS HBy 1.0 0.0 4.01 215 195 A 39 LYS H A 39 LYS HG2 1.0 0.0 5.60 216 196 A 39 LYS H A 39 LYS HG3 1.0 0.0 5.68 217 197 A 39 LYS H A 39 LYS HD2 1.0 0.0 5.51 218 197 A 39 LYS H A 39 LYS HD3 1.0 0.0 5.51 219 198 A 40 ILE H A 40 ILE HG1x 1.0 0.0 4.89 220 199 A 42 THR H A 42 THR HB 1.0 0.0 4.22 221 200 A 42 THR H A 42 THR HG2% 1.0 0.0 4.74 222 201 A 43 ILE H A 43 ILE HG2% 1.0 0.0 4.53 223 202 A 43 ILE H A 43 ILE HG1x 1.0 0.0 4.74 224 203 A 46 THR H A 46 THR HB 1.0 0.0 4.22 225 204 A 48 GLU H A 48 GLU HB2 1.0 0.0 3.80 226 204 A 48 GLU HB3 A 48 GLU H 1.0 0.0 3.80 227 205 A 48 GLU H A 48 GLU HGx 1.0 0.0 4.88 228 206 A 48 GLU H A 48 GLU HGy 1.0 0.0 4.88 229 207 A 49 MET H A 49 MET HG2 1.0 0.0 4.58 230 207 A 49 MET H A 49 MET HG3 1.0 0.0 4.58 231 208 A 52 LEU H A 52 LEU HBy 1.0 0.0 4.14 232 209 A 52 LEU H A 52 LEU HBx 1.0 0.0 4.14 233 210 A 52 LEU H A 52 LEU HD1% 1.0 0.0 5.75 234 211 A 53 ASP H A 53 ASP HB2 1.0 0.0 3.83 235 211 A 53 ASP H A 53 ASP HB3 1.0 0.0 3.83 236 212 A 55 ARG H A 55 ARG HB3 1.0 0.0 4.11 237 213 A 55 ARG H A 55 ARG HB2 1.0 0.0 3.94 238 214 A 55 ARG H A 55 ARG HG2 1.0 0.0 4.36 239 215 A 55 ARG H A 55 ARG HG3 1.0 0.0 5.10 240 216 A 56 GLU H A 56 GLU HB2 1.0 0.0 3.77 241 216 A 56 GLU H A 56 GLU HB3 1.0 0.0 3.77 242 217 A 56 GLU H A 56 GLU HGy 1.0 0.0 4.73 243 218 A 57 ASP H A 57 ASP HBy 1.0 0.0 3.94 244 219 A 57 ASP H A 57 ASP HBx 1.0 0.0 3.94 245 220 A 58 LEU H A 58 LEU HB2 1.0 0.0 3.91 246 221 A 58 LEU H A 58 LEU HG 1.0 0.0 4.00 247 222 A 59 ILE H A 59 ILE HB 1.0 0.0 3.69 248 223 A 59 ILE H A 59 ILE HG12 1.0 0.0 4.77 249 224 A 59 ILE H A 59 ILE HG13 1.0 0.0 4.04 250 225 A 24 ILE HD1% A 59 ILE H 1.0 0.0 5.16 251 226 A 60 LYS H A 60 LYS HB2 1.0 0.0 3.56 252 226 A 60 LYS H A 60 LYS HB3 1.0 0.0 3.56 253 227 A 61 LYS H A 61 LYS HB2 1.0 0.0 3.96 254 228 A 61 LYS H A 61 LYS HG3 1.0 0.0 4.36 255 229 A 62 ALA H A 62 ALA HB% 1.0 0.0 3.54 256 230 A 64 GLU H A 64 GLU HB2 1.0 0.0 3.78 257 231 A 64 GLU H A 64 GLU HB3 1.0 0.0 4.18 258 232 A 64 GLU H A 64 GLU HGx 1.0 0.0 4.89 259 233 A 65 LYS H A 65 LYS HB2 1.0 0.0 3.84 260 234 A 65 LYS H A 65 LYS HGx 1.0 0.0 4.76 261 235 A 65 LYS H A 65 LYS HGy 1.0 0.0 4.76 262 236 A 67 ALA H A 67 ALA HB% 1.0 0.0 3.63 263 237 A 68 ASP H A 68 ASP HB3 1.0 0.0 4.24 264 238 A 69 VAL H A 69 VAL HB 1.0 0.0 4.20 265 239 A 69 VAL H A 69 VAL HG2% 1.0 0.0 4.58 266 240 A 69 VAL H A 69 VAL HG1% 1.0 0.0 5.46 267 241 A 70 VAL HG2% A 69 VAL H 1.0 0.0 5.95 268 242 A 25 MET H A 71 VAL HA 1.0 0.0 5.00 269 243 A 70 VAL H A 70 VAL HB 1.0 0.0 3.90 270 244 A 71 VAL H A 71 VAL HB 1.0 0.0 4.29 271 245 A 71 VAL H A 71 VAL HG2% 1.0 0.0 4.43 272 246 A 72 LEU H A 72 LEU HB2 1.0 0.0 3.96 273 247 A 72 LEU H A 72 LEU HG 1.0 0.0 4.06 274 248 A 72 LEU H A 72 LEU HD1% 1.0 0.0 4.65 275 249 A 76 GLN H A 76 GLN HG2 1.0 0.0 4.46 276 249 A 76 GLN HG3 A 76 GLN H 1.0 0.0 4.46 277 250 A 78 GLU H A 78 GLU HG2 1.0 0.0 4.49 278 250 A 78 GLU HG3 A 78 GLU H 1.0 0.0 4.49 279 251 A 80 LYS H A 80 LYS HB2 1.0 0.0 3.92 280 251 A 80 LYS H A 80 LYS HB3 1.0 0.0 3.92 281 252 A 81 ILE H A 81 ILE HB 1.0 0.0 4.29 282 253 A 81 ILE H A 81 ILE HG1x 1.0 0.0 4.66 283 254 A 84 THR H A 84 THR HG2% 1.0 0.0 4.53 284 255 A 85 ALA H A 84 THR HG2% 1.0 0.0 4.58 285 256 A 86 ASP H A 86 ASP HB2 1.0 0.0 4.16 286 257 A 87 ILE H A 87 ILE HG2% 1.0 0.0 4.59 287 258 A 87 ILE H A 87 ILE HG12 1.0 0.0 4.27 288 259 A 87 ILE H A 87 ILE HG13 1.0 0.0 4.45 289 260 A 87 ILE H A 87 ILE HD1% 1.0 0.0 4.87 290 261 A 88 TYR H A 88 TYR HB2 1.0 0.0 4.40 291 262 A 89 LYS H A 89 LYS HG2 1.0 0.0 5.13 292 262 A 89 LYS H A 89 LYS HG3 1.0 0.0 5.13 293 263 A 90 LYS H A 90 LYS HGx 1.0 0.0 5.65 294 264 A 91 LYS H A 91 LYS HG3 1.0 0.0 4.29 295 265 A 90 LYS HB2 A 91 LYS H 1.0 0.0 5.66 296 266 A 91 LYS H A 91 LYS HDy 1.0 0.0 6.32 297 267 A 91 LYS H A 91 LYS HDx 1.0 0.0 6.32 298 268 A 92 LEU H A 92 LEU HBy 1.0 0.0 4.27 299 269 A 92 LEU H A 92 LEU HD1% 1.0 0.0 5.41 300 270 A 93 GLU H A 93 GLU HGx 1.0 0.0 6.17 301 271 A 93 GLU H A 93 GLU HGy 1.0 0.0 6.17 302 272 A 23 GLU H A 24 ILE H 1.0 0.0 5.68 303 273 A 28 THR H A 29 ASP H 1.0 0.0 4.03 304 274 A 29 ASP H A 30 PHE H 1.0 0.0 3.59 305 275 A 31 ASP H A 32 LYS H 1.0 0.0 4.13 306 276 A 32 LYS H A 33 VAL H 1.0 0.0 3.74 307 277 A 35 SER H A 36 GLU H 1.0 0.0 3.81 308 278 A 39 LYS H A 40 ILE H 1.0 0.0 5.35 309 279 A 49 MET H A 50 SER H 1.0 0.0 5.21 310 280 A 53 ASP H A 54 ALA H 1.0 0.0 4.02 311 281 A 55 ARG H A 56 GLU H 1.0 0.0 4.03 312 282 A 60 LYS H A 61 LYS H 1.0 0.0 3.93 313 283 A 63 ASP H A 64 GLU H 1.0 0.0 4.02 314 284 A 64 GLU H A 65 LYS H 1.0 0.0 4.00 315 285 A 77 THR H A 78 GLU H 1.0 0.0 4.23 316 286 A 79 ASN H A 80 LYS H 1.0 0.0 4.12 317 287 A 30 PHE H A 27 LYS HA 1.0 0.0 4.85 318 288 A 29 ASP H A 31 ASP H 1.0 0.0 5.50 319 289 A 31 ASP H A 27 LYS HA 1.0 0.0 5.28 320 290 A 31 ASP H A 33 VAL H 1.0 0.0 5.52 321 291 A 32 LYS H A 29 ASP HA 1.0 0.0 5.04 322 292 A 31 ASP HA A 34 ALA H 1.0 0.0 4.58 323 293 A 35 SER H A 33 VAL HA 1.0 0.0 5.42 324 294 A 53 ASP H A 50 SER HBy 1.0 0.0 5.69 325 295 A 52 LEU H A 54 ALA H 1.0 0.0 5.35 326 296 A 55 ARG H A 52 LEU HA 1.0 0.0 5.20 327 297 A 56 GLU H A 54 ALA HA 1.0 0.0 6.33 328 298 A 56 GLU H A 53 ASP HA 1.0 0.0 4.81 329 299 A 56 GLU H A 52 LEU HA 1.0 0.0 5.91 330 300 A 57 ASP H A 54 ALA HA 1.0 0.0 4.78 331 301 A 58 LEU H A 56 GLU HA 1.0 0.0 5.57 332 302 A 58 LEU H A 55 ARG HA 1.0 0.0 5.35 333 303 A 59 ILE H A 57 ASP HA 1.0 0.0 6.59 334 304 A 59 ILE H A 56 GLU HA 1.0 0.0 4.87 335 305 A 59 ILE H A 55 ARG HA 1.0 0.0 5.81 336 306 A 60 LYS H A 56 GLU HA 1.0 0.0 5.50 337 307 A 61 LYS H A 58 LEU HA 1.0 0.0 5.10 338 308 A 61 LYS H A 57 ASP HA 1.0 0.0 5.74 339 309 A 62 ALA H A 60 LYS HA 1.0 0.0 5.83 340 310 A 60 LYS H A 62 ALA H 1.0 0.0 5.24 341 311 A 62 ALA H A 59 ILE HA 1.0 0.0 5.05 342 312 A 62 ALA H A 58 LEU HA 1.0 0.0 5.55 343 313 A 63 ASP H A 61 LYS HA 1.0 0.0 6.35 344 314 A 63 ASP H A 60 LYS HA 1.0 0.0 4.84 345 315 A 63 ASP H A 59 ILE HA 1.0 0.0 5.68 346 316 A 64 GLU H A 61 LYS HA 1.0 0.0 4.60 347 317 A 23 GLU H A 59 ILE HG2% 1.0 0.0 6.38 348 318 A 23 GLU H A 69 VAL HG1% 1.0 0.0 5.80 349 319 A 26 LYS H A 29 ASP HB2 1.0 0.0 4.68 350 319 A 26 LYS H A 29 ASP HB3 1.0 0.0 4.68 351 320 A 28 THR H A 26 LYS HB3 1.0 0.0 4.54 352 321 A 28 THR H A 26 LYS HB2 1.0 0.0 4.85 353 322 A 29 ASP H A 26 LYS HB2 1.0 0.0 4.50 354 323 A 29 ASP H A 26 LYS HB3 1.0 0.0 4.80 355 324 A 25 MET HB3 A 30 PHE H 1.0 0.0 5.24 356 325 A 30 PHE H A 26 LYS HB3 1.0 0.0 6.06 357 326 A 30 PHE H A 25 MET HB2 1.0 0.0 5.70 358 327 A 30 PHE H A 71 VAL HG1% 1.0 0.0 5.54 359 328 A 31 ASP H A 25 MET HE% 1.0 0.0 6.79 360 329 A 31 ASP H A 27 LYS HB2 1.0 0.0 6.83 361 329 A 27 LYS HB3 A 31 ASP H 1.0 0.0 6.83 362 330 A 31 ASP H A 32 LYS HB2 1.0 0.0 6.83 363 331 A 31 ASP H A 34 ALA HB% 1.0 0.0 6.14 364 332 A 32 LYS H A 33 VAL HG2% 1.0 0.0 4.98 365 333 A 36 GLU H A 37 TYR HB2 1.0 0.0 5.85 366 334 A 36 GLU H A 33 VAL HB 1.0 0.0 6.08 367 335 A 34 ALA HB% A 36 GLU H 1.0 0.0 6.14 368 336 A 37 TYR H A 34 ALA HA 1.0 0.0 5.17 369 337 A 34 ALA HB% A 37 TYR H 1.0 0.0 6.11 370 338 A 38 THR H A 90 LYS HA 1.0 0.0 5.46 371 339 A 38 THR H A 88 TYR HB3 1.0 0.0 5.26 372 340 A 38 THR H A 89 LYS HBy 1.0 0.0 6.53 373 341 A 38 THR H A 91 LYS HG3 1.0 0.0 5.55 374 342 A 38 THR H A 91 LYS HG2 1.0 0.0 5.88 375 343 A 38 THR H A 89 LYS HBx 1.0 0.0 6.53 376 344 A 38 THR H A 88 TYR HA 1.0 0.0 5.69 377 345 A 39 LYS H A 40 ILE HG2% 1.0 0.0 5.64 378 346 A 40 ILE H A 88 TYR HA 1.0 0.0 4.36 379 347 A 40 ILE H A 87 ILE HG13 1.0 0.0 5.55 380 348 A 41 GLY H A 87 ILE H 1.0 0.0 4.80 381 349 A 41 GLY H A 39 LYS HA 1.0 0.0 5.16 382 350 A 41 GLY H A 87 ILE HG13 1.0 0.0 4.53 383 351 A 41 GLY H A 39 LYS HG2 1.0 0.0 4.15 384 352 A 41 GLY H A 87 ILE HD1% 1.0 0.0 5.40 385 353 A 41 GLY H A 87 ILE HG12 1.0 0.0 5.29 386 354 A 41 GLY H A 39 LYS HD2 1.0 0.0 6.20 387 354 A 39 LYS HD3 A 41 GLY H 1.0 0.0 6.20 388 355 A 87 ILE HB A 41 GLY H 1.0 0.0 6.69 389 356 A 42 THR H A 43 ILE HG2% 1.0 0.0 5.49 390 357 A 42 THR H A 87 ILE HD1% 1.0 0.0 5.64 391 358 A 42 THR H A 87 ILE HG12 1.0 0.0 6.34 392 359 A 42 THR H A 43 ILE HA 1.0 0.0 5.95 393 360 A 43 ILE H A 85 ALA H 1.0 0.0 4.44 394 361 A 43 ILE H A 87 ILE HG12 1.0 0.0 5.61 395 362 A 43 ILE H A 85 ALA HB% 1.0 0.0 5.08 396 363 A 44 SER H A 84 THR HA 1.0 0.0 5.95 397 364 A 44 SER H A 84 THR HG2% 1.0 0.0 6.53 398 365 A 44 SER H A 85 ALA HB% 1.0 0.0 6.83 399 366 A 45 THR H A 58 LEU HD2% 1.0 0.0 4.76 400 367 A 45 THR H A 84 THR HA 1.0 0.0 4.94 401 368 A 49 MET H A 54 ALA HB% 1.0 0.0 5.76 402 369 A 50 SER H A 53 ASP HB2 1.0 0.0 4.58 403 369 A 50 SER H A 53 ASP HB3 1.0 0.0 4.58 404 370 A 53 ASP H A 54 ALA HB% 1.0 0.0 5.99 405 371 A 54 ALA H A 49 MET HBy 1.0 0.0 5.86 406 372 A 54 ALA H A 49 MET HBx 1.0 0.0 5.86 407 373 A 55 ARG H A 72 LEU HD2% 1.0 0.0 6.01 408 374 A 56 GLU H A 59 ILE HD1% 1.0 0.0 6.17 409 375 A 57 ASP H A 58 LEU HB2 1.0 0.0 5.85 410 376 A 54 ALA HB% A 57 ASP H 1.0 0.0 5.89 411 377 A 24 ILE HD1% A 58 LEU H 1.0 0.0 6.50 412 378 A 58 LEU H A 59 ILE HD1% 1.0 0.0 6.83 413 379 A 59 ILE H A 62 ALA HB% 1.0 0.0 5.58 414 380 A 62 ALA H A 59 ILE HG2% 1.0 0.0 6.08 415 381 A 43 ILE HG2% A 62 ALA H 1.0 0.0 5.49 416 382 A 62 ALA H A 87 ILE HG2% 1.0 0.0 5.84 417 383 A 62 ALA H A 43 ILE HD1% 1.0 0.0 4.69 418 384 A 62 ALA H A 70 VAL HG1% 1.0 0.0 6.01 419 385 A 62 ALA H A 87 ILE HD1% 1.0 0.0 6.72 420 386 A 65 LYS H A 62 ALA HA 1.0 0.0 5.02 421 387 A 65 LYS H A 61 LYS HA 1.0 0.0 5.80 422 388 A 65 LYS H A 87 ILE HD1% 1.0 0.0 5.94 423 389 A 43 ILE HG2% A 65 LYS H 1.0 0.0 6.68 424 390 A 65 LYS H A 87 ILE HG2% 1.0 0.0 6.83 425 391 A 66 GLY H A 63 ASP HA 1.0 0.0 5.00 426 392 A 66 GLY H A 64 GLU HA 1.0 0.0 5.20 427 393 A 67 ALA H A 40 ILE HD1% 1.0 0.0 5.10 428 394 A 68 ASP H A 90 LYS H 1.0 0.0 5.20 429 395 A 69 VAL H A 90 LYS H 1.0 0.0 5.95 430 396 A 68 ASP H A 89 LYS HA 1.0 0.0 3.95 431 397 A 68 ASP H A 89 LYS HG2 1.0 0.0 5.81 432 397 A 68 ASP H A 89 LYS HG3 1.0 0.0 5.81 433 398 A 68 ASP H A 22 ALA HB% 1.0 0.0 6.01 434 399 A 62 ALA HB% A 68 ASP H 1.0 0.0 6.55 435 400 A 62 ALA HB% A 69 VAL H 1.0 0.0 6.83 436 401 A 69 VAL H A 67 ALA HB% 1.0 0.0 4.53 437 402 A 69 VAL H A 88 TYR HB2 1.0 0.0 5.44 438 403 A 69 VAL H A 88 TYR HB3 1.0 0.0 6.67 439 404 A 71 VAL H A 85 ALA HB% 1.0 0.0 4.57 440 405 A 58 LEU HD1% A 72 LEU H 1.0 0.0 6.83 441 406 A 69 VAL HG1% A 72 LEU H 1.0 0.0 6.83 442 407 A 73 THR H A 85 ALA HB% 1.0 0.0 4.94 443 408 A 73 THR H A 85 ALA HA 1.0 0.0 4.03 444 409 A 72 LEU HB3 A 74 SER H 1.0 0.0 5.11 445 410 A 79 ASN H A 77 THR HG2% 1.0 0.0 5.45 446 411 A 58 LEU HD1% A 84 THR H 1.0 0.0 5.63 447 412 A 72 LEU HD2% A 84 THR H 1.0 0.0 6.06 448 413 A 84 THR H A 74 SER HB2 1.0 0.0 4.60 449 413 A 84 THR H A 74 SER HB3 1.0 0.0 4.60 450 414 A 44 SER HA A 85 ALA H 1.0 0.0 4.76 451 415 A 72 LEU HA A 86 ASP H 1.0 0.0 5.41 452 416 A 70 VAL HA A 86 ASP H 1.0 0.0 6.44 453 417 A 71 VAL HA A 86 ASP H 1.0 0.0 6.83 454 418 A 85 ALA H A 42 THR HG2% 1.0 0.0 4.83 455 419 A 85 ALA H A 43 ILE HD1% 1.0 0.0 5.63 456 420 A 58 LEU HD2% A 85 ALA H 1.0 0.0 5.54 457 421 A 85 ALA H A 43 ILE HG1x 1.0 0.0 5.85 458 422 A 71 VAL HB A 86 ASP H 1.0 0.0 5.24 459 423 A 86 ASP H A 42 THR HG2% 1.0 0.0 5.22 460 424 A 71 VAL HG1% A 86 ASP H 1.0 0.0 5.49 461 425 A 86 ASP H A 70 VAL HG1% 1.0 0.0 5.86 462 426 A 88 TYR H A 69 VAL HB 1.0 0.0 5.39 463 427 A 88 TYR H A 67 ALA HB% 1.0 0.0 4.76 464 428 A 89 LYS H A 91 LYS HG3 1.0 0.0 6.83 465 429 A 89 LYS H A 39 LYS HA 1.0 0.0 5.81 466 430 A 68 ASP HB3 A 90 LYS H 1.0 0.0 4.58 467 431 A 91 LYS H A 36 GLU HA 1.0 0.0 5.62 468 432 A 37 TYR HA A 91 LYS H 1.0 0.0 4.00 469 433 A 69 VAL H A 88 TYR H 1.0 0.0 4.82 470 434 A 88 TYR H A 88 TYR HD% 1.0 0.0 5.31 471 435 A 74 SER H A 85 ALA HA 1.0 0.0 5.97 472 436 A 23 GLU H A 69 VAL HA 1.0 0.0 3.96 473 437 A 23 GLU H A 70 VAL H 1.0 0.0 5.15 474 438 A 69 VAL H A 87 ILE HA 1.0 0.0 6.39 475 439 A 69 VAL H A 89 LYS HA 1.0 0.0 5.11 476 440 A 32 LYS H A 32 LYS HG3 1.0 0.0 3.95 477 441 A 33 VAL H A 34 ALA HB% 1.0 0.0 5.22 478 442 A 36 GLU H A 33 VAL HA 1.0 0.0 5.78 479 443 A 36 GLU H A 37 TYR HE% 1.0 0.0 5.76 480 444 A 38 THR H A 91 LYS H 1.0 0.0 5.53 481 445 A 39 LYS H A 88 TYR HD% 1.0 0.0 6.15 482 446 A 41 GLY H A 42 THR HA 1.0 0.0 6.12 483 447 A 41 GLY H A 88 TYR HA 1.0 0.0 6.09 484 448 A 42 THR H A 87 ILE HG13 1.0 0.0 6.26 485 449 A 43 ILE H A 84 THR HA 1.0 0.0 5.87 486 450 A 43 ILE H A 44 SER H 1.0 0.0 5.68 487 451 A 53 ASP H A 56 GLU HB2 1.0 0.0 6.44 488 451 A 53 ASP H A 56 GLU HB3 1.0 0.0 6.44 489 452 A 53 ASP H A 52 LEU HD2% 1.0 0.0 6.49 490 453 A 55 ARG H A 52 LEU HD2% 1.0 0.0 6.76 491 454 A 55 ARG H A 72 LEU HD1% 1.0 0.0 6.36 492 455 A 55 ARG HB3 A 55 ARG HE 1.0 0.0 5.15 493 456 A 55 ARG HB2 A 55 ARG HE 1.0 0.0 5.74 494 457 A 56 GLU H A 56 GLU HGx 1.0 0.0 4.73 495 458 A 62 ALA H A 61 LYS HG3 1.0 0.0 6.12 496 459 A 63 ASP H A 65 LYS H 1.0 0.0 5.82 497 460 A 64 GLU H A 61 LYS HG3 1.0 0.0 6.83 498 461 A 61 LYS HB3 A 64 GLU H 1.0 0.0 6.70 499 462 A 64 GLU H A 65 LYS HB2 1.0 0.0 6.83 500 463 A 62 ALA HB% A 65 LYS H 1.0 0.0 6.07 501 464 A 65 LYS H A 67 ALA HB% 1.0 0.0 6.39 502 465 A 65 LYS H A 63 ASP HA 1.0 0.0 6.09 503 466 A 66 GLY H A 67 ALA HB% 1.0 0.0 6.07 504 467 A 62 ALA HB% A 67 ALA H 1.0 0.0 4.76 505 468 A 67 ALA H A 62 ALA HA 1.0 0.0 5.38 506 469 A 87 ILE HB A 68 ASP H 1.0 0.0 6.83 507 470 A 68 ASP H A 89 LYS HBy 1.0 0.0 6.65 508 471 A 87 ILE HB A 69 VAL H 1.0 0.0 5.58 509 472 A 76 GLN H A 77 THR HG2% 1.0 0.0 6.13 510 473 A 78 GLU H A 81 ILE HG2% 1.0 0.0 6.48 511 474 A 79 ASN H A 80 LYS HA 1.0 0.0 6.20 512 475 A 79 ASN H A 77 THR HA 1.0 0.0 5.83 513 476 A 81 ILE H A 48 GLU HB2 1.0 0.0 5.81 514 476 A 48 GLU HB3 A 81 ILE H 1.0 0.0 5.81 515 477 A 43 ILE HB A 85 ALA H 1.0 0.0 6.58 516 478 A 85 ALA H A 44 SER HBy 1.0 0.0 6.51 517 479 A 85 ALA H A 44 SER HBx 1.0 0.0 6.51 518 480 A 71 VAL H A 86 ASP H 1.0 0.0 4.83 519 481 A 87 ILE H A 42 THR HG2% 1.0 0.0 5.96 520 482 A 85 ALA HB% A 87 ILE H 1.0 0.0 6.83 521 483 A 40 ILE H A 89 LYS H 1.0 0.0 6.08 522 484 A 68 ASP H A 89 LYS H 1.0 0.0 6.83 523 485 A 37 TYR HB3 A 89 LYS H 1.0 0.0 5.71 524 486 A 34 ALA H A 36 GLU H 1.0 0.0 6.21 525 487 A 23 GLU H A 59 ILE HG12 1.0 0.0 6.65 526 488 A 23 GLU H A 59 ILE HD1% 1.0 0.0 6.83 527 489 A 40 ILE H A 39 LYS HG2 1.0 0.0 5.20 528 490 A 71 VAL H A 71 VAL HG1% 1.0 0.0 4.68 529 491 A 27 LYS H A 71 VAL HG1% 1.0 0.0 4.69 530 492 A 26 LYS HA A 72 LEU H 1.0 0.0 5.87 531 493 A 24 ILE HA A 24 ILE HD1% 1.0 0.0 3.94 532 494 A 24 ILE H A 24 ILE HG2% 1.0 0.0 4.96 533 495 A 24 ILE H A 24 ILE HD1% 1.0 0.0 4.88 534 496 A 24 ILE HD1% A 59 ILE HG13 1.0 0.0 3.58 535 497 A 25 MET HA A 25 MET HG2 1.0 0.0 4.35 536 498 A 26 LYS HA A 26 LYS HD2 1.0 0.0 4.75 537 498 A 26 LYS HA A 26 LYS HD3 1.0 0.0 4.75 538 499 A 26 LYS HB3 A 26 LYS HE2 1.0 0.0 6.09 539 499 A 26 LYS HB3 A 26 LYS HE3 1.0 0.0 6.09 540 500 A 26 LYS HB2 A 26 LYS HE2 1.0 0.0 6.16 541 500 A 26 LYS HB2 A 26 LYS HE3 1.0 0.0 6.16 542 501 A 26 LYS H A 26 LYS HGx 1.0 0.0 4.66 543 502 A 27 LYS HA A 27 LYS HDx 1.0 0.0 5.42 544 503 A 28 THR H A 28 THR HG2% 1.0 0.0 3.98 545 504 A 28 THR HG2% A 28 THR HA 1.0 0.0 3.60 546 505 A 28 THR HA A 31 ASP HB2 1.0 0.0 4.30 547 505 A 31 ASP HB3 A 28 THR HA 1.0 0.0 4.30 548 506 A 32 LYS HG2 A 32 LYS HA 1.0 0.0 4.23 549 507 A 32 LYS H A 32 LYS HD2 1.0 0.0 5.08 550 507 A 32 LYS H A 32 LYS HD3 1.0 0.0 5.08 551 508 A 32 LYS HA A 32 LYS HD2 1.0 0.0 4.87 552 508 A 32 LYS HA A 32 LYS HD3 1.0 0.0 4.87 553 509 A 33 VAL H A 33 VAL HG1% 1.0 0.0 4.39 554 510 A 33 VAL HG1% A 33 VAL HA 1.0 0.0 3.65 555 511 A 33 VAL H A 33 VAL HG2% 1.0 0.0 3.74 556 512 A 34 ALA H A 34 ALA HB% 1.0 0.0 3.48 557 513 A 38 THR H A 38 THR HG2% 1.0 0.0 4.68 558 514 A 38 THR HA A 38 THR HG2% 1.0 0.0 4.14 559 515 A 58 LEU HG A 58 LEU HA 1.0 0.0 4.41 560 516 A 61 LYS HB2 A 58 LEU HA 1.0 0.0 4.83 561 517 A 39 LYS HG3 A 39 LYS HA 1.0 0.0 4.32 562 518 A 39 LYS HA A 39 LYS HD2 1.0 0.0 5.83 563 518 A 39 LYS HD3 A 39 LYS HA 1.0 0.0 5.83 564 519 A 39 LYS HA A 39 LYS HE2 1.0 0.0 6.65 565 519 A 39 LYS HA A 39 LYS HE3 1.0 0.0 6.65 566 520 A 42 THR HB A 39 LYS HE2 1.0 0.0 6.83 567 520 A 42 THR HB A 39 LYS HE3 1.0 0.0 6.83 568 521 A 71 VAL HA A 71 VAL HG1% 1.0 0.0 3.85 569 522 A 40 ILE H A 40 ILE HG2% 1.0 0.0 4.71 570 523 A 40 ILE HG2% A 40 ILE HA 1.0 0.0 3.87 571 524 A 40 ILE H A 40 ILE HG1y 1.0 0.0 4.89 572 525 A 40 ILE H A 40 ILE HD1% 1.0 0.0 4.88 573 526 A 68 ASP H A 40 ILE HD1% 1.0 0.0 5.35 574 527 A 40 ILE HD1% A 40 ILE HA 1.0 0.0 5.23 575 528 A 40 ILE HB A 40 ILE HD1% 1.0 0.0 3.76 576 529 A 40 ILE HG2% A 40 ILE HD1% 1.0 0.0 3.46 577 530 A 42 THR HA A 42 THR HG2% 1.0 0.0 4.18 578 531 A 42 THR HG2% A 86 ASP HA 1.0 0.0 4.43 579 532 A 43 ILE HA A 43 ILE HG2% 1.0 0.0 3.74 580 533 A 72 LEU HB2 A 72 LEU HD1% 1.0 0.0 3.94 581 534 A 43 ILE H A 43 ILE HD1% 1.0 0.0 5.09 582 535 A 43 ILE HA A 43 ILE HD1% 1.0 0.0 5.76 583 536 A 43 ILE HB A 43 ILE HD1% 1.0 0.0 3.95 584 537 A 45 THR HA A 45 THR HG2% 1.0 0.0 4.04 585 538 A 45 THR H A 45 THR HG2% 1.0 0.0 3.99 586 539 A 46 THR HG2% A 46 THR HA 1.0 0.0 3.66 587 540 A 49 MET HA A 49 MET HG2 1.0 0.0 4.36 588 540 A 49 MET HG3 A 49 MET HA 1.0 0.0 4.36 589 541 A 52 LEU H A 52 LEU HG 1.0 0.0 4.64 590 542 A 52 LEU HD1% A 52 LEU HA 1.0 0.0 4.28 591 543 A 52 LEU HA A 52 LEU HD2% 1.0 0.0 4.18 592 544 A 54 ALA H A 54 ALA HB% 1.0 0.0 3.74 593 545 A 55 ARG HA A 55 ARG HDx 1.0 0.0 6.74 594 546 A 58 LEU H A 58 LEU HD1% 1.0 0.0 4.60 595 547 A 58 LEU HD1% A 58 LEU HA 1.0 0.0 4.95 596 548 A 58 LEU HB2 A 58 LEU HD1% 1.0 0.0 3.82 597 549 A 58 LEU HB3 A 58 LEU HD1% 1.0 0.0 4.25 598 550 A 58 LEU H A 58 LEU HD2% 1.0 0.0 5.15 599 551 A 58 LEU HD2% A 58 LEU HA 1.0 0.0 3.76 600 552 A 58 LEU HB3 A 58 LEU HD2% 1.0 0.0 3.96 601 553 A 24 ILE HD1% A 59 ILE HA 1.0 0.0 4.84 602 554 A 59 ILE H A 59 ILE HG2% 1.0 0.0 4.79 603 555 A 59 ILE HA A 59 ILE HG2% 1.0 0.0 3.97 604 556 A 59 ILE HG13 A 59 ILE HG2% 1.0 0.0 3.76 605 557 A 59 ILE H A 59 ILE HD1% 1.0 0.0 4.73 606 558 A 59 ILE HA A 59 ILE HD1% 1.0 0.0 4.46 607 559 A 59 ILE HB A 59 ILE HD1% 1.0 0.0 3.96 608 560 A 60 LYS HA A 60 LYS HD2 1.0 0.0 5.55 609 560 A 60 LYS HD3 A 60 LYS HA 1.0 0.0 5.55 610 561 A 60 LYS HB2 A 60 LYS HD2 1.0 0.0 4.11 611 561 A 60 LYS HD3 A 60 LYS HB2 1.0 0.0 4.11 612 561 A 60 LYS HB3 A 60 LYS HD3 1.0 0.0 4.11 613 561 A 60 LYS HB3 A 60 LYS HD2 1.0 0.0 4.11 614 562 A 60 LYS HB2 A 60 LYS HE2 1.0 0.0 5.59 615 562 A 60 LYS HB3 A 60 LYS HE2 1.0 0.0 5.59 616 562 A 60 LYS HE3 A 60 LYS HB2 1.0 0.0 5.59 617 562 A 60 LYS HB3 A 60 LYS HE3 1.0 0.0 5.59 618 563 A 61 LYS HG2 A 61 LYS HA 1.0 0.0 4.09 619 564 A 61 LYS HG3 A 61 LYS HA 1.0 0.0 4.16 620 565 A 61 LYS H A 61 LYS HG2 1.0 0.0 5.53 621 566 A 61 LYS HA A 61 LYS HDy 1.0 0.0 5.52 622 567 A 61 LYS HA A 61 LYS HDx 1.0 0.0 5.52 623 568 A 64 GLU H A 64 GLU HGy 1.0 0.0 4.89 624 569 A 69 VAL HA A 69 VAL HG2% 1.0 0.0 3.83 625 570 A 69 VAL HA A 69 VAL HG1% 1.0 0.0 4.17 626 571 A 70 VAL HA A 88 TYR H 1.0 0.0 5.31 627 572 A 70 VAL H A 70 VAL HG2% 1.0 0.0 4.56 628 573 A 70 VAL HG2% A 70 VAL HA 1.0 0.0 4.02 629 574 A 71 VAL HA A 71 VAL HG2% 1.0 0.0 3.84 630 575 A 72 LEU HA A 72 LEU HD1% 1.0 0.0 4.85 631 576 A 72 LEU HB3 A 72 LEU HD1% 1.0 0.0 3.95 632 577 A 72 LEU H A 72 LEU HD2% 1.0 0.0 5.08 633 578 A 72 LEU HA A 72 LEU HD2% 1.0 0.0 3.77 634 579 A 72 LEU HB3 A 72 LEU HD2% 1.0 0.0 4.12 635 580 A 73 THR HG2% A 73 THR HA 1.0 0.0 3.74 636 581 A 77 THR HG2% A 77 THR HA 1.0 0.0 4.16 637 582 A 74 SER H A 74 SER HB2 1.0 0.0 4.12 638 582 A 74 SER H A 74 SER HB3 1.0 0.0 4.12 639 583 A 76 GLN HA A 76 GLN HG2 1.0 0.0 4.33 640 583 A 76 GLN HA A 76 GLN HG3 1.0 0.0 4.33 641 584 A 77 THR H A 77 THR HG2% 1.0 0.0 4.35 642 585 A 78 GLU HA A 78 GLU HG2 1.0 0.0 4.22 643 585 A 78 GLU HG3 A 78 GLU HA 1.0 0.0 4.22 644 586 A 80 LYS H A 80 LYS HGy 1.0 0.0 5.34 645 587 A 80 LYS H A 80 LYS HGx 1.0 0.0 5.34 646 588 A 34 ALA HB% A 35 SER HA 1.0 0.0 5.10 647 589 A 81 ILE HA A 81 ILE HG2% 1.0 0.0 3.94 648 590 A 81 ILE H A 81 ILE HD1% 1.0 0.0 5.74 649 591 A 83 GLY H A 81 ILE HD1% 1.0 0.0 5.40 650 592 A 81 ILE HA A 81 ILE HD1% 1.0 0.0 4.75 651 593 A 81 ILE HB A 81 ILE HD1% 1.0 0.0 4.19 652 594 A 84 THR HA A 84 THR HG2% 1.0 0.0 3.95 653 595 A 85 ALA H A 85 ALA HB% 1.0 0.0 4.25 654 596 A 70 VAL HG2% A 87 ILE HA 1.0 0.0 5.38 655 597 A 87 ILE HA A 70 VAL HG1% 1.0 0.0 5.24 656 598 A 87 ILE HB A 70 VAL HG2% 1.0 0.0 5.52 657 599 A 87 ILE HB A 87 ILE HD1% 1.0 0.0 4.24 658 600 A 87 ILE HA A 87 ILE HG2% 1.0 0.0 3.81 659 601 A 87 ILE HG13 A 40 ILE HG1x 1.0 0.0 5.21 660 602 A 87 ILE HD1% A 67 ALA H 1.0 0.0 5.42 661 603 A 87 ILE HA A 87 ILE HD1% 1.0 0.0 5.67 662 604 A 87 ILE HD1% A 65 LYS HGy 1.0 0.0 4.99 663 605 A 89 LYS HE2 A 89 LYS HG2 1.0 0.0 4.23 664 605 A 89 LYS HE3 A 89 LYS HG2 1.0 0.0 4.23 665 605 A 89 LYS HG3 A 89 LYS HE2 1.0 0.0 4.23 666 605 A 89 LYS HG3 A 89 LYS HE3 1.0 0.0 4.23 667 606 A 90 LYS HA A 90 LYS HD2 1.0 0.0 4.86 668 606 A 90 LYS HA A 90 LYS HD3 1.0 0.0 4.86 669 607 A 91 LYS HA A 91 LYS HG2 1.0 0.0 4.23 670 608 A 91 LYS HE3 A 91 LYS HBy 1.0 0.0 6.03 671 608 A 91 LYS HBy A 91 LYS HE2 1.0 0.0 6.03 672 609 A 91 LYS HE3 A 91 LYS HBx 1.0 0.0 6.03 673 609 A 91 LYS HBx A 91 LYS HE2 1.0 0.0 6.03 674 610 A 91 LYS H A 91 LYS HG2 1.0 0.0 5.06 675 611 A 92 LEU HA A 92 LEU HG 1.0 0.0 4.14 676 612 A 92 LEU H A 92 LEU HBx 1.0 0.0 4.27 677 613 A 92 LEU H A 92 LEU HG 1.0 0.0 4.56 678 614 A 92 LEU HA A 92 LEU HD1% 1.0 0.0 3.94 679 615 A 92 LEU HA A 92 LEU HD2% 1.0 0.0 5.03 680 616 A 23 GLU H A 22 ALA HB% 1.0 0.0 4.01 681 617 A 27 LYS H A 26 LYS HB3 1.0 0.0 5.39 682 618 A 26 LYS H A 25 MET HG3 1.0 0.0 5.55 683 619 A 27 LYS H A 26 LYS HB2 1.0 0.0 5.72 684 620 A 29 ASP H A 28 THR HG2% 1.0 0.0 5.16 685 621 A 34 ALA H A 33 VAL HB 1.0 0.0 5.71 686 622 A 39 LYS H A 38 THR HB 1.0 0.0 5.28 687 623 A 39 LYS H A 38 THR HG2% 1.0 0.0 4.45 688 624 A 40 ILE H A 39 LYS HG3 1.0 0.0 5.40 689 625 A 43 ILE H A 42 THR HB 1.0 0.0 4.54 690 626 A 79 ASN H A 81 ILE HG2% 1.0 0.0 4.74 691 627 A 81 ILE H A 81 ILE HG2% 1.0 0.0 4.66 692 628 A 47 GLY H A 46 THR HB 1.0 0.0 4.86 693 629 A 60 LYS H A 59 ILE HG2% 1.0 0.0 4.73 694 630 A 68 ASP H A 67 ALA HA 1.0 0.0 3.71 695 631 A 68 ASP H A 67 ALA HB% 1.0 0.0 4.04 696 632 A 69 VAL H A 68 ASP HB2 1.0 0.0 5.08 697 633 A 70 VAL H A 69 VAL HB 1.0 0.0 5.44 698 634 A 70 VAL H A 69 VAL HG2% 1.0 0.0 4.77 699 635 A 70 VAL H A 69 VAL HG1% 1.0 0.0 3.93 700 636 A 70 VAL HG2% A 71 VAL H 1.0 0.0 4.97 701 637 A 75 GLY H A 74 SER HB2 1.0 0.0 4.51 702 637 A 75 GLY H A 74 SER HB3 1.0 0.0 4.51 703 638 A 78 GLU H A 77 THR HB 1.0 0.0 4.29 704 639 A 78 GLU H A 77 THR HG2% 1.0 0.0 5.16 705 640 A 80 LYS H A 79 ASN HBx 1.0 0.0 5.06 706 641 A 81 ILE H A 80 LYS HA 1.0 0.0 3.62 707 642 A 82 HIS H A 81 ILE HG2% 1.0 0.0 4.61 708 643 A 78 GLU H A 81 ILE HG1y 1.0 0.0 6.30 709 644 A 78 GLU H A 81 ILE HG1x 1.0 0.0 6.30 710 645 A 83 GLY H A 82 HIS HBy 1.0 0.0 5.41 711 646 A 85 ALA H A 84 THR HB 1.0 0.0 4.24 712 647 A 87 ILE H A 86 ASP HB2 1.0 0.0 5.84 713 648 A 90 LYS H A 89 LYS HBy 1.0 0.0 5.46 714 649 A 90 LYS H A 89 LYS HBx 1.0 0.0 5.46 715 650 A 30 PHE HB2 A 27 LYS HA 1.0 0.0 4.71 716 651 A 30 PHE HB3 A 27 LYS HA 1.0 0.0 4.15 717 652 A 31 ASP H A 28 THR HA 1.0 0.0 5.05 718 653 A 32 LYS HB2 A 29 ASP HA 1.0 0.0 5.45 719 654 A 32 LYS HB3 A 29 ASP HA 1.0 0.0 6.64 720 655 A 32 LYS HB3 A 33 VAL HA 1.0 0.0 6.83 721 656 A 32 LYS H A 30 PHE HA 1.0 0.0 6.06 722 657 A 33 VAL H A 30 PHE HA 1.0 0.0 5.25 723 658 A 31 ASP HA A 34 ALA HB% 1.0 0.0 3.77 724 659 A 34 ALA H A 32 LYS HA 1.0 0.0 5.67 725 660 A 54 ALA H A 51 PRO HA 1.0 0.0 5.46 726 661 A 54 ALA HB% A 51 PRO HA 1.0 0.0 4.13 727 662 A 55 ARG H A 53 ASP HA 1.0 0.0 6.03 728 663 A 53 ASP HA A 56 GLU HB2 1.0 0.0 4.39 729 663 A 56 GLU HB3 A 53 ASP HA 1.0 0.0 4.39 730 664 A 54 ALA HA A 57 ASP HBy 1.0 0.0 4.88 731 665 A 54 ALA HA A 57 ASP HBx 1.0 0.0 4.88 732 666 A 58 LEU H A 54 ALA HA 1.0 0.0 5.66 733 667 A 58 LEU HB2 A 55 ARG HA 1.0 0.0 4.98 734 668 A 58 LEU HB3 A 55 ARG HA 1.0 0.0 5.59 735 669 A 59 ILE HB A 56 GLU HA 1.0 0.0 4.19 736 670 A 60 LYS H A 57 ASP HA 1.0 0.0 4.94 737 671 A 57 ASP HA A 60 LYS HB2 1.0 0.0 4.17 738 671 A 60 LYS HB3 A 57 ASP HA 1.0 0.0 4.17 739 672 A 61 LYS HB3 A 58 LEU HA 1.0 0.0 5.62 740 673 A 62 ALA HB% A 59 ILE HA 1.0 0.0 3.99 741 674 A 64 GLU HB2 A 61 LYS HA 1.0 0.0 4.45 742 675 A 64 GLU HB3 A 61 LYS HA 1.0 0.0 5.12 743 676 A 64 GLU H A 62 ALA HA 1.0 0.0 5.89 744 677 A 63 ASP HA A 22 ALA HB% 1.0 0.0 5.27 745 678 A 22 ALA HB% A 68 ASP HA 1.0 0.0 4.81 746 679 A 69 VAL HA A 22 ALA HB% 1.0 0.0 4.97 747 680 A 59 ILE HA A 22 ALA HB% 1.0 0.0 4.38 748 681 A 55 ARG HA A 24 ILE HG2% 1.0 0.0 4.43 749 682 A 24 ILE HG2% A 55 ARG HDy 1.0 0.0 5.51 750 683 A 25 MET HB3 A 29 ASP HB2 1.0 0.0 5.06 751 683 A 25 MET HB3 A 29 ASP HB3 1.0 0.0 5.06 752 684 A 25 MET HB2 A 29 ASP HB2 1.0 0.0 6.11 753 684 A 29 ASP HB3 A 25 MET HB2 1.0 0.0 6.11 754 685 A 25 MET HB3 A 69 VAL HG1% 1.0 0.0 5.03 755 686 A 25 MET HB3 A 71 VAL HG2% 1.0 0.0 5.35 756 687 A 25 MET HG2 A 69 VAL HG1% 1.0 0.0 5.34 757 688 A 25 MET HG3 A 69 VAL HG2% 1.0 0.0 5.24 758 689 A 26 LYS HB3 A 29 ASP HB2 1.0 0.0 5.62 759 689 A 29 ASP HB3 A 26 LYS HB3 1.0 0.0 5.62 760 690 A 26 LYS HA A 71 VAL HG1% 1.0 0.0 5.28 761 691 A 71 VAL HG2% A 27 LYS HA 1.0 0.0 5.53 762 692 A 28 THR HA A 27 LYS HB2 1.0 0.0 5.89 763 692 A 27 LYS HB3 A 28 THR HA 1.0 0.0 5.89 764 693 A 28 THR HG2% A 32 LYS HE2 1.0 0.0 5.41 765 693 A 28 THR HG2% A 32 LYS HE3 1.0 0.0 5.41 766 694 A 32 LYS HG2 A 28 THR HA 1.0 0.0 6.83 767 695 A 29 ASP HA A 32 LYS HD2 1.0 0.0 4.59 768 695 A 29 ASP HA A 32 LYS HD3 1.0 0.0 4.59 769 696 A 26 LYS HB2 A 29 ASP HB2 1.0 0.0 5.11 770 696 A 29 ASP HB3 A 26 LYS HB2 1.0 0.0 5.11 771 697 A 25 MET HB3 A 30 PHE HB3 1.0 0.0 6.32 772 698 A 30 PHE HB3 A 25 MET HB2 1.0 0.0 6.15 773 699 A 32 LYS HG2 A 31 ASP HB2 1.0 0.0 6.49 774 699 A 31 ASP HB3 A 32 LYS HG2 1.0 0.0 6.49 775 700 A 32 LYS HG2 A 29 ASP HA 1.0 0.0 6.06 776 701 A 32 LYS HA A 31 ASP HB2 1.0 0.0 6.04 777 701 A 31 ASP HB3 A 32 LYS HA 1.0 0.0 6.04 778 702 A 33 VAL HG2% A 30 PHE HA 1.0 0.0 3.71 779 703 A 33 VAL HG1% A 30 PHE HA 1.0 0.0 5.49 780 704 A 31 ASP HA A 33 VAL HG2% 1.0 0.0 6.71 781 705 A 32 LYS HB3 A 33 VAL HG1% 1.0 0.0 4.50 782 706 A 32 LYS HB2 A 33 VAL HG1% 1.0 0.0 4.57 783 707 A 33 VAL HG2% A 34 ALA HA 1.0 0.0 5.34 784 708 A 36 GLU H A 34 ALA HA 1.0 0.0 5.24 785 709 A 37 TYR H A 35 SER HA 1.0 0.0 5.21 786 710 A 36 GLU HA A 91 LYS HDx 1.0 0.0 5.28 787 711 A 37 TYR HA A 91 LYS HG3 1.0 0.0 5.03 788 712 A 38 THR HB A 89 LYS HBx 1.0 0.0 5.85 789 713 A 38 THR HB A 89 LYS HBy 1.0 0.0 5.85 790 714 A 38 THR HB A 91 LYS HE2 1.0 0.0 6.24 791 714 A 38 THR HB A 91 LYS HE3 1.0 0.0 6.24 792 715 A 67 ALA HB% A 62 ALA HA 1.0 0.0 4.45 793 716 A 89 LYS HA A 67 ALA HB% 1.0 0.0 5.39 794 717 A 87 ILE HA A 67 ALA HB% 1.0 0.0 5.19 795 718 A 41 GLY H A 39 LYS HG3 1.0 0.0 5.08 796 719 A 40 ILE HG2% A 38 THR HB 1.0 0.0 5.21 797 720 A 40 ILE HD1% A 67 ALA HA 1.0 0.0 4.13 798 721 A 89 LYS HA A 40 ILE HD1% 1.0 0.0 5.72 799 722 A 88 TYR HA A 40 ILE HD1% 1.0 0.0 5.39 800 723 A 40 ILE HG2% A 88 TYR HA 1.0 0.0 5.40 801 724 A 40 ILE HB A 87 ILE HG13 1.0 0.0 4.89 802 725 A 40 ILE HB A 87 ILE HD1% 1.0 0.0 4.98 803 726 A 42 THR HA A 87 ILE HG12 1.0 0.0 5.62 804 727 A 42 THR HG2% A 39 LYS HE2 1.0 0.0 4.16 805 727 A 42 THR HG2% A 39 LYS HE3 1.0 0.0 4.16 806 728 A 43 ILE HA A 42 THR HB 1.0 0.0 5.28 807 729 A 42 THR HA A 43 ILE HG2% 1.0 0.0 5.59 808 730 A 43 ILE HG2% A 62 ALA HA 1.0 0.0 5.13 809 731 A 58 LEU HA A 43 ILE HD1% 1.0 0.0 4.19 810 732 A 43 ILE HD1% A 62 ALA HA 1.0 0.0 4.62 811 733 A 58 LEU HB3 A 43 ILE HD1% 1.0 0.0 4.15 812 734 A 85 ALA HB% A 43 ILE HD1% 1.0 0.0 4.50 813 735 A 43 ILE HB A 58 LEU HD2% 1.0 0.0 5.40 814 736 A 44 SER HA A 84 THR HA 1.0 0.0 3.89 815 737 A 43 ILE HA A 44 SER HBy 1.0 0.0 5.62 816 738 A 84 THR HA A 44 SER HBx 1.0 0.0 5.39 817 739 A 43 ILE HA A 44 SER HBx 1.0 0.0 5.62 818 740 A 44 SER HA A 45 THR HG2% 1.0 0.0 5.24 819 741 A 45 THR HG2% A 58 LEU HG 1.0 0.0 4.21 820 742 A 83 GLY HA3 A 45 THR HG2% 1.0 0.0 4.75 821 743 A 54 ALA HB% A 49 MET HG2 1.0 0.0 5.12 822 743 A 49 MET HG3 A 54 ALA HB% 1.0 0.0 5.12 823 744 A 45 THR HG2% A 49 MET HG2 1.0 0.0 5.59 824 744 A 45 THR HG2% A 49 MET HG3 1.0 0.0 5.59 825 745 A 49 MET HE% A 49 MET HG2 1.0 0.0 4.62 826 745 A 49 MET HG3 A 49 MET HE% 1.0 0.0 4.62 827 746 A 53 ASP HB3 A 49 MET HBx 1.0 0.0 5.29 828 746 A 49 MET HBx A 53 ASP HB2 1.0 0.0 5.29 829 747 A 54 ALA HA A 49 MET HG2 1.0 0.0 5.75 830 747 A 49 MET HG3 A 54 ALA HA 1.0 0.0 5.75 831 748 A 45 THR HB A 49 MET HG2 1.0 0.0 5.87 832 748 A 45 THR HB A 49 MET HG3 1.0 0.0 5.87 833 749 A 48 GLU HA A 49 MET HG2 1.0 0.0 6.00 834 749 A 48 GLU HA A 49 MET HG3 1.0 0.0 6.00 835 750 A 51 PRO HD3 A 50 SER HBx 1.0 0.0 4.48 836 750 A 50 SER HBx A 51 PRO HD2 1.0 0.0 4.48 837 751 A 51 PRO HD3 A 50 SER HBy 1.0 0.0 4.48 838 751 A 50 SER HBy A 51 PRO HD2 1.0 0.0 4.48 839 752 A 52 LEU HD2% A 55 ARG HDy 1.0 0.0 5.95 840 753 A 53 ASP HB3 A 49 MET HBy 1.0 0.0 5.29 841 753 A 49 MET HBy A 53 ASP HB2 1.0 0.0 5.29 842 754 A 54 ALA HB% A 55 ARG HA 1.0 0.0 5.47 843 755 A 45 THR HG2% A 54 ALA HA 1.0 0.0 4.47 844 756 A 24 ILE HD1% A 55 ARG HA 1.0 0.0 5.53 845 757 A 55 ARG HB3 A 59 ILE HD1% 1.0 0.0 6.18 846 758 A 55 ARG HB2 A 24 ILE HG2% 1.0 0.0 5.00 847 759 A 55 ARG HG3 A 24 ILE HG2% 1.0 0.0 4.95 848 760 A 72 LEU HD1% A 55 ARG HG3 1.0 0.0 5.21 849 761 A 72 LEU HD1% A 55 ARG HDy 1.0 0.0 6.11 850 762 A 24 ILE HG2% A 55 ARG HDx 1.0 0.0 5.51 851 763 A 72 LEU HD1% A 55 ARG HDx 1.0 0.0 6.11 852 764 A 52 LEU HA A 55 ARG HDy 1.0 0.0 5.72 853 765 A 52 LEU HA A 55 ARG HDx 1.0 0.0 5.72 854 766 A 56 GLU HA A 59 ILE HG2% 1.0 0.0 5.08 855 767 A 44 SER H A 58 LEU HD2% 1.0 0.0 5.27 856 768 A 58 LEU HD1% A 55 ARG HA 1.0 0.0 4.66 857 769 A 45 THR HB A 58 LEU HD2% 1.0 0.0 5.16 858 770 A 44 SER HA A 58 LEU HD2% 1.0 0.0 4.55 859 771 A 45 THR HG2% A 58 LEU HD1% 1.0 0.0 4.07 860 772 A 56 GLU HA A 59 ILE HD1% 1.0 0.0 4.24 861 773 A 22 ALA HA A 59 ILE HG2% 1.0 0.0 5.59 862 774 A 23 GLU HA A 59 ILE HD1% 1.0 0.0 5.08 863 775 A 60 LYS HA A 59 ILE HG2% 1.0 0.0 5.33 864 776 A 61 LYS HB2 A 43 ILE HD1% 1.0 0.0 4.96 865 777 A 43 ILE HG2% A 61 LYS HA 1.0 0.0 6.44 866 778 A 61 LYS HA A 43 ILE HD1% 1.0 0.0 6.83 867 779 A 87 ILE HG2% A 62 ALA HA 1.0 0.0 4.13 868 780 A 65 LYS HB2 A 62 ALA HA 1.0 0.0 4.75 869 781 A 62 ALA HB% A 63 ASP HA 1.0 0.0 5.64 870 782 A 61 LYS H A 62 ALA HB% 1.0 0.0 5.32 871 783 A 62 ALA HB% A 64 GLU H 1.0 0.0 5.84 872 784 A 67 ALA H A 63 ASP HA 1.0 0.0 5.80 873 785 A 61 LYS HA A 64 GLU HGx 1.0 0.0 5.72 874 786 A 61 LYS HA A 64 GLU HGy 1.0 0.0 5.72 875 787 A 40 ILE HD1% A 65 LYS HB3 1.0 0.0 5.70 876 788 A 43 ILE HG2% A 65 LYS HB3 1.0 0.0 6.30 877 789 A 87 ILE HG2% A 65 LYS HB3 1.0 0.0 6.42 878 790 A 65 LYS HB2 A 40 ILE HD1% 1.0 0.0 5.29 879 791 A 87 ILE HD1% A 65 LYS HGx 1.0 0.0 4.99 880 792 A 40 ILE HD1% A 65 LYS HA 1.0 0.0 6.13 881 793 A 69 VAL H A 67 ALA HA 1.0 0.0 5.43 882 794 A 89 LYS HA A 67 ALA HA 1.0 0.0 5.07 883 795 A 67 ALA HA A 89 LYS HG2 1.0 0.0 5.02 884 795 A 89 LYS HG3 A 67 ALA HA 1.0 0.0 5.02 885 796 A 67 ALA HA A 89 LYS HBy 1.0 0.0 5.74 886 797 A 67 ALA HB% A 40 ILE HD1% 1.0 0.0 3.57 887 798 A 90 LYS H A 68 ASP HB2 1.0 0.0 5.16 888 799 A 89 LYS HA A 68 ASP HB2 1.0 0.0 4.96 889 800 A 68 ASP HB3 A 89 LYS HA 1.0 0.0 4.62 890 801 A 22 ALA HA A 68 ASP HA 1.0 0.0 4.45 891 802 A 90 LYS HB2 A 68 ASP HB2 1.0 0.0 6.08 892 803 A 68 ASP HB3 A 90 LYS HB2 1.0 0.0 5.99 893 804 A 88 TYR HB2 A 69 VAL HB 1.0 0.0 4.35 894 805 A 69 VAL HG1% A 25 MET HG3 1.0 0.0 4.61 895 806 A 69 VAL HG1% A 88 TYR HB2 1.0 0.0 5.17 896 807 A 68 ASP HB3 A 69 VAL HG2% 1.0 0.0 4.80 897 808 A 69 VAL HG2% A 68 ASP HB2 1.0 0.0 4.65 898 809 A 69 VAL HG2% A 25 MET HE% 1.0 0.0 4.29 899 810 A 69 VAL HG2% A 23 GLU HBy 1.0 0.0 5.63 900 811 A 69 VAL HG1% A 25 MET HB2 1.0 0.0 4.30 901 812 A 69 VAL HG1% A 37 TYR HE% 1.0 0.0 5.11 902 813 A 70 VAL HG2% A 62 ALA HB% 1.0 0.0 3.32 903 814 A 70 VAL HG2% A 67 ALA HB% 1.0 0.0 4.60 904 815 A 71 VAL HG1% A 27 LYS HA 1.0 0.0 3.96 905 816 A 30 PHE HB3 A 71 VAL HG1% 1.0 0.0 5.01 906 817 A 71 VAL HG1% A 30 PHE HB2 1.0 0.0 5.20 907 818 A 30 PHE HB3 A 71 VAL HG2% 1.0 0.0 5.10 908 819 A 71 VAL HG2% A 30 PHE HB2 1.0 0.0 4.79 909 820 A 71 VAL HG2% A 88 TYR HD% 1.0 0.0 5.13 910 821 A 71 VAL HB A 88 TYR HD% 1.0 0.0 5.82 911 822 A 26 LYS HA A 72 LEU HD1% 1.0 0.0 5.54 912 823 A 71 VAL HA A 72 LEU HD1% 1.0 0.0 5.76 913 824 A 71 VAL HG1% A 73 THR HA 1.0 0.0 5.70 914 825 A 84 THR HG2% A 74 SER HB2 1.0 0.0 5.53 915 825 A 84 THR HG2% A 74 SER HB3 1.0 0.0 5.53 916 826 A 81 ILE HD1% A 74 SER HB2 1.0 0.0 5.24 917 826 A 74 SER HB3 A 81 ILE HD1% 1.0 0.0 5.24 918 827 A 78 GLU HA A 81 ILE HD1% 1.0 0.0 5.41 919 828 A 24 ILE HD1% A 70 VAL HA 1.0 0.0 5.16 920 829 A 58 LEU HD1% A 83 GLY HA2 1.0 0.0 6.16 921 830 A 72 LEU HD2% A 83 GLY HA2 1.0 0.0 6.15 922 831 A 58 LEU HD2% A 84 THR HA 1.0 0.0 5.26 923 832 A 44 SER HA A 84 THR HB 1.0 0.0 6.02 924 833 A 44 SER HA A 84 THR HG2% 1.0 0.0 4.65 925 834 A 84 THR HG2% A 44 SER HBy 1.0 0.0 4.70 926 835 A 84 THR HG2% A 44 SER HBx 1.0 0.0 4.70 927 836 A 42 THR HB A 84 THR HG2% 1.0 0.0 5.09 928 837 A 84 THR HA A 44 SER HBy 1.0 0.0 5.39 929 838 A 72 LEU HA A 85 ALA HA 1.0 0.0 4.16 930 839 A 72 LEU HA A 85 ALA HB% 1.0 0.0 4.07 931 840 A 70 VAL HA A 85 ALA HB% 1.0 0.0 5.32 932 841 A 71 VAL HA A 85 ALA HB% 1.0 0.0 5.72 933 842 A 58 LEU HD1% A 85 ALA HB% 1.0 0.0 3.61 934 843 A 58 LEU HD2% A 85 ALA HB% 1.0 0.0 3.91 935 844 A 71 VAL HB A 86 ASP HB2 1.0 0.0 5.08 936 845 A 71 VAL HB A 86 ASP HB3 1.0 0.0 5.43 937 846 A 87 ILE HG2% A 86 ASP HA 1.0 0.0 5.50 938 847 A 42 THR HG2% A 86 ASP HB2 1.0 0.0 6.26 939 848 A 39 LYS HG3 A 86 ASP HB2 1.0 0.0 6.49 940 849 A 86 ASP HB3 A 39 LYS HG3 1.0 0.0 5.54 941 850 A 43 ILE H A 86 ASP HA 1.0 0.0 5.44 942 851 A 70 VAL HA A 87 ILE HA 1.0 0.0 4.33 943 852 A 87 ILE HD1% A 62 ALA HA 1.0 0.0 4.36 944 853 A 41 GLY HA3 A 87 ILE HD1% 1.0 0.0 5.33 945 854 A 87 ILE HB A 67 ALA HB% 1.0 0.0 3.97 946 855 A 87 ILE HD1% A 65 LYS HB3 1.0 0.0 4.19 947 856 A 88 TYR HB3 A 69 VAL HB 1.0 0.0 5.40 948 857 A 88 TYR HB2 A 69 VAL HG2% 1.0 0.0 5.78 949 858 A 38 THR HG2% A 89 LYS HBy 1.0 0.0 5.91 950 859 A 38 THR HG2% A 89 LYS HBx 1.0 0.0 5.91 951 860 A 40 ILE HD1% A 89 LYS HBx 1.0 0.0 4.77 952 861 A 37 TYR HE% A 90 LYS HE2 1.0 0.0 5.38 953 861 A 37 TYR HE% A 90 LYS HE3 1.0 0.0 5.38 954 862 A 37 TYR HA A 90 LYS HA 1.0 0.0 4.02 955 863 A 36 GLU HA A 91 LYS HDy 1.0 0.0 5.28 956 864 A 72 LEU HD2% A 76 GLN HBy 1.0 0.0 6.83 957 865 A 81 ILE HG2% A 76 GLN HBy 1.0 0.0 6.83 958 866 A 72 LEU HD2% A 76 GLN HBx 1.0 0.0 6.83 959 867 A 81 ILE HG2% A 76 GLN HBx 1.0 0.0 6.83 960 868 A 72 LEU HD1% A 76 GLN HBx 1.0 0.0 6.29 961 869 A 72 LEU HD2% A 76 GLN HG2 1.0 0.0 6.83 962 869 A 72 LEU HD2% A 76 GLN HG3 1.0 0.0 6.83 963 870 A 81 ILE HG2% A 76 GLN HG2 1.0 0.0 6.83 964 870 A 76 GLN HG3 A 81 ILE HG2% 1.0 0.0 6.83 965 871 A 22 ALA HA A 23 GLU HG2 1.0 0.0 6.52 966 871 A 22 ALA HA A 23 GLU HG3 1.0 0.0 6.52 967 872 A 22 ALA HA A 23 GLU HA 1.0 0.0 6.38 968 873 A 70 VAL HG2% A 22 ALA HB% 1.0 0.0 3.84 969 874 A 59 ILE HG2% A 22 ALA HB% 1.0 0.0 3.98 970 875 A 23 GLU HA A 22 ALA HB% 1.0 0.0 5.99 971 876 A 69 VAL H A 22 ALA HB% 1.0 0.0 5.78 972 877 A 70 VAL H A 22 ALA HB% 1.0 0.0 5.72 973 878 A 63 ASP H A 22 ALA HB% 1.0 0.0 5.13 974 879 A 69 VAL HA A 23 GLU HBy 1.0 0.0 6.28 975 880 A 69 VAL HG1% A 23 GLU HBy 1.0 0.0 6.42 976 881 A 69 VAL HG1% A 23 GLU HBx 1.0 0.0 6.42 977 882 A 69 VAL HG2% A 23 GLU HBx 1.0 0.0 5.63 978 883 A 69 VAL HG2% A 23 GLU HG2 1.0 0.0 4.83 979 883 A 23 GLU HG3 A 69 VAL HG2% 1.0 0.0 4.83 980 884 A 69 VAL HG1% A 23 GLU HG2 1.0 0.0 5.57 981 884 A 23 GLU HG3 A 69 VAL HG1% 1.0 0.0 5.57 982 885 A 24 ILE HD1% A 23 GLU HG2 1.0 0.0 6.15 983 885 A 23 GLU HG3 A 24 ILE HD1% 1.0 0.0 6.15 984 886 A 24 ILE HA A 23 GLU HG2 1.0 0.0 6.48 985 886 A 23 GLU HG3 A 24 ILE HA 1.0 0.0 6.48 986 887 A 69 VAL HA A 23 GLU HG2 1.0 0.0 5.52 987 887 A 23 GLU HG3 A 69 VAL HA 1.0 0.0 5.52 988 888 A 37 TYR HE% A 23 GLU HG2 1.0 0.0 6.21 989 888 A 23 GLU HG3 A 37 TYR HE% 1.0 0.0 6.21 990 889 A 25 MET H A 23 GLU HG2 1.0 0.0 6.83 991 889 A 23 GLU HG3 A 25 MET H 1.0 0.0 6.83 992 890 A 70 VAL H A 23 GLU HG2 1.0 0.0 6.83 993 890 A 23 GLU HG3 A 70 VAL H 1.0 0.0 6.83 994 891 A 24 ILE HA A 69 VAL HG1% 1.0 0.0 4.79 995 892 A 24 ILE HA A 70 VAL HB 1.0 0.0 4.05 996 893 A 23 GLU HA A 24 ILE HB 1.0 0.0 5.74 997 894 A 55 ARG HB3 A 24 ILE HG2% 1.0 0.0 4.22 998 895 A 55 ARG HG2 A 24 ILE HG2% 1.0 0.0 4.30 999 896 A 55 ARG HE A 24 ILE HG2% 1.0 0.0 6.07 1000 897 A 55 ARG H A 24 ILE HG2% 1.0 0.0 6.45 1001 898 A 59 ILE H A 24 ILE HG2% 1.0 0.0 6.20 1002 899 A 25 MET H A 24 ILE HG2% 1.0 0.0 5.69 1003 900 A 23 GLU HA A 24 ILE HG1y 1.0 0.0 6.52 1004 901 A 23 GLU HA A 24 ILE HG1x 1.0 0.0 6.52 1005 902 A 25 MET HB3 A 33 VAL HG2% 1.0 0.0 6.28 1006 903 A 25 MET HB3 A 69 VAL HG2% 1.0 0.0 6.83 1007 904 A 25 MET HB2 A 69 VAL HG2% 1.0 0.0 5.93 1008 905 A 71 VAL HG1% A 25 MET HB2 1.0 0.0 5.99 1009 906 A 24 ILE HA A 25 MET HB3 1.0 0.0 6.24 1010 907 A 25 MET HB3 A 30 PHE HD% 1.0 0.0 6.06 1011 908 A 71 VAL HA A 25 MET HB2 1.0 0.0 6.57 1012 909 A 25 MET HB3 A 29 ASP HA 1.0 0.0 6.83 1013 910 A 25 MET HB3 A 71 VAL HA 1.0 0.0 6.83 1014 911 A 25 MET HB3 A 30 PHE HB2 1.0 0.0 5.33 1015 912 A 25 MET HG2 A 30 PHE H 1.0 0.0 6.24 1016 913 A 25 MET H A 25 MET HG2 1.0 0.0 5.95 1017 914 A 69 VAL HG1% A 25 MET HE% 1.0 0.0 4.14 1018 915 A 33 VAL HG2% A 25 MET HE% 1.0 0.0 3.45 1019 916 A 33 VAL HG1% A 25 MET HE% 1.0 0.0 4.29 1020 917 A 25 MET HG2 A 25 MET HE% 1.0 0.0 3.96 1021 918 A 25 MET HE% A 29 ASP HB2 1.0 0.0 4.00 1022 918 A 29 ASP HB3 A 25 MET HE% 1.0 0.0 4.00 1023 919 A 25 MET HE% A 30 PHE HA 1.0 0.0 4.20 1024 920 A 29 ASP HA A 25 MET HE% 1.0 0.0 5.66 1025 921 A 25 MET HA A 25 MET HE% 1.0 0.0 4.97 1026 922 A 69 VAL HA A 25 MET HE% 1.0 0.0 6.23 1027 923 A 25 MET HE% A 30 PHE HE% 1.0 0.0 6.28 1028 924 A 25 MET HE% A 37 TYR HE% 1.0 0.0 4.99 1029 925 A 25 MET HE% A 37 TYR HD% 1.0 0.0 6.23 1030 926 A 30 PHE H A 25 MET HE% 1.0 0.0 5.15 1031 927 A 25 MET H A 25 MET HE% 1.0 0.0 5.80 1032 928 A 26 LYS H A 25 MET HE% 1.0 0.0 5.55 1033 929 A 25 MET HB3 A 26 LYS HA 1.0 0.0 5.22 1034 930 A 26 LYS HB3 A 28 THR HG2% 1.0 0.0 5.88 1035 931 A 29 ASP H A 26 LYS HGx 1.0 0.0 6.42 1036 932 A 29 ASP H A 26 LYS HGy 1.0 0.0 6.42 1037 933 A 29 ASP HB3 A 26 LYS HGy 1.0 0.0 6.83 1038 933 A 26 LYS HGy A 29 ASP HB2 1.0 0.0 6.83 1039 934 A 26 LYS H A 26 LYS HD2 1.0 0.0 5.58 1040 934 A 26 LYS H A 26 LYS HD3 1.0 0.0 5.58 1041 935 A 28 THR H A 26 LYS HD2 1.0 0.0 6.79 1042 935 A 28 THR H A 26 LYS HD3 1.0 0.0 6.79 1043 936 A 29 ASP H A 26 LYS HD2 1.0 0.0 6.83 1044 936 A 29 ASP H A 26 LYS HD3 1.0 0.0 6.83 1045 937 A 27 LYS HA A 27 LYS HDy 1.0 0.0 5.42 1046 938 A 27 LYS HA A 30 PHE HD% 1.0 0.0 5.51 1047 939 A 29 ASP H A 27 LYS HA 1.0 0.0 6.66 1048 940 A 29 ASP H A 27 LYS HB2 1.0 0.0 6.83 1049 940 A 27 LYS HB3 A 29 ASP H 1.0 0.0 6.83 1050 941 A 30 PHE HD% A 27 LYS HB2 1.0 0.0 6.83 1051 941 A 27 LYS HB3 A 30 PHE HD% 1.0 0.0 6.83 1052 942 A 27 LYS H A 27 LYS HGx 1.0 0.0 6.51 1053 943 A 32 LYS H A 28 THR HA 1.0 0.0 6.29 1054 944 A 28 THR HG2% A 31 ASP HB2 1.0 0.0 5.95 1055 944 A 31 ASP HB3 A 28 THR HG2% 1.0 0.0 5.95 1056 945 A 29 ASP HA A 28 THR HG2% 1.0 0.0 6.38 1057 946 A 29 ASP HB3 A 26 LYS HGx 1.0 0.0 6.83 1058 946 A 26 LYS HGx A 29 ASP HB2 1.0 0.0 6.83 1059 947 A 26 LYS HD2 A 29 ASP HB2 1.0 0.0 6.44 1060 947 A 29 ASP HB3 A 26 LYS HD2 1.0 0.0 6.44 1061 947 A 29 ASP HB3 A 26 LYS HD3 1.0 0.0 6.44 1062 947 A 26 LYS HD3 A 29 ASP HB2 1.0 0.0 6.44 1063 948 A 32 LYS HG3 A 29 ASP HB2 1.0 0.0 6.83 1064 948 A 29 ASP HB3 A 32 LYS HG3 1.0 0.0 6.83 1065 949 A 29 ASP HB2 A 32 LYS HD2 1.0 0.0 6.83 1066 949 A 29 ASP HB3 A 32 LYS HD2 1.0 0.0 6.83 1067 949 A 32 LYS HD3 A 29 ASP HB2 1.0 0.0 6.83 1068 949 A 29 ASP HB3 A 32 LYS HD3 1.0 0.0 6.83 1069 950 A 25 MET HA A 29 ASP HB2 1.0 0.0 6.42 1070 950 A 25 MET HA A 29 ASP HB3 1.0 0.0 6.42 1071 951 A 71 VAL HG2% A 30 PHE HA 1.0 0.0 6.23 1072 952 A 25 MET HB2 A 30 PHE HA 1.0 0.0 6.57 1073 953 A 30 PHE HB3 A 33 VAL HG2% 1.0 0.0 6.45 1074 954 A 33 VAL HG2% A 30 PHE HB2 1.0 0.0 6.44 1075 955 A 30 PHE HB3 A 25 MET HE% 1.0 0.0 6.78 1076 956 A 30 PHE HB3 A 27 LYS HB2 1.0 0.0 6.83 1077 956 A 27 LYS HB3 A 30 PHE HB3 1.0 0.0 6.83 1078 957 A 30 PHE HB2 A 25 MET HE% 1.0 0.0 6.83 1079 958 A 32 LYS HG3 A 31 ASP HB2 1.0 0.0 5.99 1080 958 A 31 ASP HB3 A 32 LYS HG3 1.0 0.0 5.99 1081 959 A 30 PHE HD% A 31 ASP HB2 1.0 0.0 6.43 1082 959 A 31 ASP HB3 A 30 PHE HD% 1.0 0.0 6.43 1083 960 A 34 ALA H A 31 ASP HB2 1.0 0.0 6.83 1084 960 A 31 ASP HB3 A 34 ALA H 1.0 0.0 6.83 1085 961 A 33 VAL H A 31 ASP HB2 1.0 0.0 6.69 1086 961 A 31 ASP HB3 A 33 VAL H 1.0 0.0 6.69 1087 962 A 33 VAL HG2% A 32 LYS HA 1.0 0.0 6.65 1088 963 A 33 VAL HG1% A 32 LYS HA 1.0 0.0 5.94 1089 964 A 33 VAL H A 32 LYS HG2 1.0 0.0 6.68 1090 965 A 29 ASP HA A 32 LYS HG3 1.0 0.0 5.76 1091 966 A 33 VAL H A 32 LYS HG3 1.0 0.0 6.66 1092 967 A 33 VAL HG1% A 37 TYR HE% 1.0 0.0 5.39 1093 968 A 32 LYS H A 33 VAL HG1% 1.0 0.0 5.94 1094 969 A 33 VAL HG1% A 37 TYR HD% 1.0 0.0 6.53 1095 970 A 30 PHE H A 33 VAL HG2% 1.0 0.0 6.39 1096 971 A 31 ASP H A 33 VAL HG2% 1.0 0.0 6.83 1097 972 A 31 ASP HA A 34 ALA HA 1.0 0.0 6.71 1098 973 A 34 ALA HA A 37 TYR HD% 1.0 0.0 4.40 1099 974 A 33 VAL H A 34 ALA HA 1.0 0.0 5.73 1100 975 A 34 ALA HB% A 31 ASP HB2 1.0 0.0 5.65 1101 975 A 31 ASP HB3 A 34 ALA HB% 1.0 0.0 5.65 1102 976 A 34 ALA HB% A 30 PHE HZ 1.0 0.0 5.07 1103 977 A 32 LYS H A 34 ALA HB% 1.0 0.0 5.85 1104 978 A 36 GLU H A 35 SER HBy 1.0 0.0 6.18 1105 979 A 36 GLU H A 35 SER HBx 1.0 0.0 6.18 1106 980 A 91 LYS HG3 A 36 GLU HA 1.0 0.0 6.05 1107 981 A 36 GLU HA A 37 TYR HD% 1.0 0.0 6.06 1108 982 A 37 TYR H A 36 GLU HBx 1.0 0.0 6.71 1109 983 A 37 TYR H A 36 GLU HBy 1.0 0.0 6.71 1110 984 A 33 VAL HA A 36 GLU HGy 1.0 0.0 6.09 1111 985 A 33 VAL HA A 36 GLU HGx 1.0 0.0 6.09 1112 986 A 37 TYR HA A 91 LYS HG2 1.0 0.0 5.65 1113 987 A 37 TYR HB2 A 88 TYR HB2 1.0 0.0 5.99 1114 988 A 37 TYR HB3 A 88 TYR HB2 1.0 0.0 5.35 1115 989 A 37 TYR HB2 A 88 TYR HD% 1.0 0.0 6.37 1116 990 A 37 TYR HB3 A 90 LYS HA 1.0 0.0 6.48 1117 991 A 37 TYR HB3 A 30 PHE HE% 1.0 0.0 5.78 1118 992 A 37 TYR HB3 A 88 TYR HD% 1.0 0.0 5.84 1119 993 A 37 TYR HA A 38 THR HB 1.0 0.0 6.00 1120 994 A 89 LYS H A 38 THR HB 1.0 0.0 5.45 1121 995 A 88 TYR HB3 A 38 THR HG2% 1.0 0.0 6.83 1122 996 A 67 ALA HB% A 63 ASP HA 1.0 0.0 5.90 1123 997 A 70 VAL HA A 67 ALA HB% 1.0 0.0 6.26 1124 998 A 39 LYS HA A 88 TYR HD% 1.0 0.0 5.46 1125 999 A 38 THR HA A 39 LYS HBx 1.0 0.0 6.50 1126 1000 A 38 THR HA A 39 LYS HBy 1.0 0.0 6.50 1127 1001 A 87 ILE H A 39 LYS HG2 1.0 0.0 6.36 1128 1002 A 87 ILE H A 39 LYS HG3 1.0 0.0 6.18 1129 1003 A 86 ASP HB3 A 39 LYS HD2 1.0 0.0 5.47 1130 1003 A 39 LYS HD3 A 86 ASP HB3 1.0 0.0 5.47 1131 1004 A 86 ASP HA A 39 LYS HD2 1.0 0.0 6.63 1132 1004 A 39 LYS HD3 A 86 ASP HA 1.0 0.0 6.63 1133 1005 A 88 TYR HD% A 39 LYS HD2 1.0 0.0 6.74 1134 1005 A 39 LYS HD3 A 88 TYR HD% 1.0 0.0 6.74 1135 1006 A 41 GLY HA2 A 39 LYS HE2 1.0 0.0 6.28 1136 1006 A 39 LYS HE3 A 41 GLY HA2 1.0 0.0 6.28 1137 1007 A 39 LYS HE3 A 39 LYS HBx 1.0 0.0 5.43 1138 1007 A 39 LYS HBx A 39 LYS HE2 1.0 0.0 5.43 1139 1008 A 39 LYS HE3 A 39 LYS HBy 1.0 0.0 5.43 1140 1008 A 39 LYS HBy A 39 LYS HE2 1.0 0.0 5.43 1141 1009 A 86 ASP HB3 A 39 LYS HE2 1.0 0.0 5.08 1142 1009 A 86 ASP HB3 A 39 LYS HE3 1.0 0.0 5.08 1143 1010 A 42 THR HA A 39 LYS HE2 1.0 0.0 6.11 1144 1010 A 42 THR HA A 39 LYS HE3 1.0 0.0 6.11 1145 1011 A 86 ASP HA A 39 LYS HE2 1.0 0.0 6.58 1146 1011 A 39 LYS HE3 A 86 ASP HA 1.0 0.0 6.58 1147 1012 A 41 GLY H A 39 LYS HE2 1.0 0.0 5.96 1148 1012 A 41 GLY H A 39 LYS HE3 1.0 0.0 5.96 1149 1013 A 87 ILE H A 39 LYS HE2 1.0 0.0 6.58 1150 1013 A 87 ILE H A 39 LYS HE3 1.0 0.0 6.58 1151 1014 A 40 ILE HB A 67 ALA HB% 1.0 0.0 5.58 1152 1015 A 40 ILE HG2% A 89 LYS HDy 1.0 0.0 5.02 1153 1016 A 40 ILE HG2% A 89 LYS HBx 1.0 0.0 4.48 1154 1017 A 40 ILE HG2% A 89 LYS HDx 1.0 0.0 5.02 1155 1018 A 40 ILE HG2% A 89 LYS HG2 1.0 0.0 4.62 1156 1018 A 40 ILE HG2% A 89 LYS HG3 1.0 0.0 4.62 1157 1019 A 40 ILE HG2% A 39 LYS HA 1.0 0.0 6.00 1158 1020 A 40 ILE HG2% A 89 LYS HA 1.0 0.0 6.34 1159 1021 A 40 ILE HG2% A 89 LYS H 1.0 0.0 4.85 1160 1022 A 87 ILE HG13 A 40 ILE HG1y 1.0 0.0 5.21 1161 1023 A 87 ILE HG13 A 40 ILE HD1% 1.0 0.0 4.69 1162 1024 A 87 ILE HB A 40 ILE HD1% 1.0 0.0 4.74 1163 1025 A 40 ILE HD1% A 89 LYS HG2 1.0 0.0 4.24 1164 1025 A 89 LYS HG3 A 40 ILE HD1% 1.0 0.0 4.24 1165 1026 A 40 ILE HD1% A 89 LYS HDx 1.0 0.0 4.42 1166 1027 A 40 ILE HD1% A 89 LYS HDy 1.0 0.0 4.42 1167 1028 A 40 ILE HD1% A 89 LYS HBy 1.0 0.0 4.77 1168 1029 A 41 GLY H A 40 ILE HD1% 1.0 0.0 6.13 1169 1030 A 89 LYS H A 40 ILE HD1% 1.0 0.0 5.46 1170 1031 A 87 ILE HD1% A 41 GLY HA2 1.0 0.0 5.96 1171 1032 A 39 LYS HG3 A 41 GLY HA2 1.0 0.0 6.83 1172 1033 A 39 LYS HG2 A 41 GLY HA2 1.0 0.0 6.29 1173 1034 A 42 THR HG2% A 41 GLY HA2 1.0 0.0 6.04 1174 1035 A 87 ILE HG13 A 41 GLY HA2 1.0 0.0 6.45 1175 1036 A 42 THR HA A 41 GLY HA2 1.0 0.0 6.28 1176 1037 A 41 GLY HA3 A 40 ILE HD1% 1.0 0.0 6.83 1177 1038 A 41 GLY HA3 A 43 ILE HG2% 1.0 0.0 6.83 1178 1039 A 41 GLY HA3 A 87 ILE HG13 1.0 0.0 6.49 1179 1040 A 41 GLY HA3 A 39 LYS HE2 1.0 0.0 6.54 1180 1040 A 41 GLY HA3 A 39 LYS HE3 1.0 0.0 6.54 1181 1041 A 41 GLY HA3 A 42 THR HA 1.0 0.0 5.93 1182 1042 A 43 ILE HG2% A 42 THR HB 1.0 0.0 6.01 1183 1043 A 85 ALA H A 42 THR HB 1.0 0.0 6.28 1184 1044 A 42 THR HG2% A 84 THR HB 1.0 0.0 4.42 1185 1045 A 43 ILE H A 42 THR HG2% 1.0 0.0 4.29 1186 1046 A 43 ILE HB A 44 SER HA 1.0 0.0 6.59 1187 1047 A 43 ILE HG2% A 41 GLY HA2 1.0 0.0 6.83 1188 1048 A 85 ALA H A 43 ILE HG1y 1.0 0.0 5.85 1189 1049 A 62 ALA HB% A 43 ILE HD1% 1.0 0.0 3.95 1190 1050 A 70 VAL HA A 43 ILE HD1% 1.0 0.0 6.48 1191 1051 A 44 SER HA A 43 ILE HD1% 1.0 0.0 6.14 1192 1052 A 61 LYS H A 43 ILE HD1% 1.0 0.0 5.58 1193 1053 A 44 SER H A 43 ILE HD1% 1.0 0.0 5.82 1194 1054 A 63 ASP H A 43 ILE HD1% 1.0 0.0 6.83 1195 1055 A 45 THR HA A 58 LEU HD2% 1.0 0.0 4.92 1196 1056 A 69 VAL HG1% A 71 VAL HA 1.0 0.0 5.64 1197 1057 A 45 THR HG2% A 58 LEU HD2% 1.0 0.0 3.80 1198 1058 A 45 THR HG2% A 83 GLY HA2 1.0 0.0 5.27 1199 1059 A 45 THR HG2% A 58 LEU H 1.0 0.0 5.50 1200 1060 A 46 THR HA A 47 GLY HAx 1.0 0.0 5.48 1201 1061 A 46 THR HA A 47 GLY HAy 1.0 0.0 5.48 1202 1062 A 81 ILE HD1% A 48 GLU HB2 1.0 0.0 5.01 1203 1062 A 48 GLU HB3 A 81 ILE HD1% 1.0 0.0 5.01 1204 1063 A 50 SER H A 48 GLU HB2 1.0 0.0 6.30 1205 1063 A 48 GLU HB3 A 50 SER H 1.0 0.0 6.30 1206 1064 A 54 ALA H A 49 MET HG2 1.0 0.0 6.25 1207 1064 A 49 MET HG3 A 54 ALA H 1.0 0.0 6.25 1208 1065 A 46 THR HB A 49 MET HE% 1.0 0.0 5.30 1209 1066 A 54 ALA HA A 49 MET HE% 1.0 0.0 5.48 1210 1067 A 45 THR HB A 49 MET HE% 1.0 0.0 4.59 1211 1068 A 46 THR HA A 49 MET HE% 1.0 0.0 6.83 1212 1069 A 57 ASP HA A 49 MET HE% 1.0 0.0 6.83 1213 1070 A 45 THR HA A 49 MET HE% 1.0 0.0 5.63 1214 1071 A 49 MET HA A 49 MET HE% 1.0 0.0 5.70 1215 1072 A 57 ASP H A 49 MET HE% 1.0 0.0 5.73 1216 1073 A 47 GLY H A 49 MET HE% 1.0 0.0 5.82 1217 1074 A 49 MET H A 49 MET HE% 1.0 0.0 6.33 1218 1075 A 46 THR H A 49 MET HE% 1.0 0.0 4.87 1219 1076 A 53 ASP H A 50 SER HBx 1.0 0.0 5.69 1220 1077 A 72 LEU HD2% A 51 PRO HA 1.0 0.0 6.83 1221 1078 A 81 ILE HG2% A 51 PRO HA 1.0 0.0 6.83 1222 1079 A 55 ARG H A 51 PRO HA 1.0 0.0 5.67 1223 1080 A 50 SER HA A 51 PRO HD2 1.0 0.0 3.91 1224 1080 A 51 PRO HD3 A 50 SER HA 1.0 0.0 3.91 1225 1081 A 50 SER H A 51 PRO HD2 1.0 0.0 6.54 1226 1081 A 50 SER H A 51 PRO HD3 1.0 0.0 6.54 1227 1082 A 53 ASP H A 52 LEU HG 1.0 0.0 5.94 1228 1083 A 52 LEU HD1% A 56 GLU HGx 1.0 0.0 5.88 1229 1084 A 52 LEU HD1% A 56 GLU HGy 1.0 0.0 5.88 1230 1085 A 52 LEU HD1% A 55 ARG HDx 1.0 0.0 6.22 1231 1086 A 56 GLU H A 52 LEU HD1% 1.0 0.0 6.34 1232 1087 A 52 LEU HD2% A 55 ARG HDx 1.0 0.0 5.95 1233 1088 A 52 LEU H A 52 LEU HD2% 1.0 0.0 5.96 1234 1089 A 49 MET HE% A 53 ASP HB2 1.0 0.0 5.71 1235 1089 A 53 ASP HB3 A 49 MET HE% 1.0 0.0 5.71 1236 1090 A 53 ASP HB3 A 56 GLU HB2 1.0 0.0 5.81 1237 1090 A 53 ASP HB2 A 56 GLU HB2 1.0 0.0 5.81 1238 1090 A 56 GLU HB3 A 53 ASP HB2 1.0 0.0 5.81 1239 1090 A 53 ASP HB3 A 56 GLU HB3 1.0 0.0 5.81 1240 1091 A 54 ALA HA A 53 ASP HB2 1.0 0.0 6.29 1241 1091 A 53 ASP HB3 A 54 ALA HA 1.0 0.0 6.29 1242 1092 A 49 MET HA A 53 ASP HB2 1.0 0.0 6.58 1243 1092 A 53 ASP HB3 A 49 MET HA 1.0 0.0 6.58 1244 1093 A 58 LEU HD2% A 54 ALA HA 1.0 0.0 6.83 1245 1094 A 58 LEU HG A 54 ALA HA 1.0 0.0 6.05 1246 1095 A 54 ALA HB% A 58 LEU HD1% 1.0 0.0 4.65 1247 1096 A 54 ALA HB% A 53 ASP HB2 1.0 0.0 5.53 1248 1096 A 53 ASP HB3 A 54 ALA HB% 1.0 0.0 5.53 1249 1097 A 54 ALA HB% A 56 GLU H 1.0 0.0 6.39 1250 1098 A 52 LEU H A 54 ALA HB% 1.0 0.0 6.34 1251 1099 A 54 ALA HB% A 58 LEU H 1.0 0.0 6.83 1252 1100 A 45 THR H A 54 ALA HB% 1.0 0.0 6.73 1253 1101 A 54 ALA HB% A 83 GLY H 1.0 0.0 6.83 1254 1102 A 55 ARG HA A 55 ARG HDy 1.0 0.0 6.74 1255 1103 A 55 ARG HG2 A 58 LEU HD1% 1.0 0.0 6.24 1256 1104 A 24 ILE HD1% A 55 ARG HG2 1.0 0.0 5.97 1257 1105 A 55 ARG HG2 A 72 LEU HD2% 1.0 0.0 5.78 1258 1106 A 55 ARG HG2 A 58 LEU HB3 1.0 0.0 6.67 1259 1107 A 56 GLU H A 55 ARG HG3 1.0 0.0 6.58 1260 1108 A 52 LEU HD1% A 55 ARG HDy 1.0 0.0 6.22 1261 1109 A 56 GLU H A 55 ARG HDy 1.0 0.0 6.71 1262 1110 A 55 ARG H A 55 ARG HDy 1.0 0.0 6.69 1263 1111 A 56 GLU H A 55 ARG HDx 1.0 0.0 6.71 1264 1112 A 55 ARG H A 55 ARG HDx 1.0 0.0 6.69 1265 1113 A 55 ARG H A 56 GLU HB2 1.0 0.0 6.41 1266 1113 A 55 ARG H A 56 GLU HB3 1.0 0.0 6.41 1267 1114 A 60 LYS H A 56 GLU HB2 1.0 0.0 6.83 1268 1114 A 56 GLU HB3 A 60 LYS H 1.0 0.0 6.83 1269 1115 A 59 ILE HD1% A 56 GLU HGy 1.0 0.0 6.83 1270 1116 A 59 ILE HD1% A 56 GLU HGx 1.0 0.0 6.83 1271 1117 A 53 ASP HA A 56 GLU HGy 1.0 0.0 5.92 1272 1118 A 53 ASP HA A 56 GLU HGx 1.0 0.0 5.92 1273 1119 A 57 ASP H A 56 GLU HGy 1.0 0.0 6.59 1274 1120 A 57 ASP H A 56 GLU HGx 1.0 0.0 6.59 1275 1121 A 59 ILE HB A 57 ASP HA 1.0 0.0 5.90 1276 1122 A 49 MET HE% A 57 ASP HBy 1.0 0.0 5.81 1277 1123 A 49 MET HE% A 57 ASP HBx 1.0 0.0 5.81 1278 1124 A 45 THR HG2% A 58 LEU HA 1.0 0.0 5.44 1279 1125 A 60 LYS H A 58 LEU HA 1.0 0.0 6.23 1280 1126 A 58 LEU HB2 A 24 ILE HG2% 1.0 0.0 5.72 1281 1127 A 58 LEU HB2 A 59 ILE HG12 1.0 0.0 6.14 1282 1128 A 58 LEU HB2 A 43 ILE HD1% 1.0 0.0 5.39 1283 1129 A 58 LEU HG A 55 ARG HA 1.0 0.0 6.67 1284 1130 A 83 GLY HA3 A 58 LEU HD1% 1.0 0.0 5.28 1285 1131 A 58 LEU HD1% A 54 ALA HA 1.0 0.0 6.00 1286 1132 A 45 THR HB A 58 LEU HD1% 1.0 0.0 6.04 1287 1133 A 58 LEU HD1% A 72 LEU HA 1.0 0.0 6.41 1288 1134 A 45 THR HA A 58 LEU HD1% 1.0 0.0 6.11 1289 1135 A 58 LEU HD1% A 84 THR HA 1.0 0.0 6.45 1290 1136 A 44 SER HA A 58 LEU HD1% 1.0 0.0 6.30 1291 1137 A 45 THR H A 58 LEU HD1% 1.0 0.0 6.11 1292 1138 A 58 LEU HD1% A 85 ALA H 1.0 0.0 6.58 1293 1139 A 54 ALA HB% A 58 LEU HD2% 1.0 0.0 5.44 1294 1140 A 58 LEU HD2% A 61 LYS HDx 1.0 0.0 5.91 1295 1141 A 43 ILE HA A 58 LEU HD2% 1.0 0.0 6.14 1296 1142 A 70 VAL HG1% A 59 ILE HA 1.0 0.0 5.73 1297 1143 A 63 ASP H A 59 ILE HG2% 1.0 0.0 5.95 1298 1144 A 59 ILE HG12 A 22 ALA HB% 1.0 0.0 6.07 1299 1145 A 59 ILE HG12 A 56 GLU HA 1.0 0.0 6.46 1300 1146 A 58 LEU HD1% A 59 ILE HG13 1.0 0.0 6.67 1301 1147 A 70 VAL HG2% A 59 ILE HG13 1.0 0.0 6.83 1302 1148 A 59 ILE HG13 A 70 VAL HG1% 1.0 0.0 6.16 1303 1149 A 59 ILE HG13 A 22 ALA HB% 1.0 0.0 6.36 1304 1150 A 59 ILE HG13 A 62 ALA HB% 1.0 0.0 6.83 1305 1151 A 59 ILE HG13 A 56 GLU HA 1.0 0.0 6.03 1306 1152 A 59 ILE HD1% A 55 ARG HE 1.0 0.0 6.50 1307 1153 A 60 LYS H A 59 ILE HD1% 1.0 0.0 5.84 1308 1154 A 24 ILE H A 59 ILE HD1% 1.0 0.0 5.30 1309 1155 A 60 LYS H A 60 LYS HD2 1.0 0.0 6.29 1310 1155 A 60 LYS H A 60 LYS HD3 1.0 0.0 6.29 1311 1156 A 57 ASP HA A 60 LYS HD2 1.0 0.0 5.30 1312 1156 A 60 LYS HD3 A 57 ASP HA 1.0 0.0 5.30 1313 1157 A 62 ALA HB% A 61 LYS HA 1.0 0.0 6.46 1314 1158 A 61 LYS HA A 60 LYS HB2 1.0 0.0 5.65 1315 1158 A 60 LYS HB3 A 61 LYS HA 1.0 0.0 5.65 1316 1159 A 61 LYS HA A 60 LYS HE2 1.0 0.0 6.83 1317 1159 A 61 LYS HA A 60 LYS HE3 1.0 0.0 6.83 1318 1160 A 61 LYS HA A 61 LYS HEx 1.0 0.0 6.83 1319 1161 A 61 LYS HA A 61 LYS HEy 1.0 0.0 6.83 1320 1162 A 58 LEU HD2% A 61 LYS HB2 1.0 0.0 6.45 1321 1163 A 61 LYS HB3 A 43 ILE HD1% 1.0 0.0 4.87 1322 1164 A 58 LEU HD2% A 61 LYS HDy 1.0 0.0 5.91 1323 1165 A 40 ILE HD1% A 89 LYS HE2 1.0 0.0 5.09 1324 1165 A 40 ILE HD1% A 89 LYS HE3 1.0 0.0 5.09 1325 1166 A 71 VAL HG1% A 27 LYS HE2 1.0 0.0 5.50 1326 1166 A 71 VAL HG1% A 27 LYS HE3 1.0 0.0 5.50 1327 1167 A 40 ILE HG2% A 89 LYS HE2 1.0 0.0 5.28 1328 1167 A 40 ILE HG2% A 89 LYS HE3 1.0 0.0 5.28 1329 1168 A 38 THR HG2% A 89 LYS HE2 1.0 0.0 6.72 1330 1168 A 38 THR HG2% A 89 LYS HE3 1.0 0.0 6.72 1331 1169 A 67 ALA HB% A 89 LYS HE2 1.0 0.0 6.83 1332 1169 A 67 ALA HB% A 89 LYS HE3 1.0 0.0 6.83 1333 1170 A 70 VAL HG2% A 62 ALA HA 1.0 0.0 5.30 1334 1171 A 62 ALA HA A 65 LYS HGx 1.0 0.0 5.93 1335 1172 A 62 ALA HA A 65 LYS HGy 1.0 0.0 5.93 1336 1173 A 87 ILE HB A 62 ALA HA 1.0 0.0 6.60 1337 1174 A 61 LYS HB2 A 62 ALA HA 1.0 0.0 6.20 1338 1175 A 62 ALA HA A 65 LYS HB3 1.0 0.0 5.72 1339 1176 A 62 ALA HB% A 87 ILE HA 1.0 0.0 6.13 1340 1177 A 65 LYS HA A 65 LYS HDy 1.0 0.0 4.85 1341 1178 A 66 GLY H A 65 LYS HB3 1.0 0.0 6.29 1342 1179 A 65 LYS HA A 65 LYS HDx 1.0 0.0 4.85 1343 1180 A 65 LYS H A 65 LYS HDx 1.0 0.0 6.36 1344 1181 A 65 LYS H A 65 LYS HDy 1.0 0.0 6.36 1345 1182 A 87 ILE HD1% A 65 LYS HEx 1.0 0.0 6.16 1346 1183 A 43 ILE HG2% A 65 LYS HEx 1.0 0.0 5.04 1347 1184 A 43 ILE HG2% A 65 LYS HEy 1.0 0.0 5.04 1348 1185 A 87 ILE HD1% A 65 LYS HEy 1.0 0.0 6.16 1349 1186 A 87 ILE HB A 67 ALA HA 1.0 0.0 6.04 1350 1187 A 67 ALA HB% A 68 ASP HA 1.0 0.0 5.92 1351 1188 A 69 VAL HB A 68 ASP HB2 1.0 0.0 6.72 1352 1189 A 90 LYS HB3 A 68 ASP HB2 1.0 0.0 6.55 1353 1190 A 68 ASP HB2 A 37 TYR HD% 1.0 0.0 6.50 1354 1191 A 68 ASP HB3 A 37 TYR HD% 1.0 0.0 6.47 1355 1192 A 68 ASP HB3 A 90 LYS HB3 1.0 0.0 6.69 1356 1193 A 69 VAL HA A 70 VAL HB 1.0 0.0 5.50 1357 1194 A 69 VAL HA A 23 GLU HBx 1.0 0.0 6.28 1358 1195 A 68 ASP H A 69 VAL HB 1.0 0.0 6.17 1359 1196 A 71 VAL HG2% A 69 VAL HB 1.0 0.0 6.22 1360 1197 A 68 ASP HB3 A 69 VAL HB 1.0 0.0 6.55 1361 1198 A 69 VAL HB A 30 PHE HE% 1.0 0.0 6.59 1362 1199 A 69 VAL HB A 88 TYR HD% 1.0 0.0 6.41 1363 1200 A 69 VAL HB A 30 PHE HD% 1.0 0.0 6.44 1364 1201 A 68 ASP H A 69 VAL HG2% 1.0 0.0 6.05 1365 1202 A 90 LYS HB2 A 69 VAL HG2% 1.0 0.0 6.25 1366 1203 A 69 VAL HG2% A 30 PHE HE% 1.0 0.0 5.52 1367 1204 A 69 VAL HG2% A 37 TYR HD% 1.0 0.0 5.13 1368 1205 A 23 GLU H A 69 VAL HG2% 1.0 0.0 5.45 1369 1206 A 69 VAL HG1% A 30 PHE HB2 1.0 0.0 6.20 1370 1207 A 25 MET HA A 69 VAL HG1% 1.0 0.0 6.20 1371 1208 A 69 VAL HG1% A 88 TYR HD% 1.0 0.0 5.59 1372 1209 A 69 VAL HG1% A 37 TYR HD% 1.0 0.0 6.24 1373 1210 A 69 VAL HG1% A 30 PHE HZ 1.0 0.0 6.17 1374 1211 A 24 ILE HD1% A 70 VAL HB 1.0 0.0 4.13 1375 1212 A 70 VAL HB A 24 ILE HG2% 1.0 0.0 5.18 1376 1213 A 59 ILE HG12 A 70 VAL HB 1.0 0.0 5.80 1377 1214 A 58 LEU HB3 A 70 VAL HB 1.0 0.0 6.47 1378 1215 A 85 ALA HB% A 70 VAL HB 1.0 0.0 6.83 1379 1216 A 70 VAL HB A 22 ALA HB% 1.0 0.0 5.73 1380 1217 A 62 ALA HB% A 70 VAL HB 1.0 0.0 6.08 1381 1218 A 71 VAL H A 70 VAL HB 1.0 0.0 5.69 1382 1219 A 85 ALA HB% A 70 VAL HG1% 1.0 0.0 3.50 1383 1220 A 87 ILE HB A 70 VAL HG1% 1.0 0.0 5.21 1384 1221 A 58 LEU HB2 A 70 VAL HG1% 1.0 0.0 5.11 1385 1222 A 72 LEU HA A 70 VAL HG1% 1.0 0.0 5.64 1386 1223 A 70 VAL HA A 70 VAL HG1% 1.0 0.0 3.93 1387 1224 A 24 ILE HA A 70 VAL HG1% 1.0 0.0 4.94 1388 1225 A 85 ALA HA A 70 VAL HG1% 1.0 0.0 6.16 1389 1226 A 70 VAL H A 70 VAL HG1% 1.0 0.0 4.69 1390 1227 A 71 VAL H A 70 VAL HG1% 1.0 0.0 4.37 1391 1228 A 70 VAL HG2% A 59 ILE HA 1.0 0.0 4.51 1392 1229 A 24 ILE HA A 70 VAL HG2% 1.0 0.0 5.45 1393 1230 A 23 GLU H A 70 VAL HG2% 1.0 0.0 5.46 1394 1231 A 70 VAL HG2% A 62 ALA H 1.0 0.0 5.61 1395 1232 A 71 VAL HA A 72 LEU HG 1.0 0.0 5.29 1396 1233 A 71 VAL HB A 73 THR HG2% 1.0 0.0 5.99 1397 1234 A 71 VAL HB A 30 PHE HD% 1.0 0.0 6.60 1398 1235 A 69 VAL HG1% A 71 VAL HG2% 1.0 0.0 3.78 1399 1236 A 71 VAL HG2% A 25 MET HB2 1.0 0.0 4.85 1400 1237 A 71 VAL HG2% A 25 MET HG3 1.0 0.0 6.56 1401 1238 A 71 VAL HG2% A 86 ASP HB2 1.0 0.0 5.88 1402 1239 A 71 VAL HG2% A 30 PHE HE% 1.0 0.0 5.63 1403 1240 A 71 VAL HG2% A 37 TYR HE% 1.0 0.0 6.43 1404 1241 A 25 MET H A 71 VAL HG2% 1.0 0.0 5.62 1405 1242 A 70 VAL H A 71 VAL HG2% 1.0 0.0 6.49 1406 1243 A 71 VAL HG1% A 27 LYS HB2 1.0 0.0 4.22 1407 1243 A 27 LYS HB3 A 71 VAL HG1% 1.0 0.0 4.22 1408 1244 A 71 VAL HG1% A 86 ASP HB2 1.0 0.0 6.35 1409 1245 A 71 VAL HG1% A 73 THR H 1.0 0.0 6.83 1410 1246 A 72 LEU HA A 73 THR HG2% 1.0 0.0 5.19 1411 1247 A 72 LEU HA A 74 SER H 1.0 0.0 5.87 1412 1248 A 71 VAL HA A 72 LEU HB2 1.0 0.0 5.83 1413 1249 A 71 VAL HA A 72 LEU HB3 1.0 0.0 6.70 1414 1250 A 72 LEU HB3 A 74 SER HA 1.0 0.0 6.83 1415 1251 A 85 ALA HB% A 72 LEU HG 1.0 0.0 5.91 1416 1252 A 72 LEU HD1% A 51 PRO HA 1.0 0.0 5.86 1417 1253 A 55 ARG HG2 A 72 LEU HD1% 1.0 0.0 4.76 1418 1254 A 72 LEU HD1% A 76 GLN HG2 1.0 0.0 5.67 1419 1254 A 72 LEU HD1% A 76 GLN HG3 1.0 0.0 5.67 1420 1255 A 72 LEU HD1% A 55 ARG HA 1.0 0.0 6.23 1421 1256 A 72 LEU HD1% A 74 SER H 1.0 0.0 6.12 1422 1257 A 72 LEU HD2% A 55 ARG HA 1.0 0.0 5.75 1423 1258 A 72 LEU HD2% A 85 ALA HA 1.0 0.0 5.73 1424 1259 A 72 LEU HD2% A 76 GLN HE22 1.0 0.0 6.21 1425 1260 A 72 LEU HD2% A 76 GLN HE21 1.0 0.0 6.60 1426 1261 A 72 LEU HD2% A 74 SER H 1.0 0.0 6.13 1427 1262 A 72 LEU HB3 A 73 THR HA 1.0 0.0 5.78 1428 1263 A 72 LEU HB2 A 73 THR HA 1.0 0.0 6.02 1429 1264 A 73 THR HG2% A 86 ASP HB2 1.0 0.0 5.63 1430 1265 A 73 THR HG2% A 86 ASP H 1.0 0.0 4.49 1431 1266 A 73 THR H A 73 THR HG2% 1.0 0.0 4.34 1432 1267 A 73 THR HG2% A 74 SER HB2 1.0 0.0 6.44 1433 1267 A 73 THR HG2% A 74 SER HB3 1.0 0.0 6.44 1434 1268 A 74 SER HA A 75 GLY HA2 1.0 0.0 6.09 1435 1268 A 74 SER HA A 75 GLY HA3 1.0 0.0 6.09 1436 1269 A 76 GLN HA A 75 GLY HA2 1.0 0.0 6.57 1437 1269 A 76 GLN HA A 75 GLY HA3 1.0 0.0 6.57 1438 1270 A 74 SER H A 75 GLY HA2 1.0 0.0 6.42 1439 1270 A 74 SER H A 75 GLY HA3 1.0 0.0 6.42 1440 1271 A 77 THR H A 75 GLY HA2 1.0 0.0 6.83 1441 1271 A 77 THR H A 75 GLY HA3 1.0 0.0 6.83 1442 1272 A 72 LEU HD2% A 76 GLN HA 1.0 0.0 6.11 1443 1273 A 76 GLN HA A 81 ILE HG2% 1.0 0.0 6.31 1444 1274 A 77 THR HG2% A 76 GLN HBy 1.0 0.0 6.58 1445 1275 A 77 THR HG2% A 76 GLN HBx 1.0 0.0 6.58 1446 1276 A 77 THR HG2% A 76 GLN HG2 1.0 0.0 6.03 1447 1276 A 76 GLN HG3 A 77 THR HG2% 1.0 0.0 6.03 1448 1277 A 75 GLY HA2 A 76 GLN HG2 1.0 0.0 6.10 1449 1277 A 76 GLN HG3 A 75 GLY HA2 1.0 0.0 6.10 1450 1277 A 76 GLN HG3 A 75 GLY HA3 1.0 0.0 6.10 1451 1277 A 75 GLY HA3 A 76 GLN HG2 1.0 0.0 6.10 1452 1278 A 77 THR HB A 76 GLN HG2 1.0 0.0 6.21 1453 1278 A 76 GLN HG3 A 77 THR HB 1.0 0.0 6.21 1454 1279 A 79 ASN H A 77 THR HB 1.0 0.0 5.50 1455 1280 A 81 ILE HG2% A 78 GLU HA 1.0 0.0 6.83 1456 1281 A 78 GLU HA A 81 ILE HG1y 1.0 0.0 6.20 1457 1282 A 80 LYS H A 78 GLU HA 1.0 0.0 6.24 1458 1283 A 81 ILE HD1% A 78 GLU HG2 1.0 0.0 5.67 1459 1283 A 78 GLU HG3 A 81 ILE HD1% 1.0 0.0 5.67 1460 1284 A 81 ILE HG2% A 78 GLU HG2 1.0 0.0 6.39 1461 1284 A 78 GLU HG3 A 81 ILE HG2% 1.0 0.0 6.39 1462 1285 A 81 ILE HG2% A 80 LYS HA 1.0 0.0 5.78 1463 1286 A 80 LYS HB2 A 80 LYS HE2 1.0 0.0 5.74 1464 1286 A 80 LYS HB3 A 80 LYS HE2 1.0 0.0 5.74 1465 1286 A 80 LYS HE3 A 80 LYS HB2 1.0 0.0 5.74 1466 1286 A 80 LYS HB3 A 80 LYS HE3 1.0 0.0 5.74 1467 1287 A 78 GLU HA A 81 ILE HG1x 1.0 0.0 6.20 1468 1288 A 81 ILE HD1% A 51 PRO HA 1.0 0.0 4.68 1469 1289 A 76 GLN HA A 81 ILE HD1% 1.0 0.0 6.02 1470 1290 A 77 THR H A 81 ILE HD1% 1.0 0.0 6.72 1471 1291 A 84 THR H A 81 ILE HD1% 1.0 0.0 6.59 1472 1292 A 78 GLU H A 81 ILE HD1% 1.0 0.0 6.65 1473 1293 A 82 HIS H A 81 ILE HD1% 1.0 0.0 6.83 1474 1294 A 83 GLY HA3 A 72 LEU HD2% 1.0 0.0 6.47 1475 1295 A 83 GLY HA3 A 81 ILE HD1% 1.0 0.0 6.77 1476 1296 A 83 GLY HA3 A 54 ALA HB% 1.0 0.0 5.79 1477 1297 A 83 GLY HA3 A 84 THR HG2% 1.0 0.0 6.44 1478 1298 A 83 GLY HA2 A 81 ILE HD1% 1.0 0.0 6.32 1479 1299 A 83 GLY HA2 A 84 THR HG2% 1.0 0.0 6.83 1480 1300 A 54 ALA HB% A 83 GLY HA2 1.0 0.0 6.30 1481 1301 A 83 GLY HA3 A 84 THR HA 1.0 0.0 6.58 1482 1302 A 45 THR H A 84 THR HG2% 1.0 0.0 6.01 1483 1303 A 83 GLY H A 84 THR HG2% 1.0 0.0 6.12 1484 1304 A 73 THR HG2% A 85 ALA HA 1.0 0.0 4.43 1485 1305 A 85 ALA HB% A 86 ASP HA 1.0 0.0 5.99 1486 1306 A 44 SER HA A 85 ALA HB% 1.0 0.0 6.16 1487 1307 A 85 ALA HB% A 86 ASP HB2 1.0 0.0 6.46 1488 1308 A 86 ASP HB2 A 39 LYS HD2 1.0 0.0 6.25 1489 1308 A 39 LYS HD3 A 86 ASP HB2 1.0 0.0 6.25 1490 1309 A 85 ALA HA A 86 ASP HB2 1.0 0.0 6.25 1491 1310 A 86 ASP HB2 A 88 TYR HD% 1.0 0.0 6.24 1492 1311 A 71 VAL H A 86 ASP HB2 1.0 0.0 6.43 1493 1312 A 71 VAL HG2% A 86 ASP HB3 1.0 0.0 6.77 1494 1313 A 86 ASP HB3 A 39 LYS HG2 1.0 0.0 6.27 1495 1314 A 86 ASP HB3 A 42 THR HG2% 1.0 0.0 6.33 1496 1315 A 73 THR HG2% A 86 ASP HB3 1.0 0.0 6.83 1497 1316 A 86 ASP HB3 A 88 TYR HD% 1.0 0.0 6.16 1498 1317 A 87 ILE HA A 88 TYR HB2 1.0 0.0 6.17 1499 1318 A 87 ILE HA A 88 TYR HD% 1.0 0.0 5.80 1500 1319 A 71 VAL H A 87 ILE HA 1.0 0.0 5.42 1501 1320 A 87 ILE HB A 70 VAL HA 1.0 0.0 6.48 1502 1321 A 70 VAL HA A 87 ILE HG2% 1.0 0.0 4.38 1503 1322 A 42 THR HA A 87 ILE HG2% 1.0 0.0 5.97 1504 1323 A 86 ASP H A 87 ILE HG2% 1.0 0.0 6.70 1505 1324 A 71 VAL H A 87 ILE HG2% 1.0 0.0 5.62 1506 1325 A 43 ILE H A 87 ILE HG2% 1.0 0.0 5.61 1507 1326 A 87 ILE HG13 A 65 LYS HB3 1.0 0.0 6.47 1508 1327 A 42 THR HA A 87 ILE HG13 1.0 0.0 6.42 1509 1328 A 87 ILE HG13 A 86 ASP HA 1.0 0.0 6.83 1510 1329 A 87 ILE HD1% A 65 LYS HA 1.0 0.0 6.01 1511 1330 A 87 ILE HD1% A 67 ALA HB% 1.0 0.0 3.89 1512 1331 A 65 LYS HB2 A 87 ILE HD1% 1.0 0.0 4.18 1513 1332 A 87 ILE HD1% A 67 ALA HA 1.0 0.0 6.30 1514 1333 A 87 ILE HD1% A 40 ILE HA 1.0 0.0 6.42 1515 1334 A 42 THR HA A 87 ILE HD1% 1.0 0.0 5.81 1516 1335 A 40 ILE H A 87 ILE HD1% 1.0 0.0 6.03 1517 1336 A 43 ILE H A 87 ILE HD1% 1.0 0.0 6.34 1518 1337 A 88 TYR HA A 38 THR HG2% 1.0 0.0 6.83 1519 1338 A 88 TYR HA A 67 ALA HB% 1.0 0.0 6.83 1520 1339 A 87 ILE HB A 88 TYR HA 1.0 0.0 6.83 1521 1340 A 88 TYR HA A 89 LYS HBx 1.0 0.0 6.68 1522 1341 A 37 TYR HB3 A 88 TYR HA 1.0 0.0 6.08 1523 1342 A 88 TYR HA A 39 LYS HA 1.0 0.0 4.28 1524 1343 A 88 TYR HA A 88 TYR HD% 1.0 0.0 6.03 1525 1344 A 69 VAL HG1% A 88 TYR HB3 1.0 0.0 6.44 1526 1345 A 88 TYR HB3 A 40 ILE HD1% 1.0 0.0 6.65 1527 1346 A 88 TYR HB3 A 69 VAL HG2% 1.0 0.0 6.83 1528 1347 A 37 TYR HA A 88 TYR HB3 1.0 0.0 6.83 1529 1348 A 88 TYR HB3 A 89 LYS HA 1.0 0.0 6.83 1530 1349 A 88 TYR HB3 A 37 TYR HE% 1.0 0.0 6.17 1531 1350 A 88 TYR HB2 A 89 LYS HA 1.0 0.0 6.83 1532 1351 A 88 TYR HB2 A 30 PHE HE% 1.0 0.0 6.64 1533 1352 A 88 TYR HB2 A 37 TYR HE% 1.0 0.0 6.08 1534 1353 A 89 LYS HA A 38 THR HG2% 1.0 0.0 6.60 1535 1354 A 88 TYR HA A 89 LYS HBy 1.0 0.0 6.68 1536 1355 A 67 ALA HA A 89 LYS HBx 1.0 0.0 5.74 1537 1356 A 68 ASP H A 89 LYS HBx 1.0 0.0 6.65 1538 1357 A 38 THR H A 89 LYS HG2 1.0 0.0 6.32 1539 1357 A 38 THR H A 89 LYS HG3 1.0 0.0 6.32 1540 1358 A 90 LYS H A 89 LYS HG2 1.0 0.0 4.87 1541 1358 A 90 LYS H A 89 LYS HG3 1.0 0.0 4.87 1542 1359 A 90 LYS HA A 91 LYS HG3 1.0 0.0 5.87 1543 1360 A 37 TYR HB2 A 90 LYS HA 1.0 0.0 6.83 1544 1361 A 90 LYS HA A 90 LYS HE2 1.0 0.0 6.83 1545 1361 A 90 LYS HA A 90 LYS HE3 1.0 0.0 6.83 1546 1362 A 90 LYS HB3 A 90 LYS HE2 1.0 0.0 6.25 1547 1362 A 90 LYS HB3 A 90 LYS HE3 1.0 0.0 6.25 1548 1363 A 89 LYS HA A 90 LYS HB3 1.0 0.0 6.07 1549 1364 A 90 LYS HB3 A 37 TYR HD% 1.0 0.0 6.77 1550 1365 A 90 LYS HB3 A 92 LEU H 1.0 0.0 6.37 1551 1366 A 89 LYS HA A 90 LYS HB2 1.0 0.0 6.06 1552 1367 A 90 LYS H A 90 LYS HGy 1.0 0.0 5.65 1553 1368 A 37 TYR HD% A 90 LYS HD2 1.0 0.0 6.70 1554 1368 A 90 LYS HD3 A 37 TYR HD% 1.0 0.0 6.70 1555 1369 A 91 LYS H A 90 LYS HD2 1.0 0.0 5.97 1556 1369 A 91 LYS H A 90 LYS HD3 1.0 0.0 5.97 1557 1370 A 90 LYS H A 90 LYS HD2 1.0 0.0 5.67 1558 1370 A 90 LYS H A 90 LYS HD3 1.0 0.0 5.67 1559 1371 A 91 LYS HA A 38 THR HG2% 1.0 0.0 5.40 1560 1372 A 37 TYR HA A 91 LYS HA 1.0 0.0 6.35 1561 1373 A 91 LYS HG2 A 38 THR HB 1.0 0.0 6.25 1562 1374 A 91 LYS HG3 A 38 THR HB 1.0 0.0 6.49 1563 1375 A 91 LYS HG3 A 91 LYS HE2 1.0 0.0 4.40 1564 1375 A 91 LYS HG3 A 91 LYS HE3 1.0 0.0 4.40 1565 1376 A 38 THR HG2% A 91 LYS HE2 1.0 0.0 4.83 1566 1376 A 38 THR HG2% A 91 LYS HE3 1.0 0.0 4.83 1567 1377 A 36 GLU HA A 91 LYS HE2 1.0 0.0 5.78 1568 1377 A 36 GLU HA A 91 LYS HE3 1.0 0.0 5.78 1569 1378 A 37 TYR HA A 91 LYS HE2 1.0 0.0 6.33 1570 1378 A 37 TYR HA A 91 LYS HE3 1.0 0.0 6.33 1571 1379 A 37 TYR H A 91 LYS HE2 1.0 0.0 5.81 1572 1379 A 37 TYR H A 91 LYS HE3 1.0 0.0 5.81 1573 1380 A 91 LYS HA A 92 LEU HG 1.0 0.0 6.20 1574 1381 A 92 LEU H A 92 LEU HD2% 1.0 0.0 6.30 1575 1382 A 93 GLU H A 92 LEU HD2% 1.0 0.0 6.51 1576 1383 A 81 ILE H A 80 LYS HD2 1.0 0.0 6.83 1577 1383 A 81 ILE H A 80 LYS HD3 1.0 0.0 6.83 1578 1384 A 25 MET HB2 A 30 PHE HB2 1.0 0.0 5.19 1579 1385 A 29 ASP HA A 32 LYS HE2 1.0 0.0 5.18 1580 1385 A 29 ASP HA A 32 LYS HE3 1.0 0.0 5.18 1581 1386 A 89 LYS H A 38 THR HG2% 1.0 0.0 5.47 1582 1387 A 40 ILE HG2% A 89 LYS HBy 1.0 0.0 4.48 1583 1388 A 72 LEU HD1% A 76 GLN HBy 1.0 0.0 6.29 1584 1389 A 55 ARG HB2 A 59 ILE HD1% 1.0 0.0 6.26 1585 1390 A 62 ALA HB% A 87 ILE HG2% 1.0 0.0 3.76 1586 1391 A 30 PHE HA A 30 PHE HD% 1.0 0.0 3.50 1587 1392 A 37 TYR H A 37 TYR HD% 1.0 0.0 3.73 1588 1393 A 37 TYR HA A 37 TYR HD% 1.0 0.0 3.68 1589 1394 A 37 TYR HA A 37 TYR HE% 1.0 0.0 5.53 1590 1395 A 89 LYS HA A 37 TYR HE% 1.0 0.0 6.01 1591 1396 A 33 VAL HG2% A 30 PHE HD% 1.0 0.0 3.98 1592 1397 A 69 VAL HG2% A 30 PHE HD% 1.0 0.0 4.54 1593 1398 A 69 VAL HG1% A 30 PHE HD% 1.0 0.0 3.69 1594 1399 A 71 VAL HG2% A 30 PHE HD% 1.0 0.0 3.90 1595 1400 A 88 TYR HB3 A 37 TYR HD% 1.0 0.0 3.40 1596 1401 A 90 LYS HA A 37 TYR HD% 1.0 0.0 3.46 1597 1402 A 33 VAL HB A 37 TYR HD% 1.0 0.0 4.41 1598 1403 A 37 TYR HD% A 36 GLU HBy 1.0 0.0 4.21 1599 1404 A 37 TYR HD% A 36 GLU HBx 1.0 0.0 4.21 1600 1405 A 33 VAL HB A 37 TYR HE% 1.0 0.0 3.99 1601 1406 A 68 ASP HB3 A 37 TYR HE% 1.0 0.0 4.34 1602 1407 A 90 LYS HB3 A 37 TYR HE% 1.0 0.0 4.19 1603 1408 A 90 LYS HB2 A 37 TYR HE% 1.0 0.0 3.39 1604 1409 A 37 TYR HE% A 90 LYS HGy 1.0 0.0 3.98 1605 1410 A 69 VAL HB A 37 TYR HE% 1.0 0.0 4.37 1606 1411 A 37 TYR HE% A 90 LYS HD2 1.0 0.0 3.93 1607 1411 A 37 TYR HE% A 90 LYS HD3 1.0 0.0 3.93 1608 1412 A 37 TYR HE% A 90 LYS HGx 1.0 0.0 3.98 1609 1413 A 37 TYR HE% A 68 ASP HB2 1.0 0.0 3.73 1610 1414 A 90 LYS HA A 37 TYR HE% 1.0 0.0 4.27 1611 1415 A 33 VAL HG2% A 37 TYR HD% 1.0 0.0 3.75 1612 1416 A 33 VAL HG2% A 37 TYR HE% 1.0 0.0 3.09 1613 1417 A 69 VAL HG2% A 37 TYR HE% 1.0 0.0 3.18 1614 1418 A 36 GLU H A 37 TYR HD% 1.0 0.0 3.85 1615 1419 A 88 TYR HB2 A 37 TYR HD% 1.0 0.0 4.11 1616 1420 A 71 VAL HG1% A 30 PHE HD% 1.0 0.0 4.23 1617 1421 A 34 ALA HB% A 30 PHE HD% 1.0 0.0 4.47 1618 1422 A 25 MET HB2 A 30 PHE HD% 1.0 0.0 4.55 1619 1423 A 25 MET HE% A 30 PHE HD% 1.0 0.0 4.66 1620 1424 A 31 ASP HA A 30 PHE HD% 1.0 0.0 4.49 1621 1425 A 31 ASP H A 30 PHE HD% 1.0 0.0 4.18 1622 1426 A 69 VAL HG1% A 30 PHE HE% 1.0 0.0 5.15 1623 1427 A 33 VAL HG2% A 30 PHE HE% 1.0 0.0 5.64 1624 1428 A 37 TYR HB2 A 30 PHE HE% 1.0 0.0 5.11 1625 1429 A 34 ALA HA A 30 PHE HE% 1.0 0.0 4.85 1626 1430 A 37 TYR HB2 A 30 PHE HZ 1.0 0.0 4.32 1627 1431 A 34 ALA HA A 30 PHE HZ 1.0 0.0 4.70 1628 1432 A 37 TYR HB3 A 30 PHE HZ 1.0 0.0 4.90 1629 1433 A 34 ALA HB% A 37 TYR HD% 1.0 0.0 5.70 1630 1434 A 69 VAL HB A 37 TYR HD% 1.0 0.0 4.64 1631 1435 A 90 LYS HB2 A 37 TYR HD% 1.0 0.0 4.62 1632 1436 A 37 TYR HD% A 30 PHE HZ 1.0 0.0 4.39 1633 1437 A 30 PHE HE% A 37 TYR HD% 1.0 0.0 4.03 1634 1438 A 91 LYS H A 37 TYR HD% 1.0 0.0 4.53 1635 1439 A 83 GLY H A 82 HIS HD2 1.0 0.0 4.71 1636 1440 A 38 THR H A 37 TYR HD% 1.0 0.0 4.48 1637 1441 A 90 LYS H A 37 TYR HD% 1.0 0.0 4.34 1638 1442 A 84 THR HG2% A 82 HIS HD2 1.0 0.0 4.27 1639 1443 A 82 HIS H A 82 HIS HD2 1.0 0.0 4.81 1640 1444 A 89 LYS H A 37 TYR HD% 1.0 0.0 4.59 1641 1445 A 90 LYS H A 37 TYR HE% 1.0 0.0 4.12 1642 1446 A 34 ALA HB% A 30 PHE HE% 1.0 0.0 4.34 1643 1447 A 22 ALA HB% A 63 ASP HBx 1.0 0.0 6.58 1644 1447 A 22 ALA HB% A 63 ASP HBy 1.0 0.0 6.58 1645 1448 A 23 GLU HA A 24 ILE HG1x 1.0 0.0 5.63 1646 1448 A 23 GLU HA A 24 ILE HG1y 1.0 0.0 5.63 1647 1449 A 24 ILE H A 23 GLU HBy 1.0 0.0 4.18 1648 1449 A 24 ILE H A 23 GLU HBx 1.0 0.0 4.18 1649 1450 A 69 VAL HA A 23 GLU HBy 1.0 0.0 5.43 1650 1450 A 69 VAL HA A 23 GLU HBx 1.0 0.0 5.43 1651 1451 A 69 VAL HG1% A 23 GLU HBy 1.0 0.0 5.62 1652 1451 A 69 VAL HG1% A 23 GLU HBx 1.0 0.0 5.62 1653 1452 A 69 VAL HG2% A 23 GLU HBy 1.0 0.0 4.83 1654 1452 A 69 VAL HG2% A 23 GLU HBx 1.0 0.0 4.83 1655 1453 A 24 ILE H A 24 ILE HG1x 1.0 0.0 3.96 1656 1453 A 24 ILE H A 24 ILE HG1y 1.0 0.0 3.96 1657 1454 A 24 ILE HG2% A 24 ILE HG1x 1.0 0.0 3.42 1658 1454 A 24 ILE HG2% A 24 ILE HG1y 1.0 0.0 3.42 1659 1455 A 24 ILE HG2% A 55 ARG HDx 1.0 0.0 4.82 1660 1455 A 24 ILE HG2% A 55 ARG HDy 1.0 0.0 4.82 1661 1456 A 25 MET H A 24 ILE HG1x 1.0 0.0 5.48 1662 1456 A 25 MET H A 24 ILE HG1y 1.0 0.0 5.48 1663 1457 A 59 ILE H A 24 ILE HG1x 1.0 0.0 6.35 1664 1457 A 59 ILE H A 24 ILE HG1y 1.0 0.0 6.35 1665 1458 A 59 ILE HD1% A 24 ILE HG1x 1.0 0.0 4.32 1666 1458 A 59 ILE HD1% A 24 ILE HG1y 1.0 0.0 4.32 1667 1459 A 70 VAL H A 24 ILE HG1x 1.0 0.0 6.58 1668 1459 A 70 VAL H A 24 ILE HG1y 1.0 0.0 6.58 1669 1460 A 26 LYS H A 26 LYS HGy 1.0 0.0 3.87 1670 1460 A 26 LYS H A 26 LYS HGx 1.0 0.0 3.87 1671 1461 A 27 LYS H A 26 LYS HGy 1.0 0.0 5.23 1672 1461 A 27 LYS H A 26 LYS HGx 1.0 0.0 5.23 1673 1462 A 28 THR H A 26 LYS HGy 1.0 0.0 6.05 1674 1462 A 28 THR H A 26 LYS HGx 1.0 0.0 6.05 1675 1463 A 29 ASP H A 26 LYS HGy 1.0 0.0 5.65 1676 1463 A 29 ASP H A 26 LYS HGx 1.0 0.0 5.65 1677 1464 A 27 LYS H A 27 LYS HGx 1.0 0.0 5.64 1678 1464 A 27 LYS H A 27 LYS HGy 1.0 0.0 5.64 1679 1465 A 27 LYS HA A 27 LYS HDy 1.0 0.0 4.69 1680 1465 A 27 LYS HA A 27 LYS HDx 1.0 0.0 4.69 1681 1466 A 28 THR H A 27 LYS HGx 1.0 0.0 5.07 1682 1466 A 28 THR H A 27 LYS HGy 1.0 0.0 5.07 1683 1467 A 28 THR HA A 27 LYS HGx 1.0 0.0 6.58 1684 1467 A 28 THR HA A 27 LYS HGy 1.0 0.0 6.58 1685 1468 A 30 PHE HD% A 27 LYS HGx 1.0 0.0 4.90 1686 1468 A 30 PHE HD% A 27 LYS HGy 1.0 0.0 4.90 1687 1469 A 31 ASP H A 27 LYS HGx 1.0 0.0 6.37 1688 1469 A 31 ASP H A 27 LYS HGy 1.0 0.0 6.37 1689 1470 A 27 LYS HGy A 31 ASP HB2 1.0 0.0 6.34 1690 1470 A 27 LYS HGx A 31 ASP HB2 1.0 0.0 6.34 1691 1470 A 31 ASP HB3 A 27 LYS HGx 1.0 0.0 6.34 1692 1470 A 31 ASP HB3 A 27 LYS HGy 1.0 0.0 6.34 1693 1471 A 71 VAL HG1% A 27 LYS HGx 1.0 0.0 5.47 1694 1471 A 71 VAL HG1% A 27 LYS HGy 1.0 0.0 5.47 1695 1472 A 71 VAL HG2% A 27 LYS HGx 1.0 0.0 6.38 1696 1472 A 71 VAL HG2% A 27 LYS HGy 1.0 0.0 6.38 1697 1473 A 28 THR H A 27 LYS HDy 1.0 0.0 6.28 1698 1473 A 28 THR H A 27 LYS HDx 1.0 0.0 6.28 1699 1474 A 28 THR HA A 27 LYS HDy 1.0 0.0 6.04 1700 1474 A 28 THR HA A 27 LYS HDx 1.0 0.0 6.04 1701 1475 A 30 PHE HD% A 27 LYS HDy 1.0 0.0 4.81 1702 1475 A 30 PHE HD% A 27 LYS HDx 1.0 0.0 4.81 1703 1476 A 33 VAL HA A 36 GLU HGx 1.0 0.0 5.35 1704 1476 A 33 VAL HA A 36 GLU HGy 1.0 0.0 5.35 1705 1477 A 33 VAL HB A 36 GLU HBy 1.0 0.0 5.03 1706 1477 A 33 VAL HB A 36 GLU HBx 1.0 0.0 5.03 1707 1478 A 33 VAL HG1% A 36 GLU HGx 1.0 0.0 6.27 1708 1478 A 33 VAL HG1% A 36 GLU HGy 1.0 0.0 6.27 1709 1479 A 34 ALA HB% A 35 SER HBx 1.0 0.0 5.67 1710 1479 A 34 ALA HB% A 35 SER HBy 1.0 0.0 5.67 1711 1480 A 35 SER H A 35 SER HBx 1.0 0.0 3.70 1712 1480 A 35 SER H A 35 SER HBy 1.0 0.0 3.70 1713 1481 A 36 GLU H A 36 GLU HBy 1.0 0.0 3.79 1714 1481 A 36 GLU H A 36 GLU HBx 1.0 0.0 3.79 1715 1482 A 36 GLU H A 36 GLU HGx 1.0 0.0 3.83 1716 1482 A 36 GLU H A 36 GLU HGy 1.0 0.0 3.83 1717 1483 A 36 GLU HA A 91 LYS HBx 1.0 0.0 5.26 1718 1483 A 36 GLU HA A 91 LYS HBy 1.0 0.0 5.26 1719 1484 A 36 GLU HA A 91 LYS HDx 1.0 0.0 4.49 1720 1484 A 36 GLU HA A 91 LYS HDy 1.0 0.0 4.49 1721 1485 A 37 TYR HB2 A 36 GLU HBy 1.0 0.0 6.11 1722 1485 A 37 TYR HB2 A 36 GLU HBx 1.0 0.0 6.11 1723 1486 A 37 TYR HD% A 36 GLU HBy 1.0 0.0 3.57 1724 1486 A 37 TYR HD% A 36 GLU HBx 1.0 0.0 3.57 1725 1487 A 37 TYR HE% A 36 GLU HBy 1.0 0.0 3.58 1726 1487 A 37 TYR HE% A 36 GLU HBx 1.0 0.0 3.58 1727 1488 A 36 GLU HBx A 90 LYS HE2 1.0 0.0 5.83 1728 1488 A 36 GLU HBy A 90 LYS HE2 1.0 0.0 5.83 1729 1488 A 90 LYS HE3 A 36 GLU HBy 1.0 0.0 5.83 1730 1488 A 90 LYS HE3 A 36 GLU HBx 1.0 0.0 5.83 1731 1489 A 37 TYR HD% A 36 GLU HGx 1.0 0.0 4.85 1732 1489 A 37 TYR HD% A 36 GLU HGy 1.0 0.0 4.85 1733 1490 A 37 TYR HE% A 36 GLU HGx 1.0 0.0 6.33 1734 1490 A 37 TYR HE% A 36 GLU HGy 1.0 0.0 6.33 1735 1491 A 37 TYR H A 91 LYS HBx 1.0 0.0 6.27 1736 1491 A 37 TYR H A 91 LYS HBy 1.0 0.0 6.27 1737 1492 A 37 TYR H A 91 LYS HDx 1.0 0.0 5.67 1738 1492 A 37 TYR H A 91 LYS HDy 1.0 0.0 5.67 1739 1493 A 37 TYR HA A 90 LYS HGy 1.0 0.0 6.28 1740 1493 A 37 TYR HA A 90 LYS HGx 1.0 0.0 6.28 1741 1494 A 37 TYR HA A 91 LYS HBx 1.0 0.0 6.08 1742 1494 A 37 TYR HA A 91 LYS HBy 1.0 0.0 6.08 1743 1495 A 37 TYR HD% A 90 LYS HGy 1.0 0.0 5.75 1744 1495 A 37 TYR HD% A 90 LYS HGx 1.0 0.0 5.75 1745 1496 A 38 THR H A 89 LYS HBx 1.0 0.0 5.64 1746 1496 A 38 THR H A 89 LYS HBy 1.0 0.0 5.64 1747 1497 A 38 THR H A 91 LYS HDx 1.0 0.0 6.58 1748 1497 A 38 THR H A 91 LYS HDy 1.0 0.0 6.58 1749 1498 A 38 THR HA A 39 LYS HBy 1.0 0.0 5.71 1750 1498 A 38 THR HA A 39 LYS HBx 1.0 0.0 5.71 1751 1499 A 38 THR HB A 89 LYS HBx 1.0 0.0 5.09 1752 1499 A 38 THR HB A 89 LYS HBy 1.0 0.0 5.09 1753 1500 A 38 THR HB A 91 LYS HDx 1.0 0.0 5.00 1754 1500 A 38 THR HB A 91 LYS HDy 1.0 0.0 5.00 1755 1501 A 38 THR HG2% A 89 LYS HBx 1.0 0.0 5.12 1756 1501 A 38 THR HG2% A 89 LYS HBy 1.0 0.0 5.12 1757 1502 A 39 LYS HA A 40 ILE HG1y 1.0 0.0 6.30 1758 1502 A 39 LYS HA A 40 ILE HG1x 1.0 0.0 6.30 1759 1503 A 41 GLY H A 39 LYS HBy 1.0 0.0 5.88 1760 1503 A 41 GLY H A 39 LYS HBx 1.0 0.0 5.88 1761 1504 A 88 TYR HD% A 39 LYS HBy 1.0 0.0 6.09 1762 1504 A 88 TYR HD% A 39 LYS HBx 1.0 0.0 6.09 1763 1505 A 40 ILE H A 40 ILE HG1y 1.0 0.0 3.97 1764 1505 A 40 ILE H A 40 ILE HG1x 1.0 0.0 3.97 1765 1506 A 40 ILE H A 89 LYS HBx 1.0 0.0 6.26 1766 1506 A 40 ILE H A 89 LYS HBy 1.0 0.0 6.26 1767 1507 A 41 GLY H A 40 ILE HG1y 1.0 0.0 4.07 1768 1507 A 41 GLY H A 40 ILE HG1x 1.0 0.0 4.07 1769 1508 A 41 GLY HA2 A 40 ILE HG1y 1.0 0.0 6.58 1770 1508 A 41 GLY HA2 A 40 ILE HG1x 1.0 0.0 6.58 1771 1509 A 41 GLY HA3 A 40 ILE HG1y 1.0 0.0 6.58 1772 1509 A 41 GLY HA3 A 40 ILE HG1x 1.0 0.0 6.58 1773 1510 A 67 ALA HA A 40 ILE HG1y 1.0 0.0 6.49 1774 1510 A 67 ALA HA A 40 ILE HG1x 1.0 0.0 6.49 1775 1511 A 87 ILE H A 40 ILE HG1y 1.0 0.0 6.15 1776 1511 A 87 ILE H A 40 ILE HG1x 1.0 0.0 6.15 1777 1512 A 87 ILE HG12 A 40 ILE HG1y 1.0 0.0 5.13 1778 1512 A 87 ILE HG12 A 40 ILE HG1x 1.0 0.0 5.13 1779 1513 A 87 ILE HG13 A 40 ILE HG1y 1.0 0.0 4.30 1780 1513 A 87 ILE HG13 A 40 ILE HG1x 1.0 0.0 4.30 1781 1514 A 87 ILE HD1% A 40 ILE HG1y 1.0 0.0 4.19 1782 1514 A 87 ILE HD1% A 40 ILE HG1x 1.0 0.0 4.19 1783 1515 A 88 TYR HA A 40 ILE HG1y 1.0 0.0 4.87 1784 1515 A 88 TYR HA A 40 ILE HG1x 1.0 0.0 4.87 1785 1516 A 89 LYS H A 40 ILE HG1y 1.0 0.0 5.39 1786 1516 A 89 LYS H A 40 ILE HG1x 1.0 0.0 5.39 1787 1517 A 40 ILE HG1y A 89 LYS HBx 1.0 0.0 5.59 1788 1517 A 40 ILE HG1x A 89 LYS HBx 1.0 0.0 5.59 1789 1517 A 89 LYS HBy A 40 ILE HG1y 1.0 0.0 5.59 1790 1517 A 89 LYS HBy A 40 ILE HG1x 1.0 0.0 5.59 1791 1518 A 40 ILE HG1x A 89 LYS HDx 1.0 0.0 6.34 1792 1518 A 40 ILE HG1y A 89 LYS HDx 1.0 0.0 6.34 1793 1518 A 89 LYS HDy A 40 ILE HG1y 1.0 0.0 6.34 1794 1518 A 40 ILE HG1x A 89 LYS HDy 1.0 0.0 6.34 1795 1519 A 40 ILE HD1% A 66 GLY HAx 1.0 0.0 6.34 1796 1519 A 40 ILE HD1% A 66 GLY HAy 1.0 0.0 6.34 1797 1520 A 40 ILE HD1% A 89 LYS HBx 1.0 0.0 4.16 1798 1520 A 40 ILE HD1% A 89 LYS HBy 1.0 0.0 4.16 1799 1521 A 40 ILE HD1% A 89 LYS HDx 1.0 0.0 3.76 1800 1521 A 40 ILE HD1% A 89 LYS HDy 1.0 0.0 3.76 1801 1522 A 42 THR HA A 43 ILE HG1x 1.0 0.0 5.85 1802 1522 A 42 THR HA A 43 ILE HG1y 1.0 0.0 5.85 1803 1523 A 43 ILE H A 43 ILE HG1x 1.0 0.0 3.93 1804 1523 A 43 ILE H A 43 ILE HG1y 1.0 0.0 3.93 1805 1524 A 43 ILE HG2% A 65 LYS HGy 1.0 0.0 5.29 1806 1524 A 43 ILE HG2% A 65 LYS HGx 1.0 0.0 5.29 1807 1525 A 43 ILE HG2% A 65 LYS HDy 1.0 0.0 4.96 1808 1525 A 43 ILE HG2% A 65 LYS HDx 1.0 0.0 4.96 1809 1526 A 44 SER H A 43 ILE HG1x 1.0 0.0 4.94 1810 1526 A 44 SER H A 43 ILE HG1y 1.0 0.0 4.94 1811 1527 A 44 SER HA A 43 ILE HG1x 1.0 0.0 6.06 1812 1527 A 44 SER HA A 43 ILE HG1y 1.0 0.0 6.06 1813 1528 A 58 LEU HA A 43 ILE HG1x 1.0 0.0 5.45 1814 1528 A 58 LEU HA A 43 ILE HG1y 1.0 0.0 5.45 1815 1529 A 58 LEU HD2% A 43 ILE HG1x 1.0 0.0 4.44 1816 1529 A 58 LEU HD2% A 43 ILE HG1y 1.0 0.0 4.44 1817 1530 A 70 VAL HG1% A 43 ILE HG1x 1.0 0.0 5.21 1818 1530 A 70 VAL HG1% A 43 ILE HG1y 1.0 0.0 5.21 1819 1531 A 85 ALA H A 43 ILE HG1x 1.0 0.0 5.13 1820 1531 A 85 ALA H A 43 ILE HG1y 1.0 0.0 5.13 1821 1532 A 87 ILE H A 43 ILE HG1x 1.0 0.0 5.44 1822 1532 A 87 ILE H A 43 ILE HG1y 1.0 0.0 5.44 1823 1533 A 87 ILE HG2% A 43 ILE HG1x 1.0 0.0 4.01 1824 1533 A 87 ILE HG2% A 43 ILE HG1y 1.0 0.0 4.01 1825 1534 A 87 ILE HD1% A 43 ILE HG1x 1.0 0.0 5.73 1826 1534 A 87 ILE HD1% A 43 ILE HG1y 1.0 0.0 5.73 1827 1535 A 44 SER H A 61 LYS HDx 1.0 0.0 6.58 1828 1535 A 44 SER H A 61 LYS HDy 1.0 0.0 6.58 1829 1536 A 45 THR H A 44 SER HBx 1.0 0.0 4.16 1830 1536 A 45 THR H A 44 SER HBy 1.0 0.0 4.16 1831 1537 A 58 LEU HD2% A 44 SER HBx 1.0 0.0 6.23 1832 1537 A 58 LEU HD2% A 44 SER HBy 1.0 0.0 6.23 1833 1538 A 84 THR HA A 44 SER HBx 1.0 0.0 4.74 1834 1538 A 84 THR HA A 44 SER HBy 1.0 0.0 4.74 1835 1539 A 84 THR HG2% A 44 SER HBx 1.0 0.0 4.11 1836 1539 A 84 THR HG2% A 44 SER HBy 1.0 0.0 4.11 1837 1540 A 85 ALA H A 44 SER HBx 1.0 0.0 5.73 1838 1540 A 85 ALA H A 44 SER HBy 1.0 0.0 5.73 1839 1541 A 45 THR HG2% A 49 MET HBx 1.0 0.0 5.93 1840 1541 A 45 THR HG2% A 49 MET HBy 1.0 0.0 5.93 1841 1542 A 45 THR HG2% A 57 ASP HBx 1.0 0.0 3.97 1842 1542 A 45 THR HG2% A 57 ASP HBy 1.0 0.0 3.97 1843 1543 A 46 THR H A 47 GLY HAy 1.0 0.0 6.58 1844 1543 A 46 THR H A 47 GLY HAx 1.0 0.0 6.58 1845 1544 A 49 MET HE% A 47 GLY HAy 1.0 0.0 5.68 1846 1544 A 49 MET HE% A 47 GLY HAx 1.0 0.0 5.68 1847 1545 A 48 GLU H A 48 GLU HGy 1.0 0.0 4.26 1848 1545 A 48 GLU H A 48 GLU HGx 1.0 0.0 4.26 1849 1546 A 48 GLU HA A 49 MET HBx 1.0 0.0 6.24 1850 1546 A 48 GLU HA A 49 MET HBy 1.0 0.0 6.24 1851 1547 A 50 SER H A 49 MET HBx 1.0 0.0 4.30 1852 1547 A 50 SER H A 49 MET HBy 1.0 0.0 4.30 1853 1548 A 49 MET HBy A 53 ASP HB2 1.0 0.0 4.43 1854 1548 A 49 MET HBx A 53 ASP HB2 1.0 0.0 4.43 1855 1548 A 53 ASP HB3 A 49 MET HBx 1.0 0.0 4.43 1856 1548 A 53 ASP HB3 A 49 MET HBy 1.0 0.0 4.43 1857 1549 A 54 ALA H A 49 MET HBx 1.0 0.0 5.15 1858 1549 A 54 ALA H A 49 MET HBy 1.0 0.0 5.15 1859 1550 A 54 ALA HA A 49 MET HBx 1.0 0.0 4.91 1860 1550 A 54 ALA HA A 49 MET HBy 1.0 0.0 4.91 1861 1551 A 54 ALA HB% A 49 MET HBx 1.0 0.0 3.98 1862 1551 A 54 ALA HB% A 49 MET HBy 1.0 0.0 3.98 1863 1552 A 49 MET HE% A 57 ASP HBx 1.0 0.0 5.11 1864 1552 A 49 MET HE% A 57 ASP HBy 1.0 0.0 5.11 1865 1553 A 50 SER HA A 51 PRO HGy 1.0 0.0 5.61 1866 1553 A 50 SER HA A 51 PRO HGx 1.0 0.0 5.61 1867 1554 A 50 SER HBx A 51 PRO HGy 1.0 0.0 5.38 1868 1554 A 50 SER HBy A 51 PRO HGy 1.0 0.0 5.38 1869 1554 A 51 PRO HGx A 50 SER HBx 1.0 0.0 5.38 1870 1554 A 51 PRO HGx A 50 SER HBy 1.0 0.0 5.38 1871 1555 A 50 SER HBx A 51 PRO HD2 1.0 0.0 3.75 1872 1555 A 50 SER HBy A 51 PRO HD2 1.0 0.0 3.75 1873 1555 A 51 PRO HD3 A 50 SER HBx 1.0 0.0 3.75 1874 1555 A 51 PRO HD3 A 50 SER HBy 1.0 0.0 3.75 1875 1556 A 52 LEU H A 50 SER HBx 1.0 0.0 4.60 1876 1556 A 52 LEU H A 50 SER HBy 1.0 0.0 4.60 1877 1557 A 53 ASP H A 50 SER HBx 1.0 0.0 4.90 1878 1557 A 53 ASP H A 50 SER HBy 1.0 0.0 4.90 1879 1558 A 50 SER HBx A 53 ASP HB2 1.0 0.0 5.67 1880 1558 A 50 SER HBy A 53 ASP HB2 1.0 0.0 5.67 1881 1558 A 53 ASP HB3 A 50 SER HBx 1.0 0.0 5.67 1882 1558 A 53 ASP HB3 A 50 SER HBy 1.0 0.0 5.67 1883 1559 A 51 PRO HA A 81 ILE HG1x 1.0 0.0 5.92 1884 1559 A 51 PRO HA A 81 ILE HG1y 1.0 0.0 5.92 1885 1560 A 52 LEU H A 51 PRO HBx 1.0 0.0 4.13 1886 1560 A 52 LEU H A 51 PRO HBy 1.0 0.0 4.13 1887 1561 A 51 PRO HBx A 52 LEU HBx 1.0 0.0 5.92 1888 1561 A 51 PRO HBy A 52 LEU HBx 1.0 0.0 5.92 1889 1561 A 52 LEU HBy A 51 PRO HBx 1.0 0.0 5.92 1890 1561 A 51 PRO HBy A 52 LEU HBy 1.0 0.0 5.92 1891 1562 A 53 ASP H A 51 PRO HBx 1.0 0.0 6.10 1892 1562 A 53 ASP H A 51 PRO HBy 1.0 0.0 6.10 1893 1563 A 54 ALA HB% A 51 PRO HBx 1.0 0.0 5.74 1894 1563 A 54 ALA HB% A 51 PRO HBy 1.0 0.0 5.74 1895 1564 A 81 ILE HD1% A 51 PRO HBx 1.0 0.0 5.73 1896 1564 A 81 ILE HD1% A 51 PRO HBy 1.0 0.0 5.73 1897 1565 A 52 LEU H A 51 PRO HGy 1.0 0.0 4.78 1898 1565 A 52 LEU H A 51 PRO HGx 1.0 0.0 4.78 1899 1566 A 81 ILE HD1% A 51 PRO HGy 1.0 0.0 6.12 1900 1566 A 81 ILE HD1% A 51 PRO HGx 1.0 0.0 6.12 1901 1567 A 52 LEU H A 52 LEU HBx 1.0 0.0 3.45 1902 1567 A 52 LEU H A 52 LEU HBy 1.0 0.0 3.45 1903 1568 A 52 LEU HA A 55 ARG HDx 1.0 0.0 4.99 1904 1568 A 52 LEU HA A 55 ARG HDy 1.0 0.0 4.99 1905 1569 A 52 LEU HD1% A 55 ARG HDx 1.0 0.0 5.35 1906 1569 A 52 LEU HD1% A 55 ARG HDy 1.0 0.0 5.35 1907 1570 A 52 LEU HD1% A 56 GLU HGx 1.0 0.0 5.10 1908 1570 A 52 LEU HD1% A 56 GLU HGy 1.0 0.0 5.10 1909 1571 A 52 LEU HD2% A 55 ARG HDx 1.0 0.0 5.18 1910 1571 A 52 LEU HD2% A 55 ARG HDy 1.0 0.0 5.18 1911 1572 A 54 ALA HA A 57 ASP HBx 1.0 0.0 4.11 1912 1572 A 54 ALA HA A 57 ASP HBy 1.0 0.0 4.11 1913 1573 A 54 ALA HB% A 57 ASP HBx 1.0 0.0 5.95 1914 1573 A 54 ALA HB% A 57 ASP HBy 1.0 0.0 5.95 1915 1574 A 55 ARG HA A 55 ARG HDx 1.0 0.0 5.93 1916 1574 A 55 ARG HA A 55 ARG HDy 1.0 0.0 5.93 1917 1575 A 59 ILE HD1% A 55 ARG HDx 1.0 0.0 5.93 1918 1575 A 59 ILE HD1% A 55 ARG HDy 1.0 0.0 5.93 1919 1576 A 56 GLU H A 56 GLU HGx 1.0 0.0 4.15 1920 1576 A 56 GLU H A 56 GLU HGy 1.0 0.0 4.15 1921 1577 A 56 GLU H A 57 ASP HBx 1.0 0.0 6.56 1922 1577 A 56 GLU H A 57 ASP HBy 1.0 0.0 6.56 1923 1578 A 56 GLU HB2 A 57 ASP HBx 1.0 0.0 6.34 1924 1578 A 56 GLU HB3 A 57 ASP HBx 1.0 0.0 6.34 1925 1578 A 57 ASP HBy A 56 GLU HB2 1.0 0.0 6.34 1926 1578 A 56 GLU HB3 A 57 ASP HBy 1.0 0.0 6.34 1927 1579 A 57 ASP H A 56 GLU HGx 1.0 0.0 5.82 1928 1579 A 57 ASP H A 56 GLU HGy 1.0 0.0 5.82 1929 1580 A 59 ILE HD1% A 56 GLU HGx 1.0 0.0 6.03 1930 1580 A 59 ILE HD1% A 56 GLU HGy 1.0 0.0 6.03 1931 1581 A 57 ASP HA A 60 LYS HGy 1.0 0.0 6.58 1932 1581 A 57 ASP HA A 60 LYS HGx 1.0 0.0 6.58 1933 1582 A 57 ASP HA A 61 LYS HDx 1.0 0.0 6.58 1934 1582 A 57 ASP HA A 61 LYS HDy 1.0 0.0 6.58 1935 1583 A 58 LEU H A 57 ASP HBx 1.0 0.0 4.01 1936 1583 A 58 LEU H A 57 ASP HBy 1.0 0.0 4.01 1937 1584 A 58 LEU HA A 57 ASP HBx 1.0 0.0 6.13 1938 1584 A 58 LEU HA A 57 ASP HBy 1.0 0.0 6.13 1939 1585 A 58 LEU HG A 57 ASP HBx 1.0 0.0 6.44 1940 1585 A 58 LEU HG A 57 ASP HBy 1.0 0.0 6.44 1941 1586 A 58 LEU HA A 61 LYS HDx 1.0 0.0 5.07 1942 1586 A 58 LEU HA A 61 LYS HDy 1.0 0.0 5.07 1943 1587 A 58 LEU HD2% A 61 LYS HDx 1.0 0.0 5.11 1944 1587 A 58 LEU HD2% A 61 LYS HDy 1.0 0.0 5.11 1945 1588 A 59 ILE H A 61 LYS HDx 1.0 0.0 6.58 1946 1588 A 59 ILE H A 61 LYS HDy 1.0 0.0 6.58 1947 1589 A 59 ILE HG2% A 63 ASP HBx 1.0 0.0 6.08 1948 1589 A 59 ILE HG2% A 63 ASP HBy 1.0 0.0 6.08 1949 1590 A 60 LYS H A 60 LYS HGy 1.0 0.0 4.59 1950 1590 A 60 LYS H A 60 LYS HGx 1.0 0.0 4.59 1951 1591 A 60 LYS HA A 63 ASP HBx 1.0 0.0 4.11 1952 1591 A 60 LYS HA A 63 ASP HBy 1.0 0.0 4.11 1953 1592 A 60 LYS HE3 A 60 LYS HGy 1.0 0.0 3.81 1954 1592 A 60 LYS HE2 A 60 LYS HGy 1.0 0.0 3.81 1955 1592 A 60 LYS HGx A 60 LYS HE2 1.0 0.0 3.81 1956 1592 A 60 LYS HE3 A 60 LYS HGx 1.0 0.0 3.81 1957 1593 A 61 LYS H A 60 LYS HGy 1.0 0.0 5.35 1958 1593 A 61 LYS H A 60 LYS HGx 1.0 0.0 5.35 1959 1594 A 61 LYS HA A 60 LYS HGy 1.0 0.0 5.74 1960 1594 A 61 LYS HA A 60 LYS HGx 1.0 0.0 5.74 1961 1595 A 62 ALA H A 60 LYS HGy 1.0 0.0 6.37 1962 1595 A 62 ALA H A 60 LYS HGx 1.0 0.0 6.37 1963 1596 A 64 GLU H A 60 LYS HGy 1.0 0.0 5.70 1964 1596 A 64 GLU H A 60 LYS HGx 1.0 0.0 5.70 1965 1597 A 60 LYS HGx A 64 GLU HGy 1.0 0.0 6.05 1966 1597 A 60 LYS HGy A 64 GLU HGy 1.0 0.0 6.05 1967 1597 A 64 GLU HGx A 60 LYS HGy 1.0 0.0 6.05 1968 1597 A 60 LYS HGx A 64 GLU HGx 1.0 0.0 6.05 1969 1598 A 61 LYS H A 61 LYS HDx 1.0 0.0 4.25 1970 1598 A 61 LYS H A 61 LYS HDy 1.0 0.0 4.25 1971 1599 A 61 LYS HA A 61 LYS HDx 1.0 0.0 4.77 1972 1599 A 61 LYS HA A 61 LYS HDy 1.0 0.0 4.77 1973 1600 A 61 LYS HA A 61 LYS HEy 1.0 0.0 6.00 1974 1600 A 61 LYS HA A 61 LYS HEx 1.0 0.0 6.00 1975 1601 A 61 LYS HA A 64 GLU HGy 1.0 0.0 4.99 1976 1601 A 61 LYS HA A 64 GLU HGx 1.0 0.0 4.99 1977 1602 A 61 LYS HB3 A 61 LYS HEy 1.0 0.0 6.44 1978 1602 A 61 LYS HB3 A 61 LYS HEx 1.0 0.0 6.44 1979 1603 A 62 ALA H A 61 LYS HDx 1.0 0.0 6.58 1980 1603 A 62 ALA H A 61 LYS HDy 1.0 0.0 6.58 1981 1604 A 62 ALA HA A 65 LYS HGy 1.0 0.0 5.11 1982 1604 A 62 ALA HA A 65 LYS HGx 1.0 0.0 5.11 1983 1605 A 62 ALA HB% A 63 ASP HBx 1.0 0.0 6.58 1984 1605 A 62 ALA HB% A 63 ASP HBy 1.0 0.0 6.58 1985 1606 A 63 ASP H A 63 ASP HBx 1.0 0.0 3.65 1986 1606 A 63 ASP H A 63 ASP HBy 1.0 0.0 3.65 1987 1607 A 63 ASP HA A 66 GLY HAx 1.0 0.0 6.06 1988 1607 A 63 ASP HA A 66 GLY HAy 1.0 0.0 6.06 1989 1608 A 64 GLU H A 63 ASP HBx 1.0 0.0 4.22 1990 1608 A 64 GLU H A 63 ASP HBy 1.0 0.0 4.22 1991 1609 A 64 GLU HA A 63 ASP HBx 1.0 0.0 5.44 1992 1609 A 64 GLU HA A 63 ASP HBy 1.0 0.0 5.44 1993 1610 A 64 GLU H A 64 GLU HGy 1.0 0.0 4.18 1994 1610 A 64 GLU H A 64 GLU HGx 1.0 0.0 4.18 1995 1611 A 64 GLU H A 65 LYS HDy 1.0 0.0 6.58 1996 1611 A 64 GLU H A 65 LYS HDx 1.0 0.0 6.58 1997 1612 A 64 GLU HA A 64 GLU HGy 1.0 0.0 3.87 1998 1612 A 64 GLU HA A 64 GLU HGx 1.0 0.0 3.87 1999 1613 A 65 LYS H A 64 GLU HGy 1.0 0.0 5.52 2000 1613 A 65 LYS H A 64 GLU HGx 1.0 0.0 5.52 2001 1614 A 65 LYS H A 65 LYS HGy 1.0 0.0 4.07 2002 1614 A 65 LYS H A 65 LYS HGx 1.0 0.0 4.07 2003 1615 A 65 LYS H A 65 LYS HDy 1.0 0.0 5.52 2004 1615 A 65 LYS H A 65 LYS HDx 1.0 0.0 5.52 2005 1616 A 65 LYS H A 66 GLY HAx 1.0 0.0 5.44 2006 1616 A 65 LYS H A 66 GLY HAy 1.0 0.0 5.44 2007 1617 A 65 LYS HA A 65 LYS HDy 1.0 0.0 4.06 2008 1617 A 65 LYS HA A 65 LYS HDx 1.0 0.0 4.06 2009 1618 A 87 ILE HD1% A 65 LYS HGy 1.0 0.0 4.07 2010 1618 A 87 ILE HD1% A 65 LYS HGx 1.0 0.0 4.07 2011 1619 A 87 ILE HD1% A 65 LYS HDy 1.0 0.0 5.12 2012 1619 A 87 ILE HD1% A 65 LYS HDx 1.0 0.0 5.12 2013 1620 A 87 ILE HD1% A 65 LYS HEx 1.0 0.0 5.38 2014 1620 A 87 ILE HD1% A 65 LYS HEy 1.0 0.0 5.38 2015 1621 A 67 ALA HA A 89 LYS HDx 1.0 0.0 4.92 2016 1621 A 67 ALA HA A 89 LYS HDy 1.0 0.0 4.92 2017 1622 A 68 ASP H A 89 LYS HBx 1.0 0.0 5.74 2018 1622 A 68 ASP H A 89 LYS HBy 1.0 0.0 5.74 2019 1623 A 68 ASP H A 89 LYS HDx 1.0 0.0 5.30 2020 1623 A 68 ASP H A 89 LYS HDy 1.0 0.0 5.30 2021 1624 A 72 LEU HD1% A 76 GLN HBx 1.0 0.0 5.40 2022 1624 A 72 LEU HD1% A 76 GLN HBy 1.0 0.0 5.40 2023 1625 A 76 GLN H A 76 GLN HBx 1.0 0.0 3.82 2024 1625 A 76 GLN H A 76 GLN HBy 1.0 0.0 3.82 2025 1626 A 76 GLN HE21 A 76 GLN HBx 1.0 0.0 6.47 2026 1626 A 76 GLN HE21 A 76 GLN HBy 1.0 0.0 6.47 2027 1627 A 77 THR H A 76 GLN HBx 1.0 0.0 4.49 2028 1627 A 77 THR H A 76 GLN HBy 1.0 0.0 4.49 2029 1628 A 77 THR HB A 76 GLN HBx 1.0 0.0 6.25 2030 1628 A 77 THR HB A 76 GLN HBy 1.0 0.0 6.25 2031 1629 A 77 THR HG2% A 76 GLN HBx 1.0 0.0 5.79 2032 1629 A 77 THR HG2% A 76 GLN HBy 1.0 0.0 5.79 2033 1630 A 76 GLN HG2 A 81 ILE HG1x 1.0 0.0 6.16 2034 1630 A 76 GLN HG3 A 81 ILE HG1x 1.0 0.0 6.16 2035 1630 A 81 ILE HG1y A 76 GLN HG2 1.0 0.0 6.16 2036 1630 A 76 GLN HG3 A 81 ILE HG1y 1.0 0.0 6.16 2037 1631 A 77 THR HA A 78 GLU HBx 1.0 0.0 5.55 2038 1631 A 77 THR HA A 78 GLU HBy 1.0 0.0 5.55 2039 1632 A 77 THR HG2% A 79 ASN HBx 1.0 0.0 6.24 2040 1632 A 77 THR HG2% A 79 ASN HBy 1.0 0.0 6.24 2041 1633 A 78 GLU H A 78 GLU HBx 1.0 0.0 3.84 2042 1633 A 78 GLU H A 78 GLU HBy 1.0 0.0 3.84 2043 1634 A 78 GLU H A 81 ILE HG1x 1.0 0.0 5.49 2044 1634 A 78 GLU H A 81 ILE HG1y 1.0 0.0 5.49 2045 1635 A 79 ASN H A 78 GLU HBx 1.0 0.0 4.29 2046 1635 A 79 ASN H A 78 GLU HBy 1.0 0.0 4.29 2047 1636 A 80 LYS H A 78 GLU HBx 1.0 0.0 5.62 2048 1636 A 80 LYS H A 78 GLU HBy 1.0 0.0 5.62 2049 1637 A 81 ILE HG2% A 78 GLU HBx 1.0 0.0 5.33 2050 1637 A 81 ILE HG2% A 78 GLU HBy 1.0 0.0 5.33 2051 1638 A 81 ILE HD1% A 78 GLU HBx 1.0 0.0 5.89 2052 1638 A 81 ILE HD1% A 78 GLU HBy 1.0 0.0 5.89 2053 1639 A 79 ASN H A 79 ASN HBx 1.0 0.0 3.81 2054 1639 A 79 ASN H A 79 ASN HBy 1.0 0.0 3.81 2055 1640 A 79 ASN H A 80 LYS HGx 1.0 0.0 6.58 2056 1640 A 79 ASN H A 80 LYS HGy 1.0 0.0 6.58 2057 1641 A 80 LYS H A 79 ASN HBx 1.0 0.0 4.39 2058 1641 A 80 LYS H A 79 ASN HBy 1.0 0.0 4.39 2059 1642 A 80 LYS H A 80 LYS HGx 1.0 0.0 4.70 2060 1642 A 80 LYS H A 80 LYS HGy 1.0 0.0 4.70 2061 1643 A 80 LYS H A 81 ILE HG1x 1.0 0.0 5.85 2062 1643 A 80 LYS H A 81 ILE HG1y 1.0 0.0 5.85 2063 1644 A 81 ILE H A 80 LYS HGx 1.0 0.0 5.31 2064 1644 A 81 ILE H A 80 LYS HGy 1.0 0.0 5.31 2065 1645 A 81 ILE H A 81 ILE HG1x 1.0 0.0 4.04 2066 1645 A 81 ILE H A 81 ILE HG1y 1.0 0.0 4.04 2067 1646 A 82 HIS H A 81 ILE HG1x 1.0 0.0 5.50 2068 1646 A 82 HIS H A 81 ILE HG1y 1.0 0.0 5.50 2069 1647 A 83 GLY HA2 A 81 ILE HG1x 1.0 0.0 6.58 2070 1647 A 83 GLY HA2 A 81 ILE HG1y 1.0 0.0 6.58 2071 1648 A 89 LYS HA A 89 LYS HDx 1.0 0.0 4.95 2072 1648 A 89 LYS HA A 89 LYS HDy 1.0 0.0 4.95 2073 1649 A 89 LYS HBx A 89 LYS HE2 1.0 0.0 4.01 2074 1649 A 89 LYS HBy A 89 LYS HE2 1.0 0.0 4.01 2075 1649 A 89 LYS HE3 A 89 LYS HBx 1.0 0.0 4.01 2076 1649 A 89 LYS HE3 A 89 LYS HBy 1.0 0.0 4.01 2077 1650 A 91 LYS HG3 A 89 LYS HBx 1.0 0.0 6.26 2078 1650 A 91 LYS HG3 A 89 LYS HBy 1.0 0.0 6.26 2079 1651 A 90 LYS H A 89 LYS HDx 1.0 0.0 5.08 2080 1651 A 90 LYS H A 89 LYS HDy 1.0 0.0 5.08 2081 1652 A 90 LYS H A 90 LYS HGy 1.0 0.0 4.82 2082 1652 A 90 LYS H A 90 LYS HGx 1.0 0.0 4.82 2083 1653 A 90 LYS HA A 91 LYS HBx 1.0 0.0 5.99 2084 1653 A 90 LYS HA A 91 LYS HBy 1.0 0.0 5.99 2085 1654 A 91 LYS H A 91 LYS HBx 1.0 0.0 3.68 2086 1654 A 91 LYS H A 91 LYS HBy 1.0 0.0 3.68 2087 1655 A 91 LYS HA A 91 LYS HDx 1.0 0.0 5.33 2088 1655 A 91 LYS HA A 91 LYS HDy 1.0 0.0 5.33 2089 1656 A 91 LYS HA A 92 LEU HBx 1.0 0.0 6.22 2090 1656 A 91 LYS HA A 92 LEU HBy 1.0 0.0 6.22 2091 1657 A 92 LEU H A 91 LYS HBx 1.0 0.0 4.14 2092 1657 A 92 LEU H A 91 LYS HBy 1.0 0.0 4.14 2093 1658 A 92 LEU HA A 91 LYS HBx 1.0 0.0 6.58 2094 1658 A 92 LEU HA A 91 LYS HBy 1.0 0.0 6.58 2095 1659 A 92 LEU H A 92 LEU HBx 1.0 0.0 3.54 2096 1659 A 92 LEU H A 92 LEU HBy 1.0 0.0 3.54 2097 1660 A 93 GLU H A 92 LEU HBx 1.0 0.0 4.38 2098 1660 A 93 GLU H A 92 LEU HBy 1.0 0.0 4.38 2099 1661 A 93 GLU HA A 92 LEU HBx 1.0 0.0 5.69 2100 1661 A 92 LEU HBy A 93 GLU HA 1.0 0.0 5.69 2101 1662 A 93 GLU H A 93 GLU HBx 1.0 0.0 3.77 2102 1662 A 93 GLU H A 93 GLU HBy 1.0 0.0 3.77 2103 1663 A 93 GLU H A 93 GLU HGy 1.0 0.0 5.29 2104 1663 A 93 GLU H A 93 GLU HGx 1.0 0.0 5.29 2105 1664 A 94 HIS H A 93 GLU HGy 1.0 0.0 6.22 2106 1664 A 94 HIS H A 93 GLU HGx 1.0 0.0 6.22 2107 1665 A 25 MET H A 70 VAL O 1.0 1.8 2.00 2108 1666 A 70 VAL O A 25 MET N 1.0 2.7 3.00 2109 1667 A 30 PHE H A 26 LYS O 1.0 1.8 2.00 2110 1668 A 26 LYS O A 30 PHE N 1.0 2.7 3.00 2111 1669 A 31 ASP H A 27 LYS O 1.0 1.8 2.00 2112 1670 A 27 LYS O A 31 ASP N 1.0 2.7 3.00 2113 1671 A 33 VAL H A 30 PHE O 1.0 1.8 2.00 2114 1672 A 30 PHE O A 33 VAL N 1.0 2.7 3.00 2115 1673 A 34 ALA H A 31 ASP O 1.0 1.8 2.00 2116 1674 A 31 ASP O A 34 ALA N 1.0 2.7 3.00 2117 1675 A 36 GLU H A 33 VAL O 1.0 1.8 2.00 2118 1676 A 33 VAL O A 36 GLU N 1.0 2.7 3.00 2119 1677 A 37 TYR H A 34 ALA O 1.0 1.8 2.00 2120 1678 A 34 ALA O A 37 TYR N 1.0 2.7 3.00 2121 1679 A 38 THR H A 89 LYS O 1.0 1.8 2.00 2122 1680 A 89 LYS O A 38 THR N 1.0 2.7 3.00 2123 1681 A 40 ILE H A 87 ILE O 1.0 1.8 2.00 2124 1682 A 87 ILE O A 40 ILE N 1.0 2.7 3.00 2125 1683 A 43 ILE H A 85 ALA O 1.0 1.8 2.00 2126 1684 A 85 ALA O A 43 ILE N 1.0 2.7 3.00 2127 1685 A 58 LEU H A 54 ALA O 1.0 1.8 2.00 2128 1686 A 54 ALA O A 58 LEU N 1.0 2.7 3.00 2129 1687 A 59 ILE H A 55 ARG O 1.0 1.8 2.00 2130 1688 A 55 ARG O A 59 ILE N 1.0 2.7 3.00 2131 1689 A 60 LYS H A 56 GLU O 1.0 1.8 2.00 2132 1690 A 56 GLU O A 60 LYS N 1.0 2.7 3.00 2133 1691 A 61 LYS H A 57 ASP O 1.0 1.8 2.00 2134 1692 A 57 ASP O A 61 LYS N 1.0 2.7 3.00 2135 1693 A 62 ALA H A 58 LEU O 1.0 1.8 2.00 2136 1694 A 58 LEU O A 62 ALA N 1.0 2.7 3.00 2137 1695 A 63 ASP H A 59 ILE O 1.0 1.8 2.00 2138 1696 A 59 ILE O A 63 ASP N 1.0 2.7 3.00 2139 1697 A 64 GLU H A 60 LYS O 1.0 1.8 2.00 2140 1698 A 60 LYS O A 64 GLU N 1.0 2.7 3.00 2141 1699 A 65 LYS H A 61 LYS O 1.0 1.8 2.00 2142 1700 A 61 LYS O A 65 LYS N 1.0 2.7 3.00 2143 1701 A 66 GLY H A 63 ASP O 1.0 1.8 2.00 2144 1702 A 63 ASP O A 66 GLY N 1.0 2.7 3.00 2145 1703 A 67 ALA H A 62 ALA O 1.0 1.8 2.00 2146 1704 A 62 ALA O A 67 ALA N 1.0 2.7 3.00 2147 1705 A 68 ASP H A 88 TYR O 1.0 1.8 2.00 2148 1706 A 88 TYR O A 68 ASP N 1.0 2.7 3.00 2149 1707 A 69 VAL H A 88 TYR O 1.0 1.8 2.00 2150 1708 A 88 TYR O A 69 VAL N 1.0 2.7 3.00 2151 1709 A 70 VAL H A 23 GLU O 1.0 1.8 2.00 2152 1710 A 23 GLU O A 70 VAL N 1.0 2.7 3.00 2153 1711 A 71 VAL H A 86 ASP O 1.0 1.8 2.00 2154 1712 A 86 ASP O A 71 VAL N 1.0 2.7 3.00 2155 1713 A 72 LEU H A 25 MET O 1.0 1.8 2.00 2156 1714 A 25 MET O A 72 LEU N 1.0 2.7 3.00 2157 1715 A 85 ALA H A 43 ILE O 1.0 1.8 2.00 2158 1716 A 43 ILE O A 85 ALA N 1.0 2.7 3.00 2159 1717 A 86 ASP H A 71 VAL O 1.0 1.8 2.00 2160 1718 A 71 VAL O A 86 ASP N 1.0 2.7 3.00 2161 1719 A 87 ILE H A 41 GLY O 1.0 1.8 2.00 2162 1720 A 41 GLY O A 87 ILE N 1.0 2.7 3.00 2163 1721 A 88 TYR H A 69 VAL O 1.0 1.8 2.00 2164 1722 A 69 VAL O A 88 TYR N 1.0 2.7 3.00 2165 1723 A 89 LYS H A 38 THR O 1.0 1.8 2.00 2166 1724 A 38 THR O A 89 LYS N 1.0 2.7 3.00 2167 1725 A 90 LYS H A 68 ASP OD2 1.0 1.8 2.00 2168 1726 A 68 ASP OD2 A 90 LYS N 1.0 2.7 3.00 stop_ save_ save_CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 22 ALA C A 23 GLU N A 23 GLU CA A 23 GLU C 1.0 -164.2 -87.4 PHI 2 2 A 23 GLU N A 23 GLU CA A 23 GLU C A 24 ILE N 1.0 113.0 173.6 PSI 3 3 A 23 GLU C A 24 ILE N A 24 ILE CA A 24 ILE C 1.0 -121.0 -73.2 PHI 4 4 A 24 ILE N A 24 ILE CA A 24 ILE C A 25 MET N 1.0 107.8 144.2 PSI 5 5 A 24 ILE C A 25 MET N A 25 MET CA A 25 MET C 1.0 -158.9 -90.9 PHI 6 6 A 25 MET N A 25 MET CA A 25 MET C A 26 LYS N 1.0 109.1 167.3 PSI 7 7 A 25 MET C A 26 LYS N A 26 LYS CA A 26 LYS C 1.0 -112.1 -49.3 PHI 8 8 A 26 LYS N A 26 LYS CA A 26 LYS C A 27 LYS N 1.0 102.1 176.1 PSI 9 9 A 26 LYS C A 27 LYS N A 27 LYS CA A 27 LYS C 1.0 -68.9 -40.1 PHI 10 10 A 27 LYS N A 27 LYS CA A 27 LYS C A 28 THR N 1.0 -55.2 -21.0 PSI 11 11 A 27 LYS C A 28 THR N A 28 THR CA A 28 THR C 1.0 -72.7 -45.9 PHI 12 12 A 28 THR N A 28 THR CA A 28 THR C A 29 ASP N 1.0 -56.2 -17.2 PSI 13 13 A 28 THR C A 29 ASP N A 29 ASP CA A 29 ASP C 1.0 -80.3 -60.3 PHI 14 14 A 29 ASP N A 29 ASP CA A 29 ASP C A 30 PHE N 1.0 -50.6 -30.6 PSI 15 15 A 29 ASP C A 30 PHE N A 30 PHE CA A 30 PHE C 1.0 -73.1 -53.1 PHI 16 16 A 30 PHE N A 30 PHE CA A 30 PHE C A 31 ASP N 1.0 -56.0 -36.0 PSI 17 17 A 30 PHE C A 31 ASP N A 31 ASP CA A 31 ASP C 1.0 -70.3 -47.5 PHI 18 18 A 31 ASP N A 31 ASP CA A 31 ASP C A 32 LYS N 1.0 -54.6 -23.2 PSI 19 19 A 31 ASP C A 32 LYS N A 32 LYS CA A 32 LYS C 1.0 -85.1 -43.7 PHI 20 20 A 32 LYS N A 32 LYS CA A 32 LYS C A 33 VAL N 1.0 -57.4 -2.6 PSI 21 21 A 32 LYS C A 33 VAL N A 33 VAL CA A 33 VAL C 1.0 -141.5 -41.7 PHI 22 22 A 33 VAL N A 33 VAL CA A 33 VAL C A 34 ALA N 1.0 -49.9 22.9 PSI 23 23 A 33 VAL C A 34 ALA N A 34 ALA CA A 34 ALA C 1.0 -77.5 -39.1 PHI 24 24 A 34 ALA N A 34 ALA CA A 34 ALA C A 35 SER N 1.0 -61.8 -15.6 PSI 25 25 A 34 ALA C A 35 SER N A 35 SER CA A 35 SER C 1.0 -87.5 -49.5 PHI 26 26 A 35 SER N A 35 SER CA A 35 SER C A 36 GLU N 1.0 -62.0 2.4 PSI 27 27 A 35 SER C A 36 GLU N A 36 GLU CA A 36 GLU C 1.0 -127.7 -70.9 PHI 28 28 A 36 GLU N A 36 GLU CA A 36 GLU C A 37 TYR N 1.0 -50.8 34.4 PSI 29 29 A 36 GLU C A 37 TYR N A 37 TYR CA A 37 TYR C 1.0 -182.9 -95.1 PHI 30 30 A 37 TYR N A 37 TYR CA A 37 TYR C A 38 THR N 1.0 128.4 174.2 PSI 31 31 A 37 TYR C A 38 THR N A 38 THR CA A 38 THR C 1.0 -152.9 -114.1 PHI 32 32 A 38 THR N A 38 THR CA A 38 THR C A 39 LYS N 1.0 119.7 154.9 PSI 33 33 A 38 THR C A 39 LYS N A 39 LYS CA A 39 LYS C 1.0 -84.0 -64.0 PHI 34 34 A 39 LYS N A 39 LYS CA A 39 LYS C A 40 ILE N 1.0 107.8 144.6 PSI 35 35 A 39 LYS C A 40 ILE N A 40 ILE CA A 40 ILE C 1.0 -126.8 -98.6 PHI 36 36 A 40 ILE N A 40 ILE CA A 40 ILE C A 41 GLY N 1.0 -50.0 2.4 PSI 37 37 A 40 ILE C A 41 GLY N A 41 GLY CA A 41 GLY C 1.0 -197.1 -135.1 PHI 38 38 A 41 GLY N A 41 GLY CA A 41 GLY C A 42 THR N 1.0 134.7 182.9 PSI 39 39 A 41 GLY C A 42 THR N A 42 THR CA A 42 THR C 1.0 -164.9 -87.5 PHI 40 40 A 42 THR N A 42 THR CA A 42 THR C A 43 ILE N 1.0 134.9 167.1 PSI 41 41 A 42 THR C A 43 ILE N A 43 ILE CA A 43 ILE C 1.0 -165.5 -111.9 PHI 42 42 A 43 ILE N A 43 ILE CA A 43 ILE C A 44 SER N 1.0 146.1 185.1 PSI 43 43 A 43 ILE C A 44 SER N A 44 SER CA A 44 SER C 1.0 -191.5 -67.3 PHI 44 44 A 44 SER N A 44 SER CA A 44 SER C A 45 THR N 1.0 138.7 173.1 PSI 45 45 A 44 SER C A 45 THR N A 45 THR CA A 45 THR C 1.0 -161.3 -73.5 PHI 46 46 A 45 THR N A 45 THR CA A 45 THR C A 46 THR N 1.0 113.3 165.5 PSI 47 47 A 49 MET C A 50 SER N A 50 SER CA A 50 SER C 1.0 -129.6 -37.6 PHI 48 48 A 50 SER N A 50 SER CA A 50 SER C A 51 PRO N 1.0 122.5 177.9 PSI 49 49 A 51 PRO C A 52 LEU N A 52 LEU CA A 52 LEU C 1.0 -75.0 -55.0 PHI 50 50 A 52 LEU N A 52 LEU CA A 52 LEU C A 53 ASP N 1.0 -48.0 -19.4 PSI 51 51 A 52 LEU C A 53 ASP N A 53 ASP CA A 53 ASP C 1.0 -75.2 -54.8 PHI 52 52 A 53 ASP N A 53 ASP CA A 53 ASP C A 54 ALA N 1.0 -52.4 -26.0 PSI 53 53 A 53 ASP C A 54 ALA N A 54 ALA CA A 54 ALA C 1.0 -74.3 -54.3 PHI 54 54 A 54 ALA N A 54 ALA CA A 54 ALA C A 55 ARG N 1.0 -53.3 -33.3 PSI 55 55 A 54 ALA C A 55 ARG N A 55 ARG CA A 55 ARG C 1.0 -81.2 -42.0 PHI 56 56 A 55 ARG N A 55 ARG CA A 55 ARG C A 56 GLU N 1.0 -60.2 -31.4 PSI 57 57 A 55 ARG C A 56 GLU N A 56 GLU CA A 56 GLU C 1.0 -82.9 -44.3 PHI 58 58 A 56 GLU N A 56 GLU CA A 56 GLU C A 57 ASP N 1.0 -53.6 -24.0 PSI 59 59 A 56 GLU C A 57 ASP N A 57 ASP CA A 57 ASP C 1.0 -73.9 -53.9 PHI 60 60 A 57 ASP N A 57 ASP CA A 57 ASP C A 58 LEU N 1.0 -55.4 -33.4 PSI 61 61 A 57 ASP C A 58 LEU N A 58 LEU CA A 58 LEU C 1.0 -75.3 -54.5 PHI 62 62 A 58 LEU N A 58 LEU CA A 58 LEU C A 59 ILE N 1.0 -50.8 -20.2 PSI 63 63 A 58 LEU C A 59 ILE N A 59 ILE CA A 59 ILE C 1.0 -75.3 -54.1 PHI 64 64 A 59 ILE N A 59 ILE CA A 59 ILE C A 60 LYS N 1.0 -52.0 -32.0 PSI 65 65 A 59 ILE C A 60 LYS N A 60 LYS CA A 60 LYS C 1.0 -69.0 -44.0 PHI 66 66 A 60 LYS N A 60 LYS CA A 60 LYS C A 61 LYS N 1.0 -57.1 -30.9 PSI 67 67 A 60 LYS C A 61 LYS N A 61 LYS CA A 61 LYS C 1.0 -75.6 -55.6 PHI 68 68 A 61 LYS N A 61 LYS CA A 61 LYS C A 62 ALA N 1.0 -51.5 -30.3 PSI 69 69 A 61 LYS C A 62 ALA N A 62 ALA CA A 62 ALA C 1.0 -75.5 -51.3 PHI 70 70 A 62 ALA N A 62 ALA CA A 62 ALA C A 63 ASP N 1.0 -53.0 -26.2 PSI 71 71 A 62 ALA C A 63 ASP N A 63 ASP CA A 63 ASP C 1.0 -81.8 -50.8 PHI 72 72 A 63 ASP N A 63 ASP CA A 63 ASP C A 64 GLU N 1.0 -49.9 -26.3 PSI 73 73 A 63 ASP C A 64 GLU N A 64 GLU CA A 64 GLU C 1.0 -73.9 -53.9 PHI 74 74 A 64 GLU N A 64 GLU CA A 64 GLU C A 65 LYS N 1.0 -48.9 2.5 PSI 75 75 A 64 GLU C A 65 LYS N A 65 LYS CA A 65 LYS C 1.0 -114.5 -65.3 PHI 76 76 A 65 LYS N A 65 LYS CA A 65 LYS C A 66 GLY N 1.0 -15.7 15.7 PSI 77 77 A 65 LYS C A 66 GLY N A 66 GLY CA A 66 GLY C 1.0 50.6 108.8 PHI 78 78 A 66 GLY N A 66 GLY CA A 66 GLY C A 67 ALA N 1.0 -12.3 57.7 PSI 79 79 A 67 ALA C A 68 ASP N A 68 ASP CA A 68 ASP C 1.0 -121.6 -54.4 PHI 80 80 A 68 ASP N A 68 ASP CA A 68 ASP C A 69 VAL N 1.0 -50.5 -14.9 PSI 81 81 A 68 ASP C A 69 VAL N A 69 VAL CA A 69 VAL C 1.0 -156.9 -116.1 PHI 82 82 A 69 VAL N A 69 VAL CA A 69 VAL C A 70 VAL N 1.0 121.8 160.4 PSI 83 83 A 69 VAL C A 70 VAL N A 70 VAL CA A 70 VAL C 1.0 -153.8 -103.0 PHI 84 84 A 70 VAL N A 70 VAL CA A 70 VAL C A 71 VAL N 1.0 109.8 145.2 PSI 85 85 A 70 VAL C A 71 VAL N A 71 VAL CA A 71 VAL C 1.0 -141.9 -77.1 PHI 86 86 A 71 VAL N A 71 VAL CA A 71 VAL C A 72 LEU N 1.0 99.5 162.1 PSI 87 87 A 83 GLY C A 84 THR N A 84 THR CA A 84 THR C 1.0 -179.6 -105.0 PHI 88 88 A 84 THR N A 84 THR CA A 84 THR C A 85 ALA N 1.0 129.6 183.6 PSI 89 89 A 84 THR C A 85 ALA N A 85 ALA CA A 85 ALA C 1.0 -165.5 -124.3 PHI 90 90 A 85 ALA N A 85 ALA CA A 85 ALA C A 86 ASP N 1.0 127.7 166.9 PSI 91 91 A 85 ALA C A 86 ASP N A 86 ASP CA A 86 ASP C 1.0 -154.2 -68.6 PHI 92 92 A 86 ASP N A 86 ASP CA A 86 ASP C A 87 ILE N 1.0 128.4 174.6 PSI 93 93 A 86 ASP C A 87 ILE N A 87 ILE CA A 87 ILE C 1.0 -169.9 -87.5 PHI 94 94 A 87 ILE N A 87 ILE CA A 87 ILE C A 88 TYR N 1.0 136.4 182.0 PSI 95 95 A 87 ILE C A 88 TYR N A 88 TYR CA A 88 TYR C 1.0 -173.1 -83.9 PHI 96 96 A 88 TYR N A 88 TYR CA A 88 TYR C A 89 LYS N 1.0 114.7 168.1 PSI 97 97 A 88 TYR C A 89 LYS N A 89 LYS CA A 89 LYS C 1.0 -153.1 -113.9 PHI 98 98 A 89 LYS N A 89 LYS CA A 89 LYS C A 90 LYS N 1.0 112.0 153.0 PSI 99 99 A 89 LYS C A 90 LYS N A 90 LYS CA A 90 LYS C 1.0 -96.9 -48.1 PHI 100 100 A 90 LYS N A 90 LYS CA A 90 LYS C A 91 LYS N 1.0 110.0 143.8 PSI stop_ save_ save_N _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode N _nef_nmr_spectrum.num_dimensions 3 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 1H 5000 2 1H 10000 3 15N 2500 stop_ save_ save_C13ali _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode C13ali _nef_nmr_spectrum.num_dimensions 3 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 1H 10000 2 1H 10000 3 13C 5400 stop_ save_ save_C13aro _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode C13aro _nef_nmr_spectrum.num_dimensions 3 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 1H 5000 2 1H 10000 3 13C 5400 stop_ save_