data_18478 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 18478 _Entry.PDB_ID 2LTG save_ save_delta_chem_shifts _Entity_delta_chem_shifts.Sf_category delta_chem_shifts _Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts _Entity_delta_chem_shifts.Model_type single _Entity_delta_chem_shifts.Entry_ID 18478 _Entity_delta_chem_shifts.ID 1 loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Conformer_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 1 . 1 1 3 3 GLY C C 3 177.088 177.088 172.260 4.828 18478 2 1 1 . 1 1 3 3 GLY CA C 3 45.330 45.330 42.794 2.536 18478 3 1 1 . 1 1 4 4 SER N N 4 115.847 115.847 114.153 1.694 18478 4 1 1 . 1 1 4 4 SER HA H 4 4.480 4.480 4.839 -0.359 18478 5 1 1 . 1 1 4 4 SER C C 4 177.991 177.991 172.346 5.645 18478 6 1 1 . 1 1 4 4 SER CA C 4 58.742 58.742 58.364 0.378 18478 7 1 1 . 1 1 4 4 SER CB C 4 63.820 63.820 65.418 -1.599 18478 8 1 1 . 1 1 4 4 SER H H 4 8.207 8.207 7.955 0.252 18478 9 1 1 . 1 1 5 5 MET N N 5 125.867 125.867 122.154 3.713 18478 10 1 1 . 1 1 5 5 MET HA H 5 4.580 4.580 4.596 -0.016 18478 11 1 1 . 1 1 5 5 MET C C 5 174.825 174.825 176.319 -1.494 18478 12 1 1 . 1 1 5 5 MET CA C 5 54.733 54.733 54.247 0.486 18478 13 1 1 . 1 1 5 5 MET CB C 5 33.527 33.527 35.272 -1.745 18478 14 1 1 . 1 1 5 5 MET H H 5 8.148 8.148 8.734 -0.586 18478 15 1 1 . 1 1 6 6 THR N N 6 115.828 115.828 115.965 -0.137 18478 16 1 1 . 1 1 6 6 THR HA H 6 3.903 3.903 4.487 -0.584 18478 17 1 1 . 1 1 6 6 THR C C 6 176.930 176.930 173.015 3.915 18478 18 1 1 . 1 1 6 6 THR CA C 6 63.034 63.034 61.017 2.017 18478 19 1 1 . 1 1 6 6 THR CB C 6 69.308 69.308 68.633 0.674 18478 20 1 1 . 1 1 6 6 THR H H 6 8.408 8.408 8.539 -0.131 18478 21 1 1 . 1 1 7 7 ARG HA H 7 4.276 4.276 4.282 -0.006 18478 22 1 1 . 1 1 7 7 ARG C C 7 176.546 176.546 176.293 0.253 18478 23 1 1 . 1 1 7 7 ARG CA C 7 55.813 55.813 56.354 -0.541 18478 24 1 1 . 1 1 7 7 ARG CB C 7 30.556 30.556 30.636 -0.080 18478 25 1 1 . 1 1 8 8 ASP N N 8 121.762 121.762 125.170 -3.408 18478 26 1 1 . 1 1 8 8 ASP HA H 8 4.537 4.537 4.195 0.342 18478 27 1 1 . 1 1 8 8 ASP C C 8 177.750 177.750 175.122 2.628 18478 28 1 1 . 1 1 8 8 ASP CA C 8 54.117 54.117 54.880 -0.763 18478 29 1 1 . 1 1 8 8 ASP H H 8 8.066 8.066 8.464 -0.398 18478 30 1 1 . 1 1 9 9 PHE N N 9 119.991 119.991 119.429 0.562 18478 31 1 1 . 1 1 9 9 PHE HA H 9 4.734 4.734 5.078 -0.344 18478 32 1 1 . 1 1 9 9 PHE C C 9 176.838 176.838 175.399 1.439 18478 33 1 1 . 1 1 9 9 PHE CA C 9 58.303 58.303 57.574 0.729 18478 34 1 1 . 1 1 9 9 PHE CB C 9 41.594 41.594 40.941 0.653 18478 35 1 1 . 1 1 9 9 PHE H H 9 8.103 8.103 7.627 0.476 18478 36 1 1 . 1 1 10 10 LYS N N 10 122.957 122.957 124.320 -1.363 18478 37 1 1 . 1 1 10 10 LYS CA C 10 53.167 53.167 55.949 -2.782 18478 38 1 1 . 1 1 10 10 LYS CB C 10 33.495 33.495 32.136 1.359 18478 39 1 1 . 1 1 10 10 LYS H H 10 9.087 9.087 8.830 0.257 18478 40 1 1 . 1 1 11 11 PRO HA H 11 3.903 3.903 5.009 -1.106 18478 41 1 1 . 1 1 11 11 PRO C C 11 173.988 173.988 174.720 -0.732 18478 42 1 1 . 1 1 11 11 PRO CA C 11 63.874 63.874 61.234 2.640 18478 43 1 1 . 1 1 11 11 PRO CB C 11 31.623 31.623 35.043 -3.420 18478 44 1 1 . 1 1 12 12 GLY N N 12 115.413 115.413 111.527 3.886 18478 45 1 1 . 1 1 12 12 GLY C C 12 176.966 176.966 172.632 4.334 18478 46 1 1 . 1 1 12 12 GLY CA C 12 44.651 44.651 42.087 2.564 18478 47 1 1 . 1 1 12 12 GLY H H 12 9.667 9.667 9.079 0.588 18478 48 1 1 . 1 1 13 13 ASP N N 13 122.208 122.208 128.071 -5.863 18478 49 1 1 . 1 1 13 13 ASP HA H 13 4.601 4.601 4.783 -0.182 18478 50 1 1 . 1 1 13 13 ASP C C 13 176.244 176.244 174.624 1.620 18478 51 1 1 . 1 1 13 13 ASP CA C 13 55.870 55.870 52.060 3.810 18478 52 1 1 . 1 1 13 13 ASP CB C 13 40.794 40.794 43.046 -2.252 18478 53 1 1 . 1 1 13 13 ASP H H 13 8.303 8.303 8.501 -0.198 18478 54 1 1 . 1 1 14 14 LEU N N 14 121.306 121.306 126.135 -4.829 18478 55 1 1 . 1 1 14 14 LEU HA H 14 4.982 4.982 4.662 0.320 18478 56 1 1 . 1 1 14 14 LEU C C 14 173.461 173.461 175.832 -2.371 18478 57 1 1 . 1 1 14 14 LEU CA C 14 54.516 54.516 53.492 1.024 18478 58 1 1 . 1 1 14 14 LEU CB C 14 40.999 40.999 42.241 -1.242 18478 59 1 1 . 1 1 14 14 LEU H H 14 8.618 8.618 7.994 0.624 18478 60 1 1 . 1 1 15 15 ILE N N 15 118.806 118.806 125.325 -6.519 18478 61 1 1 . 1 1 15 15 ILE HA H 15 5.356 5.356 4.200 1.156 18478 62 1 1 . 1 1 15 15 ILE C C 15 175.982 175.982 176.124 -0.142 18478 63 1 1 . 1 1 15 15 ILE CA C 15 60.481 60.481 60.251 0.230 18478 64 1 1 . 1 1 15 15 ILE CB C 15 44.142 44.142 39.477 4.665 18478 65 1 1 . 1 1 15 15 ILE H H 15 8.864 8.864 8.625 0.239 18478 66 1 1 . 1 1 16 16 PHE N N 16 112.472 112.472 125.929 -13.457 18478 67 1 1 . 1 1 16 16 PHE HA H 16 5.306 5.306 4.238 1.068 18478 68 1 1 . 1 1 16 16 PHE C C 16 176.239 176.239 176.163 0.076 18478 69 1 1 . 1 1 16 16 PHE CA C 16 58.603 58.603 59.682 -1.079 18478 70 1 1 . 1 1 16 16 PHE CB C 16 43.305 43.305 38.556 4.749 18478 71 1 1 . 1 1 16 16 PHE H H 16 9.411 9.411 8.880 0.531 18478 72 1 1 . 1 1 17 17 ALA N N 17 123.889 123.889 126.030 -2.141 18478 73 1 1 . 1 1 17 17 ALA HA H 17 5.348 5.348 3.805 1.543 18478 74 1 1 . 1 1 17 17 ALA C C 17 174.426 174.426 176.757 -2.331 18478 75 1 1 . 1 1 17 17 ALA CA C 17 50.062 50.062 51.659 -1.597 18478 76 1 1 . 1 1 17 17 ALA H H 17 9.658 9.658 8.470 1.188 18478 77 1 1 . 1 1 18 18 LYS N N 18 127.760 127.760 121.926 5.834 18478 78 1 1 . 1 1 18 18 LYS HA H 18 4.697 4.697 4.703 -0.006 18478 79 1 1 . 1 1 18 18 LYS C C 18 178.554 178.554 174.840 3.714 18478 80 1 1 . 1 1 18 18 LYS CA C 18 53.893 53.893 52.504 1.389 18478 81 1 1 . 1 1 18 18 LYS CB C 18 35.291 35.291 32.579 2.712 18478 82 1 1 . 1 1 18 18 LYS H H 18 9.421 9.421 7.794 1.627 18478 83 1 1 . 1 1 19 19 MET HA H 19 4.656 4.656 4.620 0.036 18478 84 1 1 . 1 1 19 19 MET C C 19 175.741 175.741 174.777 0.964 18478 85 1 1 . 1 1 19 19 MET CA C 19 53.916 53.916 54.719 -0.804 18478 86 1 1 . 1 1 19 19 MET CB C 19 35.799 35.799 33.535 2.264 18478 87 1 1 . 1 1 20 20 LYS N N 20 124.062 124.062 117.866 6.196 18478 88 1 1 . 1 1 20 20 LYS CA C 20 58.585 58.585 56.143 2.442 18478 89 1 1 . 1 1 20 20 LYS CB C 20 31.978 31.978 33.028 -1.050 18478 90 1 1 . 1 1 20 20 LYS H H 20 8.645 8.645 8.052 0.593 18478 91 1 1 . 1 1 21 21 GLY C C 21 176.205 176.205 172.192 4.013 18478 92 1 1 . 1 1 21 21 GLY CA C 21 45.142 45.142 41.739 3.403 18478 93 1 1 . 1 1 22 22 TYR HA H 22 4.573 4.573 4.680 -0.107 18478 94 1 1 . 1 1 22 22 TYR CA C 22 55.748 55.748 57.865 -2.117 18478 95 1 1 . 1 1 22 22 TYR CB C 22 41.331 41.331 37.977 3.354 18478 96 1 1 . 1 1 23 23 PRO HA H 23 4.759 4.759 4.916 -0.157 18478 97 1 1 . 1 1 23 23 PRO C C 23 174.587 174.587 175.230 -0.643 18478 98 1 1 . 1 1 23 23 PRO CA C 23 62.072 62.072 61.251 0.821 18478 99 1 1 . 1 1 23 23 PRO CB C 23 31.077 31.077 34.963 -3.886 18478 100 1 1 . 1 1 24 24 HIS N N 24 119.190 119.190 114.647 4.543 18478 101 1 1 . 1 1 24 24 HIS HA H 24 3.983 3.983 5.592 -1.609 18478 102 1 1 . 1 1 24 24 HIS C C 24 175.555 175.555 173.873 1.682 18478 103 1 1 . 1 1 24 24 HIS CA C 24 60.973 60.973 54.275 6.698 18478 104 1 1 . 1 1 24 24 HIS CB C 24 30.689 30.689 32.868 -2.179 18478 105 1 1 . 1 1 24 24 HIS H H 24 8.158 8.158 8.407 -0.249 18478 106 1 1 . 1 1 25 25 TRP N N 25 127.435 127.435 122.214 5.221 18478 107 1 1 . 1 1 25 25 TRP HA H 25 3.760 3.760 5.388 -1.628 18478 108 1 1 . 1 1 25 25 TRP CA C 25 55.890 55.890 57.034 -1.144 18478 109 1 1 . 1 1 25 25 TRP CB C 25 32.879 32.879 30.126 2.753 18478 110 1 1 . 1 1 25 25 TRP H H 25 9.211 9.211 8.714 0.497 18478 111 1 1 . 1 1 26 26 PRO HA H 26 4.217 4.217 4.623 -0.406 18478 112 1 1 . 1 1 26 26 PRO C C 26 176.279 176.279 176.280 -0.001 18478 113 1 1 . 1 1 26 26 PRO CA C 26 63.140 63.140 61.720 1.420 18478 114 1 1 . 1 1 26 26 PRO CB C 26 32.171 32.171 34.666 -2.495 18478 115 1 1 . 1 1 27 27 ALA N N 27 130.162 130.162 123.343 6.819 18478 116 1 1 . 1 1 27 27 ALA HA H 27 4.981 4.981 4.314 0.667 18478 117 1 1 . 1 1 27 27 ALA C C 27 177.227 177.227 177.408 -0.181 18478 118 1 1 . 1 1 27 27 ALA CA C 27 52.574 52.574 51.064 1.510 18478 119 1 1 . 1 1 27 27 ALA CB C 27 23.239 23.239 20.005 3.234 18478 120 1 1 . 1 1 27 27 ALA H H 27 9.394 9.394 8.147 1.247 18478 121 1 1 . 1 1 28 28 ARG N N 28 117.381 117.381 115.222 2.159 18478 122 1 1 . 1 1 28 28 ARG HA H 28 5.421 5.421 4.427 0.994 18478 123 1 1 . 1 1 28 28 ARG C C 28 176.465 176.465 175.249 1.216 18478 124 1 1 . 1 1 28 28 ARG CA C 28 53.662 53.662 55.058 -1.396 18478 125 1 1 . 1 1 28 28 ARG CB C 28 35.058 35.058 29.543 5.515 18478 126 1 1 . 1 1 28 28 ARG H H 28 8.806 8.806 8.437 0.369 18478 127 1 1 . 1 1 29 29 VAL HA H 29 4.109 4.109 4.219 -0.110 18478 128 1 1 . 1 1 29 29 VAL C C 29 175.996 175.996 174.409 1.587 18478 129 1 1 . 1 1 29 29 VAL CA C 29 62.810 62.810 61.681 1.129 18478 130 1 1 . 1 1 29 29 VAL CB C 29 31.108 31.108 32.751 -1.643 18478 131 1 1 . 1 1 30 30 ASP N N 30 133.830 133.830 119.631 14.199 18478 132 1 1 . 1 1 30 30 ASP HA H 30 5.198 5.198 4.628 0.570 18478 133 1 1 . 1 1 30 30 ASP C C 30 176.207 176.207 176.558 -0.351 18478 134 1 1 . 1 1 30 30 ASP CA C 30 53.007 53.007 53.994 -0.987 18478 135 1 1 . 1 1 30 30 ASP CB C 30 44.130 44.130 40.987 3.143 18478 136 1 1 . 1 1 30 30 ASP H H 30 8.892 8.892 8.383 0.509 18478 137 1 1 . 1 1 31 31 GLU N N 31 115.905 115.905 123.643 -7.738 18478 138 1 1 . 1 1 31 31 GLU HA H 31 4.409 4.409 3.973 0.436 18478 139 1 1 . 1 1 31 31 GLU C C 31 175.192 175.192 176.121 -0.929 18478 140 1 1 . 1 1 31 31 GLU CA C 31 55.389 55.389 56.108 -0.719 18478 141 1 1 . 1 1 31 31 GLU H H 31 7.966 7.966 8.973 -1.007 18478 142 1 1 . 1 1 32 32 VAL N N 32 122.794 122.794 118.270 4.524 18478 143 1 1 . 1 1 32 32 VAL HA H 32 4.303 4.303 3.876 0.427 18478 144 1 1 . 1 1 32 32 VAL CA C 32 60.408 60.408 62.609 -2.201 18478 145 1 1 . 1 1 32 32 VAL CB C 32 32.333 32.333 31.248 1.085 18478 146 1 1 . 1 1 32 32 VAL H H 32 8.702 8.702 8.145 0.557 18478 147 1 1 . 1 1 33 33 PRO HA H 33 4.572 4.572 4.290 0.282 18478 148 1 1 . 1 1 33 33 PRO C C 33 175.366 175.366 177.102 -1.736 18478 149 1 1 . 1 1 33 33 PRO CA C 33 63.702 63.702 64.967 -1.265 18478 150 1 1 . 1 1 33 33 PRO CB C 33 32.736 32.736 31.951 0.785 18478 151 1 1 . 1 1 34 34 ASP N N 34 119.187 119.187 119.200 -0.013 18478 152 1 1 . 1 1 34 34 ASP HA H 34 4.679 4.679 4.890 -0.211 18478 153 1 1 . 1 1 34 34 ASP C C 34 175.713 175.713 173.928 1.785 18478 154 1 1 . 1 1 34 34 ASP CA C 34 53.013 53.013 52.552 0.461 18478 155 1 1 . 1 1 34 34 ASP CB C 34 40.850 40.850 41.050 -0.201 18478 156 1 1 . 1 1 34 34 ASP H H 34 8.686 8.686 7.971 0.715 18478 157 1 1 . 1 1 35 35 GLY C C 35 177.458 177.458 173.047 4.411 18478 158 1 1 . 1 1 35 35 GLY CA C 35 45.507 45.507 43.669 1.837 18478 159 1 1 . 1 1 36 36 ALA HA H 36 4.404 4.404 4.175 0.229 18478 160 1 1 . 1 1 36 36 ALA CA C 36 52.010 52.010 51.699 0.311 18478 161 1 1 . 1 1 36 36 ALA CB C 36 19.909 19.909 19.587 0.322 18478 162 1 1 . 1 1 37 37 VAL N N 37 119.594 119.594 121.564 -1.970 18478 163 1 1 . 1 1 37 37 VAL HA H 37 3.932 3.932 4.165 -0.233 18478 164 1 1 . 1 1 37 37 VAL C C 37 175.966 175.966 176.568 -0.602 18478 165 1 1 . 1 1 37 37 VAL CA C 37 62.810 62.810 63.763 -0.953 18478 166 1 1 . 1 1 37 37 VAL CB C 37 32.267 32.267 32.727 -0.460 18478 167 1 1 . 1 1 37 37 VAL H H 37 8.037 8.037 8.359 -0.322 18478 168 1 1 . 1 1 38 38 LYS N N 38 125.676 125.676 119.539 6.137 18478 169 1 1 . 1 1 38 38 LYS C C 38 173.865 173.865 174.617 -0.752 18478 170 1 1 . 1 1 38 38 LYS CA C 38 54.278 54.278 56.446 -2.168 18478 171 1 1 . 1 1 38 38 LYS CB C 38 31.740 31.740 33.532 -1.792 18478 172 1 1 . 1 1 38 38 LYS H H 38 8.292 8.292 8.405 -0.113 18478 173 1 1 . 1 1 40 40 PRO HA H 40 4.387 4.387 5.288 -0.901 18478 174 1 1 . 1 1 40 40 PRO C C 40 175.535 175.535 175.443 0.092 18478 175 1 1 . 1 1 40 40 PRO CA C 40 62.330 62.330 59.314 3.016 18478 176 1 1 . 1 1 40 40 PRO CB C 40 32.086 32.086 32.340 -0.254 18478 177 1 1 . 1 1 41 41 THR HA H 41 4.027 4.027 4.522 -0.495 18478 178 1 1 . 1 1 41 41 THR C C 41 176.795 176.795 173.232 3.563 18478 179 1 1 . 1 1 41 41 THR CA C 41 63.693 63.693 62.227 1.466 18478 180 1 1 . 1 1 41 41 THR CB C 41 69.370 69.370 69.054 0.316 18478 181 1 1 . 1 1 42 42 ASN N N 42 118.513 118.513 122.201 -3.688 18478 182 1 1 . 1 1 42 42 ASN HA H 42 4.530 4.530 5.306 -0.776 18478 183 1 1 . 1 1 42 42 ASN C C 42 177.230 177.230 175.012 2.218 18478 184 1 1 . 1 1 42 42 ASN CA C 42 56.373 56.373 50.445 5.928 18478 185 1 1 . 1 1 42 42 ASN CB C 42 37.618 37.618 38.087 -0.469 18478 186 1 1 . 1 1 42 42 ASN H H 42 8.752 8.752 8.756 -0.004 18478 187 1 1 . 1 1 43 43 LYS N N 43 115.898 115.898 128.953 -13.055 18478 188 1 1 . 1 1 43 43 LYS HA H 43 4.710 4.710 4.726 -0.016 18478 189 1 1 . 1 1 43 43 LYS C C 43 177.032 177.032 175.623 1.409 18478 190 1 1 . 1 1 43 43 LYS CA C 43 54.957 54.957 54.483 0.474 18478 191 1 1 . 1 1 43 43 LYS CB C 43 36.600 36.600 32.827 3.773 18478 192 1 1 . 1 1 43 43 LYS H H 43 7.723 7.723 8.679 -0.956 18478 193 1 1 . 1 1 44 44 LEU N N 44 121.006 121.006 129.277 -8.271 18478 194 1 1 . 1 1 44 44 LEU HA H 44 5.000 5.000 4.231 0.769 18478 195 1 1 . 1 1 44 44 LEU CA C 44 51.842 51.842 55.184 -3.342 18478 196 1 1 . 1 1 44 44 LEU CB C 44 44.418 44.418 42.025 2.393 18478 197 1 1 . 1 1 44 44 LEU H H 44 9.063 9.063 8.667 0.396 18478 198 1 1 . 1 1 45 45 PRO HA H 45 4.392 4.392 4.387 0.005 18478 199 1 1 . 1 1 45 45 PRO C C 45 177.051 177.051 178.598 -1.547 18478 200 1 1 . 1 1 45 45 PRO CA C 45 62.000 62.000 65.262 -3.262 18478 201 1 1 . 1 1 45 45 PRO CB C 45 30.737 30.737 32.545 -1.808 18478 202 1 1 . 1 1 46 46 ILE N N 46 125.996 125.996 124.257 1.739 18478 203 1 1 . 1 1 46 46 ILE HA H 46 4.564 4.564 3.909 0.655 18478 204 1 1 . 1 1 46 46 ILE C C 46 176.985 176.985 176.121 0.864 18478 205 1 1 . 1 1 46 46 ILE CA C 46 57.051 57.051 62.809 -5.758 18478 206 1 1 . 1 1 46 46 ILE H H 46 8.908 8.908 8.522 0.386 18478 207 1 1 . 1 1 47 47 PHE N N 47 128.276 128.276 118.766 9.510 18478 208 1 1 . 1 1 47 47 PHE HA H 47 4.827 4.827 4.041 0.786 18478 209 1 1 . 1 1 47 47 PHE C C 47 177.835 177.835 175.978 1.857 18478 210 1 1 . 1 1 47 47 PHE CA C 47 56.099 56.099 58.447 -2.348 18478 211 1 1 . 1 1 47 47 PHE CB C 47 41.217 41.217 39.799 1.418 18478 212 1 1 . 1 1 47 47 PHE H H 47 8.739 8.739 7.222 1.517 18478 213 1 1 . 1 1 48 48 PHE N N 48 125.953 125.953 116.388 9.565 18478 214 1 1 . 1 1 48 48 PHE HA H 48 4.251 4.251 3.663 0.588 18478 215 1 1 . 1 1 48 48 PHE C C 48 175.869 175.869 174.525 1.344 18478 216 1 1 . 1 1 48 48 PHE CA C 48 56.744 56.744 58.777 -2.033 18478 217 1 1 . 1 1 48 48 PHE CB C 48 38.835 38.835 36.269 2.566 18478 218 1 1 . 1 1 48 48 PHE H H 48 8.545 8.545 7.536 1.009 18478 219 1 1 . 1 1 49 49 PHE N N 49 122.197 122.197 118.509 3.688 18478 220 1 1 . 1 1 49 49 PHE HA H 49 4.400 4.400 4.591 -0.191 18478 221 1 1 . 1 1 49 49 PHE C C 49 174.016 174.016 175.158 -1.142 18478 222 1 1 . 1 1 49 49 PHE CA C 49 59.916 59.916 56.418 3.498 18478 223 1 1 . 1 1 49 49 PHE CB C 49 39.799 39.799 40.001 -0.202 18478 224 1 1 . 1 1 49 49 PHE H H 49 8.619 8.619 7.489 1.130 18478 225 1 1 . 1 1 50 50 GLY N N 50 114.083 114.083 107.270 6.813 18478 226 1 1 . 1 1 50 50 GLY C C 50 175.636 175.636 173.485 2.151 18478 227 1 1 . 1 1 50 50 GLY CA C 50 46.718 46.718 44.208 2.510 18478 228 1 1 . 1 1 50 50 GLY H H 50 10.329 10.329 8.234 2.095 18478 229 1 1 . 1 1 51 51 THR N N 51 111.210 111.210 118.093 -6.883 18478 230 1 1 . 1 1 51 51 THR HA H 51 3.980 3.980 4.625 -0.645 18478 231 1 1 . 1 1 51 51 THR C C 51 175.588 175.588 172.379 3.209 18478 232 1 1 . 1 1 51 51 THR CA C 51 62.223 62.223 61.366 0.857 18478 233 1 1 . 1 1 51 51 THR CB C 51 68.346 68.346 72.143 -3.797 18478 234 1 1 . 1 1 51 51 THR H H 51 7.882 7.882 8.318 -0.436 18478 235 1 1 . 1 1 52 52 HIS N N 52 115.544 115.544 120.143 -4.599 18478 236 1 1 . 1 1 52 52 HIS HA H 52 3.712 3.712 5.429 -1.717 18478 237 1 1 . 1 1 52 52 HIS C C 52 177.717 177.717 175.238 2.479 18478 238 1 1 . 1 1 52 52 HIS CA C 52 54.860 54.860 54.483 0.377 18478 239 1 1 . 1 1 52 52 HIS CB C 52 26.388 26.388 30.038 -3.650 18478 240 1 1 . 1 1 52 52 HIS H H 52 7.791 7.791 8.584 -0.793 18478 241 1 1 . 1 1 53 53 GLU N N 53 117.517 117.517 123.504 -5.987 18478 242 1 1 . 1 1 53 53 GLU HA H 53 4.298 4.298 4.794 -0.496 18478 243 1 1 . 1 1 53 53 GLU C C 53 176.958 176.958 176.796 0.162 18478 244 1 1 . 1 1 53 53 GLU CA C 53 55.403 55.403 55.091 0.312 18478 245 1 1 . 1 1 53 53 GLU CB C 53 31.588 31.588 33.070 -1.482 18478 246 1 1 . 1 1 53 53 GLU H H 53 6.795 6.795 8.293 -1.498 18478 247 1 1 . 1 1 54 54 THR N N 54 111.182 111.182 116.856 -5.674 18478 248 1 1 . 1 1 54 54 THR HA H 54 5.648 5.648 4.311 1.337 18478 249 1 1 . 1 1 54 54 THR C C 54 177.234 177.234 174.316 2.918 18478 250 1 1 . 1 1 54 54 THR CA C 54 59.894 59.894 61.221 -1.327 18478 251 1 1 . 1 1 54 54 THR H H 54 8.139 8.139 8.728 -0.589 18478 252 1 1 . 1 1 55 55 ALA HA H 55 4.403 4.403 4.130 0.274 18478 253 1 1 . 1 1 55 55 ALA C C 55 176.601 176.601 177.838 -1.237 18478 254 1 1 . 1 1 55 55 ALA CA C 55 51.079 51.079 52.989 -1.911 18478 255 1 1 . 1 1 55 55 ALA CB C 55 23.285 23.285 19.067 4.218 18478 256 1 1 . 1 1 56 56 PHE N N 56 118.058 118.058 113.122 4.936 18478 257 1 1 . 1 1 56 56 PHE HA H 56 5.678 5.678 4.570 1.108 18478 258 1 1 . 1 1 56 56 PHE C C 56 175.962 175.962 175.322 0.640 18478 259 1 1 . 1 1 56 56 PHE CA C 56 56.008 56.008 58.919 -2.911 18478 260 1 1 . 1 1 56 56 PHE CB C 56 39.995 39.995 37.798 2.197 18478 261 1 1 . 1 1 56 56 PHE H H 56 8.523 8.523 8.207 0.316 18478 262 1 1 . 1 1 57 57 LEU N N 57 123.344 123.344 120.056 3.288 18478 263 1 1 . 1 1 57 57 LEU HA H 57 4.929 4.929 4.674 0.255 18478 264 1 1 . 1 1 57 57 LEU C C 57 175.584 175.584 175.079 0.505 18478 265 1 1 . 1 1 57 57 LEU CA C 57 53.463 53.463 54.867 -1.404 18478 266 1 1 . 1 1 57 57 LEU CB C 57 46.545 46.545 43.991 2.554 18478 267 1 1 . 1 1 57 57 LEU H H 57 8.579 8.579 7.750 0.829 18478 268 1 1 . 1 1 58 58 GLY N N 58 108.499 108.499 107.196 1.303 18478 269 1 1 . 1 1 58 58 GLY CA C 58 43.755 43.755 44.847 -1.092 18478 270 1 1 . 1 1 58 58 GLY H H 58 9.318 9.318 7.222 2.096 18478 271 1 1 . 1 1 59 59 PRO HA H 59 4.048 4.048 4.908 -0.860 18478 272 1 1 . 1 1 59 59 PRO C C 59 173.763 173.763 174.679 -0.916 18478 273 1 1 . 1 1 59 59 PRO CA C 59 64.770 64.770 60.437 4.333 18478 274 1 1 . 1 1 59 59 PRO CB C 59 31.889 31.889 35.647 -3.758 18478 275 1 1 . 1 1 60 60 LYS HA H 60 4.191 4.191 4.567 -0.376 18478 276 1 1 . 1 1 60 60 LYS C C 60 174.842 174.842 176.567 -1.725 18478 277 1 1 . 1 1 60 60 LYS CA C 60 57.875 57.875 56.074 1.801 18478 278 1 1 . 1 1 60 60 LYS CB C 60 31.576 31.576 32.753 -1.177 18478 279 1 1 . 1 1 61 61 ASP N N 61 117.768 117.768 123.845 -6.077 18478 280 1 1 . 1 1 61 61 ASP HA H 61 4.973 4.973 4.349 0.624 18478 281 1 1 . 1 1 61 61 ASP C C 61 178.178 178.178 176.844 1.334 18478 282 1 1 . 1 1 61 61 ASP CA C 61 54.687 54.687 56.059 -1.372 18478 283 1 1 . 1 1 61 61 ASP CB C 61 43.555 43.555 39.490 4.065 18478 284 1 1 . 1 1 61 61 ASP H H 61 7.722 7.722 8.800 -1.078 18478 285 1 1 . 1 1 62 62 ILE N N 62 114.244 114.244 121.094 -6.850 18478 286 1 1 . 1 1 62 62 ILE HA H 62 4.891 4.891 3.441 1.450 18478 287 1 1 . 1 1 62 62 ILE C C 62 178.027 178.027 177.514 0.513 18478 288 1 1 . 1 1 62 62 ILE CA C 62 59.994 59.994 63.191 -3.197 18478 289 1 1 . 1 1 62 62 ILE CB C 62 40.652 40.652 36.787 3.865 18478 290 1 1 . 1 1 62 62 ILE H H 62 6.784 6.784 7.746 -0.962 18478 291 1 1 . 1 1 63 63 PHE N N 63 119.819 119.819 119.866 -0.047 18478 292 1 1 . 1 1 63 63 PHE HA H 63 5.214 5.214 4.164 1.050 18478 293 1 1 . 1 1 63 63 PHE CA C 63 54.735 54.735 60.114 -5.379 18478 294 1 1 . 1 1 63 63 PHE CB C 63 42.122 42.122 38.954 3.168 18478 295 1 1 . 1 1 63 63 PHE H H 63 8.734 8.734 7.606 1.128 18478 296 1 1 . 1 1 64 64 PRO HA H 64 4.771 4.771 4.253 0.518 18478 297 1 1 . 1 1 64 64 PRO C C 64 174.036 174.036 178.587 -4.551 18478 298 1 1 . 1 1 64 64 PRO CA C 64 64.474 64.474 64.526 -0.052 18478 299 1 1 . 1 1 64 64 PRO CB C 64 32.662 32.662 33.464 -0.802 18478 300 1 1 . 1 1 65 65 TYR N N 65 124.335 124.335 121.689 2.646 18478 301 1 1 . 1 1 65 65 TYR HA H 65 4.530 4.530 4.324 0.206 18478 302 1 1 . 1 1 65 65 TYR C C 65 173.944 173.944 177.404 -3.460 18478 303 1 1 . 1 1 65 65 TYR CA C 65 61.205 61.205 61.078 0.127 18478 304 1 1 . 1 1 65 65 TYR CB C 65 38.844 38.844 38.311 0.533 18478 305 1 1 . 1 1 65 65 TYR H H 65 8.359 8.359 7.966 0.393 18478 306 1 1 . 1 1 66 66 SER N N 66 114.836 114.836 112.096 2.740 18478 307 1 1 . 1 1 66 66 SER HA H 66 3.505 3.505 4.363 -0.858 18478 308 1 1 . 1 1 66 66 SER C C 66 173.697 173.697 175.415 -1.718 18478 309 1 1 . 1 1 66 66 SER CA C 66 63.078 63.078 59.679 3.399 18478 310 1 1 . 1 1 66 66 SER CB C 66 62.223 62.223 63.029 -0.806 18478 311 1 1 . 1 1 66 66 SER H H 66 8.974 8.974 7.705 1.269 18478 312 1 1 . 1 1 67 67 GLU N N 67 118.013 118.013 118.699 -0.686 18478 313 1 1 . 1 1 67 67 GLU HA H 67 4.210 4.210 4.157 0.053 18478 314 1 1 . 1 1 67 67 GLU C C 67 174.961 174.961 177.470 -2.509 18478 315 1 1 . 1 1 67 67 GLU CA C 67 58.330 58.330 57.947 0.383 18478 316 1 1 . 1 1 67 67 GLU CB C 67 30.205 30.205 31.017 -0.812 18478 317 1 1 . 1 1 67 67 GLU H H 67 8.817 8.817 7.853 0.964 18478 318 1 1 . 1 1 68 68 ASN N N 68 113.942 113.942 112.221 1.721 18478 319 1 1 . 1 1 68 68 ASN HA H 68 5.015 5.015 5.018 -0.003 18478 320 1 1 . 1 1 68 68 ASN C C 68 176.626 176.626 176.512 0.114 18478 321 1 1 . 1 1 68 68 ASN CA C 68 53.768 53.768 51.725 2.042 18478 322 1 1 . 1 1 68 68 ASN CB C 68 41.948 41.948 39.588 2.360 18478 323 1 1 . 1 1 68 68 ASN H H 68 7.448 7.448 7.713 -0.265 18478 324 1 1 . 1 1 69 69 LYS N N 69 124.584 124.584 121.296 3.288 18478 325 1 1 . 1 1 69 69 LYS HA H 69 3.794 3.794 3.886 -0.092 18478 326 1 1 . 1 1 69 69 LYS C C 69 173.330 173.330 174.775 -1.445 18478 327 1 1 . 1 1 69 69 LYS CA C 69 61.225 61.225 57.433 3.792 18478 328 1 1 . 1 1 69 69 LYS H H 69 7.592 7.592 8.685 -1.093 18478 329 1 1 . 1 1 70 70 GLU N N 70 118.408 118.408 117.693 0.715 18478 330 1 1 . 1 1 70 70 GLU HA H 70 4.005 4.005 4.828 -0.823 18478 331 1 1 . 1 1 70 70 GLU C C 70 174.588 174.588 173.747 0.841 18478 332 1 1 . 1 1 70 70 GLU CA C 70 58.695 58.695 52.971 5.724 18478 333 1 1 . 1 1 70 70 GLU CB C 70 28.928 28.928 30.921 -1.993 18478 334 1 1 . 1 1 70 70 GLU H H 70 8.478 8.478 7.867 0.611 18478 335 1 1 . 1 1 71 71 LYS HA H 71 3.847 3.847 4.346 -0.499 18478 336 1 1 . 1 1 71 71 LYS C C 71 173.420 173.420 175.333 -1.913 18478 337 1 1 . 1 1 71 71 LYS CA C 71 58.718 58.718 55.569 3.149 18478 338 1 1 . 1 1 71 71 LYS CB C 71 32.964 32.964 33.963 -0.999 18478 339 1 1 . 1 1 72 72 TYR N N 72 112.358 112.358 123.052 -10.694 18478 340 1 1 . 1 1 72 72 TYR HA H 72 4.790 4.790 4.266 0.524 18478 341 1 1 . 1 1 72 72 TYR C C 72 174.442 174.442 175.952 -1.510 18478 342 1 1 . 1 1 72 72 TYR CA C 72 55.287 55.287 59.153 -3.866 18478 343 1 1 . 1 1 72 72 TYR CB C 72 37.244 37.244 38.967 -1.723 18478 344 1 1 . 1 1 72 72 TYR H H 72 7.341 7.341 8.307 -0.966 18478 345 1 1 . 1 1 73 73 GLY N N 73 110.612 110.612 108.537 2.075 18478 346 1 1 . 1 1 73 73 GLY C C 73 177.982 177.982 173.518 4.464 18478 347 1 1 . 1 1 73 73 GLY CA C 73 46.623 46.623 44.119 2.504 18478 348 1 1 . 1 1 73 73 GLY H H 73 8.076 8.076 8.126 -0.050 18478 349 1 1 . 1 1 74 74 LYS N N 74 121.009 121.009 120.415 0.594 18478 350 1 1 . 1 1 74 74 LYS CA C 74 53.465 53.465 54.038 -0.573 18478 351 1 1 . 1 1 74 74 LYS CB C 74 32.440 32.440 33.606 -1.166 18478 352 1 1 . 1 1 74 74 LYS H H 74 7.411 7.411 7.841 -0.430 18478 353 1 1 . 1 1 75 75 PRO HA H 75 4.452 4.452 4.396 0.056 18478 354 1 1 . 1 1 75 75 PRO C C 75 174.959 174.959 178.276 -3.317 18478 355 1 1 . 1 1 75 75 PRO CA C 75 62.861 62.861 64.270 -1.409 18478 356 1 1 . 1 1 75 75 PRO CB C 75 32.407 32.407 31.892 0.515 18478 357 1 1 . 1 1 76 76 ASN N N 76 121.045 121.045 119.718 1.327 18478 358 1 1 . 1 1 76 76 ASN HA H 76 4.445 4.445 4.406 0.039 18478 359 1 1 . 1 1 76 76 ASN C C 76 174.145 174.145 175.273 -1.128 18478 360 1 1 . 1 1 76 76 ASN CA C 76 55.701 55.701 52.978 2.723 18478 361 1 1 . 1 1 76 76 ASN H H 76 8.474 8.474 8.911 -0.437 18478 362 1 1 . 1 1 77 77 LYS N N 77 111.466 111.466 121.703 -10.237 18478 363 1 1 . 1 1 77 77 LYS HA H 77 4.369 4.369 4.168 0.201 18478 364 1 1 . 1 1 77 77 LYS C C 77 173.881 173.881 176.141 -2.260 18478 365 1 1 . 1 1 77 77 LYS CA C 77 55.995 55.995 56.259 -0.264 18478 366 1 1 . 1 1 77 77 LYS CB C 77 32.538 32.538 32.191 0.347 18478 367 1 1 . 1 1 77 77 LYS H H 77 8.543 8.543 7.949 0.594 18478 368 1 1 . 1 1 78 78 ARG N N 78 122.233 122.233 120.550 1.683 18478 369 1 1 . 1 1 78 78 ARG HA H 78 4.286 4.286 4.018 0.268 18478 370 1 1 . 1 1 78 78 ARG C C 78 173.652 173.652 174.799 -1.147 18478 371 1 1 . 1 1 78 78 ARG CA C 78 55.780 55.780 57.488 -1.708 18478 372 1 1 . 1 1 78 78 ARG CB C 78 29.554 29.554 29.304 0.250 18478 373 1 1 . 1 1 78 78 ARG H H 78 8.864 8.864 8.536 0.328 18478 374 1 1 . 1 1 79 79 LYS N N 79 128.197 128.197 119.596 8.601 18478 375 1 1 . 1 1 79 79 LYS HA H 79 4.221 4.221 4.481 -0.260 18478 376 1 1 . 1 1 79 79 LYS C C 79 174.336 174.336 175.538 -1.202 18478 377 1 1 . 1 1 79 79 LYS CA C 79 58.986 58.986 55.936 3.050 18478 378 1 1 . 1 1 79 79 LYS CB C 79 32.072 32.072 32.815 -0.743 18478 379 1 1 . 1 1 79 79 LYS H H 79 8.927 8.927 7.982 0.945 18478 380 1 1 . 1 1 80 80 GLY N N 80 114.730 114.730 110.088 4.642 18478 381 1 1 . 1 1 80 80 GLY C C 80 176.536 176.536 174.490 2.046 18478 382 1 1 . 1 1 80 80 GLY CA C 80 45.992 45.992 45.251 0.741 18478 383 1 1 . 1 1 80 80 GLY H H 80 8.943 8.943 8.414 0.529 18478 384 1 1 . 1 1 81 81 PHE N N 81 123.770 123.770 118.032 5.738 18478 385 1 1 . 1 1 81 81 PHE HA H 81 3.336 3.336 4.272 -0.936 18478 386 1 1 . 1 1 81 81 PHE C C 81 174.037 174.037 176.187 -2.150 18478 387 1 1 . 1 1 81 81 PHE CA C 81 63.094 63.094 59.117 3.977 18478 388 1 1 . 1 1 81 81 PHE CB C 81 39.823 39.823 39.070 0.753 18478 389 1 1 . 1 1 81 81 PHE H H 81 8.281 8.281 7.926 0.355 18478 390 1 1 . 1 1 82 82 ASN N N 82 119.812 119.812 117.132 2.680 18478 391 1 1 . 1 1 82 82 ASN HA H 82 4.458 4.458 4.342 0.116 18478 392 1 1 . 1 1 82 82 ASN C C 82 171.290 171.290 176.491 -5.201 18478 393 1 1 . 1 1 82 82 ASN CA C 82 56.060 56.060 56.298 -0.238 18478 394 1 1 . 1 1 82 82 ASN CB C 82 36.390 36.390 38.624 -2.235 18478 395 1 1 . 1 1 82 82 ASN H H 82 9.145 9.145 8.322 0.823 18478 396 1 1 . 1 1 83 83 GLU N N 83 124.411 124.411 118.185 6.226 18478 397 1 1 . 1 1 83 83 GLU HA H 83 4.186 4.186 3.959 0.227 18478 398 1 1 . 1 1 83 83 GLU C C 83 172.222 172.222 178.558 -6.336 18478 399 1 1 . 1 1 83 83 GLU CA C 83 60.922 60.922 59.175 1.748 18478 400 1 1 . 1 1 83 83 GLU CB C 83 28.132 28.132 29.605 -1.473 18478 401 1 1 . 1 1 83 83 GLU H H 83 9.560 9.560 7.866 1.694 18478 402 1 1 . 1 1 84 84 GLY N N 84 111.388 111.388 106.340 5.048 18478 403 1 1 . 1 1 84 84 GLY C C 84 176.445 176.445 174.797 1.648 18478 404 1 1 . 1 1 84 84 GLY CA C 84 46.727 46.727 46.684 0.043 18478 405 1 1 . 1 1 84 84 GLY H H 84 8.364 8.364 7.308 1.056 18478 406 1 1 . 1 1 85 85 LEU N N 85 121.153 121.153 120.767 0.386 18478 407 1 1 . 1 1 85 85 LEU HA H 85 4.236 4.236 4.277 -0.041 18478 408 1 1 . 1 1 85 85 LEU C C 85 172.285 172.285 177.791 -5.506 18478 409 1 1 . 1 1 85 85 LEU CA C 85 56.795 56.795 56.452 0.343 18478 410 1 1 . 1 1 85 85 LEU CB C 85 41.113 41.113 42.856 -1.743 18478 411 1 1 . 1 1 85 85 LEU H H 85 8.294 8.294 7.469 0.825 18478 412 1 1 . 1 1 86 86 TRP N N 86 118.898 118.898 119.336 -0.438 18478 413 1 1 . 1 1 86 86 TRP HA H 86 4.161 4.161 4.320 -0.159 18478 414 1 1 . 1 1 86 86 TRP C C 86 171.741 171.741 176.306 -4.565 18478 415 1 1 . 1 1 86 86 TRP CA C 86 62.153 62.153 58.467 3.686 18478 416 1 1 . 1 1 86 86 TRP CB C 86 28.424 28.424 29.786 -1.362 18478 417 1 1 . 1 1 86 86 TRP H H 86 7.783 7.783 7.480 0.303 18478 418 1 1 . 1 1 87 87 GLU N N 87 120.718 120.718 119.339 1.379 18478 419 1 1 . 1 1 87 87 GLU HA H 87 3.416 3.416 4.701 -1.285 18478 420 1 1 . 1 1 87 87 GLU C C 87 172.957 172.957 175.027 -2.070 18478 421 1 1 . 1 1 87 87 GLU CA C 87 60.122 60.122 53.274 6.848 18478 422 1 1 . 1 1 87 87 GLU CB C 87 31.021 31.021 30.365 0.656 18478 423 1 1 . 1 1 87 87 GLU H H 87 8.779 8.779 7.528 1.251 18478 424 1 1 . 1 1 88 88 ILE HA H 88 2.478 2.478 4.277 -1.799 18478 425 1 1 . 1 1 88 88 ILE C C 88 177.873 177.873 177.368 0.505 18478 426 1 1 . 1 1 88 88 ILE CA C 88 65.248 65.248 62.380 2.868 18478 427 1 1 . 1 1 88 88 ILE CB C 88 37.327 37.327 38.598 -1.271 18478 428 1 1 . 1 1 89 89 ASP N N 89 114.411 114.411 118.715 -4.304 18478 429 1 1 . 1 1 89 89 ASP HA H 89 4.589 4.589 4.495 0.094 18478 430 1 1 . 1 1 89 89 ASP C C 89 174.207 174.207 177.422 -3.215 18478 431 1 1 . 1 1 89 89 ASP CA C 89 54.740 54.740 56.231 -1.491 18478 432 1 1 . 1 1 89 89 ASP CB C 89 42.473 42.473 40.140 2.333 18478 433 1 1 . 1 1 89 89 ASP H H 89 5.911 5.911 7.913 -2.002 18478 434 1 1 . 1 1 90 90 ASN N N 90 114.358 114.358 111.414 2.944 18478 435 1 1 . 1 1 90 90 ASN HA H 90 4.420 4.420 4.539 -0.119 18478 436 1 1 . 1 1 90 90 ASN C C 90 176.991 176.991 177.721 -0.730 18478 437 1 1 . 1 1 90 90 ASN CA C 90 54.855 54.855 56.368 -1.513 18478 438 1 1 . 1 1 90 90 ASN CB C 90 40.582 40.582 38.140 2.442 18478 439 1 1 . 1 1 90 90 ASN H H 90 7.480 7.480 7.710 -0.230 18478 440 1 1 . 1 1 91 91 ASN N N 91 119.185 119.185 115.521 3.664 18478 441 1 1 . 1 1 91 91 ASN HA H 91 5.006 5.006 4.944 0.062 18478 442 1 1 . 1 1 91 91 ASN CA C 91 51.624 51.624 54.056 -2.432 18478 443 1 1 . 1 1 91 91 ASN CB C 91 38.752 38.752 38.671 0.081 18478 444 1 1 . 1 1 91 91 ASN H H 91 9.238 9.238 7.787 1.451 18478 445 1 1 . 1 1 92 92 PRO HA H 92 4.296 4.296 4.179 0.117 18478 446 1 1 . 1 1 92 92 PRO C C 92 173.690 173.690 175.974 -2.284 18478 447 1 1 . 1 1 92 92 PRO CA C 92 64.714 64.714 63.547 1.167 18478 448 1 1 . 1 1 92 92 PRO CB C 92 31.781 31.781 32.268 -0.487 18478 449 1 2 . 1 1 3 3 GLY C C 3 177.088 177.088 172.416 4.672 18478 450 1 2 . 1 1 3 3 GLY CA C 3 45.330 45.330 42.820 2.510 18478 451 1 2 . 1 1 4 4 SER N N 4 115.847 115.847 114.112 1.735 18478 452 1 2 . 1 1 4 4 SER HA H 4 4.480 4.480 4.727 -0.247 18478 453 1 2 . 1 1 4 4 SER C C 4 177.991 177.991 172.057 5.934 18478 454 1 2 . 1 1 4 4 SER CA C 4 58.742 58.742 58.498 0.244 18478 455 1 2 . 1 1 4 4 SER CB C 4 63.820 63.820 64.925 -1.105 18478 456 1 2 . 1 1 4 4 SER H H 4 8.207 8.207 7.709 0.498 18478 457 1 2 . 1 1 5 5 MET N N 5 125.867 125.867 122.183 3.684 18478 458 1 2 . 1 1 5 5 MET HA H 5 4.580 4.580 4.673 -0.093 18478 459 1 2 . 1 1 5 5 MET C C 5 174.825 174.825 176.110 -1.285 18478 460 1 2 . 1 1 5 5 MET CA C 5 54.733 54.733 54.512 0.221 18478 461 1 2 . 1 1 5 5 MET CB C 5 33.527 33.527 35.530 -2.003 18478 462 1 2 . 1 1 5 5 MET H H 5 8.148 8.148 8.764 -0.616 18478 463 1 2 . 1 1 6 6 THR N N 6 115.828 115.828 115.026 0.802 18478 464 1 2 . 1 1 6 6 THR HA H 6 3.903 3.903 4.446 -0.543 18478 465 1 2 . 1 1 6 6 THR C C 6 176.930 176.930 173.311 3.619 18478 466 1 2 . 1 1 6 6 THR CA C 6 63.034 63.034 61.587 1.447 18478 467 1 2 . 1 1 6 6 THR CB C 6 69.308 69.308 68.657 0.651 18478 468 1 2 . 1 1 6 6 THR H H 6 8.408 8.408 8.380 0.028 18478 469 1 2 . 1 1 7 7 ARG HA H 7 4.276 4.276 4.255 0.021 18478 470 1 2 . 1 1 7 7 ARG C C 7 176.546 176.546 176.260 0.286 18478 471 1 2 . 1 1 7 7 ARG CA C 7 55.813 55.813 56.606 -0.793 18478 472 1 2 . 1 1 7 7 ARG CB C 7 30.556 30.556 30.383 0.173 18478 473 1 2 . 1 1 8 8 ASP N N 8 121.762 121.762 124.584 -2.822 18478 474 1 2 . 1 1 8 8 ASP HA H 8 4.537 4.537 4.214 0.323 18478 475 1 2 . 1 1 8 8 ASP C C 8 177.750 177.750 175.738 2.012 18478 476 1 2 . 1 1 8 8 ASP CA C 8 54.117 54.117 54.633 -0.516 18478 477 1 2 . 1 1 8 8 ASP H H 8 8.066 8.066 8.415 -0.349 18478 478 1 2 . 1 1 9 9 PHE N N 9 119.991 119.991 119.905 0.086 18478 479 1 2 . 1 1 9 9 PHE HA H 9 4.734 4.734 4.699 0.035 18478 480 1 2 . 1 1 9 9 PHE C C 9 176.838 176.838 175.139 1.699 18478 481 1 2 . 1 1 9 9 PHE CA C 9 58.303 58.303 58.282 0.021 18478 482 1 2 . 1 1 9 9 PHE CB C 9 41.594 41.594 40.310 1.284 18478 483 1 2 . 1 1 9 9 PHE H H 9 8.103 8.103 7.639 0.464 18478 484 1 2 . 1 1 10 10 LYS N N 10 122.957 122.957 124.293 -1.336 18478 485 1 2 . 1 1 10 10 LYS CA C 10 53.167 53.167 55.590 -2.423 18478 486 1 2 . 1 1 10 10 LYS CB C 10 33.495 33.495 31.814 1.681 18478 487 1 2 . 1 1 10 10 LYS H H 10 9.087 9.087 8.659 0.428 18478 488 1 2 . 1 1 11 11 PRO HA H 11 3.903 3.903 5.030 -1.127 18478 489 1 2 . 1 1 11 11 PRO C C 11 173.988 173.988 174.696 -0.708 18478 490 1 2 . 1 1 11 11 PRO CA C 11 63.874 63.874 61.116 2.758 18478 491 1 2 . 1 1 11 11 PRO CB C 11 31.623 31.623 35.207 -3.584 18478 492 1 2 . 1 1 12 12 GLY N N 12 115.413 115.413 111.162 4.251 18478 493 1 2 . 1 1 12 12 GLY C C 12 176.966 176.966 172.627 4.339 18478 494 1 2 . 1 1 12 12 GLY CA C 12 44.651 44.651 42.109 2.542 18478 495 1 2 . 1 1 12 12 GLY H H 12 9.667 9.667 8.996 0.671 18478 496 1 2 . 1 1 13 13 ASP N N 13 122.208 122.208 128.834 -6.626 18478 497 1 2 . 1 1 13 13 ASP HA H 13 4.601 4.601 4.756 -0.155 18478 498 1 2 . 1 1 13 13 ASP C C 13 176.244 176.244 174.460 1.784 18478 499 1 2 . 1 1 13 13 ASP CA C 13 55.870 55.870 52.135 3.735 18478 500 1 2 . 1 1 13 13 ASP CB C 13 40.794 40.794 42.407 -1.613 18478 501 1 2 . 1 1 13 13 ASP H H 13 8.303 8.303 8.506 -0.203 18478 502 1 2 . 1 1 14 14 LEU N N 14 121.306 121.306 126.552 -5.246 18478 503 1 2 . 1 1 14 14 LEU HA H 14 4.982 4.982 4.584 0.398 18478 504 1 2 . 1 1 14 14 LEU C C 14 173.461 173.461 176.143 -2.682 18478 505 1 2 . 1 1 14 14 LEU CA C 14 54.516 54.516 53.523 0.993 18478 506 1 2 . 1 1 14 14 LEU CB C 14 40.999 40.999 41.895 -0.896 18478 507 1 2 . 1 1 14 14 LEU H H 14 8.618 8.618 7.708 0.910 18478 508 1 2 . 1 1 15 15 ILE N N 15 118.806 118.806 126.883 -8.077 18478 509 1 2 . 1 1 15 15 ILE HA H 15 5.356 5.356 4.313 1.043 18478 510 1 2 . 1 1 15 15 ILE C C 15 175.982 175.982 175.514 0.468 18478 511 1 2 . 1 1 15 15 ILE CA C 15 60.481 60.481 59.683 0.798 18478 512 1 2 . 1 1 15 15 ILE CB C 15 44.142 44.142 39.426 4.716 18478 513 1 2 . 1 1 15 15 ILE H H 15 8.864 8.864 8.705 0.159 18478 514 1 2 . 1 1 16 16 PHE N N 16 112.472 112.472 126.334 -13.862 18478 515 1 2 . 1 1 16 16 PHE HA H 16 5.306 5.306 4.143 1.163 18478 516 1 2 . 1 1 16 16 PHE C C 16 176.239 176.239 176.326 -0.087 18478 517 1 2 . 1 1 16 16 PHE CA C 16 58.603 58.603 59.903 -1.300 18478 518 1 2 . 1 1 16 16 PHE CB C 16 43.305 43.305 38.980 4.325 18478 519 1 2 . 1 1 16 16 PHE H H 16 9.411 9.411 8.993 0.418 18478 520 1 2 . 1 1 17 17 ALA N N 17 123.889 123.889 126.796 -2.907 18478 521 1 2 . 1 1 17 17 ALA HA H 17 5.348 5.348 3.687 1.661 18478 522 1 2 . 1 1 17 17 ALA C C 17 174.426 174.426 175.955 -1.529 18478 523 1 2 . 1 1 17 17 ALA CA C 17 50.062 50.062 51.609 -1.547 18478 524 1 2 . 1 1 17 17 ALA H H 17 9.658 9.658 8.523 1.135 18478 525 1 2 . 1 1 18 18 LYS N N 18 127.760 127.760 121.738 6.022 18478 526 1 2 . 1 1 18 18 LYS HA H 18 4.697 4.697 4.689 0.008 18478 527 1 2 . 1 1 18 18 LYS C C 18 178.554 178.554 174.619 3.935 18478 528 1 2 . 1 1 18 18 LYS CA C 18 53.893 53.893 52.555 1.338 18478 529 1 2 . 1 1 18 18 LYS CB C 18 35.291 35.291 32.801 2.490 18478 530 1 2 . 1 1 18 18 LYS H H 18 9.421 9.421 7.952 1.469 18478 531 1 2 . 1 1 19 19 MET HA H 19 4.656 4.656 4.572 0.084 18478 532 1 2 . 1 1 19 19 MET C C 19 175.741 175.741 174.699 1.042 18478 533 1 2 . 1 1 19 19 MET CA C 19 53.916 53.916 54.924 -1.008 18478 534 1 2 . 1 1 19 19 MET CB C 19 35.799 35.799 33.371 2.428 18478 535 1 2 . 1 1 20 20 LYS N N 20 124.062 124.062 118.956 5.106 18478 536 1 2 . 1 1 20 20 LYS CA C 20 58.585 58.585 56.294 2.291 18478 537 1 2 . 1 1 20 20 LYS CB C 20 31.978 31.978 32.952 -0.974 18478 538 1 2 . 1 1 20 20 LYS H H 20 8.645 8.645 8.222 0.423 18478 539 1 2 . 1 1 21 21 GLY C C 21 176.205 176.205 172.454 3.751 18478 540 1 2 . 1 1 21 21 GLY CA C 21 45.142 45.142 41.962 3.180 18478 541 1 2 . 1 1 22 22 TYR HA H 22 4.573 4.573 4.782 -0.209 18478 542 1 2 . 1 1 22 22 TYR CA C 22 55.748 55.748 57.864 -2.116 18478 543 1 2 . 1 1 22 22 TYR CB C 22 41.331 41.331 37.998 3.333 18478 544 1 2 . 1 1 23 23 PRO HA H 23 4.759 4.759 4.942 -0.183 18478 545 1 2 . 1 1 23 23 PRO C C 23 174.587 174.587 175.222 -0.635 18478 546 1 2 . 1 1 23 23 PRO CA C 23 62.072 62.072 61.209 0.863 18478 547 1 2 . 1 1 23 23 PRO CB C 23 31.077 31.077 34.943 -3.866 18478 548 1 2 . 1 1 24 24 HIS N N 24 119.190 119.190 114.782 4.408 18478 549 1 2 . 1 1 24 24 HIS HA H 24 3.983 3.983 5.770 -1.787 18478 550 1 2 . 1 1 24 24 HIS C C 24 175.555 175.555 174.220 1.335 18478 551 1 2 . 1 1 24 24 HIS CA C 24 60.973 60.973 54.108 6.865 18478 552 1 2 . 1 1 24 24 HIS CB C 24 30.689 30.689 33.170 -2.481 18478 553 1 2 . 1 1 24 24 HIS H H 24 8.158 8.158 8.484 -0.326 18478 554 1 2 . 1 1 25 25 TRP N N 25 127.435 127.435 121.406 6.029 18478 555 1 2 . 1 1 25 25 TRP HA H 25 3.760 3.760 5.259 -1.499 18478 556 1 2 . 1 1 25 25 TRP CA C 25 55.890 55.890 57.518 -1.628 18478 557 1 2 . 1 1 25 25 TRP CB C 25 32.879 32.879 30.538 2.341 18478 558 1 2 . 1 1 25 25 TRP H H 25 9.211 9.211 8.624 0.587 18478 559 1 2 . 1 1 26 26 PRO HA H 26 4.217 4.217 4.554 -0.337 18478 560 1 2 . 1 1 26 26 PRO C C 26 176.279 176.279 175.834 0.445 18478 561 1 2 . 1 1 26 26 PRO CA C 26 63.140 63.140 61.616 1.524 18478 562 1 2 . 1 1 26 26 PRO CB C 26 32.171 32.171 34.266 -2.095 18478 563 1 2 . 1 1 27 27 ALA N N 27 130.162 130.162 123.207 6.955 18478 564 1 2 . 1 1 27 27 ALA HA H 27 4.981 4.981 4.297 0.684 18478 565 1 2 . 1 1 27 27 ALA C C 27 177.227 177.227 177.457 -0.230 18478 566 1 2 . 1 1 27 27 ALA CA C 27 52.574 52.574 51.093 1.481 18478 567 1 2 . 1 1 27 27 ALA CB C 27 23.239 23.239 20.125 3.114 18478 568 1 2 . 1 1 27 27 ALA H H 27 9.394 9.394 8.115 1.279 18478 569 1 2 . 1 1 28 28 ARG N N 28 117.381 117.381 116.533 0.848 18478 570 1 2 . 1 1 28 28 ARG HA H 28 5.421 5.421 4.461 0.960 18478 571 1 2 . 1 1 28 28 ARG C C 28 176.465 176.465 175.734 0.731 18478 572 1 2 . 1 1 28 28 ARG CA C 28 53.662 53.662 55.030 -1.368 18478 573 1 2 . 1 1 28 28 ARG CB C 28 35.058 35.058 29.687 5.371 18478 574 1 2 . 1 1 28 28 ARG H H 28 8.806 8.806 8.416 0.390 18478 575 1 2 . 1 1 29 29 VAL HA H 29 4.109 4.109 4.216 -0.107 18478 576 1 2 . 1 1 29 29 VAL C C 29 175.996 175.996 174.567 1.429 18478 577 1 2 . 1 1 29 29 VAL CA C 29 62.810 62.810 61.716 1.094 18478 578 1 2 . 1 1 29 29 VAL CB C 29 31.108 31.108 32.653 -1.544 18478 579 1 2 . 1 1 30 30 ASP N N 30 133.830 133.830 117.160 16.670 18478 580 1 2 . 1 1 30 30 ASP HA H 30 5.198 5.198 4.576 0.622 18478 581 1 2 . 1 1 30 30 ASP C C 30 176.207 176.207 176.384 -0.177 18478 582 1 2 . 1 1 30 30 ASP CA C 30 53.007 53.007 53.599 -0.592 18478 583 1 2 . 1 1 30 30 ASP CB C 30 44.130 44.130 40.355 3.775 18478 584 1 2 . 1 1 30 30 ASP H H 30 8.892 8.892 8.400 0.492 18478 585 1 2 . 1 1 31 31 GLU N N 31 115.905 115.905 122.944 -7.039 18478 586 1 2 . 1 1 31 31 GLU HA H 31 4.409 4.409 3.968 0.441 18478 587 1 2 . 1 1 31 31 GLU C C 31 175.192 175.192 176.156 -0.964 18478 588 1 2 . 1 1 31 31 GLU CA C 31 55.389 55.389 56.064 -0.675 18478 589 1 2 . 1 1 31 31 GLU H H 31 7.966 7.966 8.977 -1.011 18478 590 1 2 . 1 1 32 32 VAL N N 32 122.794 122.794 116.942 5.852 18478 591 1 2 . 1 1 32 32 VAL HA H 32 4.303 4.303 3.734 0.569 18478 592 1 2 . 1 1 32 32 VAL CA C 32 60.408 60.408 62.589 -2.181 18478 593 1 2 . 1 1 32 32 VAL CB C 32 32.333 32.333 31.081 1.252 18478 594 1 2 . 1 1 32 32 VAL H H 32 8.702 8.702 8.240 0.462 18478 595 1 2 . 1 1 33 33 PRO HA H 33 4.572 4.572 4.154 0.418 18478 596 1 2 . 1 1 33 33 PRO C C 33 175.366 175.366 178.083 -2.717 18478 597 1 2 . 1 1 33 33 PRO CA C 33 63.702 63.702 65.265 -1.563 18478 598 1 2 . 1 1 33 33 PRO CB C 33 32.736 32.736 31.819 0.917 18478 599 1 2 . 1 1 34 34 ASP N N 34 119.187 119.187 117.711 1.476 18478 600 1 2 . 1 1 34 34 ASP HA H 34 4.679 4.679 4.819 -0.140 18478 601 1 2 . 1 1 34 34 ASP C C 34 175.713 175.713 173.781 1.932 18478 602 1 2 . 1 1 34 34 ASP CA C 34 53.013 53.013 52.859 0.154 18478 603 1 2 . 1 1 34 34 ASP CB C 34 40.850 40.850 40.850 -0.000 18478 604 1 2 . 1 1 34 34 ASP H H 34 8.686 8.686 7.850 0.836 18478 605 1 2 . 1 1 35 35 GLY C C 35 177.458 177.458 173.095 4.363 18478 606 1 2 . 1 1 35 35 GLY CA C 35 45.507 45.507 43.888 1.619 18478 607 1 2 . 1 1 36 36 ALA HA H 36 4.404 4.404 4.253 0.151 18478 608 1 2 . 1 1 36 36 ALA CA C 36 52.010 52.010 51.900 0.110 18478 609 1 2 . 1 1 36 36 ALA CB C 36 19.909 19.909 19.777 0.132 18478 610 1 2 . 1 1 37 37 VAL N N 37 119.594 119.594 120.216 -0.622 18478 611 1 2 . 1 1 37 37 VAL HA H 37 3.932 3.932 4.145 -0.213 18478 612 1 2 . 1 1 37 37 VAL C C 37 175.966 175.966 176.892 -0.926 18478 613 1 2 . 1 1 37 37 VAL CA C 37 62.810 62.810 64.016 -1.206 18478 614 1 2 . 1 1 37 37 VAL CB C 37 32.267 32.267 32.536 -0.270 18478 615 1 2 . 1 1 37 37 VAL H H 37 8.037 8.037 8.302 -0.265 18478 616 1 2 . 1 1 38 38 LYS N N 38 125.676 125.676 119.096 6.580 18478 617 1 2 . 1 1 38 38 LYS C C 38 173.865 173.865 175.472 -1.607 18478 618 1 2 . 1 1 38 38 LYS CA C 38 54.278 54.278 56.674 -2.396 18478 619 1 2 . 1 1 38 38 LYS CB C 38 31.740 31.740 33.558 -1.818 18478 620 1 2 . 1 1 38 38 LYS H H 38 8.292 8.292 8.196 0.096 18478 621 1 2 . 1 1 40 40 PRO HA H 40 4.387 4.387 5.258 -0.871 18478 622 1 2 . 1 1 40 40 PRO C C 40 175.535 175.535 175.365 0.170 18478 623 1 2 . 1 1 40 40 PRO CA C 40 62.330 62.330 59.249 3.081 18478 624 1 2 . 1 1 40 40 PRO CB C 40 32.086 32.086 32.292 -0.206 18478 625 1 2 . 1 1 41 41 THR HA H 41 4.027 4.027 4.538 -0.511 18478 626 1 2 . 1 1 41 41 THR C C 41 176.795 176.795 173.176 3.619 18478 627 1 2 . 1 1 41 41 THR CA C 41 63.693 63.693 62.234 1.459 18478 628 1 2 . 1 1 41 41 THR CB C 41 69.370 69.370 69.115 0.255 18478 629 1 2 . 1 1 42 42 ASN N N 42 118.513 118.513 121.692 -3.179 18478 630 1 2 . 1 1 42 42 ASN HA H 42 4.530 4.530 5.314 -0.784 18478 631 1 2 . 1 1 42 42 ASN C C 42 177.230 177.230 174.983 2.247 18478 632 1 2 . 1 1 42 42 ASN CA C 42 56.373 56.373 50.410 5.963 18478 633 1 2 . 1 1 42 42 ASN CB C 42 37.618 37.618 38.329 -0.711 18478 634 1 2 . 1 1 42 42 ASN H H 42 8.752 8.752 8.713 0.039 18478 635 1 2 . 1 1 43 43 LYS N N 43 115.898 115.898 128.976 -13.078 18478 636 1 2 . 1 1 43 43 LYS HA H 43 4.710 4.710 4.721 -0.011 18478 637 1 2 . 1 1 43 43 LYS C C 43 177.032 177.032 175.672 1.360 18478 638 1 2 . 1 1 43 43 LYS CA C 43 54.957 54.957 54.856 0.101 18478 639 1 2 . 1 1 43 43 LYS CB C 43 36.600 36.600 32.961 3.639 18478 640 1 2 . 1 1 43 43 LYS H H 43 7.723 7.723 8.512 -0.789 18478 641 1 2 . 1 1 44 44 LEU N N 44 121.006 121.006 129.156 -8.150 18478 642 1 2 . 1 1 44 44 LEU HA H 44 5.000 5.000 4.255 0.745 18478 643 1 2 . 1 1 44 44 LEU CA C 44 51.842 51.842 55.234 -3.392 18478 644 1 2 . 1 1 44 44 LEU CB C 44 44.418 44.418 42.008 2.409 18478 645 1 2 . 1 1 44 44 LEU H H 44 9.063 9.063 8.701 0.362 18478 646 1 2 . 1 1 45 45 PRO HA H 45 4.392 4.392 4.565 -0.173 18478 647 1 2 . 1 1 45 45 PRO C C 45 177.051 177.051 178.750 -1.699 18478 648 1 2 . 1 1 45 45 PRO CA C 45 62.000 62.000 65.307 -3.307 18478 649 1 2 . 1 1 45 45 PRO CB C 45 30.737 30.737 32.642 -1.905 18478 650 1 2 . 1 1 46 46 ILE N N 46 125.996 125.996 124.333 1.663 18478 651 1 2 . 1 1 46 46 ILE HA H 46 4.564 4.564 3.821 0.743 18478 652 1 2 . 1 1 46 46 ILE C C 46 176.985 176.985 176.258 0.727 18478 653 1 2 . 1 1 46 46 ILE CA C 46 57.051 57.051 62.687 -5.636 18478 654 1 2 . 1 1 46 46 ILE H H 46 8.908 8.908 9.220 -0.312 18478 655 1 2 . 1 1 47 47 PHE N N 47 128.276 128.276 118.317 9.959 18478 656 1 2 . 1 1 47 47 PHE HA H 47 4.827 4.827 4.045 0.782 18478 657 1 2 . 1 1 47 47 PHE C C 47 177.835 177.835 175.972 1.863 18478 658 1 2 . 1 1 47 47 PHE CA C 47 56.099 56.099 57.908 -1.809 18478 659 1 2 . 1 1 47 47 PHE CB C 47 41.217 41.217 39.755 1.462 18478 660 1 2 . 1 1 47 47 PHE H H 47 8.739 8.739 7.244 1.495 18478 661 1 2 . 1 1 48 48 PHE N N 48 125.953 125.953 116.642 9.311 18478 662 1 2 . 1 1 48 48 PHE HA H 48 4.251 4.251 3.814 0.437 18478 663 1 2 . 1 1 48 48 PHE C C 48 175.869 175.869 173.983 1.886 18478 664 1 2 . 1 1 48 48 PHE CA C 48 56.744 56.744 58.951 -2.207 18478 665 1 2 . 1 1 48 48 PHE CB C 48 38.835 38.835 35.861 2.974 18478 666 1 2 . 1 1 48 48 PHE H H 48 8.545 8.545 7.710 0.835 18478 667 1 2 . 1 1 49 49 PHE N N 49 122.197 122.197 117.669 4.528 18478 668 1 2 . 1 1 49 49 PHE HA H 49 4.400 4.400 4.404 -0.004 18478 669 1 2 . 1 1 49 49 PHE C C 49 174.016 174.016 174.804 -0.788 18478 670 1 2 . 1 1 49 49 PHE CA C 49 59.916 59.916 57.416 2.500 18478 671 1 2 . 1 1 49 49 PHE CB C 49 39.799 39.799 40.344 -0.545 18478 672 1 2 . 1 1 49 49 PHE H H 49 8.619 8.619 7.436 1.183 18478 673 1 2 . 1 1 50 50 GLY N N 50 114.083 114.083 108.025 6.058 18478 674 1 2 . 1 1 50 50 GLY C C 50 175.636 175.636 173.369 2.267 18478 675 1 2 . 1 1 50 50 GLY CA C 50 46.718 46.718 44.010 2.708 18478 676 1 2 . 1 1 50 50 GLY H H 50 10.329 10.329 8.105 2.224 18478 677 1 2 . 1 1 51 51 THR N N 51 111.210 111.210 119.925 -8.715 18478 678 1 2 . 1 1 51 51 THR HA H 51 3.980 3.980 4.577 -0.597 18478 679 1 2 . 1 1 51 51 THR C C 51 175.588 175.588 171.782 3.806 18478 680 1 2 . 1 1 51 51 THR CA C 51 62.223 62.223 61.281 0.942 18478 681 1 2 . 1 1 51 51 THR CB C 51 68.346 68.346 72.255 -3.909 18478 682 1 2 . 1 1 51 51 THR H H 51 7.882 7.882 8.471 -0.589 18478 683 1 2 . 1 1 52 52 HIS N N 52 115.544 115.544 119.943 -4.399 18478 684 1 2 . 1 1 52 52 HIS HA H 52 3.712 3.712 5.483 -1.771 18478 685 1 2 . 1 1 52 52 HIS C C 52 177.717 177.717 175.315 2.402 18478 686 1 2 . 1 1 52 52 HIS CA C 52 54.860 54.860 54.402 0.458 18478 687 1 2 . 1 1 52 52 HIS CB C 52 26.388 26.388 30.500 -4.112 18478 688 1 2 . 1 1 52 52 HIS H H 52 7.791 7.791 8.587 -0.796 18478 689 1 2 . 1 1 53 53 GLU N N 53 117.517 117.517 123.175 -5.658 18478 690 1 2 . 1 1 53 53 GLU HA H 53 4.298 4.298 4.728 -0.430 18478 691 1 2 . 1 1 53 53 GLU C C 53 176.958 176.958 176.592 0.366 18478 692 1 2 . 1 1 53 53 GLU CA C 53 55.403 55.403 55.426 -0.023 18478 693 1 2 . 1 1 53 53 GLU CB C 53 31.588 31.588 33.107 -1.519 18478 694 1 2 . 1 1 53 53 GLU H H 53 6.795 6.795 8.464 -1.669 18478 695 1 2 . 1 1 54 54 THR N N 54 111.182 111.182 117.252 -6.070 18478 696 1 2 . 1 1 54 54 THR HA H 54 5.648 5.648 4.350 1.298 18478 697 1 2 . 1 1 54 54 THR C C 54 177.234 177.234 174.055 3.179 18478 698 1 2 . 1 1 54 54 THR CA C 54 59.894 59.894 61.571 -1.677 18478 699 1 2 . 1 1 54 54 THR H H 54 8.139 8.139 8.840 -0.701 18478 700 1 2 . 1 1 55 55 ALA HA H 55 4.403 4.403 4.149 0.254 18478 701 1 2 . 1 1 55 55 ALA C C 55 176.601 176.601 178.059 -1.458 18478 702 1 2 . 1 1 55 55 ALA CA C 55 51.079 51.079 53.257 -2.178 18478 703 1 2 . 1 1 55 55 ALA CB C 55 23.285 23.285 19.156 4.129 18478 704 1 2 . 1 1 56 56 PHE N N 56 118.058 118.058 113.736 4.322 18478 705 1 2 . 1 1 56 56 PHE HA H 56 5.678 5.678 4.577 1.101 18478 706 1 2 . 1 1 56 56 PHE C C 56 175.962 175.962 175.080 0.882 18478 707 1 2 . 1 1 56 56 PHE CA C 56 56.008 56.008 59.107 -3.099 18478 708 1 2 . 1 1 56 56 PHE CB C 56 39.995 39.995 37.649 2.346 18478 709 1 2 . 1 1 56 56 PHE H H 56 8.523 8.523 8.303 0.220 18478 710 1 2 . 1 1 57 57 LEU N N 57 123.344 123.344 120.559 2.785 18478 711 1 2 . 1 1 57 57 LEU HA H 57 4.929 4.929 4.727 0.202 18478 712 1 2 . 1 1 57 57 LEU C C 57 175.584 175.584 174.900 0.684 18478 713 1 2 . 1 1 57 57 LEU CA C 57 53.463 53.463 54.995 -1.532 18478 714 1 2 . 1 1 57 57 LEU CB C 57 46.545 46.545 43.805 2.740 18478 715 1 2 . 1 1 57 57 LEU H H 57 8.579 8.579 7.612 0.967 18478 716 1 2 . 1 1 58 58 GLY N N 58 108.499 108.499 107.459 1.040 18478 717 1 2 . 1 1 58 58 GLY CA C 58 43.755 43.755 44.326 -0.571 18478 718 1 2 . 1 1 58 58 GLY H H 58 9.318 9.318 7.282 2.036 18478 719 1 2 . 1 1 59 59 PRO HA H 59 4.048 4.048 4.958 -0.910 18478 720 1 2 . 1 1 59 59 PRO C C 59 173.763 173.763 174.770 -1.007 18478 721 1 2 . 1 1 59 59 PRO CA C 59 64.770 64.770 60.329 4.441 18478 722 1 2 . 1 1 59 59 PRO CB C 59 31.889 31.889 35.556 -3.667 18478 723 1 2 . 1 1 60 60 LYS HA H 60 4.191 4.191 4.593 -0.402 18478 724 1 2 . 1 1 60 60 LYS C C 60 174.842 174.842 176.571 -1.729 18478 725 1 2 . 1 1 60 60 LYS CA C 60 57.875 57.875 56.099 1.776 18478 726 1 2 . 1 1 60 60 LYS CB C 60 31.576 31.576 32.734 -1.158 18478 727 1 2 . 1 1 61 61 ASP N N 61 117.768 117.768 122.871 -5.103 18478 728 1 2 . 1 1 61 61 ASP HA H 61 4.973 4.973 4.308 0.665 18478 729 1 2 . 1 1 61 61 ASP C C 61 178.178 178.178 176.965 1.213 18478 730 1 2 . 1 1 61 61 ASP CA C 61 54.687 54.687 56.206 -1.518 18478 731 1 2 . 1 1 61 61 ASP CB C 61 43.555 43.555 39.332 4.223 18478 732 1 2 . 1 1 61 61 ASP H H 61 7.722 7.722 8.854 -1.132 18478 733 1 2 . 1 1 62 62 ILE N N 62 114.244 114.244 119.597 -5.353 18478 734 1 2 . 1 1 62 62 ILE HA H 62 4.891 4.891 3.414 1.477 18478 735 1 2 . 1 1 62 62 ILE C C 62 178.027 178.027 177.352 0.675 18478 736 1 2 . 1 1 62 62 ILE CA C 62 59.994 59.994 63.556 -3.562 18478 737 1 2 . 1 1 62 62 ILE CB C 62 40.652 40.652 36.942 3.710 18478 738 1 2 . 1 1 62 62 ILE H H 62 6.784 6.784 7.676 -0.892 18478 739 1 2 . 1 1 63 63 PHE N N 63 119.819 119.819 120.443 -0.624 18478 740 1 2 . 1 1 63 63 PHE HA H 63 5.214 5.214 4.251 0.963 18478 741 1 2 . 1 1 63 63 PHE CA C 63 54.735 54.735 59.938 -5.202 18478 742 1 2 . 1 1 63 63 PHE CB C 63 42.122 42.122 38.545 3.577 18478 743 1 2 . 1 1 63 63 PHE H H 63 8.734 8.734 7.749 0.985 18478 744 1 2 . 1 1 64 64 PRO HA H 64 4.771 4.771 4.410 0.361 18478 745 1 2 . 1 1 64 64 PRO C C 64 174.036 174.036 178.168 -4.132 18478 746 1 2 . 1 1 64 64 PRO CA C 64 64.474 64.474 64.248 0.226 18478 747 1 2 . 1 1 64 64 PRO CB C 64 32.662 32.662 33.612 -0.950 18478 748 1 2 . 1 1 65 65 TYR N N 65 124.335 124.335 122.041 2.294 18478 749 1 2 . 1 1 65 65 TYR HA H 65 4.530 4.530 4.289 0.241 18478 750 1 2 . 1 1 65 65 TYR C C 65 173.944 173.944 177.591 -3.647 18478 751 1 2 . 1 1 65 65 TYR CA C 65 61.205 61.205 61.270 -0.065 18478 752 1 2 . 1 1 65 65 TYR CB C 65 38.844 38.844 38.373 0.471 18478 753 1 2 . 1 1 65 65 TYR H H 65 8.359 8.359 7.922 0.437 18478 754 1 2 . 1 1 66 66 SER N N 66 114.836 114.836 112.373 2.463 18478 755 1 2 . 1 1 66 66 SER HA H 66 3.505 3.505 4.391 -0.886 18478 756 1 2 . 1 1 66 66 SER C C 66 173.697 173.697 175.556 -1.859 18478 757 1 2 . 1 1 66 66 SER CA C 66 63.078 63.078 59.823 3.255 18478 758 1 2 . 1 1 66 66 SER CB C 66 62.223 62.223 62.587 -0.364 18478 759 1 2 . 1 1 66 66 SER H H 66 8.974 8.974 7.700 1.274 18478 760 1 2 . 1 1 67 67 GLU N N 67 118.013 118.013 118.530 -0.517 18478 761 1 2 . 1 1 67 67 GLU HA H 67 4.210 4.210 4.155 0.055 18478 762 1 2 . 1 1 67 67 GLU C C 67 174.961 174.961 177.503 -2.542 18478 763 1 2 . 1 1 67 67 GLU CA C 67 58.330 58.330 57.935 0.395 18478 764 1 2 . 1 1 67 67 GLU CB C 67 30.205 30.205 30.808 -0.603 18478 765 1 2 . 1 1 67 67 GLU H H 67 8.817 8.817 7.831 0.986 18478 766 1 2 . 1 1 68 68 ASN N N 68 113.942 113.942 110.778 3.164 18478 767 1 2 . 1 1 68 68 ASN HA H 68 5.015 5.015 5.070 -0.055 18478 768 1 2 . 1 1 68 68 ASN C C 68 176.626 176.626 176.241 0.385 18478 769 1 2 . 1 1 68 68 ASN CA C 68 53.768 53.768 51.859 1.909 18478 770 1 2 . 1 1 68 68 ASN CB C 68 41.948 41.948 39.164 2.784 18478 771 1 2 . 1 1 68 68 ASN H H 68 7.448 7.448 7.847 -0.399 18478 772 1 2 . 1 1 69 69 LYS N N 69 124.584 124.584 121.545 3.039 18478 773 1 2 . 1 1 69 69 LYS HA H 69 3.794 3.794 3.948 -0.154 18478 774 1 2 . 1 1 69 69 LYS C C 69 173.330 173.330 175.265 -1.935 18478 775 1 2 . 1 1 69 69 LYS CA C 69 61.225 61.225 57.159 4.066 18478 776 1 2 . 1 1 69 69 LYS H H 69 7.592 7.592 8.499 -0.907 18478 777 1 2 . 1 1 70 70 GLU N N 70 118.408 118.408 117.726 0.682 18478 778 1 2 . 1 1 70 70 GLU HA H 70 4.005 4.005 4.753 -0.748 18478 779 1 2 . 1 1 70 70 GLU C C 70 174.588 174.588 173.449 1.139 18478 780 1 2 . 1 1 70 70 GLU CA C 70 58.695 58.695 52.988 5.707 18478 781 1 2 . 1 1 70 70 GLU CB C 70 28.928 28.928 31.254 -2.326 18478 782 1 2 . 1 1 70 70 GLU H H 70 8.478 8.478 8.192 0.286 18478 783 1 2 . 1 1 71 71 LYS HA H 71 3.847 3.847 4.417 -0.570 18478 784 1 2 . 1 1 71 71 LYS C C 71 173.420 173.420 175.775 -2.355 18478 785 1 2 . 1 1 71 71 LYS CA C 71 58.718 58.718 55.911 2.807 18478 786 1 2 . 1 1 71 71 LYS CB C 71 32.964 32.964 33.909 -0.945 18478 787 1 2 . 1 1 72 72 TYR N N 72 112.358 112.358 122.371 -10.013 18478 788 1 2 . 1 1 72 72 TYR HA H 72 4.790 4.790 4.303 0.487 18478 789 1 2 . 1 1 72 72 TYR C C 72 174.442 174.442 175.944 -1.502 18478 790 1 2 . 1 1 72 72 TYR CA C 72 55.287 55.287 59.222 -3.935 18478 791 1 2 . 1 1 72 72 TYR CB C 72 37.244 37.244 38.593 -1.349 18478 792 1 2 . 1 1 72 72 TYR H H 72 7.341 7.341 8.522 -1.181 18478 793 1 2 . 1 1 73 73 GLY N N 73 110.612 110.612 108.200 2.412 18478 794 1 2 . 1 1 73 73 GLY C C 73 177.982 177.982 173.807 4.175 18478 795 1 2 . 1 1 73 73 GLY CA C 73 46.623 46.623 44.420 2.203 18478 796 1 2 . 1 1 73 73 GLY H H 73 8.076 8.076 8.321 -0.245 18478 797 1 2 . 1 1 74 74 LYS N N 74 121.009 121.009 120.697 0.312 18478 798 1 2 . 1 1 74 74 LYS CA C 74 53.465 53.465 53.984 -0.519 18478 799 1 2 . 1 1 74 74 LYS CB C 74 32.440 32.440 33.591 -1.151 18478 800 1 2 . 1 1 74 74 LYS H H 74 7.411 7.411 7.884 -0.473 18478 801 1 2 . 1 1 75 75 PRO HA H 75 4.452 4.452 4.378 0.074 18478 802 1 2 . 1 1 75 75 PRO C C 75 174.959 174.959 177.709 -2.750 18478 803 1 2 . 1 1 75 75 PRO CA C 75 62.861 62.861 64.125 -1.264 18478 804 1 2 . 1 1 75 75 PRO CB C 75 32.407 32.407 31.453 0.954 18478 805 1 2 . 1 1 76 76 ASN N N 76 121.045 121.045 119.160 1.885 18478 806 1 2 . 1 1 76 76 ASN HA H 76 4.445 4.445 4.394 0.051 18478 807 1 2 . 1 1 76 76 ASN C C 76 174.145 174.145 174.584 -0.439 18478 808 1 2 . 1 1 76 76 ASN CA C 76 55.701 55.701 52.792 2.909 18478 809 1 2 . 1 1 76 76 ASN H H 76 8.474 8.474 9.013 -0.539 18478 810 1 2 . 1 1 77 77 LYS N N 77 111.466 111.466 120.652 -9.186 18478 811 1 2 . 1 1 77 77 LYS HA H 77 4.369 4.369 4.213 0.156 18478 812 1 2 . 1 1 77 77 LYS C C 77 173.881 173.881 176.211 -2.330 18478 813 1 2 . 1 1 77 77 LYS CA C 77 55.995 55.995 56.331 -0.336 18478 814 1 2 . 1 1 77 77 LYS CB C 77 32.538 32.538 32.400 0.138 18478 815 1 2 . 1 1 77 77 LYS H H 77 8.543 8.543 7.917 0.626 18478 816 1 2 . 1 1 78 78 ARG N N 78 122.233 122.233 121.366 0.867 18478 817 1 2 . 1 1 78 78 ARG HA H 78 4.286 4.286 4.013 0.273 18478 818 1 2 . 1 1 78 78 ARG C C 78 173.652 173.652 174.727 -1.075 18478 819 1 2 . 1 1 78 78 ARG CA C 78 55.780 55.780 57.437 -1.657 18478 820 1 2 . 1 1 78 78 ARG CB C 78 29.554 29.554 29.381 0.173 18478 821 1 2 . 1 1 78 78 ARG H H 78 8.864 8.864 8.641 0.223 18478 822 1 2 . 1 1 79 79 LYS N N 79 128.197 128.197 119.319 8.878 18478 823 1 2 . 1 1 79 79 LYS HA H 79 4.221 4.221 4.469 -0.248 18478 824 1 2 . 1 1 79 79 LYS C C 79 174.336 174.336 175.779 -1.443 18478 825 1 2 . 1 1 79 79 LYS CA C 79 58.986 58.986 55.854 3.132 18478 826 1 2 . 1 1 79 79 LYS CB C 79 32.072 32.072 33.134 -1.062 18478 827 1 2 . 1 1 79 79 LYS H H 79 8.927 8.927 7.878 1.049 18478 828 1 2 . 1 1 80 80 GLY N N 80 114.730 114.730 111.580 3.150 18478 829 1 2 . 1 1 80 80 GLY C C 80 176.536 176.536 174.690 1.846 18478 830 1 2 . 1 1 80 80 GLY CA C 80 45.992 45.992 45.642 0.350 18478 831 1 2 . 1 1 80 80 GLY H H 80 8.943 8.943 8.515 0.428 18478 832 1 2 . 1 1 81 81 PHE N N 81 123.770 123.770 118.307 5.463 18478 833 1 2 . 1 1 81 81 PHE HA H 81 3.336 3.336 4.336 -1.000 18478 834 1 2 . 1 1 81 81 PHE C C 81 174.037 174.037 176.336 -2.299 18478 835 1 2 . 1 1 81 81 PHE CA C 81 63.094 63.094 59.127 3.967 18478 836 1 2 . 1 1 81 81 PHE CB C 81 39.823 39.823 38.654 1.169 18478 837 1 2 . 1 1 81 81 PHE H H 81 8.281 8.281 7.872 0.409 18478 838 1 2 . 1 1 82 82 ASN N N 82 119.812 119.812 116.591 3.221 18478 839 1 2 . 1 1 82 82 ASN HA H 82 4.458 4.458 4.330 0.128 18478 840 1 2 . 1 1 82 82 ASN C C 82 171.290 171.290 176.446 -5.156 18478 841 1 2 . 1 1 82 82 ASN CA C 82 56.060 56.060 55.939 0.121 18478 842 1 2 . 1 1 82 82 ASN CB C 82 36.390 36.390 38.495 -2.105 18478 843 1 2 . 1 1 82 82 ASN H H 82 9.145 9.145 8.435 0.710 18478 844 1 2 . 1 1 83 83 GLU N N 83 124.411 124.411 118.880 5.531 18478 845 1 2 . 1 1 83 83 GLU HA H 83 4.186 4.186 4.069 0.117 18478 846 1 2 . 1 1 83 83 GLU C C 83 172.222 172.222 178.747 -6.525 18478 847 1 2 . 1 1 83 83 GLU CA C 83 60.922 60.922 59.244 1.678 18478 848 1 2 . 1 1 83 83 GLU CB C 83 28.132 28.132 29.789 -1.657 18478 849 1 2 . 1 1 83 83 GLU H H 83 9.560 9.560 7.651 1.909 18478 850 1 2 . 1 1 84 84 GLY N N 84 111.388 111.388 107.006 4.382 18478 851 1 2 . 1 1 84 84 GLY C C 84 176.445 176.445 174.316 2.129 18478 852 1 2 . 1 1 84 84 GLY CA C 84 46.727 46.727 46.726 0.001 18478 853 1 2 . 1 1 84 84 GLY H H 84 8.364 8.364 7.315 1.049 18478 854 1 2 . 1 1 85 85 LEU N N 85 121.153 121.153 120.681 0.472 18478 855 1 2 . 1 1 85 85 LEU HA H 85 4.236 4.236 4.257 -0.021 18478 856 1 2 . 1 1 85 85 LEU C C 85 172.285 172.285 178.178 -5.893 18478 857 1 2 . 1 1 85 85 LEU CA C 85 56.795 56.795 56.736 0.059 18478 858 1 2 . 1 1 85 85 LEU CB C 85 41.113 41.113 42.759 -1.646 18478 859 1 2 . 1 1 85 85 LEU H H 85 8.294 8.294 7.261 1.033 18478 860 1 2 . 1 1 86 86 TRP N N 86 118.898 118.898 119.188 -0.290 18478 861 1 2 . 1 1 86 86 TRP HA H 86 4.161 4.161 4.238 -0.077 18478 862 1 2 . 1 1 86 86 TRP C C 86 171.741 171.741 176.312 -4.571 18478 863 1 2 . 1 1 86 86 TRP CA C 86 62.153 62.153 58.516 3.638 18478 864 1 2 . 1 1 86 86 TRP CB C 86 28.424 28.424 29.541 -1.117 18478 865 1 2 . 1 1 86 86 TRP H H 86 7.783 7.783 7.515 0.268 18478 866 1 2 . 1 1 87 87 GLU N N 87 120.718 120.718 119.216 1.502 18478 867 1 2 . 1 1 87 87 GLU HA H 87 3.416 3.416 4.730 -1.314 18478 868 1 2 . 1 1 87 87 GLU C C 87 172.957 172.957 175.060 -2.103 18478 869 1 2 . 1 1 87 87 GLU CA C 87 60.122 60.122 53.231 6.891 18478 870 1 2 . 1 1 87 87 GLU CB C 87 31.021 31.021 30.308 0.713 18478 871 1 2 . 1 1 87 87 GLU H H 87 8.779 8.779 7.602 1.177 18478 872 1 2 . 1 1 88 88 ILE HA H 88 2.478 2.478 4.225 -1.747 18478 873 1 2 . 1 1 88 88 ILE C C 88 177.873 177.873 177.391 0.482 18478 874 1 2 . 1 1 88 88 ILE CA C 88 65.248 65.248 62.365 2.883 18478 875 1 2 . 1 1 88 88 ILE CB C 88 37.327 37.327 38.492 -1.165 18478 876 1 2 . 1 1 89 89 ASP N N 89 114.411 114.411 119.200 -4.789 18478 877 1 2 . 1 1 89 89 ASP HA H 89 4.589 4.589 4.515 0.074 18478 878 1 2 . 1 1 89 89 ASP C C 89 174.207 174.207 178.005 -3.798 18478 879 1 2 . 1 1 89 89 ASP CA C 89 54.740 54.740 56.674 -1.934 18478 880 1 2 . 1 1 89 89 ASP CB C 89 42.473 42.473 40.511 1.962 18478 881 1 2 . 1 1 89 89 ASP H H 89 5.911 5.911 7.888 -1.977 18478 882 1 2 . 1 1 90 90 ASN N N 90 114.358 114.358 113.780 0.578 18478 883 1 2 . 1 1 90 90 ASN HA H 90 4.420 4.420 4.444 -0.024 18478 884 1 2 . 1 1 90 90 ASN C C 90 176.991 176.991 177.026 -0.035 18478 885 1 2 . 1 1 90 90 ASN CA C 90 54.855 54.855 56.398 -1.543 18478 886 1 2 . 1 1 90 90 ASN CB C 90 40.582 40.582 38.175 2.406 18478 887 1 2 . 1 1 90 90 ASN H H 90 7.480 7.480 7.802 -0.322 18478 888 1 2 . 1 1 91 91 ASN N N 91 119.185 119.185 115.662 3.523 18478 889 1 2 . 1 1 91 91 ASN HA H 91 5.006 5.006 5.225 -0.219 18478 890 1 2 . 1 1 91 91 ASN CA C 91 51.624 51.624 54.587 -2.963 18478 891 1 2 . 1 1 91 91 ASN CB C 91 38.752 38.752 38.640 0.112 18478 892 1 2 . 1 1 91 91 ASN H H 91 9.238 9.238 7.894 1.344 18478 893 1 2 . 1 1 92 92 PRO HA H 92 4.296 4.296 4.308 -0.012 18478 894 1 2 . 1 1 92 92 PRO C C 92 173.690 173.690 176.009 -2.319 18478 895 1 2 . 1 1 92 92 PRO CA C 92 64.714 64.714 61.980 2.734 18478 896 1 2 . 1 1 92 92 PRO CB C 92 31.781 31.781 33.023 -1.242 18478 897 1 3 . 1 1 3 3 GLY C C 3 177.088 177.088 172.101 4.987 18478 898 1 3 . 1 1 3 3 GLY CA C 3 45.330 45.330 43.705 1.625 18478 899 1 3 . 1 1 4 4 SER N N 4 115.847 115.847 113.891 1.956 18478 900 1 3 . 1 1 4 4 SER HA H 4 4.480 4.480 4.669 -0.189 18478 901 1 3 . 1 1 4 4 SER C C 4 177.991 177.991 172.517 5.474 18478 902 1 3 . 1 1 4 4 SER CA C 4 58.742 58.742 58.367 0.375 18478 903 1 3 . 1 1 4 4 SER CB C 4 63.820 63.820 64.618 -0.798 18478 904 1 3 . 1 1 4 4 SER H H 4 8.207 8.207 7.672 0.535 18478 905 1 3 . 1 1 5 5 MET N N 5 125.867 125.867 122.301 3.566 18478 906 1 3 . 1 1 5 5 MET HA H 5 4.580 4.580 4.498 0.082 18478 907 1 3 . 1 1 5 5 MET C C 5 174.825 174.825 176.469 -1.644 18478 908 1 3 . 1 1 5 5 MET CA C 5 54.733 54.733 55.350 -0.617 18478 909 1 3 . 1 1 5 5 MET CB C 5 33.527 33.527 34.769 -1.242 18478 910 1 3 . 1 1 5 5 MET H H 5 8.148 8.148 8.617 -0.469 18478 911 1 3 . 1 1 6 6 THR N N 6 115.828 115.828 114.762 1.066 18478 912 1 3 . 1 1 6 6 THR HA H 6 3.903 3.903 4.377 -0.474 18478 913 1 3 . 1 1 6 6 THR C C 6 176.930 176.930 172.976 3.954 18478 914 1 3 . 1 1 6 6 THR CA C 6 63.034 63.034 61.460 1.574 18478 915 1 3 . 1 1 6 6 THR CB C 6 69.308 69.308 68.471 0.837 18478 916 1 3 . 1 1 6 6 THR H H 6 8.408 8.408 8.413 -0.005 18478 917 1 3 . 1 1 7 7 ARG HA H 7 4.276 4.276 4.247 0.029 18478 918 1 3 . 1 1 7 7 ARG C C 7 176.546 176.546 176.226 0.320 18478 919 1 3 . 1 1 7 7 ARG CA C 7 55.813 55.813 56.426 -0.613 18478 920 1 3 . 1 1 7 7 ARG CB C 7 30.556 30.556 30.667 -0.111 18478 921 1 3 . 1 1 8 8 ASP N N 8 121.762 121.762 125.419 -3.657 18478 922 1 3 . 1 1 8 8 ASP HA H 8 4.537 4.537 4.169 0.368 18478 923 1 3 . 1 1 8 8 ASP C C 8 177.750 177.750 175.042 2.708 18478 924 1 3 . 1 1 8 8 ASP CA C 8 54.117 54.117 54.855 -0.738 18478 925 1 3 . 1 1 8 8 ASP H H 8 8.066 8.066 8.437 -0.371 18478 926 1 3 . 1 1 9 9 PHE N N 9 119.991 119.991 119.203 0.788 18478 927 1 3 . 1 1 9 9 PHE HA H 9 4.734 4.734 5.061 -0.327 18478 928 1 3 . 1 1 9 9 PHE C C 9 176.838 176.838 175.287 1.551 18478 929 1 3 . 1 1 9 9 PHE CA C 9 58.303 58.303 57.449 0.854 18478 930 1 3 . 1 1 9 9 PHE CB C 9 41.594 41.594 41.186 0.408 18478 931 1 3 . 1 1 9 9 PHE H H 9 8.103 8.103 7.552 0.551 18478 932 1 3 . 1 1 10 10 LYS N N 10 122.957 122.957 123.705 -0.748 18478 933 1 3 . 1 1 10 10 LYS CA C 10 53.167 53.167 56.199 -3.032 18478 934 1 3 . 1 1 10 10 LYS CB C 10 33.495 33.495 32.215 1.280 18478 935 1 3 . 1 1 10 10 LYS H H 10 9.087 9.087 8.896 0.191 18478 936 1 3 . 1 1 11 11 PRO HA H 11 3.903 3.903 4.995 -1.092 18478 937 1 3 . 1 1 11 11 PRO C C 11 173.988 173.988 174.733 -0.745 18478 938 1 3 . 1 1 11 11 PRO CA C 11 63.874 63.874 61.405 2.469 18478 939 1 3 . 1 1 11 11 PRO CB C 11 31.623 31.623 34.844 -3.221 18478 940 1 3 . 1 1 12 12 GLY N N 12 115.413 115.413 110.709 4.704 18478 941 1 3 . 1 1 12 12 GLY C C 12 176.966 176.966 172.575 4.391 18478 942 1 3 . 1 1 12 12 GLY CA C 12 44.651 44.651 42.169 2.482 18478 943 1 3 . 1 1 12 12 GLY H H 12 9.667 9.667 8.903 0.764 18478 944 1 3 . 1 1 13 13 ASP N N 13 122.208 122.208 128.300 -6.092 18478 945 1 3 . 1 1 13 13 ASP HA H 13 4.601 4.601 4.772 -0.171 18478 946 1 3 . 1 1 13 13 ASP C C 13 176.244 176.244 174.286 1.958 18478 947 1 3 . 1 1 13 13 ASP CA C 13 55.870 55.870 52.219 3.651 18478 948 1 3 . 1 1 13 13 ASP CB C 13 40.794 40.794 43.011 -2.217 18478 949 1 3 . 1 1 13 13 ASP H H 13 8.303 8.303 8.667 -0.364 18478 950 1 3 . 1 1 14 14 LEU N N 14 121.306 121.306 127.208 -5.902 18478 951 1 3 . 1 1 14 14 LEU HA H 14 4.982 4.982 4.630 0.352 18478 952 1 3 . 1 1 14 14 LEU C C 14 173.461 173.461 176.480 -3.019 18478 953 1 3 . 1 1 14 14 LEU CA C 14 54.516 54.516 53.819 0.697 18478 954 1 3 . 1 1 14 14 LEU CB C 14 40.999 40.999 42.314 -1.315 18478 955 1 3 . 1 1 14 14 LEU H H 14 8.618 8.618 7.658 0.960 18478 956 1 3 . 1 1 15 15 ILE N N 15 118.806 118.806 125.322 -6.516 18478 957 1 3 . 1 1 15 15 ILE HA H 15 5.356 5.356 4.316 1.040 18478 958 1 3 . 1 1 15 15 ILE C C 15 175.982 175.982 176.732 -0.750 18478 959 1 3 . 1 1 15 15 ILE CA C 15 60.481 60.481 60.904 -0.423 18478 960 1 3 . 1 1 15 15 ILE CB C 15 44.142 44.142 39.874 4.268 18478 961 1 3 . 1 1 15 15 ILE H H 15 8.864 8.864 8.381 0.483 18478 962 1 3 . 1 1 16 16 PHE N N 16 112.472 112.472 123.310 -10.838 18478 963 1 3 . 1 1 16 16 PHE HA H 16 5.306 5.306 4.315 0.991 18478 964 1 3 . 1 1 16 16 PHE C C 16 176.239 176.239 176.311 -0.072 18478 965 1 3 . 1 1 16 16 PHE CA C 16 58.603 58.603 59.107 -0.504 18478 966 1 3 . 1 1 16 16 PHE CB C 16 43.305 43.305 38.251 5.054 18478 967 1 3 . 1 1 16 16 PHE H H 16 9.411 9.411 8.599 0.812 18478 968 1 3 . 1 1 17 17 ALA N N 17 123.889 123.889 126.252 -2.363 18478 969 1 3 . 1 1 17 17 ALA HA H 17 5.348 5.348 3.655 1.693 18478 970 1 3 . 1 1 17 17 ALA C C 17 174.426 174.426 176.688 -2.262 18478 971 1 3 . 1 1 17 17 ALA CA C 17 50.062 50.062 51.696 -1.634 18478 972 1 3 . 1 1 17 17 ALA H H 17 9.658 9.658 8.614 1.044 18478 973 1 3 . 1 1 18 18 LYS N N 18 127.760 127.760 121.629 6.131 18478 974 1 3 . 1 1 18 18 LYS HA H 18 4.697 4.697 4.620 0.077 18478 975 1 3 . 1 1 18 18 LYS C C 18 178.554 178.554 174.670 3.884 18478 976 1 3 . 1 1 18 18 LYS CA C 18 53.893 53.893 52.296 1.597 18478 977 1 3 . 1 1 18 18 LYS CB C 18 35.291 35.291 32.572 2.719 18478 978 1 3 . 1 1 18 18 LYS H H 18 9.421 9.421 7.344 2.077 18478 979 1 3 . 1 1 19 19 MET HA H 19 4.656 4.656 4.567 0.089 18478 980 1 3 . 1 1 19 19 MET C C 19 175.741 175.741 174.663 1.078 18478 981 1 3 . 1 1 19 19 MET CA C 19 53.916 53.916 54.734 -0.818 18478 982 1 3 . 1 1 19 19 MET CB C 19 35.799 35.799 33.475 2.324 18478 983 1 3 . 1 1 20 20 LYS N N 20 124.062 124.062 117.268 6.794 18478 984 1 3 . 1 1 20 20 LYS CA C 20 58.585 58.585 56.107 2.478 18478 985 1 3 . 1 1 20 20 LYS CB C 20 31.978 31.978 32.772 -0.794 18478 986 1 3 . 1 1 20 20 LYS H H 20 8.645 8.645 8.146 0.499 18478 987 1 3 . 1 1 21 21 GLY C C 21 176.205 176.205 172.545 3.660 18478 988 1 3 . 1 1 21 21 GLY CA C 21 45.142 45.142 42.181 2.961 18478 989 1 3 . 1 1 22 22 TYR HA H 22 4.573 4.573 4.952 -0.379 18478 990 1 3 . 1 1 22 22 TYR CA C 22 55.748 55.748 58.015 -2.267 18478 991 1 3 . 1 1 22 22 TYR CB C 22 41.331 41.331 38.014 3.317 18478 992 1 3 . 1 1 23 23 PRO HA H 23 4.759 4.759 5.143 -0.384 18478 993 1 3 . 1 1 23 23 PRO C C 23 174.587 174.587 175.313 -0.726 18478 994 1 3 . 1 1 23 23 PRO CA C 23 62.072 62.072 61.373 0.699 18478 995 1 3 . 1 1 23 23 PRO CB C 23 31.077 31.077 35.559 -4.482 18478 996 1 3 . 1 1 24 24 HIS N N 24 119.190 119.190 117.730 1.460 18478 997 1 3 . 1 1 24 24 HIS HA H 24 3.983 3.983 5.224 -1.241 18478 998 1 3 . 1 1 24 24 HIS C C 24 175.555 175.555 173.609 1.946 18478 999 1 3 . 1 1 24 24 HIS CA C 24 60.973 60.973 53.971 7.002 18478 1000 1 3 . 1 1 24 24 HIS CB C 24 30.689 30.689 33.361 -2.672 18478 1001 1 3 . 1 1 24 24 HIS H H 24 8.158 8.158 8.666 -0.508 18478 1002 1 3 . 1 1 25 25 TRP N N 25 127.435 127.435 127.808 -0.373 18478 1003 1 3 . 1 1 25 25 TRP HA H 25 3.760 3.760 5.019 -1.259 18478 1004 1 3 . 1 1 25 25 TRP CA C 25 55.890 55.890 58.665 -2.775 18478 1005 1 3 . 1 1 25 25 TRP CB C 25 32.879 32.879 29.805 3.074 18478 1006 1 3 . 1 1 25 25 TRP H H 25 9.211 9.211 8.850 0.361 18478 1007 1 3 . 1 1 26 26 PRO HA H 26 4.217 4.217 4.558 -0.341 18478 1008 1 3 . 1 1 26 26 PRO C C 26 176.279 176.279 175.753 0.526 18478 1009 1 3 . 1 1 26 26 PRO CA C 26 63.140 63.140 61.648 1.492 18478 1010 1 3 . 1 1 26 26 PRO CB C 26 32.171 32.171 34.331 -2.159 18478 1011 1 3 . 1 1 27 27 ALA N N 27 130.162 130.162 125.274 4.888 18478 1012 1 3 . 1 1 27 27 ALA HA H 27 4.981 4.981 4.273 0.708 18478 1013 1 3 . 1 1 27 27 ALA C C 27 177.227 177.227 177.334 -0.107 18478 1014 1 3 . 1 1 27 27 ALA CA C 27 52.574 52.574 51.549 1.025 18478 1015 1 3 . 1 1 27 27 ALA CB C 27 23.239 23.239 20.345 2.894 18478 1016 1 3 . 1 1 27 27 ALA H H 27 9.394 9.394 8.269 1.125 18478 1017 1 3 . 1 1 28 28 ARG N N 28 117.381 117.381 117.434 -0.053 18478 1018 1 3 . 1 1 28 28 ARG HA H 28 5.421 5.421 4.447 0.974 18478 1019 1 3 . 1 1 28 28 ARG C C 28 176.465 176.465 175.571 0.894 18478 1020 1 3 . 1 1 28 28 ARG CA C 28 53.662 53.662 53.842 -0.180 18478 1021 1 3 . 1 1 28 28 ARG CB C 28 35.058 35.058 28.755 6.303 18478 1022 1 3 . 1 1 28 28 ARG H H 28 8.806 8.806 8.411 0.395 18478 1023 1 3 . 1 1 29 29 VAL HA H 29 4.109 4.109 4.282 -0.173 18478 1024 1 3 . 1 1 29 29 VAL C C 29 175.996 175.996 174.671 1.325 18478 1025 1 3 . 1 1 29 29 VAL CA C 29 62.810 62.810 61.745 1.065 18478 1026 1 3 . 1 1 29 29 VAL CB C 29 31.108 31.108 32.718 -1.610 18478 1027 1 3 . 1 1 30 30 ASP N N 30 133.830 133.830 117.743 16.087 18478 1028 1 3 . 1 1 30 30 ASP HA H 30 5.198 5.198 4.626 0.572 18478 1029 1 3 . 1 1 30 30 ASP C C 30 176.207 176.207 176.768 -0.561 18478 1030 1 3 . 1 1 30 30 ASP CA C 30 53.007 53.007 53.638 -0.631 18478 1031 1 3 . 1 1 30 30 ASP CB C 30 44.130 44.130 40.369 3.761 18478 1032 1 3 . 1 1 30 30 ASP H H 30 8.892 8.892 8.373 0.519 18478 1033 1 3 . 1 1 31 31 GLU N N 31 115.905 115.905 122.335 -6.430 18478 1034 1 3 . 1 1 31 31 GLU HA H 31 4.409 4.409 4.009 0.400 18478 1035 1 3 . 1 1 31 31 GLU C C 31 175.192 175.192 176.334 -1.142 18478 1036 1 3 . 1 1 31 31 GLU CA C 31 55.389 55.389 56.118 -0.729 18478 1037 1 3 . 1 1 31 31 GLU H H 31 7.966 7.966 8.989 -1.023 18478 1038 1 3 . 1 1 32 32 VAL N N 32 122.794 122.794 117.365 5.429 18478 1039 1 3 . 1 1 32 32 VAL HA H 32 4.303 4.303 3.746 0.557 18478 1040 1 3 . 1 1 32 32 VAL CA C 32 60.408 60.408 62.889 -2.481 18478 1041 1 3 . 1 1 32 32 VAL CB C 32 32.333 32.333 30.916 1.417 18478 1042 1 3 . 1 1 32 32 VAL H H 32 8.702 8.702 8.170 0.532 18478 1043 1 3 . 1 1 33 33 PRO HA H 33 4.572 4.572 4.172 0.400 18478 1044 1 3 . 1 1 33 33 PRO C C 33 175.366 175.366 176.429 -1.063 18478 1045 1 3 . 1 1 33 33 PRO CA C 33 63.702 63.702 65.102 -1.400 18478 1046 1 3 . 1 1 33 33 PRO CB C 33 32.736 32.736 32.087 0.650 18478 1047 1 3 . 1 1 34 34 ASP N N 34 119.187 119.187 114.595 4.592 18478 1048 1 3 . 1 1 34 34 ASP HA H 34 4.679 4.679 4.857 -0.178 18478 1049 1 3 . 1 1 34 34 ASP C C 34 175.713 175.713 173.596 2.117 18478 1050 1 3 . 1 1 34 34 ASP CA C 34 53.013 53.013 52.453 0.560 18478 1051 1 3 . 1 1 34 34 ASP CB C 34 40.850 40.850 39.536 1.313 18478 1052 1 3 . 1 1 34 34 ASP H H 34 8.686 8.686 7.742 0.944 18478 1053 1 3 . 1 1 35 35 GLY C C 35 177.458 177.458 172.710 4.748 18478 1054 1 3 . 1 1 35 35 GLY CA C 35 45.507 45.507 43.831 1.675 18478 1055 1 3 . 1 1 36 36 ALA HA H 36 4.404 4.404 4.289 0.115 18478 1056 1 3 . 1 1 36 36 ALA CA C 36 52.010 52.010 51.714 0.296 18478 1057 1 3 . 1 1 36 36 ALA CB C 36 19.909 19.909 19.930 -0.021 18478 1058 1 3 . 1 1 37 37 VAL N N 37 119.594 119.594 125.163 -5.569 18478 1059 1 3 . 1 1 37 37 VAL HA H 37 3.932 3.932 4.108 -0.176 18478 1060 1 3 . 1 1 37 37 VAL C C 37 175.966 175.966 175.924 0.042 18478 1061 1 3 . 1 1 37 37 VAL CA C 37 62.810 62.810 64.515 -1.705 18478 1062 1 3 . 1 1 37 37 VAL CB C 37 32.267 32.267 32.342 -0.075 18478 1063 1 3 . 1 1 37 37 VAL H H 37 8.037 8.037 8.343 -0.306 18478 1064 1 3 . 1 1 38 38 LYS N N 38 125.676 125.676 120.887 4.789 18478 1065 1 3 . 1 1 38 38 LYS C C 38 173.865 173.865 174.442 -0.577 18478 1066 1 3 . 1 1 38 38 LYS CA C 38 54.278 54.278 56.729 -2.451 18478 1067 1 3 . 1 1 38 38 LYS CB C 38 31.740 31.740 34.102 -2.362 18478 1068 1 3 . 1 1 38 38 LYS H H 38 8.292 8.292 8.348 -0.056 18478 1069 1 3 . 1 1 40 40 PRO HA H 40 4.387 4.387 5.217 -0.830 18478 1070 1 3 . 1 1 40 40 PRO C C 40 175.535 175.535 175.122 0.413 18478 1071 1 3 . 1 1 40 40 PRO CA C 40 62.330 62.330 59.537 2.793 18478 1072 1 3 . 1 1 40 40 PRO CB C 40 32.086 32.086 31.608 0.478 18478 1073 1 3 . 1 1 41 41 THR HA H 41 4.027 4.027 4.522 -0.495 18478 1074 1 3 . 1 1 41 41 THR C C 41 176.795 176.795 173.277 3.518 18478 1075 1 3 . 1 1 41 41 THR CA C 41 63.693 63.693 62.019 1.674 18478 1076 1 3 . 1 1 41 41 THR CB C 41 69.370 69.370 69.047 0.323 18478 1077 1 3 . 1 1 42 42 ASN N N 42 118.513 118.513 121.169 -2.656 18478 1078 1 3 . 1 1 42 42 ASN HA H 42 4.530 4.530 4.977 -0.447 18478 1079 1 3 . 1 1 42 42 ASN C C 42 177.230 177.230 174.324 2.906 18478 1080 1 3 . 1 1 42 42 ASN CA C 42 56.373 56.373 50.029 6.344 18478 1081 1 3 . 1 1 42 42 ASN CB C 42 37.618 37.618 37.606 0.012 18478 1082 1 3 . 1 1 42 42 ASN H H 42 8.752 8.752 8.947 -0.195 18478 1083 1 3 . 1 1 43 43 LYS N N 43 115.898 115.898 128.451 -12.553 18478 1084 1 3 . 1 1 43 43 LYS HA H 43 4.710 4.710 4.375 0.335 18478 1085 1 3 . 1 1 43 43 LYS C C 43 177.032 177.032 175.875 1.157 18478 1086 1 3 . 1 1 43 43 LYS CA C 43 54.957 54.957 55.355 -0.398 18478 1087 1 3 . 1 1 43 43 LYS CB C 43 36.600 36.600 32.782 3.817 18478 1088 1 3 . 1 1 43 43 LYS H H 43 7.723 7.723 9.091 -1.368 18478 1089 1 3 . 1 1 44 44 LEU N N 44 121.006 121.006 128.420 -7.414 18478 1090 1 3 . 1 1 44 44 LEU HA H 44 5.000 5.000 4.406 0.594 18478 1091 1 3 . 1 1 44 44 LEU CA C 44 51.842 51.842 54.590 -2.748 18478 1092 1 3 . 1 1 44 44 LEU CB C 44 44.418 44.418 41.311 3.107 18478 1093 1 3 . 1 1 44 44 LEU H H 44 9.063 9.063 8.551 0.512 18478 1094 1 3 . 1 1 45 45 PRO HA H 45 4.392 4.392 4.415 -0.023 18478 1095 1 3 . 1 1 45 45 PRO C C 45 177.051 177.051 179.289 -2.238 18478 1096 1 3 . 1 1 45 45 PRO CA C 45 62.000 62.000 65.266 -3.266 18478 1097 1 3 . 1 1 45 45 PRO CB C 45 30.737 30.737 32.691 -1.954 18478 1098 1 3 . 1 1 46 46 ILE N N 46 125.996 125.996 123.722 2.274 18478 1099 1 3 . 1 1 46 46 ILE HA H 46 4.564 4.564 4.178 0.386 18478 1100 1 3 . 1 1 46 46 ILE C C 46 176.985 176.985 176.611 0.374 18478 1101 1 3 . 1 1 46 46 ILE CA C 46 57.051 57.051 63.076 -6.025 18478 1102 1 3 . 1 1 46 46 ILE H H 46 8.908 8.908 9.054 -0.146 18478 1103 1 3 . 1 1 47 47 PHE N N 47 128.276 128.276 119.588 8.688 18478 1104 1 3 . 1 1 47 47 PHE HA H 47 4.827 4.827 4.314 0.513 18478 1105 1 3 . 1 1 47 47 PHE C C 47 177.835 177.835 176.106 1.729 18478 1106 1 3 . 1 1 47 47 PHE CA C 47 56.099 56.099 58.460 -2.361 18478 1107 1 3 . 1 1 47 47 PHE CB C 47 41.217 41.217 40.344 0.873 18478 1108 1 3 . 1 1 47 47 PHE H H 47 8.739 8.739 7.787 0.952 18478 1109 1 3 . 1 1 48 48 PHE N N 48 125.953 125.953 119.712 6.241 18478 1110 1 3 . 1 1 48 48 PHE HA H 48 4.251 4.251 4.287 -0.036 18478 1111 1 3 . 1 1 48 48 PHE C C 48 175.869 175.869 174.557 1.312 18478 1112 1 3 . 1 1 48 48 PHE CA C 48 56.744 56.744 59.559 -2.815 18478 1113 1 3 . 1 1 48 48 PHE CB C 48 38.835 38.835 37.737 1.098 18478 1114 1 3 . 1 1 48 48 PHE H H 48 8.545 8.545 8.279 0.266 18478 1115 1 3 . 1 1 49 49 PHE N N 49 122.197 122.197 117.463 4.734 18478 1116 1 3 . 1 1 49 49 PHE HA H 49 4.400 4.400 4.527 -0.127 18478 1117 1 3 . 1 1 49 49 PHE C C 49 174.016 174.016 174.513 -0.497 18478 1118 1 3 . 1 1 49 49 PHE CA C 49 59.916 59.916 56.767 3.149 18478 1119 1 3 . 1 1 49 49 PHE CB C 49 39.799 39.799 41.129 -1.330 18478 1120 1 3 . 1 1 49 49 PHE H H 49 8.619 8.619 7.488 1.131 18478 1121 1 3 . 1 1 50 50 GLY N N 50 114.083 114.083 108.032 6.051 18478 1122 1 3 . 1 1 50 50 GLY C C 50 175.636 175.636 173.177 2.459 18478 1123 1 3 . 1 1 50 50 GLY CA C 50 46.718 46.718 43.779 2.939 18478 1124 1 3 . 1 1 50 50 GLY H H 50 10.329 10.329 8.125 2.204 18478 1125 1 3 . 1 1 51 51 THR N N 51 111.210 111.210 119.883 -8.673 18478 1126 1 3 . 1 1 51 51 THR HA H 51 3.980 3.980 4.562 -0.582 18478 1127 1 3 . 1 1 51 51 THR C C 51 175.588 175.588 171.509 4.079 18478 1128 1 3 . 1 1 51 51 THR CA C 51 62.223 62.223 60.228 1.995 18478 1129 1 3 . 1 1 51 51 THR CB C 51 68.346 68.346 72.532 -4.186 18478 1130 1 3 . 1 1 51 51 THR H H 51 7.882 7.882 8.285 -0.403 18478 1131 1 3 . 1 1 52 52 HIS N N 52 115.544 115.544 118.744 -3.200 18478 1132 1 3 . 1 1 52 52 HIS HA H 52 3.712 3.712 5.483 -1.771 18478 1133 1 3 . 1 1 52 52 HIS C C 52 177.717 177.717 175.081 2.636 18478 1134 1 3 . 1 1 52 52 HIS CA C 52 54.860 54.860 54.300 0.560 18478 1135 1 3 . 1 1 52 52 HIS CB C 52 26.388 26.388 30.427 -4.039 18478 1136 1 3 . 1 1 52 52 HIS H H 52 7.791 7.791 8.614 -0.823 18478 1137 1 3 . 1 1 53 53 GLU N N 53 117.517 117.517 123.238 -5.721 18478 1138 1 3 . 1 1 53 53 GLU HA H 53 4.298 4.298 4.785 -0.487 18478 1139 1 3 . 1 1 53 53 GLU C C 53 176.958 176.958 176.614 0.344 18478 1140 1 3 . 1 1 53 53 GLU CA C 53 55.403 55.403 55.062 0.341 18478 1141 1 3 . 1 1 53 53 GLU CB C 53 31.588 31.588 33.242 -1.654 18478 1142 1 3 . 1 1 53 53 GLU H H 53 6.795 6.795 8.439 -1.644 18478 1143 1 3 . 1 1 54 54 THR N N 54 111.182 111.182 116.620 -5.438 18478 1144 1 3 . 1 1 54 54 THR HA H 54 5.648 5.648 4.402 1.246 18478 1145 1 3 . 1 1 54 54 THR C C 54 177.234 177.234 174.330 2.904 18478 1146 1 3 . 1 1 54 54 THR CA C 54 59.894 59.894 61.079 -1.185 18478 1147 1 3 . 1 1 54 54 THR H H 54 8.139 8.139 8.697 -0.558 18478 1148 1 3 . 1 1 55 55 ALA HA H 55 4.403 4.403 4.226 0.177 18478 1149 1 3 . 1 1 55 55 ALA C C 55 176.601 176.601 178.212 -1.611 18478 1150 1 3 . 1 1 55 55 ALA CA C 55 51.079 51.079 53.165 -2.086 18478 1151 1 3 . 1 1 55 55 ALA CB C 55 23.285 23.285 19.074 4.211 18478 1152 1 3 . 1 1 56 56 PHE N N 56 118.058 118.058 113.948 4.110 18478 1153 1 3 . 1 1 56 56 PHE HA H 56 5.678 5.678 4.569 1.109 18478 1154 1 3 . 1 1 56 56 PHE C C 56 175.962 175.962 175.344 0.618 18478 1155 1 3 . 1 1 56 56 PHE CA C 56 56.008 56.008 59.415 -3.407 18478 1156 1 3 . 1 1 56 56 PHE CB C 56 39.995 39.995 37.676 2.319 18478 1157 1 3 . 1 1 56 56 PHE H H 56 8.523 8.523 8.288 0.235 18478 1158 1 3 . 1 1 57 57 LEU N N 57 123.344 123.344 120.372 2.972 18478 1159 1 3 . 1 1 57 57 LEU HA H 57 4.929 4.929 4.722 0.207 18478 1160 1 3 . 1 1 57 57 LEU C C 57 175.584 175.584 174.908 0.676 18478 1161 1 3 . 1 1 57 57 LEU CA C 57 53.463 53.463 54.884 -1.421 18478 1162 1 3 . 1 1 57 57 LEU CB C 57 46.545 46.545 44.064 2.481 18478 1163 1 3 . 1 1 57 57 LEU H H 57 8.579 8.579 7.682 0.897 18478 1164 1 3 . 1 1 58 58 GLY N N 58 108.499 108.499 107.580 0.919 18478 1165 1 3 . 1 1 58 58 GLY CA C 58 43.755 43.755 44.471 -0.716 18478 1166 1 3 . 1 1 58 58 GLY H H 58 9.318 9.318 7.402 1.916 18478 1167 1 3 . 1 1 59 59 PRO HA H 59 4.048 4.048 4.933 -0.885 18478 1168 1 3 . 1 1 59 59 PRO C C 59 173.763 173.763 174.693 -0.930 18478 1169 1 3 . 1 1 59 59 PRO CA C 59 64.770 64.770 60.459 4.311 18478 1170 1 3 . 1 1 59 59 PRO CB C 59 31.889 31.889 35.804 -3.915 18478 1171 1 3 . 1 1 60 60 LYS HA H 60 4.191 4.191 4.584 -0.393 18478 1172 1 3 . 1 1 60 60 LYS C C 60 174.842 174.842 176.608 -1.766 18478 1173 1 3 . 1 1 60 60 LYS CA C 60 57.875 57.875 56.089 1.786 18478 1174 1 3 . 1 1 60 60 LYS CB C 60 31.576 31.576 32.767 -1.191 18478 1175 1 3 . 1 1 61 61 ASP N N 61 117.768 117.768 123.114 -5.346 18478 1176 1 3 . 1 1 61 61 ASP HA H 61 4.973 4.973 4.339 0.634 18478 1177 1 3 . 1 1 61 61 ASP C C 61 178.178 178.178 177.221 0.957 18478 1178 1 3 . 1 1 61 61 ASP CA C 61 54.687 54.687 55.870 -1.183 18478 1179 1 3 . 1 1 61 61 ASP CB C 61 43.555 43.555 39.655 3.900 18478 1180 1 3 . 1 1 61 61 ASP H H 61 7.722 7.722 8.821 -1.099 18478 1181 1 3 . 1 1 62 62 ILE N N 62 114.244 114.244 120.971 -6.727 18478 1182 1 3 . 1 1 62 62 ILE HA H 62 4.891 4.891 3.405 1.486 18478 1183 1 3 . 1 1 62 62 ILE C C 62 178.027 178.027 177.377 0.650 18478 1184 1 3 . 1 1 62 62 ILE CA C 62 59.994 59.994 63.697 -3.703 18478 1185 1 3 . 1 1 62 62 ILE CB C 62 40.652 40.652 37.204 3.448 18478 1186 1 3 . 1 1 62 62 ILE H H 62 6.784 6.784 7.650 -0.866 18478 1187 1 3 . 1 1 63 63 PHE N N 63 119.819 119.819 119.542 0.277 18478 1188 1 3 . 1 1 63 63 PHE HA H 63 5.214 5.214 4.243 0.971 18478 1189 1 3 . 1 1 63 63 PHE CA C 63 54.735 54.735 60.009 -5.274 18478 1190 1 3 . 1 1 63 63 PHE CB C 63 42.122 42.122 38.924 3.198 18478 1191 1 3 . 1 1 63 63 PHE H H 63 8.734 8.734 7.681 1.053 18478 1192 1 3 . 1 1 64 64 PRO HA H 64 4.771 4.771 4.409 0.362 18478 1193 1 3 . 1 1 64 64 PRO C C 64 174.036 174.036 178.609 -4.573 18478 1194 1 3 . 1 1 64 64 PRO CA C 64 64.474 64.474 64.247 0.227 18478 1195 1 3 . 1 1 64 64 PRO CB C 64 32.662 32.662 33.358 -0.696 18478 1196 1 3 . 1 1 65 65 TYR N N 65 124.335 124.335 121.600 2.735 18478 1197 1 3 . 1 1 65 65 TYR HA H 65 4.530 4.530 4.335 0.195 18478 1198 1 3 . 1 1 65 65 TYR C C 65 173.944 173.944 177.326 -3.382 18478 1199 1 3 . 1 1 65 65 TYR CA C 65 61.205 61.205 61.151 0.055 18478 1200 1 3 . 1 1 65 65 TYR CB C 65 38.844 38.844 38.066 0.778 18478 1201 1 3 . 1 1 65 65 TYR H H 65 8.359 8.359 7.937 0.422 18478 1202 1 3 . 1 1 66 66 SER N N 66 114.836 114.836 112.050 2.786 18478 1203 1 3 . 1 1 66 66 SER HA H 66 3.505 3.505 4.377 -0.872 18478 1204 1 3 . 1 1 66 66 SER C C 66 173.697 173.697 175.498 -1.801 18478 1205 1 3 . 1 1 66 66 SER CA C 66 63.078 63.078 59.690 3.388 18478 1206 1 3 . 1 1 66 66 SER CB C 66 62.223 62.223 63.007 -0.784 18478 1207 1 3 . 1 1 66 66 SER H H 66 8.974 8.974 7.705 1.269 18478 1208 1 3 . 1 1 67 67 GLU N N 67 118.013 118.013 118.705 -0.692 18478 1209 1 3 . 1 1 67 67 GLU HA H 67 4.210 4.210 4.172 0.038 18478 1210 1 3 . 1 1 67 67 GLU C C 67 174.961 174.961 177.515 -2.554 18478 1211 1 3 . 1 1 67 67 GLU CA C 67 58.330 58.330 57.838 0.492 18478 1212 1 3 . 1 1 67 67 GLU CB C 67 30.205 30.205 30.848 -0.643 18478 1213 1 3 . 1 1 67 67 GLU H H 67 8.817 8.817 7.879 0.938 18478 1214 1 3 . 1 1 68 68 ASN N N 68 113.942 113.942 110.805 3.137 18478 1215 1 3 . 1 1 68 68 ASN HA H 68 5.015 5.015 5.088 -0.073 18478 1216 1 3 . 1 1 68 68 ASN C C 68 176.626 176.626 176.297 0.329 18478 1217 1 3 . 1 1 68 68 ASN CA C 68 53.768 53.768 51.938 1.830 18478 1218 1 3 . 1 1 68 68 ASN CB C 68 41.948 41.948 39.189 2.759 18478 1219 1 3 . 1 1 68 68 ASN H H 68 7.448 7.448 7.855 -0.407 18478 1220 1 3 . 1 1 69 69 LYS N N 69 124.584 124.584 121.440 3.144 18478 1221 1 3 . 1 1 69 69 LYS HA H 69 3.794 3.794 3.970 -0.176 18478 1222 1 3 . 1 1 69 69 LYS C C 69 173.330 173.330 175.284 -1.954 18478 1223 1 3 . 1 1 69 69 LYS CA C 69 61.225 61.225 57.166 4.059 18478 1224 1 3 . 1 1 69 69 LYS H H 69 7.592 7.592 8.535 -0.943 18478 1225 1 3 . 1 1 70 70 GLU N N 70 118.408 118.408 117.696 0.712 18478 1226 1 3 . 1 1 70 70 GLU HA H 70 4.005 4.005 4.773 -0.768 18478 1227 1 3 . 1 1 70 70 GLU C C 70 174.588 174.588 173.448 1.140 18478 1228 1 3 . 1 1 70 70 GLU CA C 70 58.695 58.695 52.963 5.732 18478 1229 1 3 . 1 1 70 70 GLU CB C 70 28.928 28.928 31.142 -2.215 18478 1230 1 3 . 1 1 70 70 GLU H H 70 8.478 8.478 8.211 0.267 18478 1231 1 3 . 1 1 71 71 LYS HA H 71 3.847 3.847 4.412 -0.565 18478 1232 1 3 . 1 1 71 71 LYS C C 71 173.420 173.420 175.395 -1.975 18478 1233 1 3 . 1 1 71 71 LYS CA C 71 58.718 58.718 55.654 3.064 18478 1234 1 3 . 1 1 71 71 LYS CB C 71 32.964 32.964 33.954 -0.990 18478 1235 1 3 . 1 1 72 72 TYR N N 72 112.358 112.358 122.898 -10.540 18478 1236 1 3 . 1 1 72 72 TYR HA H 72 4.790 4.790 4.351 0.439 18478 1237 1 3 . 1 1 72 72 TYR C C 72 174.442 174.442 176.399 -1.957 18478 1238 1 3 . 1 1 72 72 TYR CA C 72 55.287 55.287 59.161 -3.874 18478 1239 1 3 . 1 1 72 72 TYR CB C 72 37.244 37.244 38.844 -1.600 18478 1240 1 3 . 1 1 72 72 TYR H H 72 7.341 7.341 8.280 -0.939 18478 1241 1 3 . 1 1 73 73 GLY N N 73 110.612 110.612 107.899 2.713 18478 1242 1 3 . 1 1 73 73 GLY C C 73 177.982 177.982 173.335 4.647 18478 1243 1 3 . 1 1 73 73 GLY CA C 73 46.623 46.623 44.539 2.084 18478 1244 1 3 . 1 1 73 73 GLY H H 73 8.076 8.076 8.145 -0.069 18478 1245 1 3 . 1 1 74 74 LYS N N 74 121.009 121.009 120.812 0.197 18478 1246 1 3 . 1 1 74 74 LYS CA C 74 53.465 53.465 54.226 -0.761 18478 1247 1 3 . 1 1 74 74 LYS CB C 74 32.440 32.440 33.223 -0.783 18478 1248 1 3 . 1 1 74 74 LYS H H 74 7.411 7.411 7.910 -0.499 18478 1249 1 3 . 1 1 75 75 PRO HA H 75 4.452 4.452 4.364 0.088 18478 1250 1 3 . 1 1 75 75 PRO C C 75 174.959 174.959 178.095 -3.136 18478 1251 1 3 . 1 1 75 75 PRO CA C 75 62.861 62.861 64.516 -1.655 18478 1252 1 3 . 1 1 75 75 PRO CB C 75 32.407 32.407 31.751 0.656 18478 1253 1 3 . 1 1 76 76 ASN N N 76 121.045 121.045 119.388 1.657 18478 1254 1 3 . 1 1 76 76 ASN HA H 76 4.445 4.445 4.490 -0.045 18478 1255 1 3 . 1 1 76 76 ASN C C 76 174.145 174.145 174.834 -0.689 18478 1256 1 3 . 1 1 76 76 ASN CA C 76 55.701 55.701 52.926 2.775 18478 1257 1 3 . 1 1 76 76 ASN H H 76 8.474 8.474 8.895 -0.421 18478 1258 1 3 . 1 1 77 77 LYS N N 77 111.466 111.466 120.689 -9.223 18478 1259 1 3 . 1 1 77 77 LYS HA H 77 4.369 4.369 4.209 0.160 18478 1260 1 3 . 1 1 77 77 LYS C C 77 173.881 173.881 176.277 -2.396 18478 1261 1 3 . 1 1 77 77 LYS CA C 77 55.995 55.995 56.283 -0.288 18478 1262 1 3 . 1 1 77 77 LYS CB C 77 32.538 32.538 32.361 0.177 18478 1263 1 3 . 1 1 77 77 LYS H H 77 8.543 8.543 7.942 0.601 18478 1264 1 3 . 1 1 78 78 ARG N N 78 122.233 122.233 120.984 1.249 18478 1265 1 3 . 1 1 78 78 ARG HA H 78 4.286 4.286 4.000 0.286 18478 1266 1 3 . 1 1 78 78 ARG C C 78 173.652 173.652 174.852 -1.200 18478 1267 1 3 . 1 1 78 78 ARG CA C 78 55.780 55.780 57.489 -1.709 18478 1268 1 3 . 1 1 78 78 ARG CB C 78 29.554 29.554 29.287 0.267 18478 1269 1 3 . 1 1 78 78 ARG H H 78 8.864 8.864 8.646 0.218 18478 1270 1 3 . 1 1 79 79 LYS N N 79 128.197 128.197 119.278 8.919 18478 1271 1 3 . 1 1 79 79 LYS HA H 79 4.221 4.221 4.445 -0.224 18478 1272 1 3 . 1 1 79 79 LYS C C 79 174.336 174.336 175.423 -1.087 18478 1273 1 3 . 1 1 79 79 LYS CA C 79 58.986 58.986 56.009 2.977 18478 1274 1 3 . 1 1 79 79 LYS CB C 79 32.072 32.072 33.129 -1.057 18478 1275 1 3 . 1 1 79 79 LYS H H 79 8.927 8.927 7.920 1.007 18478 1276 1 3 . 1 1 80 80 GLY N N 80 114.730 114.730 110.279 4.451 18478 1277 1 3 . 1 1 80 80 GLY C C 80 176.536 176.536 174.539 1.997 18478 1278 1 3 . 1 1 80 80 GLY CA C 80 45.992 45.992 45.160 0.832 18478 1279 1 3 . 1 1 80 80 GLY H H 80 8.943 8.943 8.340 0.603 18478 1280 1 3 . 1 1 81 81 PHE N N 81 123.770 123.770 118.312 5.458 18478 1281 1 3 . 1 1 81 81 PHE HA H 81 3.336 3.336 4.487 -1.151 18478 1282 1 3 . 1 1 81 81 PHE C C 81 174.037 174.037 176.272 -2.235 18478 1283 1 3 . 1 1 81 81 PHE CA C 81 63.094 63.094 58.900 4.194 18478 1284 1 3 . 1 1 81 81 PHE CB C 81 39.823 39.823 38.690 1.133 18478 1285 1 3 . 1 1 81 81 PHE H H 81 8.281 8.281 7.795 0.486 18478 1286 1 3 . 1 1 82 82 ASN N N 82 119.812 119.812 117.605 2.207 18478 1287 1 3 . 1 1 82 82 ASN HA H 82 4.458 4.458 4.378 0.080 18478 1288 1 3 . 1 1 82 82 ASN C C 82 171.290 171.290 176.667 -5.377 18478 1289 1 3 . 1 1 82 82 ASN CA C 82 56.060 56.060 56.464 -0.404 18478 1290 1 3 . 1 1 82 82 ASN CB C 82 36.390 36.390 38.548 -2.158 18478 1291 1 3 . 1 1 82 82 ASN H H 82 9.145 9.145 8.339 0.806 18478 1292 1 3 . 1 1 83 83 GLU N N 83 124.411 124.411 118.038 6.373 18478 1293 1 3 . 1 1 83 83 GLU HA H 83 4.186 4.186 4.092 0.094 18478 1294 1 3 . 1 1 83 83 GLU C C 83 172.222 172.222 178.824 -6.602 18478 1295 1 3 . 1 1 83 83 GLU CA C 83 60.922 60.922 59.559 1.363 18478 1296 1 3 . 1 1 83 83 GLU CB C 83 28.132 28.132 29.176 -1.044 18478 1297 1 3 . 1 1 83 83 GLU H H 83 9.560 9.560 7.996 1.564 18478 1298 1 3 . 1 1 84 84 GLY N N 84 111.388 111.388 106.263 5.125 18478 1299 1 3 . 1 1 84 84 GLY C C 84 176.445 176.445 175.028 1.417 18478 1300 1 3 . 1 1 84 84 GLY CA C 84 46.727 46.727 46.621 0.106 18478 1301 1 3 . 1 1 84 84 GLY H H 84 8.364 8.364 7.319 1.045 18478 1302 1 3 . 1 1 85 85 LEU N N 85 121.153 121.153 120.169 0.984 18478 1303 1 3 . 1 1 85 85 LEU HA H 85 4.236 4.236 4.268 -0.032 18478 1304 1 3 . 1 1 85 85 LEU C C 85 172.285 172.285 177.568 -5.283 18478 1305 1 3 . 1 1 85 85 LEU CA C 85 56.795 56.795 56.833 -0.038 18478 1306 1 3 . 1 1 85 85 LEU CB C 85 41.113 41.113 43.419 -2.305 18478 1307 1 3 . 1 1 85 85 LEU H H 85 8.294 8.294 7.350 0.944 18478 1308 1 3 . 1 1 86 86 TRP N N 86 118.898 118.898 118.404 0.494 18478 1309 1 3 . 1 1 86 86 TRP HA H 86 4.161 4.161 4.289 -0.128 18478 1310 1 3 . 1 1 86 86 TRP C C 86 171.741 171.741 176.313 -4.572 18478 1311 1 3 . 1 1 86 86 TRP CA C 86 62.153 62.153 58.603 3.550 18478 1312 1 3 . 1 1 86 86 TRP CB C 86 28.424 28.424 29.492 -1.068 18478 1313 1 3 . 1 1 86 86 TRP H H 86 7.783 7.783 7.632 0.151 18478 1314 1 3 . 1 1 87 87 GLU N N 87 120.718 120.718 119.063 1.655 18478 1315 1 3 . 1 1 87 87 GLU HA H 87 3.416 3.416 4.729 -1.313 18478 1316 1 3 . 1 1 87 87 GLU C C 87 172.957 172.957 175.024 -2.067 18478 1317 1 3 . 1 1 87 87 GLU CA C 87 60.122 60.122 53.208 6.914 18478 1318 1 3 . 1 1 87 87 GLU CB C 87 31.021 31.021 30.472 0.549 18478 1319 1 3 . 1 1 87 87 GLU H H 87 8.779 8.779 7.533 1.246 18478 1320 1 3 . 1 1 88 88 ILE HA H 88 2.478 2.478 4.254 -1.776 18478 1321 1 3 . 1 1 88 88 ILE C C 88 177.873 177.873 177.164 0.709 18478 1322 1 3 . 1 1 88 88 ILE CA C 88 65.248 65.248 62.357 2.891 18478 1323 1 3 . 1 1 88 88 ILE CB C 88 37.327 37.327 38.474 -1.147 18478 1324 1 3 . 1 1 89 89 ASP N N 89 114.411 114.411 118.537 -4.126 18478 1325 1 3 . 1 1 89 89 ASP HA H 89 4.589 4.589 4.527 0.062 18478 1326 1 3 . 1 1 89 89 ASP C C 89 174.207 174.207 177.654 -3.447 18478 1327 1 3 . 1 1 89 89 ASP CA C 89 54.740 54.740 56.488 -1.748 18478 1328 1 3 . 1 1 89 89 ASP CB C 89 42.473 42.473 40.261 2.212 18478 1329 1 3 . 1 1 89 89 ASP H H 89 5.911 5.911 8.120 -2.209 18478 1330 1 3 . 1 1 90 90 ASN N N 90 114.358 114.358 114.975 -0.617 18478 1331 1 3 . 1 1 90 90 ASN HA H 90 4.420 4.420 4.433 -0.013 18478 1332 1 3 . 1 1 90 90 ASN C C 90 176.991 176.991 177.291 -0.300 18478 1333 1 3 . 1 1 90 90 ASN CA C 90 54.855 54.855 56.855 -2.000 18478 1334 1 3 . 1 1 90 90 ASN CB C 90 40.582 40.582 38.099 2.483 18478 1335 1 3 . 1 1 90 90 ASN H H 90 7.480 7.480 7.843 -0.363 18478 1336 1 3 . 1 1 91 91 ASN N N 91 119.185 119.185 115.633 3.552 18478 1337 1 3 . 1 1 91 91 ASN HA H 91 5.006 5.006 4.919 0.087 18478 1338 1 3 . 1 1 91 91 ASN CA C 91 51.624 51.624 54.127 -2.503 18478 1339 1 3 . 1 1 91 91 ASN CB C 91 38.752 38.752 38.476 0.276 18478 1340 1 3 . 1 1 91 91 ASN H H 91 9.238 9.238 7.698 1.540 18478 1341 1 3 . 1 1 92 92 PRO HA H 92 4.296 4.296 4.216 0.080 18478 1342 1 3 . 1 1 92 92 PRO C C 92 173.690 173.690 176.662 -2.972 18478 1343 1 3 . 1 1 92 92 PRO CA C 92 64.714 64.714 64.118 0.596 18478 1344 1 3 . 1 1 92 92 PRO CB C 92 31.781 31.781 32.213 -0.432 18478 1345 1 4 . 1 1 3 3 GLY C C 3 177.088 177.088 172.686 4.402 18478 1346 1 4 . 1 1 3 3 GLY CA C 3 45.330 45.330 44.176 1.154 18478 1347 1 4 . 1 1 4 4 SER N N 4 115.847 115.847 114.152 1.695 18478 1348 1 4 . 1 1 4 4 SER HA H 4 4.480 4.480 4.620 -0.140 18478 1349 1 4 . 1 1 4 4 SER C C 4 177.991 177.991 172.020 5.971 18478 1350 1 4 . 1 1 4 4 SER CA C 4 58.742 58.742 58.625 0.117 18478 1351 1 4 . 1 1 4 4 SER CB C 4 63.820 63.820 64.900 -1.080 18478 1352 1 4 . 1 1 4 4 SER H H 4 8.207 8.207 7.520 0.687 18478 1353 1 4 . 1 1 5 5 MET N N 5 125.867 125.867 122.418 3.449 18478 1354 1 4 . 1 1 5 5 MET HA H 5 4.580 4.580 4.597 -0.017 18478 1355 1 4 . 1 1 5 5 MET C C 5 174.825 174.825 176.204 -1.379 18478 1356 1 4 . 1 1 5 5 MET CA C 5 54.733 54.733 54.309 0.424 18478 1357 1 4 . 1 1 5 5 MET CB C 5 33.527 33.527 35.506 -1.979 18478 1358 1 4 . 1 1 5 5 MET H H 5 8.148 8.148 8.622 -0.474 18478 1359 1 4 . 1 1 6 6 THR N N 6 115.828 115.828 115.323 0.505 18478 1360 1 4 . 1 1 6 6 THR HA H 6 3.903 3.903 4.437 -0.534 18478 1361 1 4 . 1 1 6 6 THR C C 6 176.930 176.930 172.899 4.031 18478 1362 1 4 . 1 1 6 6 THR CA C 6 63.034 63.034 60.897 2.137 18478 1363 1 4 . 1 1 6 6 THR CB C 6 69.308 69.308 68.632 0.676 18478 1364 1 4 . 1 1 6 6 THR H H 6 8.408 8.408 8.367 0.041 18478 1365 1 4 . 1 1 7 7 ARG HA H 7 4.276 4.276 4.246 0.030 18478 1366 1 4 . 1 1 7 7 ARG C C 7 176.546 176.546 176.263 0.283 18478 1367 1 4 . 1 1 7 7 ARG CA C 7 55.813 55.813 56.447 -0.634 18478 1368 1 4 . 1 1 7 7 ARG CB C 7 30.556 30.556 30.513 0.043 18478 1369 1 4 . 1 1 8 8 ASP N N 8 121.762 121.762 125.509 -3.747 18478 1370 1 4 . 1 1 8 8 ASP HA H 8 4.537 4.537 4.144 0.393 18478 1371 1 4 . 1 1 8 8 ASP C C 8 177.750 177.750 175.094 2.656 18478 1372 1 4 . 1 1 8 8 ASP CA C 8 54.117 54.117 54.851 -0.734 18478 1373 1 4 . 1 1 8 8 ASP H H 8 8.066 8.066 8.409 -0.343 18478 1374 1 4 . 1 1 9 9 PHE N N 9 119.991 119.991 119.322 0.669 18478 1375 1 4 . 1 1 9 9 PHE HA H 9 4.734 4.734 5.006 -0.272 18478 1376 1 4 . 1 1 9 9 PHE C C 9 176.838 176.838 175.408 1.430 18478 1377 1 4 . 1 1 9 9 PHE CA C 9 58.303 58.303 57.403 0.901 18478 1378 1 4 . 1 1 9 9 PHE CB C 9 41.594 41.594 40.877 0.717 18478 1379 1 4 . 1 1 9 9 PHE H H 9 8.103 8.103 7.580 0.523 18478 1380 1 4 . 1 1 10 10 LYS N N 10 122.957 122.957 123.819 -0.862 18478 1381 1 4 . 1 1 10 10 LYS CA C 10 53.167 53.167 56.092 -2.925 18478 1382 1 4 . 1 1 10 10 LYS CB C 10 33.495 33.495 32.000 1.495 18478 1383 1 4 . 1 1 10 10 LYS H H 10 9.087 9.087 8.797 0.290 18478 1384 1 4 . 1 1 11 11 PRO HA H 11 3.903 3.903 4.976 -1.073 18478 1385 1 4 . 1 1 11 11 PRO C C 11 173.988 173.988 174.700 -0.712 18478 1386 1 4 . 1 1 11 11 PRO CA C 11 63.874 63.874 61.379 2.495 18478 1387 1 4 . 1 1 11 11 PRO CB C 11 31.623 31.623 34.959 -3.336 18478 1388 1 4 . 1 1 12 12 GLY N N 12 115.413 115.413 111.062 4.351 18478 1389 1 4 . 1 1 12 12 GLY C C 12 176.966 176.966 172.536 4.430 18478 1390 1 4 . 1 1 12 12 GLY CA C 12 44.651 44.651 42.303 2.349 18478 1391 1 4 . 1 1 12 12 GLY H H 12 9.667 9.667 8.772 0.895 18478 1392 1 4 . 1 1 13 13 ASP N N 13 122.208 122.208 128.821 -6.613 18478 1393 1 4 . 1 1 13 13 ASP HA H 13 4.601 4.601 4.970 -0.369 18478 1394 1 4 . 1 1 13 13 ASP C C 13 176.244 176.244 174.452 1.792 18478 1395 1 4 . 1 1 13 13 ASP CA C 13 55.870 55.870 52.141 3.729 18478 1396 1 4 . 1 1 13 13 ASP CB C 13 40.794 40.794 42.782 -1.988 18478 1397 1 4 . 1 1 13 13 ASP H H 13 8.303 8.303 8.577 -0.274 18478 1398 1 4 . 1 1 14 14 LEU N N 14 121.306 121.306 126.585 -5.279 18478 1399 1 4 . 1 1 14 14 LEU HA H 14 4.982 4.982 4.545 0.437 18478 1400 1 4 . 1 1 14 14 LEU C C 14 173.461 173.461 176.262 -2.801 18478 1401 1 4 . 1 1 14 14 LEU CA C 14 54.516 54.516 53.892 0.624 18478 1402 1 4 . 1 1 14 14 LEU CB C 14 40.999 40.999 41.696 -0.697 18478 1403 1 4 . 1 1 14 14 LEU H H 14 8.618 8.618 7.736 0.882 18478 1404 1 4 . 1 1 15 15 ILE N N 15 118.806 118.806 126.444 -7.638 18478 1405 1 4 . 1 1 15 15 ILE HA H 15 5.356 5.356 4.213 1.143 18478 1406 1 4 . 1 1 15 15 ILE C C 15 175.982 175.982 176.048 -0.066 18478 1407 1 4 . 1 1 15 15 ILE CA C 15 60.481 60.481 61.498 -1.016 18478 1408 1 4 . 1 1 15 15 ILE CB C 15 44.142 44.142 39.955 4.187 18478 1409 1 4 . 1 1 15 15 ILE H H 15 8.864 8.864 8.529 0.335 18478 1410 1 4 . 1 1 16 16 PHE N N 16 112.472 112.472 123.233 -10.761 18478 1411 1 4 . 1 1 16 16 PHE HA H 16 5.306 5.306 4.318 0.988 18478 1412 1 4 . 1 1 16 16 PHE C C 16 176.239 176.239 176.234 0.005 18478 1413 1 4 . 1 1 16 16 PHE CA C 16 58.603 58.603 58.776 -0.173 18478 1414 1 4 . 1 1 16 16 PHE CB C 16 43.305 43.305 38.029 5.276 18478 1415 1 4 . 1 1 16 16 PHE H H 16 9.411 9.411 8.549 0.862 18478 1416 1 4 . 1 1 17 17 ALA N N 17 123.889 123.889 127.361 -3.472 18478 1417 1 4 . 1 1 17 17 ALA HA H 17 5.348 5.348 3.624 1.724 18478 1418 1 4 . 1 1 17 17 ALA C C 17 174.426 174.426 176.375 -1.949 18478 1419 1 4 . 1 1 17 17 ALA CA C 17 50.062 50.062 51.669 -1.607 18478 1420 1 4 . 1 1 17 17 ALA H H 17 9.658 9.658 8.492 1.166 18478 1421 1 4 . 1 1 18 18 LYS N N 18 127.760 127.760 121.256 6.504 18478 1422 1 4 . 1 1 18 18 LYS HA H 18 4.697 4.697 4.737 -0.040 18478 1423 1 4 . 1 1 18 18 LYS C C 18 178.554 178.554 174.535 4.019 18478 1424 1 4 . 1 1 18 18 LYS CA C 18 53.893 53.893 52.240 1.653 18478 1425 1 4 . 1 1 18 18 LYS CB C 18 35.291 35.291 32.700 2.591 18478 1426 1 4 . 1 1 18 18 LYS H H 18 9.421 9.421 7.409 2.012 18478 1427 1 4 . 1 1 19 19 MET HA H 19 4.656 4.656 4.346 0.310 18478 1428 1 4 . 1 1 19 19 MET C C 19 175.741 175.741 174.814 0.927 18478 1429 1 4 . 1 1 19 19 MET CA C 19 53.916 53.916 54.743 -0.827 18478 1430 1 4 . 1 1 19 19 MET CB C 19 35.799 35.799 33.637 2.162 18478 1431 1 4 . 1 1 20 20 LYS N N 20 124.062 124.062 118.309 5.753 18478 1432 1 4 . 1 1 20 20 LYS CA C 20 58.585 58.585 57.254 1.331 18478 1433 1 4 . 1 1 20 20 LYS CB C 20 31.978 31.978 32.267 -0.289 18478 1434 1 4 . 1 1 20 20 LYS H H 20 8.645 8.645 8.150 0.495 18478 1435 1 4 . 1 1 21 21 GLY C C 21 176.205 176.205 171.966 4.239 18478 1436 1 4 . 1 1 21 21 GLY CA C 21 45.142 45.142 41.834 3.308 18478 1437 1 4 . 1 1 22 22 TYR HA H 22 4.573 4.573 4.585 -0.012 18478 1438 1 4 . 1 1 22 22 TYR CA C 22 55.748 55.748 57.673 -1.925 18478 1439 1 4 . 1 1 22 22 TYR CB C 22 41.331 41.331 38.389 2.942 18478 1440 1 4 . 1 1 23 23 PRO HA H 23 4.759 4.759 4.989 -0.230 18478 1441 1 4 . 1 1 23 23 PRO C C 23 174.587 174.587 175.025 -0.438 18478 1442 1 4 . 1 1 23 23 PRO CA C 23 62.072 62.072 61.766 0.306 18478 1443 1 4 . 1 1 23 23 PRO CB C 23 31.077 31.077 35.070 -3.993 18478 1444 1 4 . 1 1 24 24 HIS N N 24 119.190 119.190 115.967 3.223 18478 1445 1 4 . 1 1 24 24 HIS HA H 24 3.983 3.983 5.549 -1.566 18478 1446 1 4 . 1 1 24 24 HIS C C 24 175.555 175.555 173.930 1.625 18478 1447 1 4 . 1 1 24 24 HIS CA C 24 60.973 60.973 54.252 6.721 18478 1448 1 4 . 1 1 24 24 HIS CB C 24 30.689 30.689 32.984 -2.295 18478 1449 1 4 . 1 1 24 24 HIS H H 24 8.158 8.158 8.487 -0.329 18478 1450 1 4 . 1 1 25 25 TRP N N 25 127.435 127.435 122.257 5.178 18478 1451 1 4 . 1 1 25 25 TRP HA H 25 3.760 3.760 5.267 -1.507 18478 1452 1 4 . 1 1 25 25 TRP CA C 25 55.890 55.890 57.211 -1.321 18478 1453 1 4 . 1 1 25 25 TRP CB C 25 32.879 32.879 30.988 1.891 18478 1454 1 4 . 1 1 25 25 TRP H H 25 9.211 9.211 8.699 0.512 18478 1455 1 4 . 1 1 26 26 PRO HA H 26 4.217 4.217 4.533 -0.316 18478 1456 1 4 . 1 1 26 26 PRO C C 26 176.279 176.279 175.957 0.322 18478 1457 1 4 . 1 1 26 26 PRO CA C 26 63.140 63.140 61.888 1.252 18478 1458 1 4 . 1 1 26 26 PRO CB C 26 32.171 32.171 34.170 -1.999 18478 1459 1 4 . 1 1 27 27 ALA N N 27 130.162 130.162 125.950 4.212 18478 1460 1 4 . 1 1 27 27 ALA HA H 27 4.981 4.981 4.242 0.739 18478 1461 1 4 . 1 1 27 27 ALA C C 27 177.227 177.227 177.373 -0.146 18478 1462 1 4 . 1 1 27 27 ALA CA C 27 52.574 52.574 51.644 0.930 18478 1463 1 4 . 1 1 27 27 ALA CB C 27 23.239 23.239 20.369 2.870 18478 1464 1 4 . 1 1 27 27 ALA H H 27 9.394 9.394 8.283 1.111 18478 1465 1 4 . 1 1 28 28 ARG N N 28 117.381 117.381 118.517 -1.136 18478 1466 1 4 . 1 1 28 28 ARG HA H 28 5.421 5.421 4.479 0.942 18478 1467 1 4 . 1 1 28 28 ARG C C 28 176.465 176.465 175.472 0.993 18478 1468 1 4 . 1 1 28 28 ARG CA C 28 53.662 53.662 55.065 -1.403 18478 1469 1 4 . 1 1 28 28 ARG CB C 28 35.058 35.058 29.898 5.160 18478 1470 1 4 . 1 1 28 28 ARG H H 28 8.806 8.806 8.370 0.436 18478 1471 1 4 . 1 1 29 29 VAL HA H 29 4.109 4.109 4.251 -0.142 18478 1472 1 4 . 1 1 29 29 VAL C C 29 175.996 175.996 174.526 1.470 18478 1473 1 4 . 1 1 29 29 VAL CA C 29 62.810 62.810 61.755 1.055 18478 1474 1 4 . 1 1 29 29 VAL CB C 29 31.108 31.108 32.744 -1.636 18478 1475 1 4 . 1 1 30 30 ASP N N 30 133.830 133.830 116.290 17.540 18478 1476 1 4 . 1 1 30 30 ASP HA H 30 5.198 5.198 4.617 0.581 18478 1477 1 4 . 1 1 30 30 ASP C C 30 176.207 176.207 176.340 -0.133 18478 1478 1 4 . 1 1 30 30 ASP CA C 30 53.007 53.007 53.244 -0.237 18478 1479 1 4 . 1 1 30 30 ASP CB C 30 44.130 44.130 40.583 3.547 18478 1480 1 4 . 1 1 30 30 ASP H H 30 8.892 8.892 8.358 0.534 18478 1481 1 4 . 1 1 31 31 GLU N N 31 115.905 115.905 123.158 -7.253 18478 1482 1 4 . 1 1 31 31 GLU HA H 31 4.409 4.409 3.965 0.444 18478 1483 1 4 . 1 1 31 31 GLU C C 31 175.192 175.192 176.206 -1.014 18478 1484 1 4 . 1 1 31 31 GLU CA C 31 55.389 55.389 56.094 -0.705 18478 1485 1 4 . 1 1 31 31 GLU H H 31 7.966 7.966 8.973 -1.007 18478 1486 1 4 . 1 1 32 32 VAL N N 32 122.794 122.794 116.939 5.855 18478 1487 1 4 . 1 1 32 32 VAL HA H 32 4.303 4.303 3.731 0.572 18478 1488 1 4 . 1 1 32 32 VAL CA C 32 60.408 60.408 62.598 -2.190 18478 1489 1 4 . 1 1 32 32 VAL CB C 32 32.333 32.333 31.092 1.241 18478 1490 1 4 . 1 1 32 32 VAL H H 32 8.702 8.702 8.272 0.430 18478 1491 1 4 . 1 1 33 33 PRO HA H 33 4.572 4.572 4.147 0.425 18478 1492 1 4 . 1 1 33 33 PRO C C 33 175.366 175.366 178.170 -2.804 18478 1493 1 4 . 1 1 33 33 PRO CA C 33 63.702 63.702 65.240 -1.538 18478 1494 1 4 . 1 1 33 33 PRO CB C 33 32.736 32.736 31.888 0.848 18478 1495 1 4 . 1 1 34 34 ASP N N 34 119.187 119.187 117.912 1.275 18478 1496 1 4 . 1 1 34 34 ASP HA H 34 4.679 4.679 4.830 -0.151 18478 1497 1 4 . 1 1 34 34 ASP C C 34 175.713 175.713 173.843 1.870 18478 1498 1 4 . 1 1 34 34 ASP CA C 34 53.013 53.013 52.616 0.397 18478 1499 1 4 . 1 1 34 34 ASP CB C 34 40.850 40.850 41.093 -0.243 18478 1500 1 4 . 1 1 34 34 ASP H H 34 8.686 8.686 7.920 0.766 18478 1501 1 4 . 1 1 35 35 GLY C C 35 177.458 177.458 172.953 4.505 18478 1502 1 4 . 1 1 35 35 GLY CA C 35 45.507 45.507 43.816 1.691 18478 1503 1 4 . 1 1 36 36 ALA HA H 36 4.404 4.404 4.259 0.145 18478 1504 1 4 . 1 1 36 36 ALA CA C 36 52.010 52.010 51.773 0.237 18478 1505 1 4 . 1 1 36 36 ALA CB C 36 19.909 19.909 19.729 0.180 18478 1506 1 4 . 1 1 37 37 VAL N N 37 119.594 119.594 122.171 -2.577 18478 1507 1 4 . 1 1 37 37 VAL HA H 37 3.932 3.932 4.106 -0.174 18478 1508 1 4 . 1 1 37 37 VAL C C 37 175.966 175.966 175.631 0.335 18478 1509 1 4 . 1 1 37 37 VAL CA C 37 62.810 62.810 64.078 -1.268 18478 1510 1 4 . 1 1 37 37 VAL CB C 37 32.267 32.267 32.693 -0.426 18478 1511 1 4 . 1 1 37 37 VAL H H 37 8.037 8.037 8.512 -0.475 18478 1512 1 4 . 1 1 38 38 LYS N N 38 125.676 125.676 118.511 7.165 18478 1513 1 4 . 1 1 38 38 LYS C C 38 173.865 173.865 175.317 -1.452 18478 1514 1 4 . 1 1 38 38 LYS CA C 38 54.278 54.278 56.496 -2.218 18478 1515 1 4 . 1 1 38 38 LYS CB C 38 31.740 31.740 33.359 -1.619 18478 1516 1 4 . 1 1 38 38 LYS H H 38 8.292 8.292 8.415 -0.123 18478 1517 1 4 . 1 1 40 40 PRO HA H 40 4.387 4.387 5.314 -0.927 18478 1518 1 4 . 1 1 40 40 PRO C C 40 175.535 175.535 175.074 0.461 18478 1519 1 4 . 1 1 40 40 PRO CA C 40 62.330 62.330 59.213 3.117 18478 1520 1 4 . 1 1 40 40 PRO CB C 40 32.086 32.086 32.608 -0.522 18478 1521 1 4 . 1 1 41 41 THR HA H 41 4.027 4.027 4.502 -0.475 18478 1522 1 4 . 1 1 41 41 THR C C 41 176.795 176.795 173.173 3.622 18478 1523 1 4 . 1 1 41 41 THR CA C 41 63.693 63.693 62.218 1.475 18478 1524 1 4 . 1 1 41 41 THR CB C 41 69.370 69.370 68.926 0.444 18478 1525 1 4 . 1 1 42 42 ASN N N 42 118.513 118.513 122.513 -4.000 18478 1526 1 4 . 1 1 42 42 ASN HA H 42 4.530 4.530 5.306 -0.776 18478 1527 1 4 . 1 1 42 42 ASN C C 42 177.230 177.230 175.153 2.077 18478 1528 1 4 . 1 1 42 42 ASN CA C 42 56.373 56.373 50.364 6.009 18478 1529 1 4 . 1 1 42 42 ASN CB C 42 37.618 37.618 37.860 -0.242 18478 1530 1 4 . 1 1 42 42 ASN H H 42 8.752 8.752 8.843 -0.091 18478 1531 1 4 . 1 1 43 43 LYS N N 43 115.898 115.898 128.994 -13.096 18478 1532 1 4 . 1 1 43 43 LYS HA H 43 4.710 4.710 4.574 0.136 18478 1533 1 4 . 1 1 43 43 LYS C C 43 177.032 177.032 176.025 1.007 18478 1534 1 4 . 1 1 43 43 LYS CA C 43 54.957 54.957 54.883 0.074 18478 1535 1 4 . 1 1 43 43 LYS CB C 43 36.600 36.600 32.212 4.388 18478 1536 1 4 . 1 1 43 43 LYS H H 43 7.723 7.723 8.802 -1.079 18478 1537 1 4 . 1 1 44 44 LEU N N 44 121.006 121.006 129.788 -8.782 18478 1538 1 4 . 1 1 44 44 LEU HA H 44 5.000 5.000 4.323 0.677 18478 1539 1 4 . 1 1 44 44 LEU CA C 44 51.842 51.842 54.096 -2.254 18478 1540 1 4 . 1 1 44 44 LEU CB C 44 44.418 44.418 40.739 3.679 18478 1541 1 4 . 1 1 44 44 LEU H H 44 9.063 9.063 8.446 0.617 18478 1542 1 4 . 1 1 45 45 PRO HA H 45 4.392 4.392 4.387 0.005 18478 1543 1 4 . 1 1 45 45 PRO C C 45 177.051 177.051 177.441 -0.390 18478 1544 1 4 . 1 1 45 45 PRO CA C 45 62.000 62.000 63.953 -1.953 18478 1545 1 4 . 1 1 45 45 PRO CB C 45 30.737 30.737 32.333 -1.596 18478 1546 1 4 . 1 1 46 46 ILE N N 46 125.996 125.996 125.254 0.742 18478 1547 1 4 . 1 1 46 46 ILE HA H 46 4.564 4.564 3.573 0.991 18478 1548 1 4 . 1 1 46 46 ILE C C 46 176.985 176.985 175.344 1.641 18478 1549 1 4 . 1 1 46 46 ILE CA C 46 57.051 57.051 62.339 -5.288 18478 1550 1 4 . 1 1 46 46 ILE H H 46 8.908 8.908 8.545 0.363 18478 1551 1 4 . 1 1 47 47 PHE N N 47 128.276 128.276 116.534 11.742 18478 1552 1 4 . 1 1 47 47 PHE HA H 47 4.827 4.827 4.465 0.362 18478 1553 1 4 . 1 1 47 47 PHE C C 47 177.835 177.835 175.928 1.907 18478 1554 1 4 . 1 1 47 47 PHE CA C 47 56.099 56.099 56.673 -0.574 18478 1555 1 4 . 1 1 47 47 PHE CB C 47 41.217 41.217 40.260 0.957 18478 1556 1 4 . 1 1 47 47 PHE H H 47 8.739 8.739 7.472 1.267 18478 1557 1 4 . 1 1 48 48 PHE N N 48 125.953 125.953 118.225 7.728 18478 1558 1 4 . 1 1 48 48 PHE HA H 48 4.251 4.251 3.940 0.311 18478 1559 1 4 . 1 1 48 48 PHE C C 48 175.869 175.869 174.694 1.175 18478 1560 1 4 . 1 1 48 48 PHE CA C 48 56.744 56.744 59.587 -2.843 18478 1561 1 4 . 1 1 48 48 PHE CB C 48 38.835 38.835 36.690 2.145 18478 1562 1 4 . 1 1 48 48 PHE H H 48 8.545 8.545 7.849 0.696 18478 1563 1 4 . 1 1 49 49 PHE N N 49 122.197 122.197 116.771 5.426 18478 1564 1 4 . 1 1 49 49 PHE HA H 49 4.400 4.400 4.609 -0.209 18478 1565 1 4 . 1 1 49 49 PHE C C 49 174.016 174.016 174.698 -0.682 18478 1566 1 4 . 1 1 49 49 PHE CA C 49 59.916 59.916 55.991 3.925 18478 1567 1 4 . 1 1 49 49 PHE CB C 49 39.799 39.799 41.776 -1.977 18478 1568 1 4 . 1 1 49 49 PHE H H 49 8.619 8.619 7.262 1.357 18478 1569 1 4 . 1 1 50 50 GLY N N 50 114.083 114.083 107.212 6.871 18478 1570 1 4 . 1 1 50 50 GLY C C 50 175.636 175.636 173.072 2.564 18478 1571 1 4 . 1 1 50 50 GLY CA C 50 46.718 46.718 43.714 3.004 18478 1572 1 4 . 1 1 50 50 GLY H H 50 10.329 10.329 8.099 2.230 18478 1573 1 4 . 1 1 51 51 THR N N 51 111.210 111.210 117.885 -6.675 18478 1574 1 4 . 1 1 51 51 THR HA H 51 3.980 3.980 4.523 -0.543 18478 1575 1 4 . 1 1 51 51 THR C C 51 175.588 175.588 172.058 3.530 18478 1576 1 4 . 1 1 51 51 THR CA C 51 62.223 62.223 61.223 1.000 18478 1577 1 4 . 1 1 51 51 THR CB C 51 68.346 68.346 72.020 -3.674 18478 1578 1 4 . 1 1 51 51 THR H H 51 7.882 7.882 8.461 -0.579 18478 1579 1 4 . 1 1 52 52 HIS N N 52 115.544 115.544 120.436 -4.892 18478 1580 1 4 . 1 1 52 52 HIS HA H 52 3.712 3.712 5.479 -1.767 18478 1581 1 4 . 1 1 52 52 HIS C C 52 177.717 177.717 175.269 2.448 18478 1582 1 4 . 1 1 52 52 HIS CA C 52 54.860 54.860 54.588 0.272 18478 1583 1 4 . 1 1 52 52 HIS CB C 52 26.388 26.388 30.279 -3.892 18478 1584 1 4 . 1 1 52 52 HIS H H 52 7.791 7.791 8.529 -0.738 18478 1585 1 4 . 1 1 53 53 GLU N N 53 117.517 117.517 123.172 -5.655 18478 1586 1 4 . 1 1 53 53 GLU HA H 53 4.298 4.298 4.770 -0.472 18478 1587 1 4 . 1 1 53 53 GLU C C 53 176.958 176.958 176.429 0.529 18478 1588 1 4 . 1 1 53 53 GLU CA C 53 55.403 55.403 55.105 0.298 18478 1589 1 4 . 1 1 53 53 GLU CB C 53 31.588 31.588 33.506 -1.918 18478 1590 1 4 . 1 1 53 53 GLU H H 53 6.795 6.795 8.526 -1.731 18478 1591 1 4 . 1 1 54 54 THR N N 54 111.182 111.182 116.502 -5.320 18478 1592 1 4 . 1 1 54 54 THR HA H 54 5.648 5.648 4.383 1.265 18478 1593 1 4 . 1 1 54 54 THR C C 54 177.234 177.234 174.405 2.829 18478 1594 1 4 . 1 1 54 54 THR CA C 54 59.894 59.894 61.409 -1.515 18478 1595 1 4 . 1 1 54 54 THR H H 54 8.139 8.139 8.754 -0.615 18478 1596 1 4 . 1 1 55 55 ALA HA H 55 4.403 4.403 4.208 0.195 18478 1597 1 4 . 1 1 55 55 ALA C C 55 176.601 176.601 178.097 -1.496 18478 1598 1 4 . 1 1 55 55 ALA CA C 55 51.079 51.079 53.233 -2.154 18478 1599 1 4 . 1 1 55 55 ALA CB C 55 23.285 23.285 19.050 4.235 18478 1600 1 4 . 1 1 56 56 PHE N N 56 118.058 118.058 113.562 4.496 18478 1601 1 4 . 1 1 56 56 PHE HA H 56 5.678 5.678 4.581 1.097 18478 1602 1 4 . 1 1 56 56 PHE C C 56 175.962 175.962 174.991 0.971 18478 1603 1 4 . 1 1 56 56 PHE CA C 56 56.008 56.008 59.058 -3.050 18478 1604 1 4 . 1 1 56 56 PHE CB C 56 39.995 39.995 37.686 2.309 18478 1605 1 4 . 1 1 56 56 PHE H H 56 8.523 8.523 8.304 0.219 18478 1606 1 4 . 1 1 57 57 LEU N N 57 123.344 123.344 120.586 2.758 18478 1607 1 4 . 1 1 57 57 LEU HA H 57 4.929 4.929 4.703 0.226 18478 1608 1 4 . 1 1 57 57 LEU C C 57 175.584 175.584 174.974 0.610 18478 1609 1 4 . 1 1 57 57 LEU CA C 57 53.463 53.463 55.388 -1.925 18478 1610 1 4 . 1 1 57 57 LEU CB C 57 46.545 46.545 44.128 2.417 18478 1611 1 4 . 1 1 57 57 LEU H H 57 8.579 8.579 7.594 0.985 18478 1612 1 4 . 1 1 58 58 GLY N N 58 108.499 108.499 107.330 1.169 18478 1613 1 4 . 1 1 58 58 GLY CA C 58 43.755 43.755 44.230 -0.475 18478 1614 1 4 . 1 1 58 58 GLY H H 58 9.318 9.318 7.328 1.990 18478 1615 1 4 . 1 1 59 59 PRO HA H 59 4.048 4.048 4.937 -0.889 18478 1616 1 4 . 1 1 59 59 PRO C C 59 173.763 173.763 174.694 -0.931 18478 1617 1 4 . 1 1 59 59 PRO CA C 59 64.770 64.770 60.509 4.261 18478 1618 1 4 . 1 1 59 59 PRO CB C 59 31.889 31.889 35.800 -3.911 18478 1619 1 4 . 1 1 60 60 LYS HA H 60 4.191 4.191 4.563 -0.372 18478 1620 1 4 . 1 1 60 60 LYS C C 60 174.842 174.842 176.571 -1.729 18478 1621 1 4 . 1 1 60 60 LYS CA C 60 57.875 57.875 56.075 1.800 18478 1622 1 4 . 1 1 60 60 LYS CB C 60 31.576 31.576 32.711 -1.135 18478 1623 1 4 . 1 1 61 61 ASP N N 61 117.768 117.768 123.024 -5.256 18478 1624 1 4 . 1 1 61 61 ASP HA H 61 4.973 4.973 4.289 0.684 18478 1625 1 4 . 1 1 61 61 ASP C C 61 178.178 178.178 177.079 1.099 18478 1626 1 4 . 1 1 61 61 ASP CA C 61 54.687 54.687 55.674 -0.987 18478 1627 1 4 . 1 1 61 61 ASP CB C 61 43.555 43.555 39.728 3.827 18478 1628 1 4 . 1 1 61 61 ASP H H 61 7.722 7.722 8.750 -1.028 18478 1629 1 4 . 1 1 62 62 ILE N N 62 114.244 114.244 121.820 -7.576 18478 1630 1 4 . 1 1 62 62 ILE HA H 62 4.891 4.891 3.411 1.480 18478 1631 1 4 . 1 1 62 62 ILE C C 62 178.027 178.027 177.266 0.761 18478 1632 1 4 . 1 1 62 62 ILE CA C 62 59.994 59.994 63.611 -3.618 18478 1633 1 4 . 1 1 62 62 ILE CB C 62 40.652 40.652 37.054 3.598 18478 1634 1 4 . 1 1 62 62 ILE H H 62 6.784 6.784 7.612 -0.828 18478 1635 1 4 . 1 1 63 63 PHE N N 63 119.819 119.819 120.363 -0.544 18478 1636 1 4 . 1 1 63 63 PHE HA H 63 5.214 5.214 4.251 0.963 18478 1637 1 4 . 1 1 63 63 PHE CA C 63 54.735 54.735 60.161 -5.426 18478 1638 1 4 . 1 1 63 63 PHE CB C 63 42.122 42.122 38.904 3.218 18478 1639 1 4 . 1 1 63 63 PHE H H 63 8.734 8.734 7.769 0.965 18478 1640 1 4 . 1 1 64 64 PRO HA H 64 4.771 4.771 4.347 0.424 18478 1641 1 4 . 1 1 64 64 PRO C C 64 174.036 174.036 178.286 -4.250 18478 1642 1 4 . 1 1 64 64 PRO CA C 64 64.474 64.474 64.276 0.198 18478 1643 1 4 . 1 1 64 64 PRO CB C 64 32.662 32.662 32.973 -0.311 18478 1644 1 4 . 1 1 65 65 TYR N N 65 124.335 124.335 121.601 2.734 18478 1645 1 4 . 1 1 65 65 TYR HA H 65 4.530 4.530 4.329 0.201 18478 1646 1 4 . 1 1 65 65 TYR C C 65 173.944 173.944 177.260 -3.316 18478 1647 1 4 . 1 1 65 65 TYR CA C 65 61.205 61.205 61.099 0.106 18478 1648 1 4 . 1 1 65 65 TYR CB C 65 38.844 38.844 38.177 0.667 18478 1649 1 4 . 1 1 65 65 TYR H H 65 8.359 8.359 7.887 0.472 18478 1650 1 4 . 1 1 66 66 SER N N 66 114.836 114.836 112.404 2.432 18478 1651 1 4 . 1 1 66 66 SER HA H 66 3.505 3.505 4.396 -0.891 18478 1652 1 4 . 1 1 66 66 SER C C 66 173.697 173.697 175.555 -1.858 18478 1653 1 4 . 1 1 66 66 SER CA C 66 63.078 63.078 59.836 3.243 18478 1654 1 4 . 1 1 66 66 SER CB C 66 62.223 62.223 62.620 -0.397 18478 1655 1 4 . 1 1 66 66 SER H H 66 8.974 8.974 7.706 1.268 18478 1656 1 4 . 1 1 67 67 GLU N N 67 118.013 118.013 118.504 -0.491 18478 1657 1 4 . 1 1 67 67 GLU HA H 67 4.210 4.210 4.172 0.038 18478 1658 1 4 . 1 1 67 67 GLU C C 67 174.961 174.961 177.548 -2.587 18478 1659 1 4 . 1 1 67 67 GLU CA C 67 58.330 58.330 57.903 0.427 18478 1660 1 4 . 1 1 67 67 GLU CB C 67 30.205 30.205 30.859 -0.654 18478 1661 1 4 . 1 1 67 67 GLU H H 67 8.817 8.817 7.866 0.951 18478 1662 1 4 . 1 1 68 68 ASN N N 68 113.942 113.942 110.817 3.125 18478 1663 1 4 . 1 1 68 68 ASN HA H 68 5.015 5.015 5.082 -0.067 18478 1664 1 4 . 1 1 68 68 ASN C C 68 176.626 176.626 176.278 0.348 18478 1665 1 4 . 1 1 68 68 ASN CA C 68 53.768 53.768 51.858 1.910 18478 1666 1 4 . 1 1 68 68 ASN CB C 68 41.948 41.948 39.132 2.816 18478 1667 1 4 . 1 1 68 68 ASN H H 68 7.448 7.448 7.854 -0.406 18478 1668 1 4 . 1 1 69 69 LYS N N 69 124.584 124.584 121.527 3.057 18478 1669 1 4 . 1 1 69 69 LYS HA H 69 3.794 3.794 3.966 -0.172 18478 1670 1 4 . 1 1 69 69 LYS C C 69 173.330 173.330 175.324 -1.994 18478 1671 1 4 . 1 1 69 69 LYS CA C 69 61.225 61.225 57.165 4.060 18478 1672 1 4 . 1 1 69 69 LYS H H 69 7.592 7.592 8.520 -0.928 18478 1673 1 4 . 1 1 70 70 GLU N N 70 118.408 118.408 117.890 0.518 18478 1674 1 4 . 1 1 70 70 GLU HA H 70 4.005 4.005 4.808 -0.803 18478 1675 1 4 . 1 1 70 70 GLU C C 70 174.588 174.588 173.475 1.113 18478 1676 1 4 . 1 1 70 70 GLU CA C 70 58.695 58.695 53.118 5.577 18478 1677 1 4 . 1 1 70 70 GLU CB C 70 28.928 28.928 31.304 -2.376 18478 1678 1 4 . 1 1 70 70 GLU H H 70 8.478 8.478 8.221 0.257 18478 1679 1 4 . 1 1 71 71 LYS HA H 71 3.847 3.847 4.436 -0.589 18478 1680 1 4 . 1 1 71 71 LYS C C 71 173.420 173.420 175.369 -1.949 18478 1681 1 4 . 1 1 71 71 LYS CA C 71 58.718 58.718 55.553 3.165 18478 1682 1 4 . 1 1 71 71 LYS CB C 71 32.964 32.964 34.078 -1.114 18478 1683 1 4 . 1 1 72 72 TYR N N 72 112.358 112.358 122.350 -9.992 18478 1684 1 4 . 1 1 72 72 TYR HA H 72 4.790 4.790 4.314 0.476 18478 1685 1 4 . 1 1 72 72 TYR C C 72 174.442 174.442 175.655 -1.213 18478 1686 1 4 . 1 1 72 72 TYR CA C 72 55.287 55.287 59.348 -4.061 18478 1687 1 4 . 1 1 72 72 TYR CB C 72 37.244 37.244 39.061 -1.817 18478 1688 1 4 . 1 1 72 72 TYR H H 72 7.341 7.341 8.479 -1.138 18478 1689 1 4 . 1 1 73 73 GLY N N 73 110.612 110.612 107.552 3.060 18478 1690 1 4 . 1 1 73 73 GLY C C 73 177.982 177.982 173.590 4.392 18478 1691 1 4 . 1 1 73 73 GLY CA C 73 46.623 46.623 44.309 2.314 18478 1692 1 4 . 1 1 73 73 GLY H H 73 8.076 8.076 8.406 -0.330 18478 1693 1 4 . 1 1 74 74 LYS N N 74 121.009 121.009 120.537 0.472 18478 1694 1 4 . 1 1 74 74 LYS CA C 74 53.465 53.465 53.985 -0.520 18478 1695 1 4 . 1 1 74 74 LYS CB C 74 32.440 32.440 32.660 -0.220 18478 1696 1 4 . 1 1 74 74 LYS H H 74 7.411 7.411 7.875 -0.464 18478 1697 1 4 . 1 1 75 75 PRO HA H 75 4.452 4.452 4.203 0.249 18478 1698 1 4 . 1 1 75 75 PRO C C 75 174.959 174.959 178.388 -3.429 18478 1699 1 4 . 1 1 75 75 PRO CA C 75 62.861 62.861 64.520 -1.659 18478 1700 1 4 . 1 1 75 75 PRO CB C 75 32.407 32.407 31.924 0.483 18478 1701 1 4 . 1 1 76 76 ASN N N 76 121.045 121.045 121.111 -0.066 18478 1702 1 4 . 1 1 76 76 ASN HA H 76 4.445 4.445 4.392 0.053 18478 1703 1 4 . 1 1 76 76 ASN C C 76 174.145 174.145 174.553 -0.408 18478 1704 1 4 . 1 1 76 76 ASN CA C 76 55.701 55.701 52.861 2.840 18478 1705 1 4 . 1 1 76 76 ASN H H 76 8.474 8.474 8.771 -0.297 18478 1706 1 4 . 1 1 77 77 LYS N N 77 111.466 111.466 120.464 -8.998 18478 1707 1 4 . 1 1 77 77 LYS HA H 77 4.369 4.369 4.174 0.195 18478 1708 1 4 . 1 1 77 77 LYS C C 77 173.881 173.881 176.691 -2.810 18478 1709 1 4 . 1 1 77 77 LYS CA C 77 55.995 55.995 56.368 -0.373 18478 1710 1 4 . 1 1 77 77 LYS CB C 77 32.538 32.538 32.349 0.188 18478 1711 1 4 . 1 1 77 77 LYS H H 77 8.543 8.543 7.926 0.617 18478 1712 1 4 . 1 1 78 78 ARG N N 78 122.233 122.233 119.598 2.635 18478 1713 1 4 . 1 1 78 78 ARG HA H 78 4.286 4.286 3.951 0.335 18478 1714 1 4 . 1 1 78 78 ARG C C 78 173.652 173.652 174.481 -0.829 18478 1715 1 4 . 1 1 78 78 ARG CA C 78 55.780 55.780 57.107 -1.327 18478 1716 1 4 . 1 1 78 78 ARG CB C 78 29.554 29.554 29.461 0.093 18478 1717 1 4 . 1 1 78 78 ARG H H 78 8.864 8.864 8.769 0.095 18478 1718 1 4 . 1 1 79 79 LYS N N 79 128.197 128.197 119.682 8.515 18478 1719 1 4 . 1 1 79 79 LYS HA H 79 4.221 4.221 4.537 -0.316 18478 1720 1 4 . 1 1 79 79 LYS C C 79 174.336 174.336 175.934 -1.598 18478 1721 1 4 . 1 1 79 79 LYS CA C 79 58.986 58.986 55.961 3.025 18478 1722 1 4 . 1 1 79 79 LYS CB C 79 32.072 32.072 32.887 -0.815 18478 1723 1 4 . 1 1 79 79 LYS H H 79 8.927 8.927 8.178 0.749 18478 1724 1 4 . 1 1 80 80 GLY N N 80 114.730 114.730 109.644 5.086 18478 1725 1 4 . 1 1 80 80 GLY C C 80 176.536 176.536 174.809 1.727 18478 1726 1 4 . 1 1 80 80 GLY CA C 80 45.992 45.992 45.875 0.117 18478 1727 1 4 . 1 1 80 80 GLY H H 80 8.943 8.943 8.643 0.300 18478 1728 1 4 . 1 1 81 81 PHE N N 81 123.770 123.770 118.801 4.969 18478 1729 1 4 . 1 1 81 81 PHE HA H 81 3.336 3.336 4.349 -1.013 18478 1730 1 4 . 1 1 81 81 PHE C C 81 174.037 174.037 176.321 -2.284 18478 1731 1 4 . 1 1 81 81 PHE CA C 81 63.094 63.094 59.478 3.616 18478 1732 1 4 . 1 1 81 81 PHE CB C 81 39.823 39.823 38.850 0.973 18478 1733 1 4 . 1 1 81 81 PHE H H 81 8.281 8.281 8.105 0.176 18478 1734 1 4 . 1 1 82 82 ASN N N 82 119.812 119.812 116.602 3.210 18478 1735 1 4 . 1 1 82 82 ASN HA H 82 4.458 4.458 4.310 0.148 18478 1736 1 4 . 1 1 82 82 ASN C C 82 171.290 171.290 176.596 -5.306 18478 1737 1 4 . 1 1 82 82 ASN CA C 82 56.060 56.060 56.127 -0.067 18478 1738 1 4 . 1 1 82 82 ASN CB C 82 36.390 36.390 38.409 -2.019 18478 1739 1 4 . 1 1 82 82 ASN H H 82 9.145 9.145 8.589 0.556 18478 1740 1 4 . 1 1 83 83 GLU N N 83 124.411 124.411 118.655 5.756 18478 1741 1 4 . 1 1 83 83 GLU HA H 83 4.186 4.186 4.066 0.120 18478 1742 1 4 . 1 1 83 83 GLU C C 83 172.222 172.222 178.682 -6.460 18478 1743 1 4 . 1 1 83 83 GLU CA C 83 60.922 60.922 59.171 1.751 18478 1744 1 4 . 1 1 83 83 GLU CB C 83 28.132 28.132 29.804 -1.672 18478 1745 1 4 . 1 1 83 83 GLU H H 83 9.560 9.560 7.702 1.858 18478 1746 1 4 . 1 1 84 84 GLY N N 84 111.388 111.388 106.319 5.069 18478 1747 1 4 . 1 1 84 84 GLY C C 84 176.445 176.445 174.835 1.610 18478 1748 1 4 . 1 1 84 84 GLY CA C 84 46.727 46.727 46.732 -0.005 18478 1749 1 4 . 1 1 84 84 GLY H H 84 8.364 8.364 7.379 0.985 18478 1750 1 4 . 1 1 85 85 LEU N N 85 121.153 121.153 120.821 0.332 18478 1751 1 4 . 1 1 85 85 LEU HA H 85 4.236 4.236 4.234 0.002 18478 1752 1 4 . 1 1 85 85 LEU C C 85 172.285 172.285 177.661 -5.376 18478 1753 1 4 . 1 1 85 85 LEU CA C 85 56.795 56.795 57.131 -0.336 18478 1754 1 4 . 1 1 85 85 LEU CB C 85 41.113 41.113 42.859 -1.746 18478 1755 1 4 . 1 1 85 85 LEU H H 85 8.294 8.294 7.580 0.714 18478 1756 1 4 . 1 1 86 86 TRP N N 86 118.898 118.898 118.611 0.287 18478 1757 1 4 . 1 1 86 86 TRP HA H 86 4.161 4.161 4.294 -0.133 18478 1758 1 4 . 1 1 86 86 TRP C C 86 171.741 171.741 176.399 -4.658 18478 1759 1 4 . 1 1 86 86 TRP CA C 86 62.153 62.153 58.493 3.660 18478 1760 1 4 . 1 1 86 86 TRP CB C 86 28.424 28.424 29.672 -1.248 18478 1761 1 4 . 1 1 86 86 TRP H H 86 7.783 7.783 7.436 0.347 18478 1762 1 4 . 1 1 87 87 GLU N N 87 120.718 120.718 119.388 1.330 18478 1763 1 4 . 1 1 87 87 GLU HA H 87 3.416 3.416 4.700 -1.284 18478 1764 1 4 . 1 1 87 87 GLU C C 87 172.957 172.957 175.022 -2.065 18478 1765 1 4 . 1 1 87 87 GLU CA C 87 60.122 60.122 53.298 6.824 18478 1766 1 4 . 1 1 87 87 GLU CB C 87 31.021 31.021 30.415 0.606 18478 1767 1 4 . 1 1 87 87 GLU H H 87 8.779 8.779 7.578 1.201 18478 1768 1 4 . 1 1 88 88 ILE HA H 88 2.478 2.478 4.255 -1.777 18478 1769 1 4 . 1 1 88 88 ILE C C 88 177.873 177.873 177.381 0.492 18478 1770 1 4 . 1 1 88 88 ILE CA C 88 65.248 65.248 62.371 2.877 18478 1771 1 4 . 1 1 88 88 ILE CB C 88 37.327 37.327 38.547 -1.220 18478 1772 1 4 . 1 1 89 89 ASP N N 89 114.411 114.411 119.056 -4.645 18478 1773 1 4 . 1 1 89 89 ASP HA H 89 4.589 4.589 4.511 0.078 18478 1774 1 4 . 1 1 89 89 ASP C C 89 174.207 174.207 178.251 -4.044 18478 1775 1 4 . 1 1 89 89 ASP CA C 89 54.740 54.740 56.607 -1.867 18478 1776 1 4 . 1 1 89 89 ASP CB C 89 42.473 42.473 40.379 2.094 18478 1777 1 4 . 1 1 89 89 ASP H H 89 5.911 5.911 7.997 -2.086 18478 1778 1 4 . 1 1 90 90 ASN N N 90 114.358 114.358 114.313 0.045 18478 1779 1 4 . 1 1 90 90 ASN HA H 90 4.420 4.420 4.323 0.097 18478 1780 1 4 . 1 1 90 90 ASN C C 90 176.991 176.991 177.500 -0.509 18478 1781 1 4 . 1 1 90 90 ASN CA C 90 54.855 54.855 56.497 -1.642 18478 1782 1 4 . 1 1 90 90 ASN CB C 90 40.582 40.582 38.177 2.405 18478 1783 1 4 . 1 1 90 90 ASN H H 90 7.480 7.480 7.821 -0.341 18478 1784 1 4 . 1 1 91 91 ASN N N 91 119.185 119.185 116.170 3.015 18478 1785 1 4 . 1 1 91 91 ASN HA H 91 5.006 5.006 4.845 0.161 18478 1786 1 4 . 1 1 91 91 ASN CA C 91 51.624 51.624 54.982 -3.358 18478 1787 1 4 . 1 1 91 91 ASN CB C 91 38.752 38.752 38.316 0.436 18478 1788 1 4 . 1 1 91 91 ASN H H 91 9.238 9.238 7.869 1.369 18478 1789 1 4 . 1 1 92 92 PRO HA H 92 4.296 4.296 4.309 -0.013 18478 1790 1 4 . 1 1 92 92 PRO C C 92 173.690 173.690 176.779 -3.089 18478 1791 1 4 . 1 1 92 92 PRO CA C 92 64.714 64.714 65.389 -0.675 18478 1792 1 4 . 1 1 92 92 PRO CB C 92 31.781 31.781 32.996 -1.215 18478 1793 1 5 . 1 1 3 3 GLY C C 3 177.088 177.088 172.732 4.356 18478 1794 1 5 . 1 1 3 3 GLY CA C 3 45.330 45.330 46.021 -0.691 18478 1795 1 5 . 1 1 4 4 SER N N 4 115.847 115.847 110.737 5.110 18478 1796 1 5 . 1 1 4 4 SER HA H 4 4.480 4.480 4.633 -0.153 18478 1797 1 5 . 1 1 4 4 SER C C 4 177.991 177.991 172.387 5.604 18478 1798 1 5 . 1 1 4 4 SER CA C 4 58.742 58.742 58.184 0.558 18478 1799 1 5 . 1 1 4 4 SER CB C 4 63.820 63.820 65.120 -1.300 18478 1800 1 5 . 1 1 4 4 SER H H 4 8.207 8.207 7.584 0.623 18478 1801 1 5 . 1 1 5 5 MET N N 5 125.867 125.867 121.791 4.076 18478 1802 1 5 . 1 1 5 5 MET HA H 5 4.580 4.580 4.579 0.001 18478 1803 1 5 . 1 1 5 5 MET C C 5 174.825 174.825 176.538 -1.713 18478 1804 1 5 . 1 1 5 5 MET CA C 5 54.733 54.733 55.512 -0.779 18478 1805 1 5 . 1 1 5 5 MET CB C 5 33.527 33.527 34.692 -1.165 18478 1806 1 5 . 1 1 5 5 MET H H 5 8.148 8.148 8.723 -0.575 18478 1807 1 5 . 1 1 6 6 THR N N 6 115.828 115.828 115.326 0.502 18478 1808 1 5 . 1 1 6 6 THR HA H 6 3.903 3.903 4.512 -0.609 18478 1809 1 5 . 1 1 6 6 THR C C 6 176.930 176.930 172.822 4.108 18478 1810 1 5 . 1 1 6 6 THR CA C 6 63.034 63.034 60.772 2.262 18478 1811 1 5 . 1 1 6 6 THR CB C 6 69.308 69.308 68.778 0.530 18478 1812 1 5 . 1 1 6 6 THR H H 6 8.408 8.408 8.469 -0.061 18478 1813 1 5 . 1 1 7 7 ARG HA H 7 4.276 4.276 4.220 0.056 18478 1814 1 5 . 1 1 7 7 ARG C C 7 176.546 176.546 176.375 0.171 18478 1815 1 5 . 1 1 7 7 ARG CA C 7 55.813 55.813 56.371 -0.558 18478 1816 1 5 . 1 1 7 7 ARG CB C 7 30.556 30.556 30.716 -0.160 18478 1817 1 5 . 1 1 8 8 ASP N N 8 121.762 121.762 125.631 -3.869 18478 1818 1 5 . 1 1 8 8 ASP HA H 8 4.537 4.537 4.199 0.338 18478 1819 1 5 . 1 1 8 8 ASP C C 8 177.750 177.750 174.946 2.804 18478 1820 1 5 . 1 1 8 8 ASP CA C 8 54.117 54.117 54.901 -0.784 18478 1821 1 5 . 1 1 8 8 ASP H H 8 8.066 8.066 8.474 -0.408 18478 1822 1 5 . 1 1 9 9 PHE N N 9 119.991 119.991 118.891 1.100 18478 1823 1 5 . 1 1 9 9 PHE HA H 9 4.734 4.734 5.112 -0.378 18478 1824 1 5 . 1 1 9 9 PHE C C 9 176.838 176.838 175.242 1.596 18478 1825 1 5 . 1 1 9 9 PHE CA C 9 58.303 58.303 57.179 1.124 18478 1826 1 5 . 1 1 9 9 PHE CB C 9 41.594 41.594 41.234 0.360 18478 1827 1 5 . 1 1 9 9 PHE H H 9 8.103 8.103 7.623 0.480 18478 1828 1 5 . 1 1 10 10 LYS N N 10 122.957 122.957 123.983 -1.026 18478 1829 1 5 . 1 1 10 10 LYS CA C 10 53.167 53.167 55.908 -2.741 18478 1830 1 5 . 1 1 10 10 LYS CB C 10 33.495 33.495 31.705 1.790 18478 1831 1 5 . 1 1 10 10 LYS H H 10 9.087 9.087 8.962 0.125 18478 1832 1 5 . 1 1 11 11 PRO HA H 11 3.903 3.903 4.953 -1.050 18478 1833 1 5 . 1 1 11 11 PRO C C 11 173.988 173.988 174.695 -0.707 18478 1834 1 5 . 1 1 11 11 PRO CA C 11 63.874 63.874 60.761 3.113 18478 1835 1 5 . 1 1 11 11 PRO CB C 11 31.623 31.623 34.872 -3.249 18478 1836 1 5 . 1 1 12 12 GLY N N 12 115.413 115.413 111.178 4.235 18478 1837 1 5 . 1 1 12 12 GLY C C 12 176.966 176.966 172.640 4.326 18478 1838 1 5 . 1 1 12 12 GLY CA C 12 44.651 44.651 42.052 2.599 18478 1839 1 5 . 1 1 12 12 GLY H H 12 9.667 9.667 9.052 0.615 18478 1840 1 5 . 1 1 13 13 ASP N N 13 122.208 122.208 128.618 -6.410 18478 1841 1 5 . 1 1 13 13 ASP HA H 13 4.601 4.601 4.651 -0.050 18478 1842 1 5 . 1 1 13 13 ASP C C 13 176.244 176.244 174.263 1.981 18478 1843 1 5 . 1 1 13 13 ASP CA C 13 55.870 55.870 52.186 3.684 18478 1844 1 5 . 1 1 13 13 ASP CB C 13 40.794 40.794 42.566 -1.772 18478 1845 1 5 . 1 1 13 13 ASP H H 13 8.303 8.303 8.403 -0.100 18478 1846 1 5 . 1 1 14 14 LEU N N 14 121.306 121.306 126.619 -5.313 18478 1847 1 5 . 1 1 14 14 LEU HA H 14 4.982 4.982 4.581 0.401 18478 1848 1 5 . 1 1 14 14 LEU C C 14 173.461 173.461 176.184 -2.723 18478 1849 1 5 . 1 1 14 14 LEU CA C 14 54.516 54.516 53.648 0.868 18478 1850 1 5 . 1 1 14 14 LEU CB C 14 40.999 40.999 41.966 -0.967 18478 1851 1 5 . 1 1 14 14 LEU H H 14 8.618 8.618 7.711 0.907 18478 1852 1 5 . 1 1 15 15 ILE N N 15 118.806 118.806 125.481 -6.675 18478 1853 1 5 . 1 1 15 15 ILE HA H 15 5.356 5.356 4.323 1.033 18478 1854 1 5 . 1 1 15 15 ILE C C 15 175.982 175.982 176.050 -0.068 18478 1855 1 5 . 1 1 15 15 ILE CA C 15 60.481 60.481 60.793 -0.312 18478 1856 1 5 . 1 1 15 15 ILE CB C 15 44.142 44.142 40.487 3.655 18478 1857 1 5 . 1 1 15 15 ILE H H 15 8.864 8.864 8.540 0.324 18478 1858 1 5 . 1 1 16 16 PHE N N 16 112.472 112.472 123.738 -11.266 18478 1859 1 5 . 1 1 16 16 PHE HA H 16 5.306 5.306 4.277 1.029 18478 1860 1 5 . 1 1 16 16 PHE C C 16 176.239 176.239 176.391 -0.152 18478 1861 1 5 . 1 1 16 16 PHE CA C 16 58.603 58.603 59.330 -0.727 18478 1862 1 5 . 1 1 16 16 PHE CB C 16 43.305 43.305 38.423 4.882 18478 1863 1 5 . 1 1 16 16 PHE H H 16 9.411 9.411 8.684 0.727 18478 1864 1 5 . 1 1 17 17 ALA N N 17 123.889 123.889 127.651 -3.762 18478 1865 1 5 . 1 1 17 17 ALA HA H 17 5.348 5.348 3.690 1.658 18478 1866 1 5 . 1 1 17 17 ALA C C 17 174.426 174.426 176.639 -2.213 18478 1867 1 5 . 1 1 17 17 ALA CA C 17 50.062 50.062 51.646 -1.584 18478 1868 1 5 . 1 1 17 17 ALA H H 17 9.658 9.658 8.587 1.071 18478 1869 1 5 . 1 1 18 18 LYS N N 18 127.760 127.760 121.791 5.969 18478 1870 1 5 . 1 1 18 18 LYS HA H 18 4.697 4.697 4.737 -0.040 18478 1871 1 5 . 1 1 18 18 LYS C C 18 178.554 178.554 174.691 3.863 18478 1872 1 5 . 1 1 18 18 LYS CA C 18 53.893 53.893 52.183 1.710 18478 1873 1 5 . 1 1 18 18 LYS CB C 18 35.291 35.291 32.250 3.041 18478 1874 1 5 . 1 1 18 18 LYS H H 18 9.421 9.421 7.370 2.051 18478 1875 1 5 . 1 1 19 19 MET HA H 19 4.656 4.656 4.613 0.043 18478 1876 1 5 . 1 1 19 19 MET C C 19 175.741 175.741 174.873 0.868 18478 1877 1 5 . 1 1 19 19 MET CA C 19 53.916 53.916 54.701 -0.785 18478 1878 1 5 . 1 1 19 19 MET CB C 19 35.799 35.799 33.678 2.120 18478 1879 1 5 . 1 1 20 20 LYS N N 20 124.062 124.062 117.728 6.334 18478 1880 1 5 . 1 1 20 20 LYS CA C 20 58.585 58.585 55.918 2.667 18478 1881 1 5 . 1 1 20 20 LYS CB C 20 31.978 31.978 33.032 -1.054 18478 1882 1 5 . 1 1 20 20 LYS H H 20 8.645 8.645 8.041 0.604 18478 1883 1 5 . 1 1 21 21 GLY C C 21 176.205 176.205 172.160 4.045 18478 1884 1 5 . 1 1 21 21 GLY CA C 21 45.142 45.142 41.797 3.345 18478 1885 1 5 . 1 1 22 22 TYR HA H 22 4.573 4.573 4.807 -0.234 18478 1886 1 5 . 1 1 22 22 TYR CA C 22 55.748 55.748 57.830 -2.082 18478 1887 1 5 . 1 1 22 22 TYR CB C 22 41.331 41.331 37.762 3.569 18478 1888 1 5 . 1 1 23 23 PRO HA H 23 4.759 4.759 5.040 -0.281 18478 1889 1 5 . 1 1 23 23 PRO C C 23 174.587 174.587 175.198 -0.611 18478 1890 1 5 . 1 1 23 23 PRO CA C 23 62.072 62.072 61.308 0.764 18478 1891 1 5 . 1 1 23 23 PRO CB C 23 31.077 31.077 35.151 -4.074 18478 1892 1 5 . 1 1 24 24 HIS N N 24 119.190 119.190 115.815 3.375 18478 1893 1 5 . 1 1 24 24 HIS HA H 24 3.983 3.983 5.819 -1.836 18478 1894 1 5 . 1 1 24 24 HIS C C 24 175.555 175.555 174.566 0.989 18478 1895 1 5 . 1 1 24 24 HIS CA C 24 60.973 60.973 53.825 7.148 18478 1896 1 5 . 1 1 24 24 HIS CB C 24 30.689 30.689 32.831 -2.142 18478 1897 1 5 . 1 1 24 24 HIS H H 24 8.158 8.158 8.733 -0.575 18478 1898 1 5 . 1 1 25 25 TRP N N 25 127.435 127.435 122.685 4.750 18478 1899 1 5 . 1 1 25 25 TRP HA H 25 3.760 3.760 5.107 -1.347 18478 1900 1 5 . 1 1 25 25 TRP CA C 25 55.890 55.890 57.717 -1.827 18478 1901 1 5 . 1 1 25 25 TRP CB C 25 32.879 32.879 29.955 2.924 18478 1902 1 5 . 1 1 25 25 TRP H H 25 9.211 9.211 8.701 0.510 18478 1903 1 5 . 1 1 26 26 PRO HA H 26 4.217 4.217 4.601 -0.384 18478 1904 1 5 . 1 1 26 26 PRO C C 26 176.279 176.279 175.904 0.375 18478 1905 1 5 . 1 1 26 26 PRO CA C 26 63.140 63.140 61.908 1.232 18478 1906 1 5 . 1 1 26 26 PRO CB C 26 32.171 32.171 34.157 -1.986 18478 1907 1 5 . 1 1 27 27 ALA N N 27 130.162 130.162 126.067 4.095 18478 1908 1 5 . 1 1 27 27 ALA HA H 27 4.981 4.981 4.244 0.737 18478 1909 1 5 . 1 1 27 27 ALA C C 27 177.227 177.227 177.471 -0.244 18478 1910 1 5 . 1 1 27 27 ALA CA C 27 52.574 52.574 51.894 0.680 18478 1911 1 5 . 1 1 27 27 ALA CB C 27 23.239 23.239 20.424 2.815 18478 1912 1 5 . 1 1 27 27 ALA H H 27 9.394 9.394 8.313 1.081 18478 1913 1 5 . 1 1 28 28 ARG N N 28 117.381 117.381 118.793 -1.412 18478 1914 1 5 . 1 1 28 28 ARG HA H 28 5.421 5.421 4.338 1.083 18478 1915 1 5 . 1 1 28 28 ARG C C 28 176.465 176.465 175.232 1.233 18478 1916 1 5 . 1 1 28 28 ARG CA C 28 53.662 53.662 55.120 -1.458 18478 1917 1 5 . 1 1 28 28 ARG CB C 28 35.058 35.058 30.017 5.041 18478 1918 1 5 . 1 1 28 28 ARG H H 28 8.806 8.806 8.412 0.394 18478 1919 1 5 . 1 1 29 29 VAL HA H 29 4.109 4.109 4.167 -0.058 18478 1920 1 5 . 1 1 29 29 VAL C C 29 175.996 175.996 174.998 0.998 18478 1921 1 5 . 1 1 29 29 VAL CA C 29 62.810 62.810 61.767 1.043 18478 1922 1 5 . 1 1 29 29 VAL CB C 29 31.108 31.108 32.601 -1.493 18478 1923 1 5 . 1 1 30 30 ASP N N 30 133.830 133.830 118.028 15.802 18478 1924 1 5 . 1 1 30 30 ASP HA H 30 5.198 5.198 4.644 0.554 18478 1925 1 5 . 1 1 30 30 ASP C C 30 176.207 176.207 177.392 -1.185 18478 1926 1 5 . 1 1 30 30 ASP CA C 30 53.007 53.007 54.168 -1.161 18478 1927 1 5 . 1 1 30 30 ASP CB C 30 44.130 44.130 42.147 1.983 18478 1928 1 5 . 1 1 30 30 ASP H H 30 8.892 8.892 8.455 0.437 18478 1929 1 5 . 1 1 31 31 GLU N N 31 115.905 115.905 123.023 -7.118 18478 1930 1 5 . 1 1 31 31 GLU HA H 31 4.409 4.409 3.970 0.439 18478 1931 1 5 . 1 1 31 31 GLU C C 31 175.192 175.192 175.975 -0.783 18478 1932 1 5 . 1 1 31 31 GLU CA C 31 55.389 55.389 56.886 -1.496 18478 1933 1 5 . 1 1 31 31 GLU H H 31 7.966 7.966 8.862 -0.896 18478 1934 1 5 . 1 1 32 32 VAL N N 32 122.794 122.794 117.243 5.551 18478 1935 1 5 . 1 1 32 32 VAL HA H 32 4.303 4.303 3.736 0.567 18478 1936 1 5 . 1 1 32 32 VAL CA C 32 60.408 60.408 62.814 -2.406 18478 1937 1 5 . 1 1 32 32 VAL CB C 32 32.333 32.333 30.748 1.585 18478 1938 1 5 . 1 1 32 32 VAL H H 32 8.702 8.702 7.974 0.728 18478 1939 1 5 . 1 1 33 33 PRO HA H 33 4.572 4.572 4.170 0.402 18478 1940 1 5 . 1 1 33 33 PRO C C 33 175.366 175.366 177.157 -1.791 18478 1941 1 5 . 1 1 33 33 PRO CA C 33 63.702 63.702 65.021 -1.319 18478 1942 1 5 . 1 1 33 33 PRO CB C 33 32.736 32.736 32.153 0.583 18478 1943 1 5 . 1 1 34 34 ASP N N 34 119.187 119.187 117.814 1.373 18478 1944 1 5 . 1 1 34 34 ASP HA H 34 4.679 4.679 4.804 -0.125 18478 1945 1 5 . 1 1 34 34 ASP C C 34 175.713 175.713 173.683 2.030 18478 1946 1 5 . 1 1 34 34 ASP CA C 34 53.013 53.013 52.107 0.906 18478 1947 1 5 . 1 1 34 34 ASP CB C 34 40.850 40.850 41.102 -0.252 18478 1948 1 5 . 1 1 34 34 ASP H H 34 8.686 8.686 8.046 0.640 18478 1949 1 5 . 1 1 35 35 GLY C C 35 177.458 177.458 172.658 4.800 18478 1950 1 5 . 1 1 35 35 GLY CA C 35 45.507 45.507 43.909 1.598 18478 1951 1 5 . 1 1 36 36 ALA HA H 36 4.404 4.404 4.322 0.082 18478 1952 1 5 . 1 1 36 36 ALA CA C 36 52.010 52.010 51.809 0.201 18478 1953 1 5 . 1 1 36 36 ALA CB C 36 19.909 19.909 19.729 0.180 18478 1954 1 5 . 1 1 37 37 VAL N N 37 119.594 119.594 120.933 -1.339 18478 1955 1 5 . 1 1 37 37 VAL HA H 37 3.932 3.932 4.197 -0.265 18478 1956 1 5 . 1 1 37 37 VAL C C 37 175.966 175.966 175.756 0.210 18478 1957 1 5 . 1 1 37 37 VAL CA C 37 62.810 62.810 63.954 -1.144 18478 1958 1 5 . 1 1 37 37 VAL CB C 37 32.267 32.267 33.505 -1.238 18478 1959 1 5 . 1 1 37 37 VAL H H 37 8.037 8.037 8.442 -0.405 18478 1960 1 5 . 1 1 38 38 LYS N N 38 125.676 125.676 119.734 5.942 18478 1961 1 5 . 1 1 38 38 LYS C C 38 173.865 173.865 175.132 -1.267 18478 1962 1 5 . 1 1 38 38 LYS CA C 38 54.278 54.278 56.577 -2.299 18478 1963 1 5 . 1 1 38 38 LYS CB C 38 31.740 31.740 33.880 -2.140 18478 1964 1 5 . 1 1 38 38 LYS H H 38 8.292 8.292 8.389 -0.097 18478 1965 1 5 . 1 1 40 40 PRO HA H 40 4.387 4.387 5.258 -0.871 18478 1966 1 5 . 1 1 40 40 PRO C C 40 175.535 175.535 175.181 0.354 18478 1967 1 5 . 1 1 40 40 PRO CA C 40 62.330 62.330 59.545 2.785 18478 1968 1 5 . 1 1 40 40 PRO CB C 40 32.086 32.086 31.723 0.363 18478 1969 1 5 . 1 1 41 41 THR HA H 41 4.027 4.027 4.531 -0.504 18478 1970 1 5 . 1 1 41 41 THR C C 41 176.795 176.795 173.065 3.730 18478 1971 1 5 . 1 1 41 41 THR CA C 41 63.693 63.693 62.279 1.414 18478 1972 1 5 . 1 1 41 41 THR CB C 41 69.370 69.370 68.896 0.474 18478 1973 1 5 . 1 1 42 42 ASN N N 42 118.513 118.513 122.138 -3.625 18478 1974 1 5 . 1 1 42 42 ASN HA H 42 4.530 4.530 5.315 -0.785 18478 1975 1 5 . 1 1 42 42 ASN C C 42 177.230 177.230 175.052 2.178 18478 1976 1 5 . 1 1 42 42 ASN CA C 42 56.373 56.373 50.355 6.018 18478 1977 1 5 . 1 1 42 42 ASN CB C 42 37.618 37.618 37.851 -0.233 18478 1978 1 5 . 1 1 42 42 ASN H H 42 8.752 8.752 8.718 0.034 18478 1979 1 5 . 1 1 43 43 LYS N N 43 115.898 115.898 128.686 -12.788 18478 1980 1 5 . 1 1 43 43 LYS HA H 43 4.710 4.710 4.713 -0.003 18478 1981 1 5 . 1 1 43 43 LYS C C 43 177.032 177.032 176.043 0.989 18478 1982 1 5 . 1 1 43 43 LYS CA C 43 54.957 54.957 55.200 -0.242 18478 1983 1 5 . 1 1 43 43 LYS CB C 43 36.600 36.600 33.239 3.361 18478 1984 1 5 . 1 1 43 43 LYS H H 43 7.723 7.723 8.383 -0.660 18478 1985 1 5 . 1 1 44 44 LEU N N 44 121.006 121.006 128.861 -7.855 18478 1986 1 5 . 1 1 44 44 LEU HA H 44 5.000 5.000 4.257 0.743 18478 1987 1 5 . 1 1 44 44 LEU CA C 44 51.842 51.842 55.092 -3.250 18478 1988 1 5 . 1 1 44 44 LEU CB C 44 44.418 44.418 41.596 2.822 18478 1989 1 5 . 1 1 44 44 LEU H H 44 9.063 9.063 8.691 0.372 18478 1990 1 5 . 1 1 45 45 PRO HA H 45 4.392 4.392 4.474 -0.082 18478 1991 1 5 . 1 1 45 45 PRO C C 45 177.051 177.051 177.810 -0.759 18478 1992 1 5 . 1 1 45 45 PRO CA C 45 62.000 62.000 64.481 -2.481 18478 1993 1 5 . 1 1 45 45 PRO CB C 45 30.737 30.737 32.504 -1.767 18478 1994 1 5 . 1 1 46 46 ILE N N 46 125.996 125.996 125.821 0.175 18478 1995 1 5 . 1 1 46 46 ILE HA H 46 4.564 4.564 4.071 0.493 18478 1996 1 5 . 1 1 46 46 ILE C C 46 176.985 176.985 175.538 1.447 18478 1997 1 5 . 1 1 46 46 ILE CA C 46 57.051 57.051 62.269 -5.218 18478 1998 1 5 . 1 1 46 46 ILE H H 46 8.908 8.908 8.259 0.649 18478 1999 1 5 . 1 1 47 47 PHE N N 47 128.276 128.276 117.456 10.820 18478 2000 1 5 . 1 1 47 47 PHE HA H 47 4.827 4.827 4.150 0.677 18478 2001 1 5 . 1 1 47 47 PHE C C 47 177.835 177.835 175.806 2.029 18478 2002 1 5 . 1 1 47 47 PHE CA C 47 56.099 56.099 57.776 -1.677 18478 2003 1 5 . 1 1 47 47 PHE CB C 47 41.217 41.217 39.833 1.385 18478 2004 1 5 . 1 1 47 47 PHE H H 47 8.739 8.739 7.558 1.181 18478 2005 1 5 . 1 1 48 48 PHE N N 48 125.953 125.953 116.844 9.109 18478 2006 1 5 . 1 1 48 48 PHE HA H 48 4.251 4.251 4.269 -0.018 18478 2007 1 5 . 1 1 48 48 PHE C C 48 175.869 175.869 174.444 1.425 18478 2008 1 5 . 1 1 48 48 PHE CA C 48 56.744 56.744 59.678 -2.933 18478 2009 1 5 . 1 1 48 48 PHE CB C 48 38.835 38.835 35.826 3.009 18478 2010 1 5 . 1 1 48 48 PHE H H 48 8.545 8.545 7.576 0.969 18478 2011 1 5 . 1 1 49 49 PHE N N 49 122.197 122.197 117.984 4.213 18478 2012 1 5 . 1 1 49 49 PHE HA H 49 4.400 4.400 4.205 0.195 18478 2013 1 5 . 1 1 49 49 PHE C C 49 174.016 174.016 174.619 -0.603 18478 2014 1 5 . 1 1 49 49 PHE CA C 49 59.916 59.916 57.939 1.977 18478 2015 1 5 . 1 1 49 49 PHE CB C 49 39.799 39.799 39.821 -0.022 18478 2016 1 5 . 1 1 49 49 PHE H H 49 8.619 8.619 7.415 1.204 18478 2017 1 5 . 1 1 50 50 GLY N N 50 114.083 114.083 106.752 7.331 18478 2018 1 5 . 1 1 50 50 GLY C C 50 175.636 175.636 173.387 2.249 18478 2019 1 5 . 1 1 50 50 GLY CA C 50 46.718 46.718 43.816 2.902 18478 2020 1 5 . 1 1 50 50 GLY H H 50 10.329 10.329 8.038 2.291 18478 2021 1 5 . 1 1 51 51 THR N N 51 111.210 111.210 117.632 -6.422 18478 2022 1 5 . 1 1 51 51 THR HA H 51 3.980 3.980 4.535 -0.555 18478 2023 1 5 . 1 1 51 51 THR C C 51 175.588 175.588 171.948 3.640 18478 2024 1 5 . 1 1 51 51 THR CA C 51 62.223 62.223 61.306 0.917 18478 2025 1 5 . 1 1 51 51 THR CB C 51 68.346 68.346 72.164 -3.818 18478 2026 1 5 . 1 1 51 51 THR H H 51 7.882 7.882 8.396 -0.514 18478 2027 1 5 . 1 1 52 52 HIS N N 52 115.544 115.544 120.730 -5.186 18478 2028 1 5 . 1 1 52 52 HIS HA H 52 3.712 3.712 5.467 -1.755 18478 2029 1 5 . 1 1 52 52 HIS C C 52 177.717 177.717 174.583 3.134 18478 2030 1 5 . 1 1 52 52 HIS CA C 52 54.860 54.860 54.408 0.452 18478 2031 1 5 . 1 1 52 52 HIS CB C 52 26.388 26.388 30.434 -4.046 18478 2032 1 5 . 1 1 52 52 HIS H H 52 7.791 7.791 8.707 -0.916 18478 2033 1 5 . 1 1 53 53 GLU N N 53 117.517 117.517 121.640 -4.123 18478 2034 1 5 . 1 1 53 53 GLU HA H 53 4.298 4.298 4.829 -0.531 18478 2035 1 5 . 1 1 53 53 GLU C C 53 176.958 176.958 176.493 0.465 18478 2036 1 5 . 1 1 53 53 GLU CA C 53 55.403 55.403 55.235 0.168 18478 2037 1 5 . 1 1 53 53 GLU CB C 53 31.588 31.588 33.914 -2.326 18478 2038 1 5 . 1 1 53 53 GLU H H 53 6.795 6.795 8.398 -1.603 18478 2039 1 5 . 1 1 54 54 THR N N 54 111.182 111.182 116.301 -5.119 18478 2040 1 5 . 1 1 54 54 THR HA H 54 5.648 5.648 4.368 1.280 18478 2041 1 5 . 1 1 54 54 THR C C 54 177.234 177.234 174.525 2.709 18478 2042 1 5 . 1 1 54 54 THR CA C 54 59.894 59.894 61.136 -1.242 18478 2043 1 5 . 1 1 54 54 THR H H 54 8.139 8.139 8.689 -0.550 18478 2044 1 5 . 1 1 55 55 ALA HA H 55 4.403 4.403 4.331 0.072 18478 2045 1 5 . 1 1 55 55 ALA C C 55 176.601 176.601 177.157 -0.556 18478 2046 1 5 . 1 1 55 55 ALA CA C 55 51.079 51.079 52.851 -1.772 18478 2047 1 5 . 1 1 55 55 ALA CB C 55 23.285 23.285 19.235 4.050 18478 2048 1 5 . 1 1 56 56 PHE N N 56 118.058 118.058 114.121 3.937 18478 2049 1 5 . 1 1 56 56 PHE HA H 56 5.678 5.678 4.595 1.083 18478 2050 1 5 . 1 1 56 56 PHE C C 56 175.962 175.962 175.622 0.340 18478 2051 1 5 . 1 1 56 56 PHE CA C 56 56.008 56.008 58.066 -2.058 18478 2052 1 5 . 1 1 56 56 PHE CB C 56 39.995 39.995 38.131 1.864 18478 2053 1 5 . 1 1 56 56 PHE H H 56 8.523 8.523 8.296 0.227 18478 2054 1 5 . 1 1 57 57 LEU N N 57 123.344 123.344 120.076 3.268 18478 2055 1 5 . 1 1 57 57 LEU HA H 57 4.929 4.929 4.571 0.358 18478 2056 1 5 . 1 1 57 57 LEU C C 57 175.584 175.584 175.201 0.383 18478 2057 1 5 . 1 1 57 57 LEU CA C 57 53.463 53.463 55.328 -1.865 18478 2058 1 5 . 1 1 57 57 LEU CB C 57 46.545 46.545 43.122 3.423 18478 2059 1 5 . 1 1 57 57 LEU H H 57 8.579 8.579 7.654 0.925 18478 2060 1 5 . 1 1 58 58 GLY N N 58 108.499 108.499 106.608 1.891 18478 2061 1 5 . 1 1 58 58 GLY CA C 58 43.755 43.755 44.888 -1.133 18478 2062 1 5 . 1 1 58 58 GLY H H 58 9.318 9.318 7.062 2.256 18478 2063 1 5 . 1 1 59 59 PRO HA H 59 4.048 4.048 4.917 -0.869 18478 2064 1 5 . 1 1 59 59 PRO C C 59 173.763 173.763 174.736 -0.973 18478 2065 1 5 . 1 1 59 59 PRO CA C 59 64.770 64.770 60.319 4.450 18478 2066 1 5 . 1 1 59 59 PRO CB C 59 31.889 31.889 35.640 -3.751 18478 2067 1 5 . 1 1 60 60 LYS HA H 60 4.191 4.191 4.553 -0.362 18478 2068 1 5 . 1 1 60 60 LYS C C 60 174.842 174.842 176.603 -1.761 18478 2069 1 5 . 1 1 60 60 LYS CA C 60 57.875 57.875 56.072 1.803 18478 2070 1 5 . 1 1 60 60 LYS CB C 60 31.576 31.576 32.690 -1.114 18478 2071 1 5 . 1 1 61 61 ASP N N 61 117.768 117.768 124.363 -6.595 18478 2072 1 5 . 1 1 61 61 ASP HA H 61 4.973 4.973 4.317 0.656 18478 2073 1 5 . 1 1 61 61 ASP C C 61 178.178 178.178 176.981 1.197 18478 2074 1 5 . 1 1 61 61 ASP CA C 61 54.687 54.687 55.947 -1.260 18478 2075 1 5 . 1 1 61 61 ASP CB C 61 43.555 43.555 39.586 3.969 18478 2076 1 5 . 1 1 61 61 ASP H H 61 7.722 7.722 8.809 -1.087 18478 2077 1 5 . 1 1 62 62 ILE N N 62 114.244 114.244 121.534 -7.290 18478 2078 1 5 . 1 1 62 62 ILE HA H 62 4.891 4.891 3.355 1.536 18478 2079 1 5 . 1 1 62 62 ILE C C 62 178.027 178.027 177.286 0.741 18478 2080 1 5 . 1 1 62 62 ILE CA C 62 59.994 59.994 65.496 -5.502 18478 2081 1 5 . 1 1 62 62 ILE CB C 62 40.652 40.652 37.109 3.543 18478 2082 1 5 . 1 1 62 62 ILE H H 62 6.784 6.784 7.749 -0.965 18478 2083 1 5 . 1 1 63 63 PHE N N 63 119.819 119.819 119.953 -0.134 18478 2084 1 5 . 1 1 63 63 PHE HA H 63 5.214 5.214 4.195 1.019 18478 2085 1 5 . 1 1 63 63 PHE CA C 63 54.735 54.735 60.059 -5.324 18478 2086 1 5 . 1 1 63 63 PHE CB C 63 42.122 42.122 38.904 3.218 18478 2087 1 5 . 1 1 63 63 PHE H H 63 8.734 8.734 7.583 1.151 18478 2088 1 5 . 1 1 64 64 PRO HA H 64 4.771 4.771 4.241 0.530 18478 2089 1 5 . 1 1 64 64 PRO C C 64 174.036 174.036 178.395 -4.359 18478 2090 1 5 . 1 1 64 64 PRO CA C 64 64.474 64.474 65.350 -0.876 18478 2091 1 5 . 1 1 64 64 PRO CB C 64 32.662 32.662 33.049 -0.387 18478 2092 1 5 . 1 1 65 65 TYR N N 65 124.335 124.335 121.629 2.706 18478 2093 1 5 . 1 1 65 65 TYR HA H 65 4.530 4.530 4.248 0.282 18478 2094 1 5 . 1 1 65 65 TYR C C 65 173.944 173.944 177.575 -3.631 18478 2095 1 5 . 1 1 65 65 TYR CA C 65 61.205 61.205 60.811 0.394 18478 2096 1 5 . 1 1 65 65 TYR CB C 65 38.844 38.844 38.049 0.795 18478 2097 1 5 . 1 1 65 65 TYR H H 65 8.359 8.359 7.843 0.516 18478 2098 1 5 . 1 1 66 66 SER N N 66 114.836 114.836 112.251 2.585 18478 2099 1 5 . 1 1 66 66 SER HA H 66 3.505 3.505 4.356 -0.851 18478 2100 1 5 . 1 1 66 66 SER C C 66 173.697 173.697 175.541 -1.844 18478 2101 1 5 . 1 1 66 66 SER CA C 66 63.078 63.078 59.645 3.433 18478 2102 1 5 . 1 1 66 66 SER CB C 66 62.223 62.223 63.001 -0.778 18478 2103 1 5 . 1 1 66 66 SER H H 66 8.974 8.974 7.670 1.304 18478 2104 1 5 . 1 1 67 67 GLU N N 67 118.013 118.013 118.616 -0.603 18478 2105 1 5 . 1 1 67 67 GLU HA H 67 4.210 4.210 4.157 0.053 18478 2106 1 5 . 1 1 67 67 GLU C C 67 174.961 174.961 177.476 -2.515 18478 2107 1 5 . 1 1 67 67 GLU CA C 67 58.330 58.330 57.805 0.525 18478 2108 1 5 . 1 1 67 67 GLU CB C 67 30.205 30.205 30.791 -0.586 18478 2109 1 5 . 1 1 67 67 GLU H H 67 8.817 8.817 7.846 0.971 18478 2110 1 5 . 1 1 68 68 ASN N N 68 113.942 113.942 112.220 1.722 18478 2111 1 5 . 1 1 68 68 ASN HA H 68 5.015 5.015 5.007 0.008 18478 2112 1 5 . 1 1 68 68 ASN C C 68 176.626 176.626 176.541 0.085 18478 2113 1 5 . 1 1 68 68 ASN CA C 68 53.768 53.768 51.749 2.019 18478 2114 1 5 . 1 1 68 68 ASN CB C 68 41.948 41.948 39.531 2.417 18478 2115 1 5 . 1 1 68 68 ASN H H 68 7.448 7.448 7.724 -0.276 18478 2116 1 5 . 1 1 69 69 LYS N N 69 124.584 124.584 121.308 3.276 18478 2117 1 5 . 1 1 69 69 LYS HA H 69 3.794 3.794 3.930 -0.136 18478 2118 1 5 . 1 1 69 69 LYS C C 69 173.330 173.330 175.185 -1.855 18478 2119 1 5 . 1 1 69 69 LYS CA C 69 61.225 61.225 57.252 3.973 18478 2120 1 5 . 1 1 69 69 LYS H H 69 7.592 7.592 8.499 -0.907 18478 2121 1 5 . 1 1 70 70 GLU N N 70 118.408 118.408 117.819 0.589 18478 2122 1 5 . 1 1 70 70 GLU HA H 70 4.005 4.005 4.748 -0.743 18478 2123 1 5 . 1 1 70 70 GLU C C 70 174.588 174.588 173.472 1.116 18478 2124 1 5 . 1 1 70 70 GLU CA C 70 58.695 58.695 52.617 6.078 18478 2125 1 5 . 1 1 70 70 GLU CB C 70 28.928 28.928 30.448 -1.520 18478 2126 1 5 . 1 1 70 70 GLU H H 70 8.478 8.478 8.163 0.315 18478 2127 1 5 . 1 1 71 71 LYS HA H 71 3.847 3.847 4.359 -0.512 18478 2128 1 5 . 1 1 71 71 LYS C C 71 173.420 173.420 175.296 -1.876 18478 2129 1 5 . 1 1 71 71 LYS CA C 71 58.718 58.718 55.540 3.178 18478 2130 1 5 . 1 1 71 71 LYS CB C 71 32.964 32.964 33.907 -0.943 18478 2131 1 5 . 1 1 72 72 TYR N N 72 112.358 112.358 122.206 -9.848 18478 2132 1 5 . 1 1 72 72 TYR HA H 72 4.790 4.790 4.369 0.421 18478 2133 1 5 . 1 1 72 72 TYR C C 72 174.442 174.442 176.084 -1.642 18478 2134 1 5 . 1 1 72 72 TYR CA C 72 55.287 55.287 59.431 -4.144 18478 2135 1 5 . 1 1 72 72 TYR CB C 72 37.244 37.244 38.964 -1.720 18478 2136 1 5 . 1 1 72 72 TYR H H 72 7.341 7.341 8.398 -1.057 18478 2137 1 5 . 1 1 73 73 GLY N N 73 110.612 110.612 107.325 3.287 18478 2138 1 5 . 1 1 73 73 GLY C C 73 177.982 177.982 173.329 4.653 18478 2139 1 5 . 1 1 73 73 GLY CA C 73 46.623 46.623 44.522 2.101 18478 2140 1 5 . 1 1 73 73 GLY H H 73 8.076 8.076 8.106 -0.030 18478 2141 1 5 . 1 1 74 74 LYS N N 74 121.009 121.009 120.522 0.487 18478 2142 1 5 . 1 1 74 74 LYS CA C 74 53.465 53.465 54.221 -0.756 18478 2143 1 5 . 1 1 74 74 LYS CB C 74 32.440 32.440 32.685 -0.245 18478 2144 1 5 . 1 1 74 74 LYS H H 74 7.411 7.411 7.881 -0.470 18478 2145 1 5 . 1 1 75 75 PRO HA H 75 4.452 4.452 4.232 0.220 18478 2146 1 5 . 1 1 75 75 PRO C C 75 174.959 174.959 178.144 -3.185 18478 2147 1 5 . 1 1 75 75 PRO CA C 75 62.861 62.861 64.873 -2.012 18478 2148 1 5 . 1 1 75 75 PRO CB C 75 32.407 32.407 31.958 0.449 18478 2149 1 5 . 1 1 76 76 ASN N N 76 121.045 121.045 121.727 -0.682 18478 2150 1 5 . 1 1 76 76 ASN HA H 76 4.445 4.445 4.493 -0.048 18478 2151 1 5 . 1 1 76 76 ASN C C 76 174.145 174.145 174.595 -0.450 18478 2152 1 5 . 1 1 76 76 ASN CA C 76 55.701 55.701 52.915 2.786 18478 2153 1 5 . 1 1 76 76 ASN H H 76 8.474 8.474 8.923 -0.449 18478 2154 1 5 . 1 1 77 77 LYS N N 77 111.466 111.466 121.863 -10.397 18478 2155 1 5 . 1 1 77 77 LYS HA H 77 4.369 4.369 4.095 0.274 18478 2156 1 5 . 1 1 77 77 LYS C C 77 173.881 173.881 176.915 -3.034 18478 2157 1 5 . 1 1 77 77 LYS CA C 77 55.995 55.995 56.322 -0.327 18478 2158 1 5 . 1 1 77 77 LYS CB C 77 32.538 32.538 32.691 -0.153 18478 2159 1 5 . 1 1 77 77 LYS H H 77 8.543 8.543 7.836 0.707 18478 2160 1 5 . 1 1 78 78 ARG N N 78 122.233 122.233 120.067 2.166 18478 2161 1 5 . 1 1 78 78 ARG HA H 78 4.286 4.286 3.967 0.319 18478 2162 1 5 . 1 1 78 78 ARG C C 78 173.652 173.652 174.724 -1.072 18478 2163 1 5 . 1 1 78 78 ARG CA C 78 55.780 55.780 57.198 -1.418 18478 2164 1 5 . 1 1 78 78 ARG CB C 78 29.554 29.554 29.543 0.012 18478 2165 1 5 . 1 1 78 78 ARG H H 78 8.864 8.864 8.855 0.009 18478 2166 1 5 . 1 1 79 79 LYS N N 79 128.197 128.197 118.802 9.395 18478 2167 1 5 . 1 1 79 79 LYS HA H 79 4.221 4.221 4.519 -0.298 18478 2168 1 5 . 1 1 79 79 LYS C C 79 174.336 174.336 175.506 -1.170 18478 2169 1 5 . 1 1 79 79 LYS CA C 79 58.986 58.986 55.548 3.438 18478 2170 1 5 . 1 1 79 79 LYS CB C 79 32.072 32.072 33.208 -1.136 18478 2171 1 5 . 1 1 79 79 LYS H H 79 8.927 8.927 8.081 0.846 18478 2172 1 5 . 1 1 80 80 GLY N N 80 114.730 114.730 109.186 5.544 18478 2173 1 5 . 1 1 80 80 GLY C C 80 176.536 176.536 174.386 2.150 18478 2174 1 5 . 1 1 80 80 GLY CA C 80 45.992 45.992 45.903 0.089 18478 2175 1 5 . 1 1 80 80 GLY H H 80 8.943 8.943 8.211 0.732 18478 2176 1 5 . 1 1 81 81 PHE N N 81 123.770 123.770 118.641 5.129 18478 2177 1 5 . 1 1 81 81 PHE HA H 81 3.336 3.336 4.441 -1.105 18478 2178 1 5 . 1 1 81 81 PHE C C 81 174.037 174.037 176.283 -2.246 18478 2179 1 5 . 1 1 81 81 PHE CA C 81 63.094 63.094 59.129 3.965 18478 2180 1 5 . 1 1 81 81 PHE CB C 81 39.823 39.823 38.679 1.144 18478 2181 1 5 . 1 1 81 81 PHE H H 81 8.281 8.281 7.985 0.296 18478 2182 1 5 . 1 1 82 82 ASN N N 82 119.812 119.812 117.403 2.409 18478 2183 1 5 . 1 1 82 82 ASN HA H 82 4.458 4.458 4.374 0.084 18478 2184 1 5 . 1 1 82 82 ASN C C 82 171.290 171.290 176.630 -5.340 18478 2185 1 5 . 1 1 82 82 ASN CA C 82 56.060 56.060 56.356 -0.296 18478 2186 1 5 . 1 1 82 82 ASN CB C 82 36.390 36.390 38.570 -2.180 18478 2187 1 5 . 1 1 82 82 ASN H H 82 9.145 9.145 8.418 0.727 18478 2188 1 5 . 1 1 83 83 GLU N N 83 124.411 124.411 118.628 5.783 18478 2189 1 5 . 1 1 83 83 GLU HA H 83 4.186 4.186 4.067 0.119 18478 2190 1 5 . 1 1 83 83 GLU C C 83 172.222 172.222 178.726 -6.504 18478 2191 1 5 . 1 1 83 83 GLU CA C 83 60.922 60.922 59.359 1.562 18478 2192 1 5 . 1 1 83 83 GLU CB C 83 28.132 28.132 29.569 -1.437 18478 2193 1 5 . 1 1 83 83 GLU H H 83 9.560 9.560 7.859 1.701 18478 2194 1 5 . 1 1 84 84 GLY N N 84 111.388 111.388 105.917 5.471 18478 2195 1 5 . 1 1 84 84 GLY C C 84 176.445 176.445 174.712 1.733 18478 2196 1 5 . 1 1 84 84 GLY CA C 84 46.727 46.727 46.611 0.116 18478 2197 1 5 . 1 1 84 84 GLY H H 84 8.364 8.364 7.236 1.128 18478 2198 1 5 . 1 1 85 85 LEU N N 85 121.153 121.153 120.885 0.268 18478 2199 1 5 . 1 1 85 85 LEU HA H 85 4.236 4.236 4.260 -0.024 18478 2200 1 5 . 1 1 85 85 LEU C C 85 172.285 172.285 177.466 -5.181 18478 2201 1 5 . 1 1 85 85 LEU CA C 85 56.795 56.795 56.809 -0.014 18478 2202 1 5 . 1 1 85 85 LEU CB C 85 41.113 41.113 43.066 -1.953 18478 2203 1 5 . 1 1 85 85 LEU H H 85 8.294 8.294 7.323 0.971 18478 2204 1 5 . 1 1 86 86 TRP N N 86 118.898 118.898 118.574 0.324 18478 2205 1 5 . 1 1 86 86 TRP HA H 86 4.161 4.161 4.252 -0.091 18478 2206 1 5 . 1 1 86 86 TRP C C 86 171.741 171.741 176.576 -4.835 18478 2207 1 5 . 1 1 86 86 TRP CA C 86 62.153 62.153 58.681 3.472 18478 2208 1 5 . 1 1 86 86 TRP CB C 86 28.424 28.424 29.602 -1.178 18478 2209 1 5 . 1 1 86 86 TRP H H 86 7.783 7.783 7.662 0.121 18478 2210 1 5 . 1 1 87 87 GLU N N 87 120.718 120.718 119.196 1.522 18478 2211 1 5 . 1 1 87 87 GLU HA H 87 3.416 3.416 4.715 -1.299 18478 2212 1 5 . 1 1 87 87 GLU C C 87 172.957 172.957 175.007 -2.050 18478 2213 1 5 . 1 1 87 87 GLU CA C 87 60.122 60.122 53.265 6.857 18478 2214 1 5 . 1 1 87 87 GLU CB C 87 31.021 31.021 30.306 0.715 18478 2215 1 5 . 1 1 87 87 GLU H H 87 8.779 8.779 7.561 1.218 18478 2216 1 5 . 1 1 88 88 ILE HA H 88 2.478 2.478 4.224 -1.746 18478 2217 1 5 . 1 1 88 88 ILE C C 88 177.873 177.873 177.198 0.675 18478 2218 1 5 . 1 1 88 88 ILE CA C 88 65.248 65.248 62.388 2.860 18478 2219 1 5 . 1 1 88 88 ILE CB C 88 37.327 37.327 38.498 -1.171 18478 2220 1 5 . 1 1 89 89 ASP N N 89 114.411 114.411 118.807 -4.396 18478 2221 1 5 . 1 1 89 89 ASP HA H 89 4.589 4.589 4.545 0.044 18478 2222 1 5 . 1 1 89 89 ASP C C 89 174.207 174.207 177.414 -3.207 18478 2223 1 5 . 1 1 89 89 ASP CA C 89 54.740 54.740 55.989 -1.249 18478 2224 1 5 . 1 1 89 89 ASP CB C 89 42.473 42.473 40.345 2.128 18478 2225 1 5 . 1 1 89 89 ASP H H 89 5.911 5.911 7.823 -1.912 18478 2226 1 5 . 1 1 90 90 ASN N N 90 114.358 114.358 113.604 0.754 18478 2227 1 5 . 1 1 90 90 ASN HA H 90 4.420 4.420 4.498 -0.078 18478 2228 1 5 . 1 1 90 90 ASN C C 90 176.991 176.991 177.495 -0.504 18478 2229 1 5 . 1 1 90 90 ASN CA C 90 54.855 54.855 55.942 -1.087 18478 2230 1 5 . 1 1 90 90 ASN CB C 90 40.582 40.582 38.188 2.394 18478 2231 1 5 . 1 1 90 90 ASN H H 90 7.480 7.480 7.726 -0.246 18478 2232 1 5 . 1 1 91 91 ASN N N 91 119.185 119.185 115.561 3.624 18478 2233 1 5 . 1 1 91 91 ASN HA H 91 5.006 5.006 4.894 0.112 18478 2234 1 5 . 1 1 91 91 ASN CA C 91 51.624 51.624 54.059 -2.435 18478 2235 1 5 . 1 1 91 91 ASN CB C 91 38.752 38.752 38.678 0.074 18478 2236 1 5 . 1 1 91 91 ASN H H 91 9.238 9.238 7.597 1.641 18478 2237 1 5 . 1 1 92 92 PRO HA H 92 4.296 4.296 4.150 0.146 18478 2238 1 5 . 1 1 92 92 PRO C C 92 173.690 173.690 176.894 -3.204 18478 2239 1 5 . 1 1 92 92 PRO CA C 92 64.714 64.714 63.886 0.828 18478 2240 1 5 . 1 1 92 92 PRO CB C 92 31.781 31.781 32.799 -1.018 18478 2241 1 6 . 1 1 3 3 GLY C C 3 177.088 177.088 172.649 4.439 18478 2242 1 6 . 1 1 3 3 GLY CA C 3 45.330 45.330 45.780 -0.450 18478 2243 1 6 . 1 1 4 4 SER N N 4 115.847 115.847 111.110 4.737 18478 2244 1 6 . 1 1 4 4 SER HA H 4 4.480 4.480 4.677 -0.197 18478 2245 1 6 . 1 1 4 4 SER C C 4 177.991 177.991 172.395 5.596 18478 2246 1 6 . 1 1 4 4 SER CA C 4 58.742 58.742 58.177 0.565 18478 2247 1 6 . 1 1 4 4 SER CB C 4 63.820 63.820 65.048 -1.228 18478 2248 1 6 . 1 1 4 4 SER H H 4 8.207 8.207 7.826 0.381 18478 2249 1 6 . 1 1 5 5 MET N N 5 125.867 125.867 121.933 3.934 18478 2250 1 6 . 1 1 5 5 MET HA H 5 4.580 4.580 4.636 -0.056 18478 2251 1 6 . 1 1 5 5 MET C C 5 174.825 174.825 176.236 -1.411 18478 2252 1 6 . 1 1 5 5 MET CA C 5 54.733 54.733 54.496 0.237 18478 2253 1 6 . 1 1 5 5 MET CB C 5 33.527 33.527 35.664 -2.137 18478 2254 1 6 . 1 1 5 5 MET H H 5 8.148 8.148 8.721 -0.573 18478 2255 1 6 . 1 1 6 6 THR N N 6 115.828 115.828 115.783 0.045 18478 2256 1 6 . 1 1 6 6 THR HA H 6 3.903 3.903 4.490 -0.587 18478 2257 1 6 . 1 1 6 6 THR C C 6 176.930 176.930 172.576 4.354 18478 2258 1 6 . 1 1 6 6 THR CA C 6 63.034 63.034 60.785 2.248 18478 2259 1 6 . 1 1 6 6 THR CB C 6 69.308 69.308 68.773 0.535 18478 2260 1 6 . 1 1 6 6 THR H H 6 8.408 8.408 8.500 -0.092 18478 2261 1 6 . 1 1 7 7 ARG HA H 7 4.276 4.276 4.219 0.057 18478 2262 1 6 . 1 1 7 7 ARG C C 7 176.546 176.546 176.282 0.264 18478 2263 1 6 . 1 1 7 7 ARG CA C 7 55.813 55.813 56.399 -0.586 18478 2264 1 6 . 1 1 7 7 ARG CB C 7 30.556 30.556 30.734 -0.178 18478 2265 1 6 . 1 1 8 8 ASP N N 8 121.762 121.762 125.448 -3.686 18478 2266 1 6 . 1 1 8 8 ASP HA H 8 4.537 4.537 4.131 0.406 18478 2267 1 6 . 1 1 8 8 ASP C C 8 177.750 177.750 175.175 2.575 18478 2268 1 6 . 1 1 8 8 ASP CA C 8 54.117 54.117 54.742 -0.625 18478 2269 1 6 . 1 1 8 8 ASP H H 8 8.066 8.066 8.400 -0.334 18478 2270 1 6 . 1 1 9 9 PHE N N 9 119.991 119.991 118.204 1.787 18478 2271 1 6 . 1 1 9 9 PHE HA H 9 4.734 4.734 4.972 -0.238 18478 2272 1 6 . 1 1 9 9 PHE C C 9 176.838 176.838 175.078 1.760 18478 2273 1 6 . 1 1 9 9 PHE CA C 9 58.303 58.303 57.200 1.103 18478 2274 1 6 . 1 1 9 9 PHE CB C 9 41.594 41.594 41.466 0.128 18478 2275 1 6 . 1 1 9 9 PHE H H 9 8.103 8.103 7.505 0.598 18478 2276 1 6 . 1 1 10 10 LYS N N 10 122.957 122.957 120.142 2.815 18478 2277 1 6 . 1 1 10 10 LYS CA C 10 53.167 53.167 55.035 -1.869 18478 2278 1 6 . 1 1 10 10 LYS CB C 10 33.495 33.495 33.841 -0.346 18478 2279 1 6 . 1 1 10 10 LYS H H 10 9.087 9.087 8.546 0.541 18478 2280 1 6 . 1 1 11 11 PRO HA H 11 3.903 3.903 4.964 -1.061 18478 2281 1 6 . 1 1 11 11 PRO C C 11 173.988 173.988 174.535 -0.547 18478 2282 1 6 . 1 1 11 11 PRO CA C 11 63.874 63.874 61.467 2.407 18478 2283 1 6 . 1 1 11 11 PRO CB C 11 31.623 31.623 34.773 -3.151 18478 2284 1 6 . 1 1 12 12 GLY N N 12 115.413 115.413 111.100 4.313 18478 2285 1 6 . 1 1 12 12 GLY C C 12 176.966 176.966 172.507 4.459 18478 2286 1 6 . 1 1 12 12 GLY CA C 12 44.651 44.651 42.225 2.426 18478 2287 1 6 . 1 1 12 12 GLY H H 12 9.667 9.667 8.834 0.833 18478 2288 1 6 . 1 1 13 13 ASP N N 13 122.208 122.208 128.774 -6.566 18478 2289 1 6 . 1 1 13 13 ASP HA H 13 4.601 4.601 4.663 -0.062 18478 2290 1 6 . 1 1 13 13 ASP C C 13 176.244 176.244 174.316 1.928 18478 2291 1 6 . 1 1 13 13 ASP CA C 13 55.870 55.870 52.199 3.671 18478 2292 1 6 . 1 1 13 13 ASP CB C 13 40.794 40.794 42.365 -1.571 18478 2293 1 6 . 1 1 13 13 ASP H H 13 8.303 8.303 8.490 -0.187 18478 2294 1 6 . 1 1 14 14 LEU N N 14 121.306 121.306 126.707 -5.401 18478 2295 1 6 . 1 1 14 14 LEU HA H 14 4.982 4.982 4.585 0.397 18478 2296 1 6 . 1 1 14 14 LEU C C 14 173.461 173.461 176.302 -2.841 18478 2297 1 6 . 1 1 14 14 LEU CA C 14 54.516 54.516 53.627 0.889 18478 2298 1 6 . 1 1 14 14 LEU CB C 14 40.999 40.999 41.986 -0.987 18478 2299 1 6 . 1 1 14 14 LEU H H 14 8.618 8.618 7.819 0.799 18478 2300 1 6 . 1 1 15 15 ILE N N 15 118.806 118.806 126.371 -7.565 18478 2301 1 6 . 1 1 15 15 ILE HA H 15 5.356 5.356 4.322 1.034 18478 2302 1 6 . 1 1 15 15 ILE C C 15 175.982 175.982 175.802 0.180 18478 2303 1 6 . 1 1 15 15 ILE CA C 15 60.481 60.481 59.982 0.499 18478 2304 1 6 . 1 1 15 15 ILE CB C 15 44.142 44.142 39.563 4.579 18478 2305 1 6 . 1 1 15 15 ILE H H 15 8.864 8.864 8.673 0.191 18478 2306 1 6 . 1 1 16 16 PHE N N 16 112.472 112.472 126.279 -13.807 18478 2307 1 6 . 1 1 16 16 PHE HA H 16 5.306 5.306 4.236 1.070 18478 2308 1 6 . 1 1 16 16 PHE C C 16 176.239 176.239 176.371 -0.132 18478 2309 1 6 . 1 1 16 16 PHE CA C 16 58.603 58.603 59.824 -1.221 18478 2310 1 6 . 1 1 16 16 PHE CB C 16 43.305 43.305 38.772 4.533 18478 2311 1 6 . 1 1 16 16 PHE H H 16 9.411 9.411 8.900 0.511 18478 2312 1 6 . 1 1 17 17 ALA N N 17 123.889 123.889 127.449 -3.560 18478 2313 1 6 . 1 1 17 17 ALA HA H 17 5.348 5.348 3.681 1.667 18478 2314 1 6 . 1 1 17 17 ALA C C 17 174.426 174.426 176.443 -2.017 18478 2315 1 6 . 1 1 17 17 ALA CA C 17 50.062 50.062 51.567 -1.505 18478 2316 1 6 . 1 1 17 17 ALA H H 17 9.658 9.658 8.561 1.097 18478 2317 1 6 . 1 1 18 18 LYS N N 18 127.760 127.760 121.683 6.077 18478 2318 1 6 . 1 1 18 18 LYS HA H 18 4.697 4.697 4.704 -0.007 18478 2319 1 6 . 1 1 18 18 LYS C C 18 178.554 178.554 174.502 4.052 18478 2320 1 6 . 1 1 18 18 LYS CA C 18 53.893 53.893 52.417 1.476 18478 2321 1 6 . 1 1 18 18 LYS CB C 18 35.291 35.291 32.435 2.856 18478 2322 1 6 . 1 1 18 18 LYS H H 18 9.421 9.421 7.789 1.632 18478 2323 1 6 . 1 1 19 19 MET HA H 19 4.656 4.656 4.537 0.119 18478 2324 1 6 . 1 1 19 19 MET C C 19 175.741 175.741 174.708 1.033 18478 2325 1 6 . 1 1 19 19 MET CA C 19 53.916 53.916 54.739 -0.823 18478 2326 1 6 . 1 1 19 19 MET CB C 19 35.799 35.799 33.445 2.354 18478 2327 1 6 . 1 1 20 20 LYS N N 20 124.062 124.062 118.635 5.427 18478 2328 1 6 . 1 1 20 20 LYS CA C 20 58.585 58.585 56.501 2.084 18478 2329 1 6 . 1 1 20 20 LYS CB C 20 31.978 31.978 32.926 -0.948 18478 2330 1 6 . 1 1 20 20 LYS H H 20 8.645 8.645 8.109 0.536 18478 2331 1 6 . 1 1 21 21 GLY C C 21 176.205 176.205 172.385 3.820 18478 2332 1 6 . 1 1 21 21 GLY CA C 21 45.142 45.142 41.854 3.288 18478 2333 1 6 . 1 1 22 22 TYR HA H 22 4.573 4.573 4.767 -0.194 18478 2334 1 6 . 1 1 22 22 TYR CA C 22 55.748 55.748 57.744 -1.996 18478 2335 1 6 . 1 1 22 22 TYR CB C 22 41.331 41.331 38.390 2.941 18478 2336 1 6 . 1 1 23 23 PRO HA H 23 4.759 4.759 5.077 -0.318 18478 2337 1 6 . 1 1 23 23 PRO C C 23 174.587 174.587 175.105 -0.518 18478 2338 1 6 . 1 1 23 23 PRO CA C 23 62.072 62.072 61.739 0.333 18478 2339 1 6 . 1 1 23 23 PRO CB C 23 31.077 31.077 34.761 -3.684 18478 2340 1 6 . 1 1 24 24 HIS N N 24 119.190 119.190 115.958 3.232 18478 2341 1 6 . 1 1 24 24 HIS HA H 24 3.983 3.983 5.473 -1.490 18478 2342 1 6 . 1 1 24 24 HIS C C 24 175.555 175.555 173.916 1.639 18478 2343 1 6 . 1 1 24 24 HIS CA C 24 60.973 60.973 54.187 6.786 18478 2344 1 6 . 1 1 24 24 HIS CB C 24 30.689 30.689 32.754 -2.065 18478 2345 1 6 . 1 1 24 24 HIS H H 24 8.158 8.158 8.513 -0.355 18478 2346 1 6 . 1 1 25 25 TRP N N 25 127.435 127.435 123.142 4.293 18478 2347 1 6 . 1 1 25 25 TRP HA H 25 3.760 3.760 5.140 -1.380 18478 2348 1 6 . 1 1 25 25 TRP CA C 25 55.890 55.890 57.461 -1.571 18478 2349 1 6 . 1 1 25 25 TRP CB C 25 32.879 32.879 30.705 2.174 18478 2350 1 6 . 1 1 25 25 TRP H H 25 9.211 9.211 8.612 0.599 18478 2351 1 6 . 1 1 26 26 PRO HA H 26 4.217 4.217 4.577 -0.360 18478 2352 1 6 . 1 1 26 26 PRO C C 26 176.279 176.279 175.946 0.333 18478 2353 1 6 . 1 1 26 26 PRO CA C 26 63.140 63.140 61.805 1.335 18478 2354 1 6 . 1 1 26 26 PRO CB C 26 32.171 32.171 34.393 -2.222 18478 2355 1 6 . 1 1 27 27 ALA N N 27 130.162 130.162 125.088 5.074 18478 2356 1 6 . 1 1 27 27 ALA HA H 27 4.981 4.981 4.267 0.714 18478 2357 1 6 . 1 1 27 27 ALA C C 27 177.227 177.227 177.591 -0.364 18478 2358 1 6 . 1 1 27 27 ALA CA C 27 52.574 52.574 51.735 0.839 18478 2359 1 6 . 1 1 27 27 ALA CB C 27 23.239 23.239 20.285 2.954 18478 2360 1 6 . 1 1 27 27 ALA H H 27 9.394 9.394 8.286 1.108 18478 2361 1 6 . 1 1 28 28 ARG N N 28 117.381 117.381 118.039 -0.658 18478 2362 1 6 . 1 1 28 28 ARG HA H 28 5.421 5.421 4.457 0.964 18478 2363 1 6 . 1 1 28 28 ARG C C 28 176.465 176.465 175.577 0.888 18478 2364 1 6 . 1 1 28 28 ARG CA C 28 53.662 53.662 55.292 -1.630 18478 2365 1 6 . 1 1 28 28 ARG CB C 28 35.058 35.058 29.694 5.364 18478 2366 1 6 . 1 1 28 28 ARG H H 28 8.806 8.806 8.443 0.363 18478 2367 1 6 . 1 1 29 29 VAL HA H 29 4.109 4.109 4.240 -0.131 18478 2368 1 6 . 1 1 29 29 VAL C C 29 175.996 175.996 174.661 1.335 18478 2369 1 6 . 1 1 29 29 VAL CA C 29 62.810 62.810 61.708 1.102 18478 2370 1 6 . 1 1 29 29 VAL CB C 29 31.108 31.108 32.635 -1.527 18478 2371 1 6 . 1 1 30 30 ASP N N 30 133.830 133.830 119.786 14.044 18478 2372 1 6 . 1 1 30 30 ASP HA H 30 5.198 5.198 4.689 0.509 18478 2373 1 6 . 1 1 30 30 ASP C C 30 176.207 176.207 177.172 -0.965 18478 2374 1 6 . 1 1 30 30 ASP CA C 30 53.007 53.007 54.036 -1.029 18478 2375 1 6 . 1 1 30 30 ASP CB C 30 44.130 44.130 40.851 3.279 18478 2376 1 6 . 1 1 30 30 ASP H H 30 8.892 8.892 8.457 0.435 18478 2377 1 6 . 1 1 31 31 GLU N N 31 115.905 115.905 122.796 -6.891 18478 2378 1 6 . 1 1 31 31 GLU HA H 31 4.409 4.409 4.014 0.395 18478 2379 1 6 . 1 1 31 31 GLU C C 31 175.192 175.192 176.387 -1.195 18478 2380 1 6 . 1 1 31 31 GLU CA C 31 55.389 55.389 56.126 -0.737 18478 2381 1 6 . 1 1 31 31 GLU H H 31 7.966 7.966 8.960 -0.994 18478 2382 1 6 . 1 1 32 32 VAL N N 32 122.794 122.794 117.765 5.029 18478 2383 1 6 . 1 1 32 32 VAL HA H 32 4.303 4.303 3.809 0.494 18478 2384 1 6 . 1 1 32 32 VAL CA C 32 60.408 60.408 62.882 -2.474 18478 2385 1 6 . 1 1 32 32 VAL CB C 32 32.333 32.333 31.059 1.274 18478 2386 1 6 . 1 1 32 32 VAL H H 32 8.702 8.702 8.167 0.535 18478 2387 1 6 . 1 1 33 33 PRO HA H 33 4.572 4.572 4.227 0.345 18478 2388 1 6 . 1 1 33 33 PRO C C 33 175.366 175.366 177.648 -2.282 18478 2389 1 6 . 1 1 33 33 PRO CA C 33 63.702 63.702 65.017 -1.315 18478 2390 1 6 . 1 1 33 33 PRO CB C 33 32.736 32.736 31.728 1.008 18478 2391 1 6 . 1 1 34 34 ASP N N 34 119.187 119.187 118.272 0.915 18478 2392 1 6 . 1 1 34 34 ASP HA H 34 4.679 4.679 4.918 -0.239 18478 2393 1 6 . 1 1 34 34 ASP C C 34 175.713 175.713 173.856 1.857 18478 2394 1 6 . 1 1 34 34 ASP CA C 34 53.013 53.013 52.148 0.865 18478 2395 1 6 . 1 1 34 34 ASP CB C 34 40.850 40.850 41.028 -0.178 18478 2396 1 6 . 1 1 34 34 ASP H H 34 8.686 8.686 7.843 0.843 18478 2397 1 6 . 1 1 35 35 GLY C C 35 177.458 177.458 172.749 4.709 18478 2398 1 6 . 1 1 35 35 GLY CA C 35 45.507 45.507 43.825 1.682 18478 2399 1 6 . 1 1 36 36 ALA HA H 36 4.404 4.404 4.304 0.100 18478 2400 1 6 . 1 1 36 36 ALA CA C 36 52.010 52.010 51.719 0.291 18478 2401 1 6 . 1 1 36 36 ALA CB C 36 19.909 19.909 19.662 0.247 18478 2402 1 6 . 1 1 37 37 VAL N N 37 119.594 119.594 123.113 -3.519 18478 2403 1 6 . 1 1 37 37 VAL HA H 37 3.932 3.932 4.126 -0.194 18478 2404 1 6 . 1 1 37 37 VAL C C 37 175.966 175.966 176.004 -0.038 18478 2405 1 6 . 1 1 37 37 VAL CA C 37 62.810 62.810 63.532 -0.722 18478 2406 1 6 . 1 1 37 37 VAL CB C 37 32.267 32.267 32.795 -0.528 18478 2407 1 6 . 1 1 37 37 VAL H H 37 8.037 8.037 8.375 -0.338 18478 2408 1 6 . 1 1 38 38 LYS N N 38 125.676 125.676 120.499 5.177 18478 2409 1 6 . 1 1 38 38 LYS C C 38 173.865 173.865 174.699 -0.834 18478 2410 1 6 . 1 1 38 38 LYS CA C 38 54.278 54.278 56.790 -2.512 18478 2411 1 6 . 1 1 38 38 LYS CB C 38 31.740 31.740 33.409 -1.669 18478 2412 1 6 . 1 1 38 38 LYS H H 38 8.292 8.292 8.513 -0.221 18478 2413 1 6 . 1 1 40 40 PRO HA H 40 4.387 4.387 5.290 -0.903 18478 2414 1 6 . 1 1 40 40 PRO C C 40 175.535 175.535 175.333 0.202 18478 2415 1 6 . 1 1 40 40 PRO CA C 40 62.330 62.330 59.475 2.855 18478 2416 1 6 . 1 1 40 40 PRO CB C 40 32.086 32.086 32.130 -0.044 18478 2417 1 6 . 1 1 41 41 THR HA H 41 4.027 4.027 4.595 -0.568 18478 2418 1 6 . 1 1 41 41 THR C C 41 176.795 176.795 173.069 3.726 18478 2419 1 6 . 1 1 41 41 THR CA C 41 63.693 63.693 62.313 1.380 18478 2420 1 6 . 1 1 41 41 THR CB C 41 69.370 69.370 68.898 0.472 18478 2421 1 6 . 1 1 42 42 ASN N N 42 118.513 118.513 122.303 -3.790 18478 2422 1 6 . 1 1 42 42 ASN HA H 42 4.530 4.530 5.221 -0.691 18478 2423 1 6 . 1 1 42 42 ASN C C 42 177.230 177.230 174.828 2.402 18478 2424 1 6 . 1 1 42 42 ASN CA C 42 56.373 56.373 50.420 5.953 18478 2425 1 6 . 1 1 42 42 ASN CB C 42 37.618 37.618 38.078 -0.460 18478 2426 1 6 . 1 1 42 42 ASN H H 42 8.752 8.752 8.720 0.032 18478 2427 1 6 . 1 1 43 43 LYS N N 43 115.898 115.898 129.067 -13.169 18478 2428 1 6 . 1 1 43 43 LYS HA H 43 4.710 4.710 4.729 -0.019 18478 2429 1 6 . 1 1 43 43 LYS C C 43 177.032 177.032 175.925 1.107 18478 2430 1 6 . 1 1 43 43 LYS CA C 43 54.957 54.957 55.041 -0.084 18478 2431 1 6 . 1 1 43 43 LYS CB C 43 36.600 36.600 33.178 3.422 18478 2432 1 6 . 1 1 43 43 LYS H H 43 7.723 7.723 8.768 -1.045 18478 2433 1 6 . 1 1 44 44 LEU N N 44 121.006 121.006 129.408 -8.402 18478 2434 1 6 . 1 1 44 44 LEU HA H 44 5.000 5.000 4.369 0.631 18478 2435 1 6 . 1 1 44 44 LEU CA C 44 51.842 51.842 54.706 -2.864 18478 2436 1 6 . 1 1 44 44 LEU CB C 44 44.418 44.418 40.670 3.748 18478 2437 1 6 . 1 1 44 44 LEU H H 44 9.063 9.063 8.502 0.561 18478 2438 1 6 . 1 1 45 45 PRO HA H 45 4.392 4.392 4.526 -0.134 18478 2439 1 6 . 1 1 45 45 PRO C C 45 177.051 177.051 177.476 -0.425 18478 2440 1 6 . 1 1 45 45 PRO CA C 45 62.000 62.000 64.138 -2.138 18478 2441 1 6 . 1 1 45 45 PRO CB C 45 30.737 30.737 32.793 -2.056 18478 2442 1 6 . 1 1 46 46 ILE N N 46 125.996 125.996 124.440 1.556 18478 2443 1 6 . 1 1 46 46 ILE HA H 46 4.564 4.564 3.615 0.949 18478 2444 1 6 . 1 1 46 46 ILE C C 46 176.985 176.985 176.025 0.960 18478 2445 1 6 . 1 1 46 46 ILE CA C 46 57.051 57.051 62.336 -5.285 18478 2446 1 6 . 1 1 46 46 ILE H H 46 8.908 8.908 8.576 0.332 18478 2447 1 6 . 1 1 47 47 PHE N N 47 128.276 128.276 119.011 9.265 18478 2448 1 6 . 1 1 47 47 PHE HA H 47 4.827 4.827 4.529 0.298 18478 2449 1 6 . 1 1 47 47 PHE C C 47 177.835 177.835 176.452 1.383 18478 2450 1 6 . 1 1 47 47 PHE CA C 47 56.099 56.099 58.020 -1.921 18478 2451 1 6 . 1 1 47 47 PHE CB C 47 41.217 41.217 40.361 0.856 18478 2452 1 6 . 1 1 47 47 PHE H H 47 8.739 8.739 7.591 1.148 18478 2453 1 6 . 1 1 48 48 PHE N N 48 125.953 125.953 117.380 8.573 18478 2454 1 6 . 1 1 48 48 PHE HA H 48 4.251 4.251 4.361 -0.110 18478 2455 1 6 . 1 1 48 48 PHE C C 48 175.869 175.869 174.320 1.549 18478 2456 1 6 . 1 1 48 48 PHE CA C 48 56.744 56.744 59.365 -2.621 18478 2457 1 6 . 1 1 48 48 PHE CB C 48 38.835 38.835 36.798 2.037 18478 2458 1 6 . 1 1 48 48 PHE H H 48 8.545 8.545 7.964 0.581 18478 2459 1 6 . 1 1 49 49 PHE N N 49 122.197 122.197 119.029 3.168 18478 2460 1 6 . 1 1 49 49 PHE HA H 49 4.400 4.400 4.803 -0.403 18478 2461 1 6 . 1 1 49 49 PHE C C 49 174.016 174.016 174.560 -0.544 18478 2462 1 6 . 1 1 49 49 PHE CA C 49 59.916 59.916 55.331 4.585 18478 2463 1 6 . 1 1 49 49 PHE CB C 49 39.799 39.799 41.237 -1.438 18478 2464 1 6 . 1 1 49 49 PHE H H 49 8.619 8.619 7.579 1.040 18478 2465 1 6 . 1 1 50 50 GLY N N 50 114.083 114.083 107.773 6.310 18478 2466 1 6 . 1 1 50 50 GLY C C 50 175.636 175.636 173.349 2.287 18478 2467 1 6 . 1 1 50 50 GLY CA C 50 46.718 46.718 43.919 2.799 18478 2468 1 6 . 1 1 50 50 GLY H H 50 10.329 10.329 8.065 2.264 18478 2469 1 6 . 1 1 51 51 THR N N 51 111.210 111.210 118.152 -6.942 18478 2470 1 6 . 1 1 51 51 THR HA H 51 3.980 3.980 4.539 -0.559 18478 2471 1 6 . 1 1 51 51 THR C C 51 175.588 175.588 171.859 3.729 18478 2472 1 6 . 1 1 51 51 THR CA C 51 62.223 62.223 61.302 0.921 18478 2473 1 6 . 1 1 51 51 THR CB C 51 68.346 68.346 72.143 -3.797 18478 2474 1 6 . 1 1 51 51 THR H H 51 7.882 7.882 8.654 -0.772 18478 2475 1 6 . 1 1 52 52 HIS N N 52 115.544 115.544 120.441 -4.897 18478 2476 1 6 . 1 1 52 52 HIS HA H 52 3.712 3.712 5.471 -1.759 18478 2477 1 6 . 1 1 52 52 HIS C C 52 177.717 177.717 175.467 2.250 18478 2478 1 6 . 1 1 52 52 HIS CA C 52 54.860 54.860 54.589 0.271 18478 2479 1 6 . 1 1 52 52 HIS CB C 52 26.388 26.388 30.410 -4.022 18478 2480 1 6 . 1 1 52 52 HIS H H 52 7.791 7.791 8.555 -0.763 18478 2481 1 6 . 1 1 53 53 GLU N N 53 117.517 117.517 123.229 -5.712 18478 2482 1 6 . 1 1 53 53 GLU HA H 53 4.298 4.298 4.744 -0.446 18478 2483 1 6 . 1 1 53 53 GLU C C 53 176.958 176.958 176.561 0.397 18478 2484 1 6 . 1 1 53 53 GLU CA C 53 55.403 55.403 55.446 -0.043 18478 2485 1 6 . 1 1 53 53 GLU CB C 53 31.588 31.588 33.259 -1.671 18478 2486 1 6 . 1 1 53 53 GLU H H 53 6.795 6.795 8.580 -1.785 18478 2487 1 6 . 1 1 54 54 THR N N 54 111.182 111.182 117.031 -5.849 18478 2488 1 6 . 1 1 54 54 THR HA H 54 5.648 5.648 4.353 1.295 18478 2489 1 6 . 1 1 54 54 THR C C 54 177.234 177.234 174.191 3.043 18478 2490 1 6 . 1 1 54 54 THR CA C 54 59.894 59.894 61.376 -1.482 18478 2491 1 6 . 1 1 54 54 THR H H 54 8.139 8.139 8.835 -0.696 18478 2492 1 6 . 1 1 55 55 ALA HA H 55 4.403 4.403 4.217 0.186 18478 2493 1 6 . 1 1 55 55 ALA C C 55 176.601 176.601 177.869 -1.268 18478 2494 1 6 . 1 1 55 55 ALA CA C 55 51.079 51.079 53.042 -1.963 18478 2495 1 6 . 1 1 55 55 ALA CB C 55 23.285 23.285 18.987 4.298 18478 2496 1 6 . 1 1 56 56 PHE N N 56 118.058 118.058 112.825 5.233 18478 2497 1 6 . 1 1 56 56 PHE HA H 56 5.678 5.678 4.596 1.082 18478 2498 1 6 . 1 1 56 56 PHE C C 56 175.962 175.962 175.153 0.809 18478 2499 1 6 . 1 1 56 56 PHE CA C 56 56.008 56.008 58.935 -2.928 18478 2500 1 6 . 1 1 56 56 PHE CB C 56 39.995 39.995 37.918 2.077 18478 2501 1 6 . 1 1 56 56 PHE H H 56 8.523 8.523 8.181 0.342 18478 2502 1 6 . 1 1 57 57 LEU N N 57 123.344 123.344 120.226 3.118 18478 2503 1 6 . 1 1 57 57 LEU HA H 57 4.929 4.929 4.674 0.255 18478 2504 1 6 . 1 1 57 57 LEU C C 57 175.584 175.584 175.006 0.578 18478 2505 1 6 . 1 1 57 57 LEU CA C 57 53.463 53.463 54.986 -1.523 18478 2506 1 6 . 1 1 57 57 LEU CB C 57 46.545 46.545 44.246 2.299 18478 2507 1 6 . 1 1 57 57 LEU H H 57 8.579 8.579 7.765 0.814 18478 2508 1 6 . 1 1 58 58 GLY N N 58 108.499 108.499 107.265 1.234 18478 2509 1 6 . 1 1 58 58 GLY CA C 58 43.755 43.755 44.858 -1.103 18478 2510 1 6 . 1 1 58 58 GLY H H 58 9.318 9.318 7.236 2.082 18478 2511 1 6 . 1 1 59 59 PRO HA H 59 4.048 4.048 4.921 -0.873 18478 2512 1 6 . 1 1 59 59 PRO C C 59 173.763 173.763 174.722 -0.959 18478 2513 1 6 . 1 1 59 59 PRO CA C 59 64.770 64.770 60.331 4.439 18478 2514 1 6 . 1 1 59 59 PRO CB C 59 31.889 31.889 35.629 -3.740 18478 2515 1 6 . 1 1 60 60 LYS HA H 60 4.191 4.191 4.547 -0.356 18478 2516 1 6 . 1 1 60 60 LYS C C 60 174.842 174.842 176.552 -1.710 18478 2517 1 6 . 1 1 60 60 LYS CA C 60 57.875 57.875 56.063 1.812 18478 2518 1 6 . 1 1 60 60 LYS CB C 60 31.576 31.576 32.732 -1.156 18478 2519 1 6 . 1 1 61 61 ASP N N 61 117.768 117.768 123.282 -5.514 18478 2520 1 6 . 1 1 61 61 ASP HA H 61 4.973 4.973 4.282 0.691 18478 2521 1 6 . 1 1 61 61 ASP C C 61 178.178 178.178 177.116 1.062 18478 2522 1 6 . 1 1 61 61 ASP CA C 61 54.687 54.687 56.242 -1.555 18478 2523 1 6 . 1 1 61 61 ASP CB C 61 43.555 43.555 39.593 3.962 18478 2524 1 6 . 1 1 61 61 ASP H H 61 7.722 7.722 8.789 -1.067 18478 2525 1 6 . 1 1 62 62 ILE N N 62 114.244 114.244 120.837 -6.593 18478 2526 1 6 . 1 1 62 62 ILE HA H 62 4.891 4.891 3.373 1.518 18478 2527 1 6 . 1 1 62 62 ILE C C 62 178.027 178.027 177.529 0.498 18478 2528 1 6 . 1 1 62 62 ILE CA C 62 59.994 59.994 63.791 -3.797 18478 2529 1 6 . 1 1 62 62 ILE CB C 62 40.652 40.652 37.227 3.425 18478 2530 1 6 . 1 1 62 62 ILE H H 62 6.784 6.784 7.838 -1.054 18478 2531 1 6 . 1 1 63 63 PHE N N 63 119.819 119.819 118.247 1.572 18478 2532 1 6 . 1 1 63 63 PHE HA H 63 5.214 5.214 4.343 0.871 18478 2533 1 6 . 1 1 63 63 PHE CA C 63 54.735 54.735 60.194 -5.459 18478 2534 1 6 . 1 1 63 63 PHE CB C 63 42.122 42.122 38.836 3.286 18478 2535 1 6 . 1 1 63 63 PHE H H 63 8.734 8.734 7.587 1.147 18478 2536 1 6 . 1 1 64 64 PRO HA H 64 4.771 4.771 4.443 0.328 18478 2537 1 6 . 1 1 64 64 PRO C C 64 174.036 174.036 178.682 -4.646 18478 2538 1 6 . 1 1 64 64 PRO CA C 64 64.474 64.474 64.252 0.222 18478 2539 1 6 . 1 1 64 64 PRO CB C 64 32.662 32.662 33.355 -0.693 18478 2540 1 6 . 1 1 65 65 TYR N N 65 124.335 124.335 121.860 2.475 18478 2541 1 6 . 1 1 65 65 TYR HA H 65 4.530 4.530 4.318 0.212 18478 2542 1 6 . 1 1 65 65 TYR C C 65 173.944 173.944 177.570 -3.626 18478 2543 1 6 . 1 1 65 65 TYR CA C 65 61.205 61.205 60.784 0.421 18478 2544 1 6 . 1 1 65 65 TYR CB C 65 38.844 38.844 38.003 0.841 18478 2545 1 6 . 1 1 65 65 TYR H H 65 8.359 8.359 7.808 0.551 18478 2546 1 6 . 1 1 66 66 SER N N 66 114.836 114.836 112.339 2.497 18478 2547 1 6 . 1 1 66 66 SER HA H 66 3.505 3.505 4.346 -0.841 18478 2548 1 6 . 1 1 66 66 SER C C 66 173.697 173.697 175.397 -1.700 18478 2549 1 6 . 1 1 66 66 SER CA C 66 63.078 63.078 59.610 3.468 18478 2550 1 6 . 1 1 66 66 SER CB C 66 62.223 62.223 63.046 -0.823 18478 2551 1 6 . 1 1 66 66 SER H H 66 8.974 8.974 7.684 1.290 18478 2552 1 6 . 1 1 67 67 GLU N N 67 118.013 118.013 118.633 -0.620 18478 2553 1 6 . 1 1 67 67 GLU HA H 67 4.210 4.210 4.171 0.039 18478 2554 1 6 . 1 1 67 67 GLU C C 67 174.961 174.961 177.534 -2.573 18478 2555 1 6 . 1 1 67 67 GLU CA C 67 58.330 58.330 57.932 0.398 18478 2556 1 6 . 1 1 67 67 GLU CB C 67 30.205 30.205 31.007 -0.802 18478 2557 1 6 . 1 1 67 67 GLU H H 67 8.817 8.817 7.895 0.922 18478 2558 1 6 . 1 1 68 68 ASN N N 68 113.942 113.942 111.107 2.835 18478 2559 1 6 . 1 1 68 68 ASN HA H 68 5.015 5.015 4.965 0.050 18478 2560 1 6 . 1 1 68 68 ASN C C 68 176.626 176.626 175.933 0.693 18478 2561 1 6 . 1 1 68 68 ASN CA C 68 53.768 53.768 51.159 2.609 18478 2562 1 6 . 1 1 68 68 ASN CB C 68 41.948 41.948 39.262 2.686 18478 2563 1 6 . 1 1 68 68 ASN H H 68 7.448 7.448 7.679 -0.231 18478 2564 1 6 . 1 1 69 69 LYS N N 69 124.584 124.584 120.733 3.851 18478 2565 1 6 . 1 1 69 69 LYS HA H 69 3.794 3.794 4.007 -0.213 18478 2566 1 6 . 1 1 69 69 LYS C C 69 173.330 173.330 175.675 -2.345 18478 2567 1 6 . 1 1 69 69 LYS CA C 69 61.225 61.225 57.492 3.733 18478 2568 1 6 . 1 1 69 69 LYS H H 69 7.592 7.592 8.568 -0.976 18478 2569 1 6 . 1 1 70 70 GLU N N 70 118.408 118.408 117.932 0.476 18478 2570 1 6 . 1 1 70 70 GLU HA H 70 4.005 4.005 4.853 -0.848 18478 2571 1 6 . 1 1 70 70 GLU C C 70 174.588 174.588 173.524 1.064 18478 2572 1 6 . 1 1 70 70 GLU CA C 70 58.695 58.695 52.789 5.906 18478 2573 1 6 . 1 1 70 70 GLU CB C 70 28.928 28.928 30.698 -1.770 18478 2574 1 6 . 1 1 70 70 GLU H H 70 8.478 8.478 8.225 0.253 18478 2575 1 6 . 1 1 71 71 LYS HA H 71 3.847 3.847 4.379 -0.532 18478 2576 1 6 . 1 1 71 71 LYS C C 71 173.420 173.420 175.314 -1.894 18478 2577 1 6 . 1 1 71 71 LYS CA C 71 58.718 58.718 55.368 3.349 18478 2578 1 6 . 1 1 71 71 LYS CB C 71 32.964 32.964 34.150 -1.186 18478 2579 1 6 . 1 1 72 72 TYR N N 72 112.358 112.358 121.706 -9.348 18478 2580 1 6 . 1 1 72 72 TYR HA H 72 4.790 4.790 4.274 0.516 18478 2581 1 6 . 1 1 72 72 TYR C C 72 174.442 174.442 175.503 -1.061 18478 2582 1 6 . 1 1 72 72 TYR CA C 72 55.287 55.287 59.433 -4.146 18478 2583 1 6 . 1 1 72 72 TYR CB C 72 37.244 37.244 39.053 -1.809 18478 2584 1 6 . 1 1 72 72 TYR H H 72 7.341 7.341 8.469 -1.128 18478 2585 1 6 . 1 1 73 73 GLY N N 73 110.612 110.612 107.987 2.625 18478 2586 1 6 . 1 1 73 73 GLY C C 73 177.982 177.982 173.619 4.363 18478 2587 1 6 . 1 1 73 73 GLY CA C 73 46.623 46.623 44.316 2.307 18478 2588 1 6 . 1 1 73 73 GLY H H 73 8.076 8.076 8.328 -0.252 18478 2589 1 6 . 1 1 74 74 LYS N N 74 121.009 121.009 121.239 -0.230 18478 2590 1 6 . 1 1 74 74 LYS CA C 74 53.465 53.465 54.363 -0.898 18478 2591 1 6 . 1 1 74 74 LYS CB C 74 32.440 32.440 32.716 -0.276 18478 2592 1 6 . 1 1 74 74 LYS H H 74 7.411 7.411 7.887 -0.476 18478 2593 1 6 . 1 1 75 75 PRO HA H 75 4.452 4.452 4.311 0.141 18478 2594 1 6 . 1 1 75 75 PRO C C 75 174.959 174.959 177.802 -2.843 18478 2595 1 6 . 1 1 75 75 PRO CA C 75 62.861 62.861 64.185 -1.324 18478 2596 1 6 . 1 1 75 75 PRO CB C 75 32.407 32.407 31.349 1.058 18478 2597 1 6 . 1 1 76 76 ASN N N 76 121.045 121.045 119.566 1.479 18478 2598 1 6 . 1 1 76 76 ASN HA H 76 4.445 4.445 4.381 0.064 18478 2599 1 6 . 1 1 76 76 ASN C C 76 174.145 174.145 174.754 -0.609 18478 2600 1 6 . 1 1 76 76 ASN CA C 76 55.701 55.701 52.639 3.062 18478 2601 1 6 . 1 1 76 76 ASN H H 76 8.474 8.474 9.003 -0.529 18478 2602 1 6 . 1 1 77 77 LYS N N 77 111.466 111.466 120.185 -8.719 18478 2603 1 6 . 1 1 77 77 LYS HA H 77 4.369 4.369 4.266 0.103 18478 2604 1 6 . 1 1 77 77 LYS C C 77 173.881 173.881 176.479 -2.598 18478 2605 1 6 . 1 1 77 77 LYS CA C 77 55.995 55.995 56.197 -0.202 18478 2606 1 6 . 1 1 77 77 LYS CB C 77 32.538 32.538 32.348 0.190 18478 2607 1 6 . 1 1 77 77 LYS H H 77 8.543 8.543 7.893 0.650 18478 2608 1 6 . 1 1 78 78 ARG N N 78 122.233 122.233 119.775 2.458 18478 2609 1 6 . 1 1 78 78 ARG HA H 78 4.286 4.286 4.039 0.247 18478 2610 1 6 . 1 1 78 78 ARG C C 78 173.652 173.652 174.477 -0.825 18478 2611 1 6 . 1 1 78 78 ARG CA C 78 55.780 55.780 57.217 -1.437 18478 2612 1 6 . 1 1 78 78 ARG CB C 78 29.554 29.554 29.346 0.208 18478 2613 1 6 . 1 1 78 78 ARG H H 78 8.864 8.864 8.923 -0.059 18478 2614 1 6 . 1 1 79 79 LYS N N 79 128.197 128.197 117.964 10.233 18478 2615 1 6 . 1 1 79 79 LYS HA H 79 4.221 4.221 4.523 -0.302 18478 2616 1 6 . 1 1 79 79 LYS C C 79 174.336 174.336 175.779 -1.443 18478 2617 1 6 . 1 1 79 79 LYS CA C 79 58.986 58.986 55.463 3.523 18478 2618 1 6 . 1 1 79 79 LYS CB C 79 32.072 32.072 32.868 -0.796 18478 2619 1 6 . 1 1 79 79 LYS H H 79 8.927 8.927 8.278 0.649 18478 2620 1 6 . 1 1 80 80 GLY N N 80 114.730 114.730 109.111 5.619 18478 2621 1 6 . 1 1 80 80 GLY C C 80 176.536 176.536 175.223 1.313 18478 2622 1 6 . 1 1 80 80 GLY CA C 80 45.992 45.992 46.068 -0.076 18478 2623 1 6 . 1 1 80 80 GLY H H 80 8.943 8.943 8.382 0.561 18478 2624 1 6 . 1 1 81 81 PHE N N 81 123.770 123.770 120.388 3.382 18478 2625 1 6 . 1 1 81 81 PHE HA H 81 3.336 3.336 4.247 -0.911 18478 2626 1 6 . 1 1 81 81 PHE C C 81 174.037 174.037 176.206 -2.169 18478 2627 1 6 . 1 1 81 81 PHE CA C 81 63.094 63.094 60.237 2.857 18478 2628 1 6 . 1 1 81 81 PHE CB C 81 39.823 39.823 38.491 1.332 18478 2629 1 6 . 1 1 81 81 PHE H H 81 8.281 8.281 8.262 0.019 18478 2630 1 6 . 1 1 82 82 ASN N N 82 119.812 119.812 116.366 3.446 18478 2631 1 6 . 1 1 82 82 ASN HA H 82 4.458 4.458 4.312 0.146 18478 2632 1 6 . 1 1 82 82 ASN C C 82 171.290 171.290 176.863 -5.573 18478 2633 1 6 . 1 1 82 82 ASN CA C 82 56.060 56.060 55.915 0.145 18478 2634 1 6 . 1 1 82 82 ASN CB C 82 36.390 36.390 38.433 -2.043 18478 2635 1 6 . 1 1 82 82 ASN H H 82 9.145 9.145 8.433 0.712 18478 2636 1 6 . 1 1 83 83 GLU N N 83 124.411 124.411 119.087 5.324 18478 2637 1 6 . 1 1 83 83 GLU HA H 83 4.186 4.186 4.018 0.168 18478 2638 1 6 . 1 1 83 83 GLU C C 83 172.222 172.222 178.764 -6.542 18478 2639 1 6 . 1 1 83 83 GLU CA C 83 60.922 60.922 59.127 1.795 18478 2640 1 6 . 1 1 83 83 GLU CB C 83 28.132 28.132 29.989 -1.857 18478 2641 1 6 . 1 1 83 83 GLU H H 83 9.560 9.560 8.045 1.515 18478 2642 1 6 . 1 1 84 84 GLY N N 84 111.388 111.388 107.094 4.294 18478 2643 1 6 . 1 1 84 84 GLY C C 84 176.445 176.445 173.900 2.545 18478 2644 1 6 . 1 1 84 84 GLY CA C 84 46.727 46.727 46.487 0.240 18478 2645 1 6 . 1 1 84 84 GLY H H 84 8.364 8.364 7.219 1.145 18478 2646 1 6 . 1 1 85 85 LEU N N 85 121.153 121.153 119.783 1.370 18478 2647 1 6 . 1 1 85 85 LEU HA H 85 4.236 4.236 4.231 0.005 18478 2648 1 6 . 1 1 85 85 LEU C C 85 172.285 172.285 178.054 -5.769 18478 2649 1 6 . 1 1 85 85 LEU CA C 85 56.795 56.795 56.627 0.168 18478 2650 1 6 . 1 1 85 85 LEU CB C 85 41.113 41.113 42.630 -1.517 18478 2651 1 6 . 1 1 85 85 LEU H H 85 8.294 8.294 7.575 0.719 18478 2652 1 6 . 1 1 86 86 TRP N N 86 118.898 118.898 119.212 -0.314 18478 2653 1 6 . 1 1 86 86 TRP HA H 86 4.161 4.161 4.312 -0.151 18478 2654 1 6 . 1 1 86 86 TRP C C 86 171.741 171.741 176.381 -4.640 18478 2655 1 6 . 1 1 86 86 TRP CA C 86 62.153 62.153 58.542 3.611 18478 2656 1 6 . 1 1 86 86 TRP CB C 86 28.424 28.424 29.778 -1.354 18478 2657 1 6 . 1 1 86 86 TRP H H 86 7.783 7.783 7.360 0.423 18478 2658 1 6 . 1 1 87 87 GLU N N 87 120.718 120.718 119.215 1.503 18478 2659 1 6 . 1 1 87 87 GLU HA H 87 3.416 3.416 4.701 -1.285 18478 2660 1 6 . 1 1 87 87 GLU C C 87 172.957 172.957 175.012 -2.055 18478 2661 1 6 . 1 1 87 87 GLU CA C 87 60.122 60.122 53.203 6.919 18478 2662 1 6 . 1 1 87 87 GLU CB C 87 31.021 31.021 30.271 0.750 18478 2663 1 6 . 1 1 87 87 GLU H H 87 8.779 8.779 7.505 1.274 18478 2664 1 6 . 1 1 88 88 ILE HA H 88 2.478 2.478 4.201 -1.723 18478 2665 1 6 . 1 1 88 88 ILE C C 88 177.873 177.873 177.384 0.489 18478 2666 1 6 . 1 1 88 88 ILE CA C 88 65.248 65.248 62.374 2.873 18478 2667 1 6 . 1 1 88 88 ILE CB C 88 37.327 37.327 38.506 -1.179 18478 2668 1 6 . 1 1 89 89 ASP N N 89 114.411 114.411 118.631 -4.220 18478 2669 1 6 . 1 1 89 89 ASP HA H 89 4.589 4.589 4.511 0.078 18478 2670 1 6 . 1 1 89 89 ASP C C 89 174.207 174.207 177.408 -3.201 18478 2671 1 6 . 1 1 89 89 ASP CA C 89 54.740 54.740 56.531 -1.791 18478 2672 1 6 . 1 1 89 89 ASP CB C 89 42.473 42.473 40.388 2.085 18478 2673 1 6 . 1 1 89 89 ASP H H 89 5.911 5.911 7.816 -1.905 18478 2674 1 6 . 1 1 90 90 ASN N N 90 114.358 114.358 112.434 1.924 18478 2675 1 6 . 1 1 90 90 ASN HA H 90 4.420 4.420 4.435 -0.015 18478 2676 1 6 . 1 1 90 90 ASN C C 90 176.991 176.991 177.210 -0.219 18478 2677 1 6 . 1 1 90 90 ASN CA C 90 54.855 54.855 55.957 -1.102 18478 2678 1 6 . 1 1 90 90 ASN CB C 90 40.582 40.582 37.979 2.603 18478 2679 1 6 . 1 1 90 90 ASN H H 90 7.480 7.480 7.659 -0.179 18478 2680 1 6 . 1 1 91 91 ASN N N 91 119.185 119.185 114.226 4.959 18478 2681 1 6 . 1 1 91 91 ASN HA H 91 5.006 5.006 5.126 -0.120 18478 2682 1 6 . 1 1 91 91 ASN CA C 91 51.624 51.624 53.840 -2.216 18478 2683 1 6 . 1 1 91 91 ASN CB C 91 38.752 38.752 38.979 -0.227 18478 2684 1 6 . 1 1 91 91 ASN H H 91 9.238 9.238 7.791 1.447 18478 2685 1 6 . 1 1 92 92 PRO HA H 92 4.296 4.296 4.276 0.020 18478 2686 1 6 . 1 1 92 92 PRO C C 92 173.690 173.690 176.040 -2.350 18478 2687 1 6 . 1 1 92 92 PRO CA C 92 64.714 64.714 63.201 1.513 18478 2688 1 6 . 1 1 92 92 PRO CB C 92 31.781 31.781 32.352 -0.572 18478 2689 1 7 . 1 1 3 3 GLY C C 3 177.088 177.088 172.788 4.300 18478 2690 1 7 . 1 1 3 3 GLY CA C 3 45.330 45.330 45.030 0.300 18478 2691 1 7 . 1 1 4 4 SER N N 4 115.847 115.847 113.253 2.594 18478 2692 1 7 . 1 1 4 4 SER HA H 4 4.480 4.480 4.605 -0.125 18478 2693 1 7 . 1 1 4 4 SER C C 4 177.991 177.991 172.446 5.545 18478 2694 1 7 . 1 1 4 4 SER CA C 4 58.742 58.742 58.454 0.288 18478 2695 1 7 . 1 1 4 4 SER CB C 4 63.820 63.820 64.693 -0.873 18478 2696 1 7 . 1 1 4 4 SER H H 4 8.207 8.207 7.757 0.450 18478 2697 1 7 . 1 1 5 5 MET N N 5 125.867 125.867 122.160 3.707 18478 2698 1 7 . 1 1 5 5 MET HA H 5 4.580 4.580 4.535 0.045 18478 2699 1 7 . 1 1 5 5 MET C C 5 174.825 174.825 176.572 -1.747 18478 2700 1 7 . 1 1 5 5 MET CA C 5 54.733 54.733 54.967 -0.234 18478 2701 1 7 . 1 1 5 5 MET CB C 5 33.527 33.527 34.992 -1.465 18478 2702 1 7 . 1 1 5 5 MET H H 5 8.148 8.148 8.750 -0.602 18478 2703 1 7 . 1 1 6 6 THR N N 6 115.828 115.828 114.953 0.875 18478 2704 1 7 . 1 1 6 6 THR HA H 6 3.903 3.903 4.348 -0.445 18478 2705 1 7 . 1 1 6 6 THR C C 6 176.930 176.930 173.387 3.543 18478 2706 1 7 . 1 1 6 6 THR CA C 6 63.034 63.034 61.608 1.426 18478 2707 1 7 . 1 1 6 6 THR CB C 6 69.308 69.308 68.197 1.111 18478 2708 1 7 . 1 1 6 6 THR H H 6 8.408 8.408 8.405 0.003 18478 2709 1 7 . 1 1 7 7 ARG HA H 7 4.276 4.276 4.265 0.011 18478 2710 1 7 . 1 1 7 7 ARG C C 7 176.546 176.546 176.055 0.491 18478 2711 1 7 . 1 1 7 7 ARG CA C 7 55.813 55.813 56.739 -0.926 18478 2712 1 7 . 1 1 7 7 ARG CB C 7 30.556 30.556 30.555 0.001 18478 2713 1 7 . 1 1 8 8 ASP N N 8 121.762 121.762 124.874 -3.112 18478 2714 1 7 . 1 1 8 8 ASP HA H 8 4.537 4.537 4.181 0.356 18478 2715 1 7 . 1 1 8 8 ASP C C 8 177.750 177.750 175.616 2.134 18478 2716 1 7 . 1 1 8 8 ASP CA C 8 54.117 54.117 54.701 -0.584 18478 2717 1 7 . 1 1 8 8 ASP H H 8 8.066 8.066 8.541 -0.475 18478 2718 1 7 . 1 1 9 9 PHE N N 9 119.991 119.991 120.046 -0.055 18478 2719 1 7 . 1 1 9 9 PHE HA H 9 4.734 4.734 4.659 0.075 18478 2720 1 7 . 1 1 9 9 PHE C C 9 176.838 176.838 175.191 1.647 18478 2721 1 7 . 1 1 9 9 PHE CA C 9 58.303 58.303 57.642 0.661 18478 2722 1 7 . 1 1 9 9 PHE CB C 9 41.594 41.594 40.196 1.398 18478 2723 1 7 . 1 1 9 9 PHE H H 9 8.103 8.103 7.597 0.506 18478 2724 1 7 . 1 1 10 10 LYS N N 10 122.957 122.957 125.276 -2.319 18478 2725 1 7 . 1 1 10 10 LYS CA C 10 53.167 53.167 55.532 -2.365 18478 2726 1 7 . 1 1 10 10 LYS CB C 10 33.495 33.495 31.156 2.339 18478 2727 1 7 . 1 1 10 10 LYS H H 10 9.087 9.087 8.592 0.495 18478 2728 1 7 . 1 1 11 11 PRO HA H 11 3.903 3.903 4.905 -1.002 18478 2729 1 7 . 1 1 11 11 PRO C C 11 173.988 173.988 174.817 -0.829 18478 2730 1 7 . 1 1 11 11 PRO CA C 11 63.874 63.874 60.381 3.493 18478 2731 1 7 . 1 1 11 11 PRO CB C 11 31.623 31.623 34.565 -2.942 18478 2732 1 7 . 1 1 12 12 GLY N N 12 115.413 115.413 110.103 5.310 18478 2733 1 7 . 1 1 12 12 GLY C C 12 176.966 176.966 172.415 4.551 18478 2734 1 7 . 1 1 12 12 GLY CA C 12 44.651 44.651 42.196 2.455 18478 2735 1 7 . 1 1 12 12 GLY H H 12 9.667 9.667 8.839 0.827 18478 2736 1 7 . 1 1 13 13 ASP N N 13 122.208 122.208 128.054 -5.846 18478 2737 1 7 . 1 1 13 13 ASP HA H 13 4.601 4.601 4.882 -0.281 18478 2738 1 7 . 1 1 13 13 ASP C C 13 176.244 176.244 174.275 1.969 18478 2739 1 7 . 1 1 13 13 ASP CA C 13 55.870 55.870 51.919 3.951 18478 2740 1 7 . 1 1 13 13 ASP CB C 13 40.794 40.794 42.800 -2.006 18478 2741 1 7 . 1 1 13 13 ASP H H 13 8.303 8.303 8.370 -0.067 18478 2742 1 7 . 1 1 14 14 LEU N N 14 121.306 121.306 126.338 -5.032 18478 2743 1 7 . 1 1 14 14 LEU HA H 14 4.982 4.982 4.527 0.455 18478 2744 1 7 . 1 1 14 14 LEU C C 14 173.461 173.461 176.396 -2.935 18478 2745 1 7 . 1 1 14 14 LEU CA C 14 54.516 54.516 54.007 0.509 18478 2746 1 7 . 1 1 14 14 LEU CB C 14 40.999 40.999 41.788 -0.789 18478 2747 1 7 . 1 1 14 14 LEU H H 14 8.618 8.618 7.575 1.043 18478 2748 1 7 . 1 1 15 15 ILE N N 15 118.806 118.806 126.300 -7.494 18478 2749 1 7 . 1 1 15 15 ILE HA H 15 5.356 5.356 4.284 1.072 18478 2750 1 7 . 1 1 15 15 ILE C C 15 175.982 175.982 176.044 -0.062 18478 2751 1 7 . 1 1 15 15 ILE CA C 15 60.481 60.481 61.113 -0.632 18478 2752 1 7 . 1 1 15 15 ILE CB C 15 44.142 44.142 39.852 4.290 18478 2753 1 7 . 1 1 15 15 ILE H H 15 8.864 8.864 8.416 0.448 18478 2754 1 7 . 1 1 16 16 PHE N N 16 112.472 112.472 123.017 -10.545 18478 2755 1 7 . 1 1 16 16 PHE HA H 16 5.306 5.306 4.393 0.913 18478 2756 1 7 . 1 1 16 16 PHE C C 16 176.239 176.239 176.299 -0.060 18478 2757 1 7 . 1 1 16 16 PHE CA C 16 58.603 58.603 58.674 -0.071 18478 2758 1 7 . 1 1 16 16 PHE CB C 16 43.305 43.305 38.419 4.886 18478 2759 1 7 . 1 1 16 16 PHE H H 16 9.411 9.411 8.421 0.990 18478 2760 1 7 . 1 1 17 17 ALA N N 17 123.889 123.889 128.194 -4.305 18478 2761 1 7 . 1 1 17 17 ALA HA H 17 5.348 5.348 3.598 1.750 18478 2762 1 7 . 1 1 17 17 ALA C C 17 174.426 174.426 176.409 -1.983 18478 2763 1 7 . 1 1 17 17 ALA CA C 17 50.062 50.062 51.733 -1.671 18478 2764 1 7 . 1 1 17 17 ALA H H 17 9.658 9.658 8.630 1.028 18478 2765 1 7 . 1 1 18 18 LYS N N 18 127.760 127.760 121.430 6.330 18478 2766 1 7 . 1 1 18 18 LYS HA H 18 4.697 4.697 4.686 0.011 18478 2767 1 7 . 1 1 18 18 LYS C C 18 178.554 178.554 174.840 3.714 18478 2768 1 7 . 1 1 18 18 LYS CA C 18 53.893 53.893 52.025 1.868 18478 2769 1 7 . 1 1 18 18 LYS CB C 18 35.291 35.291 32.321 2.970 18478 2770 1 7 . 1 1 18 18 LYS H H 18 9.421 9.421 7.207 2.214 18478 2771 1 7 . 1 1 19 19 MET HA H 19 4.656 4.656 4.615 0.041 18478 2772 1 7 . 1 1 19 19 MET C C 19 175.741 175.741 174.900 0.841 18478 2773 1 7 . 1 1 19 19 MET CA C 19 53.916 53.916 54.869 -0.953 18478 2774 1 7 . 1 1 19 19 MET CB C 19 35.799 35.799 33.690 2.109 18478 2775 1 7 . 1 1 20 20 LYS N N 20 124.062 124.062 117.972 6.090 18478 2776 1 7 . 1 1 20 20 LYS CA C 20 58.585 58.585 56.582 2.003 18478 2777 1 7 . 1 1 20 20 LYS CB C 20 31.978 31.978 32.684 -0.705 18478 2778 1 7 . 1 1 20 20 LYS H H 20 8.645 8.645 8.290 0.355 18478 2779 1 7 . 1 1 21 21 GLY C C 21 176.205 176.205 172.415 3.790 18478 2780 1 7 . 1 1 21 21 GLY CA C 21 45.142 45.142 42.091 3.051 18478 2781 1 7 . 1 1 22 22 TYR HA H 22 4.573 4.573 4.704 -0.131 18478 2782 1 7 . 1 1 22 22 TYR CA C 22 55.748 55.748 57.784 -2.036 18478 2783 1 7 . 1 1 22 22 TYR CB C 22 41.331 41.331 38.066 3.265 18478 2784 1 7 . 1 1 23 23 PRO HA H 23 4.759 4.759 4.740 0.019 18478 2785 1 7 . 1 1 23 23 PRO C C 23 174.587 174.587 175.049 -0.462 18478 2786 1 7 . 1 1 23 23 PRO CA C 23 62.072 62.072 61.093 0.979 18478 2787 1 7 . 1 1 23 23 PRO CB C 23 31.077 31.077 35.122 -4.045 18478 2788 1 7 . 1 1 24 24 HIS N N 24 119.190 119.190 117.394 1.796 18478 2789 1 7 . 1 1 24 24 HIS HA H 24 3.983 3.983 5.003 -1.020 18478 2790 1 7 . 1 1 24 24 HIS C C 24 175.555 175.555 173.586 1.969 18478 2791 1 7 . 1 1 24 24 HIS CA C 24 60.973 60.973 54.056 6.917 18478 2792 1 7 . 1 1 24 24 HIS CB C 24 30.689 30.689 33.475 -2.786 18478 2793 1 7 . 1 1 24 24 HIS H H 24 8.158 8.158 8.792 -0.634 18478 2794 1 7 . 1 1 25 25 TRP N N 25 127.435 127.435 128.068 -0.633 18478 2795 1 7 . 1 1 25 25 TRP HA H 25 3.760 3.760 5.009 -1.249 18478 2796 1 7 . 1 1 25 25 TRP CA C 25 55.890 55.890 58.035 -2.145 18478 2797 1 7 . 1 1 25 25 TRP CB C 25 32.879 32.879 29.691 3.188 18478 2798 1 7 . 1 1 25 25 TRP H H 25 9.211 9.211 8.920 0.291 18478 2799 1 7 . 1 1 26 26 PRO HA H 26 4.217 4.217 4.674 -0.457 18478 2800 1 7 . 1 1 26 26 PRO C C 26 176.279 176.279 176.131 0.148 18478 2801 1 7 . 1 1 26 26 PRO CA C 26 63.140 63.140 61.537 1.603 18478 2802 1 7 . 1 1 26 26 PRO CB C 26 32.171 32.171 34.645 -2.474 18478 2803 1 7 . 1 1 27 27 ALA N N 27 130.162 130.162 123.450 6.712 18478 2804 1 7 . 1 1 27 27 ALA HA H 27 4.981 4.981 4.375 0.606 18478 2805 1 7 . 1 1 27 27 ALA C C 27 177.227 177.227 177.512 -0.285 18478 2806 1 7 . 1 1 27 27 ALA CA C 27 52.574 52.574 51.008 1.567 18478 2807 1 7 . 1 1 27 27 ALA CB C 27 23.239 23.239 20.186 3.053 18478 2808 1 7 . 1 1 27 27 ALA H H 27 9.394 9.394 8.201 1.193 18478 2809 1 7 . 1 1 28 28 ARG N N 28 117.381 117.381 115.842 1.539 18478 2810 1 7 . 1 1 28 28 ARG HA H 28 5.421 5.421 4.494 0.927 18478 2811 1 7 . 1 1 28 28 ARG C C 28 176.465 176.465 175.800 0.665 18478 2812 1 7 . 1 1 28 28 ARG CA C 28 53.662 53.662 54.597 -0.935 18478 2813 1 7 . 1 1 28 28 ARG CB C 28 35.058 35.058 29.691 5.367 18478 2814 1 7 . 1 1 28 28 ARG H H 28 8.806 8.806 8.521 0.285 18478 2815 1 7 . 1 1 29 29 VAL HA H 29 4.109 4.109 4.292 -0.183 18478 2816 1 7 . 1 1 29 29 VAL C C 29 175.996 175.996 174.280 1.716 18478 2817 1 7 . 1 1 29 29 VAL CA C 29 62.810 62.810 61.751 1.059 18478 2818 1 7 . 1 1 29 29 VAL CB C 29 31.108 31.108 32.708 -1.600 18478 2819 1 7 . 1 1 30 30 ASP N N 30 133.830 133.830 116.191 17.639 18478 2820 1 7 . 1 1 30 30 ASP HA H 30 5.198 5.198 4.663 0.535 18478 2821 1 7 . 1 1 30 30 ASP C C 30 176.207 176.207 176.194 0.013 18478 2822 1 7 . 1 1 30 30 ASP CA C 30 53.007 53.007 53.166 -0.159 18478 2823 1 7 . 1 1 30 30 ASP CB C 30 44.130 44.130 40.702 3.428 18478 2824 1 7 . 1 1 30 30 ASP H H 30 8.892 8.892 8.321 0.571 18478 2825 1 7 . 1 1 31 31 GLU N N 31 115.905 115.905 123.218 -7.313 18478 2826 1 7 . 1 1 31 31 GLU HA H 31 4.409 4.409 4.002 0.407 18478 2827 1 7 . 1 1 31 31 GLU C C 31 175.192 175.192 176.159 -0.967 18478 2828 1 7 . 1 1 31 31 GLU CA C 31 55.389 55.389 56.128 -0.739 18478 2829 1 7 . 1 1 31 31 GLU H H 31 7.966 7.966 8.974 -1.008 18478 2830 1 7 . 1 1 32 32 VAL N N 32 122.794 122.794 117.257 5.537 18478 2831 1 7 . 1 1 32 32 VAL HA H 32 4.303 4.303 3.819 0.484 18478 2832 1 7 . 1 1 32 32 VAL CA C 32 60.408 60.408 62.673 -2.265 18478 2833 1 7 . 1 1 32 32 VAL CB C 32 32.333 32.333 31.228 1.105 18478 2834 1 7 . 1 1 32 32 VAL H H 32 8.702 8.702 8.280 0.422 18478 2835 1 7 . 1 1 33 33 PRO HA H 33 4.572 4.572 4.218 0.354 18478 2836 1 7 . 1 1 33 33 PRO C C 33 175.366 175.366 178.282 -2.916 18478 2837 1 7 . 1 1 33 33 PRO CA C 33 63.702 63.702 65.039 -1.337 18478 2838 1 7 . 1 1 33 33 PRO CB C 33 32.736 32.736 31.717 1.019 18478 2839 1 7 . 1 1 34 34 ASP N N 34 119.187 119.187 118.551 0.636 18478 2840 1 7 . 1 1 34 34 ASP HA H 34 4.679 4.679 4.863 -0.184 18478 2841 1 7 . 1 1 34 34 ASP C C 34 175.713 175.713 173.906 1.807 18478 2842 1 7 . 1 1 34 34 ASP CA C 34 53.013 53.013 52.547 0.466 18478 2843 1 7 . 1 1 34 34 ASP CB C 34 40.850 40.850 41.222 -0.372 18478 2844 1 7 . 1 1 34 34 ASP H H 34 8.686 8.686 7.941 0.745 18478 2845 1 7 . 1 1 35 35 GLY C C 35 177.458 177.458 172.619 4.839 18478 2846 1 7 . 1 1 35 35 GLY CA C 35 45.507 45.507 43.928 1.579 18478 2847 1 7 . 1 1 36 36 ALA HA H 36 4.404 4.404 4.215 0.189 18478 2848 1 7 . 1 1 36 36 ALA CA C 36 52.010 52.010 51.862 0.148 18478 2849 1 7 . 1 1 36 36 ALA CB C 36 19.909 19.909 19.662 0.247 18478 2850 1 7 . 1 1 37 37 VAL N N 37 119.594 119.594 121.401 -1.807 18478 2851 1 7 . 1 1 37 37 VAL HA H 37 3.932 3.932 4.160 -0.228 18478 2852 1 7 . 1 1 37 37 VAL C C 37 175.966 175.966 176.177 -0.211 18478 2853 1 7 . 1 1 37 37 VAL CA C 37 62.810 62.810 64.071 -1.261 18478 2854 1 7 . 1 1 37 37 VAL CB C 37 32.267 32.267 33.257 -0.990 18478 2855 1 7 . 1 1 37 37 VAL H H 37 8.037 8.037 8.448 -0.411 18478 2856 1 7 . 1 1 38 38 LYS N N 38 125.676 125.676 121.299 4.377 18478 2857 1 7 . 1 1 38 38 LYS C C 38 173.865 173.865 174.577 -0.712 18478 2858 1 7 . 1 1 38 38 LYS CA C 38 54.278 54.278 56.417 -2.139 18478 2859 1 7 . 1 1 38 38 LYS CB C 38 31.740 31.740 33.472 -1.732 18478 2860 1 7 . 1 1 38 38 LYS H H 38 8.292 8.292 8.474 -0.182 18478 2861 1 7 . 1 1 40 40 PRO HA H 40 4.387 4.387 5.250 -0.863 18478 2862 1 7 . 1 1 40 40 PRO C C 40 175.535 175.535 175.276 0.259 18478 2863 1 7 . 1 1 40 40 PRO CA C 40 62.330 62.330 59.468 2.862 18478 2864 1 7 . 1 1 40 40 PRO CB C 40 32.086 32.086 32.145 -0.059 18478 2865 1 7 . 1 1 41 41 THR HA H 41 4.027 4.027 4.550 -0.523 18478 2866 1 7 . 1 1 41 41 THR C C 41 176.795 176.795 173.072 3.723 18478 2867 1 7 . 1 1 41 41 THR CA C 41 63.693 63.693 62.237 1.456 18478 2868 1 7 . 1 1 41 41 THR CB C 41 69.370 69.370 69.000 0.370 18478 2869 1 7 . 1 1 42 42 ASN N N 42 118.513 118.513 121.728 -3.215 18478 2870 1 7 . 1 1 42 42 ASN HA H 42 4.530 4.530 5.146 -0.616 18478 2871 1 7 . 1 1 42 42 ASN C C 42 177.230 177.230 174.761 2.469 18478 2872 1 7 . 1 1 42 42 ASN CA C 42 56.373 56.373 50.517 5.856 18478 2873 1 7 . 1 1 42 42 ASN CB C 42 37.618 37.618 38.149 -0.531 18478 2874 1 7 . 1 1 42 42 ASN H H 42 8.752 8.752 8.706 0.046 18478 2875 1 7 . 1 1 43 43 LYS N N 43 115.898 115.898 128.710 -12.812 18478 2876 1 7 . 1 1 43 43 LYS HA H 43 4.710 4.710 4.787 -0.077 18478 2877 1 7 . 1 1 43 43 LYS C C 43 177.032 177.032 176.501 0.531 18478 2878 1 7 . 1 1 43 43 LYS CA C 43 54.957 54.957 55.454 -0.497 18478 2879 1 7 . 1 1 43 43 LYS CB C 43 36.600 36.600 32.857 3.743 18478 2880 1 7 . 1 1 43 43 LYS H H 43 7.723 7.723 9.265 -1.542 18478 2881 1 7 . 1 1 44 44 LEU N N 44 121.006 121.006 127.865 -6.859 18478 2882 1 7 . 1 1 44 44 LEU HA H 44 5.000 5.000 4.427 0.573 18478 2883 1 7 . 1 1 44 44 LEU CA C 44 51.842 51.842 55.925 -4.083 18478 2884 1 7 . 1 1 44 44 LEU CB C 44 44.418 44.418 42.128 2.290 18478 2885 1 7 . 1 1 44 44 LEU H H 44 9.063 9.063 9.008 0.055 18478 2886 1 7 . 1 1 45 45 PRO HA H 45 4.392 4.392 4.603 -0.211 18478 2887 1 7 . 1 1 45 45 PRO C C 45 177.051 177.051 178.893 -1.842 18478 2888 1 7 . 1 1 45 45 PRO CA C 45 62.000 62.000 64.708 -2.708 18478 2889 1 7 . 1 1 45 45 PRO CB C 45 30.737 30.737 32.585 -1.848 18478 2890 1 7 . 1 1 46 46 ILE N N 46 125.996 125.996 124.220 1.776 18478 2891 1 7 . 1 1 46 46 ILE HA H 46 4.564 4.564 3.965 0.599 18478 2892 1 7 . 1 1 46 46 ILE C C 46 176.985 176.985 176.674 0.311 18478 2893 1 7 . 1 1 46 46 ILE CA C 46 57.051 57.051 62.879 -5.828 18478 2894 1 7 . 1 1 46 46 ILE H H 46 8.908 8.908 8.741 0.167 18478 2895 1 7 . 1 1 47 47 PHE N N 47 128.276 128.276 117.959 10.317 18478 2896 1 7 . 1 1 47 47 PHE HA H 47 4.827 4.827 4.306 0.521 18478 2897 1 7 . 1 1 47 47 PHE C C 47 177.835 177.835 176.448 1.387 18478 2898 1 7 . 1 1 47 47 PHE CA C 47 56.099 56.099 57.609 -1.510 18478 2899 1 7 . 1 1 47 47 PHE CB C 47 41.217 41.217 40.237 0.980 18478 2900 1 7 . 1 1 47 47 PHE H H 47 8.739 8.739 7.704 1.035 18478 2901 1 7 . 1 1 48 48 PHE N N 48 125.953 125.953 119.736 6.217 18478 2902 1 7 . 1 1 48 48 PHE HA H 48 4.251 4.251 4.434 -0.183 18478 2903 1 7 . 1 1 48 48 PHE C C 48 175.869 175.869 174.519 1.350 18478 2904 1 7 . 1 1 48 48 PHE CA C 48 56.744 56.744 59.879 -3.135 18478 2905 1 7 . 1 1 48 48 PHE CB C 48 38.835 38.835 37.776 1.059 18478 2906 1 7 . 1 1 48 48 PHE H H 48 8.545 8.545 8.170 0.375 18478 2907 1 7 . 1 1 49 49 PHE N N 49 122.197 122.197 118.163 4.034 18478 2908 1 7 . 1 1 49 49 PHE HA H 49 4.400 4.400 4.612 -0.212 18478 2909 1 7 . 1 1 49 49 PHE C C 49 174.016 174.016 174.354 -0.338 18478 2910 1 7 . 1 1 49 49 PHE CA C 49 59.916 59.916 57.109 2.807 18478 2911 1 7 . 1 1 49 49 PHE CB C 49 39.799 39.799 41.362 -1.563 18478 2912 1 7 . 1 1 49 49 PHE H H 49 8.619 8.619 7.452 1.167 18478 2913 1 7 . 1 1 50 50 GLY N N 50 114.083 114.083 108.600 5.483 18478 2914 1 7 . 1 1 50 50 GLY C C 50 175.636 175.636 173.144 2.492 18478 2915 1 7 . 1 1 50 50 GLY CA C 50 46.718 46.718 43.414 3.304 18478 2916 1 7 . 1 1 50 50 GLY H H 50 10.329 10.329 8.170 2.159 18478 2917 1 7 . 1 1 51 51 THR N N 51 111.210 111.210 121.573 -10.363 18478 2918 1 7 . 1 1 51 51 THR HA H 51 3.980 3.980 4.613 -0.633 18478 2919 1 7 . 1 1 51 51 THR C C 51 175.588 175.588 172.013 3.575 18478 2920 1 7 . 1 1 51 51 THR CA C 51 62.223 62.223 60.803 1.420 18478 2921 1 7 . 1 1 51 51 THR CB C 51 68.346 68.346 72.362 -4.016 18478 2922 1 7 . 1 1 51 51 THR H H 51 7.882 7.882 8.656 -0.774 18478 2923 1 7 . 1 1 52 52 HIS N N 52 115.544 115.544 119.916 -4.372 18478 2924 1 7 . 1 1 52 52 HIS HA H 52 3.712 3.712 5.431 -1.719 18478 2925 1 7 . 1 1 52 52 HIS C C 52 177.717 177.717 175.358 2.359 18478 2926 1 7 . 1 1 52 52 HIS CA C 52 54.860 54.860 54.343 0.517 18478 2927 1 7 . 1 1 52 52 HIS CB C 52 26.388 26.388 30.426 -4.038 18478 2928 1 7 . 1 1 52 52 HIS H H 52 7.791 7.791 8.459 -0.668 18478 2929 1 7 . 1 1 53 53 GLU N N 53 117.517 117.517 123.349 -5.832 18478 2930 1 7 . 1 1 53 53 GLU HA H 53 4.298 4.298 4.718 -0.420 18478 2931 1 7 . 1 1 53 53 GLU C C 53 176.958 176.958 176.571 0.387 18478 2932 1 7 . 1 1 53 53 GLU CA C 53 55.403 55.403 55.396 0.007 18478 2933 1 7 . 1 1 53 53 GLU CB C 53 31.588 31.588 33.323 -1.735 18478 2934 1 7 . 1 1 53 53 GLU H H 53 6.795 6.795 8.482 -1.687 18478 2935 1 7 . 1 1 54 54 THR N N 54 111.182 111.182 117.120 -5.938 18478 2936 1 7 . 1 1 54 54 THR HA H 54 5.648 5.648 4.321 1.327 18478 2937 1 7 . 1 1 54 54 THR C C 54 177.234 177.234 174.313 2.921 18478 2938 1 7 . 1 1 54 54 THR CA C 54 59.894 59.894 61.571 -1.677 18478 2939 1 7 . 1 1 54 54 THR H H 54 8.139 8.139 8.793 -0.654 18478 2940 1 7 . 1 1 55 55 ALA HA H 55 4.403 4.403 4.235 0.168 18478 2941 1 7 . 1 1 55 55 ALA C C 55 176.601 176.601 178.062 -1.461 18478 2942 1 7 . 1 1 55 55 ALA CA C 55 51.079 51.079 53.157 -2.078 18478 2943 1 7 . 1 1 55 55 ALA CB C 55 23.285 23.285 19.073 4.212 18478 2944 1 7 . 1 1 56 56 PHE N N 56 118.058 118.058 113.684 4.374 18478 2945 1 7 . 1 1 56 56 PHE HA H 56 5.678 5.678 4.592 1.086 18478 2946 1 7 . 1 1 56 56 PHE C C 56 175.962 175.962 174.794 1.168 18478 2947 1 7 . 1 1 56 56 PHE CA C 56 56.008 56.008 58.831 -2.823 18478 2948 1 7 . 1 1 56 56 PHE CB C 56 39.995 39.995 37.516 2.479 18478 2949 1 7 . 1 1 56 56 PHE H H 56 8.523 8.523 8.265 0.258 18478 2950 1 7 . 1 1 57 57 LEU N N 57 123.344 123.344 121.052 2.292 18478 2951 1 7 . 1 1 57 57 LEU HA H 57 4.929 4.929 4.696 0.233 18478 2952 1 7 . 1 1 57 57 LEU C C 57 175.584 175.584 174.554 1.030 18478 2953 1 7 . 1 1 57 57 LEU CA C 57 53.463 53.463 54.894 -1.431 18478 2954 1 7 . 1 1 57 57 LEU CB C 57 46.545 46.545 43.719 2.826 18478 2955 1 7 . 1 1 57 57 LEU H H 57 8.579 8.579 7.555 1.024 18478 2956 1 7 . 1 1 58 58 GLY N N 58 108.499 108.499 107.129 1.370 18478 2957 1 7 . 1 1 58 58 GLY CA C 58 43.755 43.755 44.056 -0.301 18478 2958 1 7 . 1 1 58 58 GLY H H 58 9.318 9.318 7.322 1.996 18478 2959 1 7 . 1 1 59 59 PRO HA H 59 4.048 4.048 4.960 -0.912 18478 2960 1 7 . 1 1 59 59 PRO C C 59 173.763 173.763 174.688 -0.925 18478 2961 1 7 . 1 1 59 59 PRO CA C 59 64.770 64.770 60.431 4.339 18478 2962 1 7 . 1 1 59 59 PRO CB C 59 31.889 31.889 35.855 -3.966 18478 2963 1 7 . 1 1 60 60 LYS HA H 60 4.191 4.191 4.588 -0.397 18478 2964 1 7 . 1 1 60 60 LYS C C 60 174.842 174.842 176.657 -1.815 18478 2965 1 7 . 1 1 60 60 LYS CA C 60 57.875 57.875 56.023 1.852 18478 2966 1 7 . 1 1 60 60 LYS CB C 60 31.576 31.576 32.900 -1.324 18478 2967 1 7 . 1 1 61 61 ASP N N 61 117.768 117.768 124.128 -6.360 18478 2968 1 7 . 1 1 61 61 ASP HA H 61 4.973 4.973 4.306 0.667 18478 2969 1 7 . 1 1 61 61 ASP C C 61 178.178 178.178 176.992 1.186 18478 2970 1 7 . 1 1 61 61 ASP CA C 61 54.687 54.687 55.321 -0.634 18478 2971 1 7 . 1 1 61 61 ASP CB C 61 43.555 43.555 39.674 3.881 18478 2972 1 7 . 1 1 61 61 ASP H H 61 7.722 7.722 8.828 -1.106 18478 2973 1 7 . 1 1 62 62 ILE N N 62 114.244 114.244 121.629 -7.385 18478 2974 1 7 . 1 1 62 62 ILE HA H 62 4.891 4.891 3.340 1.551 18478 2975 1 7 . 1 1 62 62 ILE C C 62 178.027 178.027 177.741 0.286 18478 2976 1 7 . 1 1 62 62 ILE CA C 62 59.994 59.994 63.545 -3.551 18478 2977 1 7 . 1 1 62 62 ILE CB C 62 40.652 40.652 36.934 3.718 18478 2978 1 7 . 1 1 62 62 ILE H H 62 6.784 6.784 7.529 -0.745 18478 2979 1 7 . 1 1 63 63 PHE N N 63 119.819 119.819 118.363 1.456 18478 2980 1 7 . 1 1 63 63 PHE HA H 63 5.214 5.214 4.384 0.830 18478 2981 1 7 . 1 1 63 63 PHE CA C 63 54.735 54.735 59.865 -5.130 18478 2982 1 7 . 1 1 63 63 PHE CB C 63 42.122 42.122 38.864 3.258 18478 2983 1 7 . 1 1 63 63 PHE H H 63 8.734 8.734 7.688 1.046 18478 2984 1 7 . 1 1 64 64 PRO HA H 64 4.771 4.771 4.238 0.533 18478 2985 1 7 . 1 1 64 64 PRO C C 64 174.036 174.036 178.613 -4.577 18478 2986 1 7 . 1 1 64 64 PRO CA C 64 64.474 64.474 64.711 -0.237 18478 2987 1 7 . 1 1 64 64 PRO CB C 64 32.662 32.662 33.018 -0.356 18478 2988 1 7 . 1 1 65 65 TYR N N 65 124.335 124.335 121.641 2.694 18478 2989 1 7 . 1 1 65 65 TYR HA H 65 4.530 4.530 4.275 0.255 18478 2990 1 7 . 1 1 65 65 TYR C C 65 173.944 173.944 177.492 -3.548 18478 2991 1 7 . 1 1 65 65 TYR CA C 65 61.205 61.205 60.843 0.362 18478 2992 1 7 . 1 1 65 65 TYR CB C 65 38.844 38.844 38.060 0.784 18478 2993 1 7 . 1 1 65 65 TYR H H 65 8.359 8.359 7.913 0.446 18478 2994 1 7 . 1 1 66 66 SER N N 66 114.836 114.836 112.274 2.562 18478 2995 1 7 . 1 1 66 66 SER HA H 66 3.505 3.505 4.343 -0.838 18478 2996 1 7 . 1 1 66 66 SER C C 66 173.697 173.697 175.395 -1.698 18478 2997 1 7 . 1 1 66 66 SER CA C 66 63.078 63.078 59.623 3.455 18478 2998 1 7 . 1 1 66 66 SER CB C 66 62.223 62.223 63.080 -0.857 18478 2999 1 7 . 1 1 66 66 SER H H 66 8.974 8.974 7.663 1.311 18478 3000 1 7 . 1 1 67 67 GLU N N 67 118.013 118.013 118.694 -0.681 18478 3001 1 7 . 1 1 67 67 GLU HA H 67 4.210 4.210 4.174 0.036 18478 3002 1 7 . 1 1 67 67 GLU C C 67 174.961 174.961 177.500 -2.539 18478 3003 1 7 . 1 1 67 67 GLU CA C 67 58.330 58.330 57.624 0.706 18478 3004 1 7 . 1 1 67 67 GLU CB C 67 30.205 30.205 30.762 -0.557 18478 3005 1 7 . 1 1 67 67 GLU H H 67 8.817 8.817 7.895 0.922 18478 3006 1 7 . 1 1 68 68 ASN N N 68 113.942 113.942 112.207 1.735 18478 3007 1 7 . 1 1 68 68 ASN HA H 68 5.015 5.015 5.022 -0.007 18478 3008 1 7 . 1 1 68 68 ASN C C 68 176.626 176.626 176.531 0.095 18478 3009 1 7 . 1 1 68 68 ASN CA C 68 53.768 53.768 51.845 1.923 18478 3010 1 7 . 1 1 68 68 ASN CB C 68 41.948 41.948 39.599 2.349 18478 3011 1 7 . 1 1 68 68 ASN H H 68 7.448 7.448 7.744 -0.296 18478 3012 1 7 . 1 1 69 69 LYS N N 69 124.584 124.584 120.491 4.093 18478 3013 1 7 . 1 1 69 69 LYS HA H 69 3.794 3.794 3.936 -0.142 18478 3014 1 7 . 1 1 69 69 LYS C C 69 173.330 173.330 175.396 -2.066 18478 3015 1 7 . 1 1 69 69 LYS CA C 69 61.225 61.225 57.156 4.069 18478 3016 1 7 . 1 1 69 69 LYS H H 69 7.592 7.592 8.452 -0.860 18478 3017 1 7 . 1 1 70 70 GLU N N 70 118.408 118.408 118.586 -0.178 18478 3018 1 7 . 1 1 70 70 GLU HA H 70 4.005 4.005 4.695 -0.690 18478 3019 1 7 . 1 1 70 70 GLU C C 70 174.588 174.588 173.613 0.975 18478 3020 1 7 . 1 1 70 70 GLU CA C 70 58.695 58.695 53.183 5.512 18478 3021 1 7 . 1 1 70 70 GLU CB C 70 28.928 28.928 31.870 -2.942 18478 3022 1 7 . 1 1 70 70 GLU H H 70 8.478 8.478 8.238 0.240 18478 3023 1 7 . 1 1 71 71 LYS HA H 71 3.847 3.847 4.396 -0.549 18478 3024 1 7 . 1 1 71 71 LYS C C 71 173.420 173.420 175.776 -2.356 18478 3025 1 7 . 1 1 71 71 LYS CA C 71 58.718 58.718 55.800 2.918 18478 3026 1 7 . 1 1 71 71 LYS CB C 71 32.964 32.964 33.714 -0.750 18478 3027 1 7 . 1 1 72 72 TYR N N 72 112.358 112.358 123.131 -10.773 18478 3028 1 7 . 1 1 72 72 TYR HA H 72 4.790 4.790 4.299 0.491 18478 3029 1 7 . 1 1 72 72 TYR C C 72 174.442 174.442 175.814 -1.372 18478 3030 1 7 . 1 1 72 72 TYR CA C 72 55.287 55.287 59.148 -3.861 18478 3031 1 7 . 1 1 72 72 TYR CB C 72 37.244 37.244 38.844 -1.601 18478 3032 1 7 . 1 1 72 72 TYR H H 72 7.341 7.341 8.161 -0.820 18478 3033 1 7 . 1 1 73 73 GLY N N 73 110.612 110.612 108.033 2.579 18478 3034 1 7 . 1 1 73 73 GLY C C 73 177.982 177.982 173.386 4.596 18478 3035 1 7 . 1 1 73 73 GLY CA C 73 46.623 46.623 44.369 2.254 18478 3036 1 7 . 1 1 73 73 GLY H H 73 8.076 8.076 8.255 -0.179 18478 3037 1 7 . 1 1 74 74 LYS N N 74 121.009 121.009 120.791 0.218 18478 3038 1 7 . 1 1 74 74 LYS CA C 74 53.465 53.465 54.361 -0.895 18478 3039 1 7 . 1 1 74 74 LYS CB C 74 32.440 32.440 33.350 -0.910 18478 3040 1 7 . 1 1 74 74 LYS H H 74 7.411 7.411 7.899 -0.488 18478 3041 1 7 . 1 1 75 75 PRO HA H 75 4.452 4.452 4.412 0.040 18478 3042 1 7 . 1 1 75 75 PRO C C 75 174.959 174.959 178.058 -3.099 18478 3043 1 7 . 1 1 75 75 PRO CA C 75 62.861 62.861 64.187 -1.326 18478 3044 1 7 . 1 1 75 75 PRO CB C 75 32.407 32.407 31.762 0.645 18478 3045 1 7 . 1 1 76 76 ASN N N 76 121.045 121.045 119.611 1.434 18478 3046 1 7 . 1 1 76 76 ASN HA H 76 4.445 4.445 4.418 0.027 18478 3047 1 7 . 1 1 76 76 ASN C C 76 174.145 174.145 174.835 -0.690 18478 3048 1 7 . 1 1 76 76 ASN CA C 76 55.701 55.701 52.965 2.736 18478 3049 1 7 . 1 1 76 76 ASN H H 76 8.474 8.474 8.879 -0.405 18478 3050 1 7 . 1 1 77 77 LYS N N 77 111.466 111.466 120.502 -9.036 18478 3051 1 7 . 1 1 77 77 LYS HA H 77 4.369 4.369 4.292 0.077 18478 3052 1 7 . 1 1 77 77 LYS C C 77 173.881 173.881 176.236 -2.355 18478 3053 1 7 . 1 1 77 77 LYS CA C 77 55.995 55.995 56.380 -0.385 18478 3054 1 7 . 1 1 77 77 LYS CB C 77 32.538 32.538 32.466 0.072 18478 3055 1 7 . 1 1 77 77 LYS H H 77 8.543 8.543 7.909 0.634 18478 3056 1 7 . 1 1 78 78 ARG N N 78 122.233 122.233 121.370 0.863 18478 3057 1 7 . 1 1 78 78 ARG HA H 78 4.286 4.286 4.064 0.222 18478 3058 1 7 . 1 1 78 78 ARG C C 78 173.652 173.652 174.812 -1.160 18478 3059 1 7 . 1 1 78 78 ARG CA C 78 55.780 55.780 57.514 -1.734 18478 3060 1 7 . 1 1 78 78 ARG CB C 78 29.554 29.554 29.390 0.164 18478 3061 1 7 . 1 1 78 78 ARG H H 78 8.864 8.864 8.701 0.163 18478 3062 1 7 . 1 1 79 79 LYS N N 79 128.197 128.197 119.373 8.824 18478 3063 1 7 . 1 1 79 79 LYS HA H 79 4.221 4.221 4.458 -0.237 18478 3064 1 7 . 1 1 79 79 LYS C C 79 174.336 174.336 175.686 -1.350 18478 3065 1 7 . 1 1 79 79 LYS CA C 79 58.986 58.986 55.939 3.047 18478 3066 1 7 . 1 1 79 79 LYS CB C 79 32.072 32.072 33.115 -1.043 18478 3067 1 7 . 1 1 79 79 LYS H H 79 8.927 8.927 7.967 0.960 18478 3068 1 7 . 1 1 80 80 GLY N N 80 114.730 114.730 111.088 3.642 18478 3069 1 7 . 1 1 80 80 GLY C C 80 176.536 176.536 175.195 1.341 18478 3070 1 7 . 1 1 80 80 GLY CA C 80 45.992 45.992 45.828 0.164 18478 3071 1 7 . 1 1 80 80 GLY H H 80 8.943 8.943 8.526 0.417 18478 3072 1 7 . 1 1 81 81 PHE N N 81 123.770 123.770 118.217 5.553 18478 3073 1 7 . 1 1 81 81 PHE HA H 81 3.336 3.336 4.607 -1.271 18478 3074 1 7 . 1 1 81 81 PHE C C 81 174.037 174.037 176.247 -2.210 18478 3075 1 7 . 1 1 81 81 PHE CA C 81 63.094 63.094 59.221 3.873 18478 3076 1 7 . 1 1 81 81 PHE CB C 81 39.823 39.823 38.718 1.105 18478 3077 1 7 . 1 1 81 81 PHE H H 81 8.281 8.281 8.067 0.214 18478 3078 1 7 . 1 1 82 82 ASN N N 82 119.812 119.812 116.910 2.902 18478 3079 1 7 . 1 1 82 82 ASN HA H 82 4.458 4.458 4.457 0.001 18478 3080 1 7 . 1 1 82 82 ASN C C 82 171.290 171.290 176.080 -4.790 18478 3081 1 7 . 1 1 82 82 ASN CA C 82 56.060 56.060 55.893 0.167 18478 3082 1 7 . 1 1 82 82 ASN CB C 82 36.390 36.390 38.723 -2.333 18478 3083 1 7 . 1 1 82 82 ASN H H 82 9.145 9.145 8.442 0.703 18478 3084 1 7 . 1 1 83 83 GLU N N 83 124.411 124.411 118.951 5.460 18478 3085 1 7 . 1 1 83 83 GLU HA H 83 4.186 4.186 4.173 0.013 18478 3086 1 7 . 1 1 83 83 GLU C C 83 172.222 172.222 178.772 -6.550 18478 3087 1 7 . 1 1 83 83 GLU CA C 83 60.922 60.922 59.347 1.575 18478 3088 1 7 . 1 1 83 83 GLU CB C 83 28.132 28.132 29.798 -1.666 18478 3089 1 7 . 1 1 83 83 GLU H H 83 9.560 9.560 8.007 1.553 18478 3090 1 7 . 1 1 84 84 GLY N N 84 111.388 111.388 106.318 5.070 18478 3091 1 7 . 1 1 84 84 GLY C C 84 176.445 176.445 174.518 1.927 18478 3092 1 7 . 1 1 84 84 GLY CA C 84 46.727 46.727 46.587 0.140 18478 3093 1 7 . 1 1 84 84 GLY H H 84 8.364 8.364 7.464 0.900 18478 3094 1 7 . 1 1 85 85 LEU N N 85 121.153 121.153 119.568 1.585 18478 3095 1 7 . 1 1 85 85 LEU HA H 85 4.236 4.236 4.308 -0.072 18478 3096 1 7 . 1 1 85 85 LEU C C 85 172.285 172.285 177.319 -5.034 18478 3097 1 7 . 1 1 85 85 LEU CA C 85 56.795 56.795 56.393 0.402 18478 3098 1 7 . 1 1 85 85 LEU CB C 85 41.113 41.113 43.312 -2.200 18478 3099 1 7 . 1 1 85 85 LEU H H 85 8.294 8.294 7.332 0.962 18478 3100 1 7 . 1 1 86 86 TRP N N 86 118.898 118.898 118.513 0.385 18478 3101 1 7 . 1 1 86 86 TRP HA H 86 4.161 4.161 4.317 -0.156 18478 3102 1 7 . 1 1 86 86 TRP C C 86 171.741 171.741 176.217 -4.476 18478 3103 1 7 . 1 1 86 86 TRP CA C 86 62.153 62.153 58.264 3.889 18478 3104 1 7 . 1 1 86 86 TRP CB C 86 28.424 28.424 29.519 -1.095 18478 3105 1 7 . 1 1 86 86 TRP H H 86 7.783 7.783 7.562 0.221 18478 3106 1 7 . 1 1 87 87 GLU N N 87 120.718 120.718 119.502 1.216 18478 3107 1 7 . 1 1 87 87 GLU HA H 87 3.416 3.416 4.756 -1.340 18478 3108 1 7 . 1 1 87 87 GLU C C 87 172.957 172.957 174.977 -2.020 18478 3109 1 7 . 1 1 87 87 GLU CA C 87 60.122 60.122 53.279 6.843 18478 3110 1 7 . 1 1 87 87 GLU CB C 87 31.021 31.021 30.521 0.500 18478 3111 1 7 . 1 1 87 87 GLU H H 87 8.779 8.779 7.550 1.229 18478 3112 1 7 . 1 1 88 88 ILE HA H 88 2.478 2.478 4.200 -1.722 18478 3113 1 7 . 1 1 88 88 ILE C C 88 177.873 177.873 177.001 0.872 18478 3114 1 7 . 1 1 88 88 ILE CA C 88 65.248 65.248 62.369 2.879 18478 3115 1 7 . 1 1 88 88 ILE CB C 88 37.327 37.327 38.237 -0.910 18478 3116 1 7 . 1 1 89 89 ASP N N 89 114.411 114.411 119.333 -4.922 18478 3117 1 7 . 1 1 89 89 ASP HA H 89 4.589 4.589 4.525 0.064 18478 3118 1 7 . 1 1 89 89 ASP C C 89 174.207 174.207 177.572 -3.365 18478 3119 1 7 . 1 1 89 89 ASP CA C 89 54.740 54.740 56.098 -1.358 18478 3120 1 7 . 1 1 89 89 ASP CB C 89 42.473 42.473 40.086 2.387 18478 3121 1 7 . 1 1 89 89 ASP H H 89 5.911 5.911 8.292 -2.381 18478 3122 1 7 . 1 1 90 90 ASN N N 90 114.358 114.358 113.345 1.013 18478 3123 1 7 . 1 1 90 90 ASN HA H 90 4.420 4.420 4.330 0.090 18478 3124 1 7 . 1 1 90 90 ASN C C 90 176.991 176.991 177.099 -0.108 18478 3125 1 7 . 1 1 90 90 ASN CA C 90 54.855 54.855 56.790 -1.935 18478 3126 1 7 . 1 1 90 90 ASN CB C 90 40.582 40.582 38.372 2.210 18478 3127 1 7 . 1 1 90 90 ASN H H 90 7.480 7.480 7.769 -0.289 18478 3128 1 7 . 1 1 91 91 ASN N N 91 119.185 119.185 115.917 3.268 18478 3129 1 7 . 1 1 91 91 ASN HA H 91 5.006 5.006 4.958 0.048 18478 3130 1 7 . 1 1 91 91 ASN CA C 91 51.624 51.624 53.914 -2.290 18478 3131 1 7 . 1 1 91 91 ASN CB C 91 38.752 38.752 38.748 0.004 18478 3132 1 7 . 1 1 91 91 ASN H H 91 9.238 9.238 7.735 1.503 18478 3133 1 7 . 1 1 92 92 PRO HA H 92 4.296 4.296 4.185 0.111 18478 3134 1 7 . 1 1 92 92 PRO C C 92 173.690 173.690 176.280 -2.590 18478 3135 1 7 . 1 1 92 92 PRO CA C 92 64.714 64.714 64.453 0.261 18478 3136 1 7 . 1 1 92 92 PRO CB C 92 31.781 31.781 32.267 -0.486 18478 3137 1 8 . 1 1 3 3 GLY C C 3 177.088 177.088 172.151 4.937 18478 3138 1 8 . 1 1 3 3 GLY CA C 3 45.330 45.330 43.789 1.541 18478 3139 1 8 . 1 1 4 4 SER N N 4 115.847 115.847 115.031 0.816 18478 3140 1 8 . 1 1 4 4 SER HA H 4 4.480 4.480 4.736 -0.256 18478 3141 1 8 . 1 1 4 4 SER C C 4 177.991 177.991 171.934 6.057 18478 3142 1 8 . 1 1 4 4 SER CA C 4 58.742 58.742 58.783 -0.041 18478 3143 1 8 . 1 1 4 4 SER CB C 4 63.820 63.820 65.159 -1.339 18478 3144 1 8 . 1 1 4 4 SER H H 4 8.207 8.207 7.822 0.385 18478 3145 1 8 . 1 1 5 5 MET N N 5 125.867 125.867 122.067 3.800 18478 3146 1 8 . 1 1 5 5 MET HA H 5 4.580 4.580 4.678 -0.098 18478 3147 1 8 . 1 1 5 5 MET C C 5 174.825 174.825 176.025 -1.200 18478 3148 1 8 . 1 1 5 5 MET CA C 5 54.733 54.733 54.461 0.272 18478 3149 1 8 . 1 1 5 5 MET CB C 5 33.527 33.527 35.853 -2.326 18478 3150 1 8 . 1 1 5 5 MET H H 5 8.148 8.148 8.850 -0.702 18478 3151 1 8 . 1 1 6 6 THR N N 6 115.828 115.828 115.597 0.231 18478 3152 1 8 . 1 1 6 6 THR HA H 6 3.903 3.903 4.514 -0.611 18478 3153 1 8 . 1 1 6 6 THR C C 6 176.930 176.930 172.883 4.047 18478 3154 1 8 . 1 1 6 6 THR CA C 6 63.034 63.034 61.132 1.902 18478 3155 1 8 . 1 1 6 6 THR CB C 6 69.308 69.308 68.629 0.679 18478 3156 1 8 . 1 1 6 6 THR H H 6 8.408 8.408 8.595 -0.187 18478 3157 1 8 . 1 1 7 7 ARG HA H 7 4.276 4.276 4.270 0.006 18478 3158 1 8 . 1 1 7 7 ARG C C 7 176.546 176.546 176.226 0.320 18478 3159 1 8 . 1 1 7 7 ARG CA C 7 55.813 55.813 56.429 -0.616 18478 3160 1 8 . 1 1 7 7 ARG CB C 7 30.556 30.556 30.521 0.035 18478 3161 1 8 . 1 1 8 8 ASP N N 8 121.762 121.762 124.619 -2.857 18478 3162 1 8 . 1 1 8 8 ASP HA H 8 4.537 4.537 4.160 0.377 18478 3163 1 8 . 1 1 8 8 ASP C C 8 177.750 177.750 175.255 2.495 18478 3164 1 8 . 1 1 8 8 ASP CA C 8 54.117 54.117 54.702 -0.585 18478 3165 1 8 . 1 1 8 8 ASP H H 8 8.066 8.066 8.412 -0.346 18478 3166 1 8 . 1 1 9 9 PHE N N 9 119.991 119.991 120.243 -0.252 18478 3167 1 8 . 1 1 9 9 PHE HA H 9 4.734 4.734 4.974 -0.240 18478 3168 1 8 . 1 1 9 9 PHE C C 9 176.838 176.838 175.425 1.413 18478 3169 1 8 . 1 1 9 9 PHE CA C 9 58.303 58.303 57.597 0.706 18478 3170 1 8 . 1 1 9 9 PHE CB C 9 41.594 41.594 40.484 1.110 18478 3171 1 8 . 1 1 9 9 PHE H H 9 8.103 8.103 7.641 0.462 18478 3172 1 8 . 1 1 10 10 LYS N N 10 122.957 122.957 124.604 -1.647 18478 3173 1 8 . 1 1 10 10 LYS CA C 10 53.167 53.167 56.066 -2.899 18478 3174 1 8 . 1 1 10 10 LYS CB C 10 33.495 33.495 31.879 1.616 18478 3175 1 8 . 1 1 10 10 LYS H H 10 9.087 9.087 8.693 0.394 18478 3176 1 8 . 1 1 11 11 PRO HA H 11 3.903 3.903 4.950 -1.047 18478 3177 1 8 . 1 1 11 11 PRO C C 11 173.988 173.988 174.718 -0.730 18478 3178 1 8 . 1 1 11 11 PRO CA C 11 63.874 63.874 61.181 2.693 18478 3179 1 8 . 1 1 11 11 PRO CB C 11 31.623 31.623 34.834 -3.211 18478 3180 1 8 . 1 1 12 12 GLY N N 12 115.413 115.413 111.314 4.099 18478 3181 1 8 . 1 1 12 12 GLY C C 12 176.966 176.966 172.522 4.444 18478 3182 1 8 . 1 1 12 12 GLY CA C 12 44.651 44.651 42.117 2.534 18478 3183 1 8 . 1 1 12 12 GLY H H 12 9.667 9.667 8.905 0.762 18478 3184 1 8 . 1 1 13 13 ASP N N 13 122.208 122.208 128.489 -6.281 18478 3185 1 8 . 1 1 13 13 ASP HA H 13 4.601 4.601 4.678 -0.077 18478 3186 1 8 . 1 1 13 13 ASP C C 13 176.244 176.244 174.252 1.992 18478 3187 1 8 . 1 1 13 13 ASP CA C 13 55.870 55.870 52.217 3.653 18478 3188 1 8 . 1 1 13 13 ASP CB C 13 40.794 40.794 42.758 -1.964 18478 3189 1 8 . 1 1 13 13 ASP H H 13 8.303 8.303 8.448 -0.145 18478 3190 1 8 . 1 1 14 14 LEU N N 14 121.306 121.306 125.813 -4.507 18478 3191 1 8 . 1 1 14 14 LEU HA H 14 4.982 4.982 4.613 0.369 18478 3192 1 8 . 1 1 14 14 LEU C C 14 173.461 173.461 176.315 -2.854 18478 3193 1 8 . 1 1 14 14 LEU CA C 14 54.516 54.516 53.545 0.971 18478 3194 1 8 . 1 1 14 14 LEU CB C 14 40.999 40.999 42.160 -1.161 18478 3195 1 8 . 1 1 14 14 LEU H H 14 8.618 8.618 7.999 0.619 18478 3196 1 8 . 1 1 15 15 ILE N N 15 118.806 118.806 124.980 -6.174 18478 3197 1 8 . 1 1 15 15 ILE HA H 15 5.356 5.356 4.253 1.103 18478 3198 1 8 . 1 1 15 15 ILE C C 15 175.982 175.982 175.619 0.363 18478 3199 1 8 . 1 1 15 15 ILE CA C 15 60.481 60.481 61.368 -0.887 18478 3200 1 8 . 1 1 15 15 ILE CB C 15 44.142 44.142 39.599 4.543 18478 3201 1 8 . 1 1 15 15 ILE H H 15 8.864 8.864 8.596 0.268 18478 3202 1 8 . 1 1 16 16 PHE N N 16 112.472 112.472 123.565 -11.093 18478 3203 1 8 . 1 1 16 16 PHE HA H 16 5.306 5.306 4.331 0.975 18478 3204 1 8 . 1 1 16 16 PHE C C 16 176.239 176.239 176.088 0.151 18478 3205 1 8 . 1 1 16 16 PHE CA C 16 58.603 58.603 59.150 -0.547 18478 3206 1 8 . 1 1 16 16 PHE CB C 16 43.305 43.305 38.117 5.188 18478 3207 1 8 . 1 1 16 16 PHE H H 16 9.411 9.411 8.713 0.699 18478 3208 1 8 . 1 1 17 17 ALA N N 17 123.889 123.889 126.179 -2.290 18478 3209 1 8 . 1 1 17 17 ALA HA H 17 5.348 5.348 3.667 1.681 18478 3210 1 8 . 1 1 17 17 ALA C C 17 174.426 174.426 176.657 -2.231 18478 3211 1 8 . 1 1 17 17 ALA CA C 17 50.062 50.062 51.669 -1.607 18478 3212 1 8 . 1 1 17 17 ALA H H 17 9.658 9.658 8.624 1.034 18478 3213 1 8 . 1 1 18 18 LYS N N 18 127.760 127.760 121.328 6.432 18478 3214 1 8 . 1 1 18 18 LYS HA H 18 4.697 4.697 4.724 -0.027 18478 3215 1 8 . 1 1 18 18 LYS C C 18 178.554 178.554 174.761 3.793 18478 3216 1 8 . 1 1 18 18 LYS CA C 18 53.893 53.893 52.029 1.864 18478 3217 1 8 . 1 1 18 18 LYS CB C 18 35.291 35.291 32.261 3.030 18478 3218 1 8 . 1 1 18 18 LYS H H 18 9.421 9.421 7.402 2.019 18478 3219 1 8 . 1 1 19 19 MET HA H 19 4.656 4.656 4.622 0.034 18478 3220 1 8 . 1 1 19 19 MET C C 19 175.741 175.741 174.775 0.966 18478 3221 1 8 . 1 1 19 19 MET CA C 19 53.916 53.916 54.706 -0.790 18478 3222 1 8 . 1 1 19 19 MET CB C 19 35.799 35.799 33.604 2.195 18478 3223 1 8 . 1 1 20 20 LYS N N 20 124.062 124.062 117.725 6.337 18478 3224 1 8 . 1 1 20 20 LYS CA C 20 58.585 58.585 56.099 2.486 18478 3225 1 8 . 1 1 20 20 LYS CB C 20 31.978 31.978 33.089 -1.111 18478 3226 1 8 . 1 1 20 20 LYS H H 20 8.645 8.645 8.070 0.575 18478 3227 1 8 . 1 1 21 21 GLY C C 21 176.205 176.205 172.273 3.932 18478 3228 1 8 . 1 1 21 21 GLY CA C 21 45.142 45.142 41.760 3.382 18478 3229 1 8 . 1 1 22 22 TYR HA H 22 4.573 4.573 4.659 -0.086 18478 3230 1 8 . 1 1 22 22 TYR CA C 22 55.748 55.748 57.725 -1.978 18478 3231 1 8 . 1 1 22 22 TYR CB C 22 41.331 41.331 38.248 3.083 18478 3232 1 8 . 1 1 23 23 PRO HA H 23 4.759 4.759 5.076 -0.317 18478 3233 1 8 . 1 1 23 23 PRO C C 23 174.587 174.587 175.169 -0.582 18478 3234 1 8 . 1 1 23 23 PRO CA C 23 62.072 62.072 61.683 0.389 18478 3235 1 8 . 1 1 23 23 PRO CB C 23 31.077 31.077 34.735 -3.658 18478 3236 1 8 . 1 1 24 24 HIS N N 24 119.190 119.190 114.795 4.395 18478 3237 1 8 . 1 1 24 24 HIS HA H 24 3.983 3.983 5.346 -1.363 18478 3238 1 8 . 1 1 24 24 HIS C C 24 175.555 175.555 173.823 1.732 18478 3239 1 8 . 1 1 24 24 HIS CA C 24 60.973 60.973 54.302 6.671 18478 3240 1 8 . 1 1 24 24 HIS CB C 24 30.689 30.689 32.714 -2.025 18478 3241 1 8 . 1 1 24 24 HIS H H 24 8.158 8.158 8.649 -0.491 18478 3242 1 8 . 1 1 25 25 TRP N N 25 127.435 127.435 122.448 4.987 18478 3243 1 8 . 1 1 25 25 TRP HA H 25 3.760 3.760 5.324 -1.564 18478 3244 1 8 . 1 1 25 25 TRP CA C 25 55.890 55.890 56.813 -0.923 18478 3245 1 8 . 1 1 25 25 TRP CB C 25 32.879 32.879 29.998 2.881 18478 3246 1 8 . 1 1 25 25 TRP H H 25 9.211 9.211 8.612 0.599 18478 3247 1 8 . 1 1 26 26 PRO HA H 26 4.217 4.217 4.670 -0.453 18478 3248 1 8 . 1 1 26 26 PRO C C 26 176.279 176.279 176.246 0.033 18478 3249 1 8 . 1 1 26 26 PRO CA C 26 63.140 63.140 61.330 1.810 18478 3250 1 8 . 1 1 26 26 PRO CB C 26 32.171 32.171 34.907 -2.736 18478 3251 1 8 . 1 1 27 27 ALA N N 27 130.162 130.162 122.397 7.765 18478 3252 1 8 . 1 1 27 27 ALA HA H 27 4.981 4.981 4.448 0.533 18478 3253 1 8 . 1 1 27 27 ALA C C 27 177.227 177.227 177.403 -0.176 18478 3254 1 8 . 1 1 27 27 ALA CA C 27 52.574 52.574 50.565 2.009 18478 3255 1 8 . 1 1 27 27 ALA CB C 27 23.239 23.239 20.127 3.112 18478 3256 1 8 . 1 1 27 27 ALA H H 27 9.394 9.394 8.163 1.231 18478 3257 1 8 . 1 1 28 28 ARG N N 28 117.381 117.381 121.879 -4.498 18478 3258 1 8 . 1 1 28 28 ARG HA H 28 5.421 5.421 4.411 1.010 18478 3259 1 8 . 1 1 28 28 ARG C C 28 176.465 176.465 175.354 1.111 18478 3260 1 8 . 1 1 28 28 ARG CA C 28 53.662 53.662 54.856 -1.194 18478 3261 1 8 . 1 1 28 28 ARG CB C 28 35.058 35.058 30.102 4.955 18478 3262 1 8 . 1 1 28 28 ARG H H 28 8.806 8.806 8.494 0.312 18478 3263 1 8 . 1 1 29 29 VAL HA H 29 4.109 4.109 4.241 -0.132 18478 3264 1 8 . 1 1 29 29 VAL C C 29 175.996 175.996 174.781 1.215 18478 3265 1 8 . 1 1 29 29 VAL CA C 29 62.810 62.810 61.587 1.222 18478 3266 1 8 . 1 1 29 29 VAL CB C 29 31.108 31.108 32.659 -1.551 18478 3267 1 8 . 1 1 30 30 ASP N N 30 133.830 133.830 118.789 15.041 18478 3268 1 8 . 1 1 30 30 ASP HA H 30 5.198 5.198 4.551 0.647 18478 3269 1 8 . 1 1 30 30 ASP C C 30 176.207 176.207 177.438 -1.231 18478 3270 1 8 . 1 1 30 30 ASP CA C 30 53.007 53.007 54.487 -1.480 18478 3271 1 8 . 1 1 30 30 ASP CB C 30 44.130 44.130 42.011 2.119 18478 3272 1 8 . 1 1 30 30 ASP H H 30 8.892 8.892 8.414 0.478 18478 3273 1 8 . 1 1 31 31 GLU N N 31 115.905 115.905 122.041 -6.136 18478 3274 1 8 . 1 1 31 31 GLU HA H 31 4.409 4.409 3.993 0.416 18478 3275 1 8 . 1 1 31 31 GLU C C 31 175.192 175.192 175.911 -0.719 18478 3276 1 8 . 1 1 31 31 GLU CA C 31 55.389 55.389 56.881 -1.492 18478 3277 1 8 . 1 1 31 31 GLU H H 31 7.966 7.966 8.762 -0.796 18478 3278 1 8 . 1 1 32 32 VAL N N 32 122.794 122.794 116.817 5.977 18478 3279 1 8 . 1 1 32 32 VAL HA H 32 4.303 4.303 3.682 0.621 18478 3280 1 8 . 1 1 32 32 VAL CA C 32 60.408 60.408 62.698 -2.290 18478 3281 1 8 . 1 1 32 32 VAL CB C 32 32.333 32.333 30.533 1.800 18478 3282 1 8 . 1 1 32 32 VAL H H 32 8.702 8.702 7.770 0.932 18478 3283 1 8 . 1 1 33 33 PRO HA H 33 4.572 4.572 4.131 0.441 18478 3284 1 8 . 1 1 33 33 PRO C C 33 175.366 175.366 178.545 -3.179 18478 3285 1 8 . 1 1 33 33 PRO CA C 33 63.702 63.702 65.818 -2.116 18478 3286 1 8 . 1 1 33 33 PRO CB C 33 32.736 32.736 32.095 0.641 18478 3287 1 8 . 1 1 34 34 ASP N N 34 119.187 119.187 118.295 0.892 18478 3288 1 8 . 1 1 34 34 ASP HA H 34 4.679 4.679 4.889 -0.210 18478 3289 1 8 . 1 1 34 34 ASP C C 34 175.713 175.713 173.926 1.787 18478 3290 1 8 . 1 1 34 34 ASP CA C 34 53.013 53.013 52.798 0.215 18478 3291 1 8 . 1 1 34 34 ASP CB C 34 40.850 40.850 41.035 -0.186 18478 3292 1 8 . 1 1 34 34 ASP H H 34 8.686 8.686 8.015 0.671 18478 3293 1 8 . 1 1 35 35 GLY C C 35 177.458 177.458 172.654 4.804 18478 3294 1 8 . 1 1 35 35 GLY CA C 35 45.507 45.507 43.874 1.633 18478 3295 1 8 . 1 1 36 36 ALA HA H 36 4.404 4.404 4.188 0.216 18478 3296 1 8 . 1 1 36 36 ALA CA C 36 52.010 52.010 51.813 0.197 18478 3297 1 8 . 1 1 36 36 ALA CB C 36 19.909 19.909 19.732 0.177 18478 3298 1 8 . 1 1 37 37 VAL N N 37 119.594 119.594 123.259 -3.665 18478 3299 1 8 . 1 1 37 37 VAL HA H 37 3.932 3.932 4.056 -0.124 18478 3300 1 8 . 1 1 37 37 VAL C C 37 175.966 175.966 176.232 -0.266 18478 3301 1 8 . 1 1 37 37 VAL CA C 37 62.810 62.810 64.000 -1.190 18478 3302 1 8 . 1 1 37 37 VAL CB C 37 32.267 32.267 32.285 -0.018 18478 3303 1 8 . 1 1 37 37 VAL H H 37 8.037 8.037 8.467 -0.430 18478 3304 1 8 . 1 1 38 38 LYS N N 38 125.676 125.676 120.640 5.036 18478 3305 1 8 . 1 1 38 38 LYS C C 38 173.865 173.865 174.860 -0.995 18478 3306 1 8 . 1 1 38 38 LYS CA C 38 54.278 54.278 56.620 -2.342 18478 3307 1 8 . 1 1 38 38 LYS CB C 38 31.740 31.740 33.456 -1.716 18478 3308 1 8 . 1 1 38 38 LYS H H 38 8.292 8.292 8.358 -0.066 18478 3309 1 8 . 1 1 40 40 PRO HA H 40 4.387 4.387 5.297 -0.910 18478 3310 1 8 . 1 1 40 40 PRO C C 40 175.535 175.535 175.453 0.082 18478 3311 1 8 . 1 1 40 40 PRO CA C 40 62.330 62.330 59.274 3.056 18478 3312 1 8 . 1 1 40 40 PRO CB C 40 32.086 32.086 32.099 -0.013 18478 3313 1 8 . 1 1 41 41 THR HA H 41 4.027 4.027 4.639 -0.612 18478 3314 1 8 . 1 1 41 41 THR C C 41 176.795 176.795 173.205 3.590 18478 3315 1 8 . 1 1 41 41 THR CA C 41 63.693 63.693 62.477 1.216 18478 3316 1 8 . 1 1 41 41 THR CB C 41 69.370 69.370 68.841 0.529 18478 3317 1 8 . 1 1 42 42 ASN N N 42 118.513 118.513 122.163 -3.650 18478 3318 1 8 . 1 1 42 42 ASN HA H 42 4.530 4.530 5.248 -0.718 18478 3319 1 8 . 1 1 42 42 ASN C C 42 177.230 177.230 174.892 2.338 18478 3320 1 8 . 1 1 42 42 ASN CA C 42 56.373 56.373 50.420 5.953 18478 3321 1 8 . 1 1 42 42 ASN CB C 42 37.618 37.618 37.962 -0.344 18478 3322 1 8 . 1 1 42 42 ASN H H 42 8.752 8.752 8.559 0.193 18478 3323 1 8 . 1 1 43 43 LYS N N 43 115.898 115.898 128.719 -12.821 18478 3324 1 8 . 1 1 43 43 LYS HA H 43 4.710 4.710 4.731 -0.021 18478 3325 1 8 . 1 1 43 43 LYS C C 43 177.032 177.032 175.944 1.088 18478 3326 1 8 . 1 1 43 43 LYS CA C 43 54.957 54.957 55.224 -0.266 18478 3327 1 8 . 1 1 43 43 LYS CB C 43 36.600 36.600 33.437 3.163 18478 3328 1 8 . 1 1 43 43 LYS H H 43 7.723 7.723 8.714 -0.991 18478 3329 1 8 . 1 1 44 44 LEU N N 44 121.006 121.006 129.480 -8.474 18478 3330 1 8 . 1 1 44 44 LEU HA H 44 5.000 5.000 4.410 0.590 18478 3331 1 8 . 1 1 44 44 LEU CA C 44 51.842 51.842 54.266 -2.424 18478 3332 1 8 . 1 1 44 44 LEU CB C 44 44.418 44.418 40.510 3.908 18478 3333 1 8 . 1 1 44 44 LEU H H 44 9.063 9.063 8.551 0.512 18478 3334 1 8 . 1 1 45 45 PRO HA H 45 4.392 4.392 4.316 0.076 18478 3335 1 8 . 1 1 45 45 PRO C C 45 177.051 177.051 177.823 -0.772 18478 3336 1 8 . 1 1 45 45 PRO CA C 45 62.000 62.000 63.865 -1.865 18478 3337 1 8 . 1 1 45 45 PRO CB C 45 30.737 30.737 32.045 -1.308 18478 3338 1 8 . 1 1 46 46 ILE N N 46 125.996 125.996 125.132 0.864 18478 3339 1 8 . 1 1 46 46 ILE HA H 46 4.564 4.564 3.720 0.844 18478 3340 1 8 . 1 1 46 46 ILE C C 46 176.985 176.985 175.950 1.035 18478 3341 1 8 . 1 1 46 46 ILE CA C 46 57.051 57.051 62.761 -5.710 18478 3342 1 8 . 1 1 46 46 ILE H H 46 8.908 8.908 8.759 0.149 18478 3343 1 8 . 1 1 47 47 PHE N N 47 128.276 128.276 117.695 10.581 18478 3344 1 8 . 1 1 47 47 PHE HA H 47 4.827 4.827 4.474 0.353 18478 3345 1 8 . 1 1 47 47 PHE C C 47 177.835 177.835 176.053 1.782 18478 3346 1 8 . 1 1 47 47 PHE CA C 47 56.099 56.099 57.884 -1.785 18478 3347 1 8 . 1 1 47 47 PHE CB C 47 41.217 41.217 40.827 0.390 18478 3348 1 8 . 1 1 47 47 PHE H H 47 8.739 8.739 7.784 0.955 18478 3349 1 8 . 1 1 48 48 PHE N N 48 125.953 125.953 117.622 8.331 18478 3350 1 8 . 1 1 48 48 PHE HA H 48 4.251 4.251 4.579 -0.328 18478 3351 1 8 . 1 1 48 48 PHE C C 48 175.869 175.869 174.663 1.206 18478 3352 1 8 . 1 1 48 48 PHE CA C 48 56.744 56.744 59.700 -2.956 18478 3353 1 8 . 1 1 48 48 PHE CB C 48 38.835 38.835 36.883 1.952 18478 3354 1 8 . 1 1 48 48 PHE H H 48 8.545 8.545 8.007 0.538 18478 3355 1 8 . 1 1 49 49 PHE N N 49 122.197 122.197 118.190 4.007 18478 3356 1 8 . 1 1 49 49 PHE HA H 49 4.400 4.400 4.516 -0.116 18478 3357 1 8 . 1 1 49 49 PHE C C 49 174.016 174.016 173.898 0.118 18478 3358 1 8 . 1 1 49 49 PHE CA C 49 59.916 59.916 55.319 4.596 18478 3359 1 8 . 1 1 49 49 PHE CB C 49 39.799 39.799 41.736 -1.937 18478 3360 1 8 . 1 1 49 49 PHE H H 49 8.619 8.619 7.400 1.219 18478 3361 1 8 . 1 1 50 50 GLY N N 50 114.083 114.083 107.083 7.000 18478 3362 1 8 . 1 1 50 50 GLY C C 50 175.636 175.636 173.118 2.518 18478 3363 1 8 . 1 1 50 50 GLY CA C 50 46.718 46.718 43.936 2.782 18478 3364 1 8 . 1 1 50 50 GLY H H 50 10.329 10.329 7.897 2.432 18478 3365 1 8 . 1 1 51 51 THR N N 51 111.210 111.210 117.914 -6.704 18478 3366 1 8 . 1 1 51 51 THR HA H 51 3.980 3.980 4.534 -0.554 18478 3367 1 8 . 1 1 51 51 THR C C 51 175.588 175.588 171.946 3.642 18478 3368 1 8 . 1 1 51 51 THR CA C 51 62.223 62.223 61.303 0.920 18478 3369 1 8 . 1 1 51 51 THR CB C 51 68.346 68.346 72.096 -3.750 18478 3370 1 8 . 1 1 51 51 THR H H 51 7.882 7.882 8.565 -0.683 18478 3371 1 8 . 1 1 52 52 HIS N N 52 115.544 115.544 120.806 -5.262 18478 3372 1 8 . 1 1 52 52 HIS HA H 52 3.712 3.712 5.406 -1.694 18478 3373 1 8 . 1 1 52 52 HIS C C 52 177.717 177.717 175.425 2.292 18478 3374 1 8 . 1 1 52 52 HIS CA C 52 54.860 54.860 54.719 0.141 18478 3375 1 8 . 1 1 52 52 HIS CB C 52 26.388 26.388 30.265 -3.877 18478 3376 1 8 . 1 1 52 52 HIS H H 52 7.791 7.791 8.540 -0.749 18478 3377 1 8 . 1 1 53 53 GLU N N 53 117.517 117.517 123.390 -5.873 18478 3378 1 8 . 1 1 53 53 GLU HA H 53 4.298 4.298 4.738 -0.440 18478 3379 1 8 . 1 1 53 53 GLU C C 53 176.958 176.958 176.574 0.384 18478 3380 1 8 . 1 1 53 53 GLU CA C 53 55.403 55.403 55.402 0.001 18478 3381 1 8 . 1 1 53 53 GLU CB C 53 31.588 31.588 33.227 -1.639 18478 3382 1 8 . 1 1 53 53 GLU H H 53 6.795 6.795 8.492 -1.697 18478 3383 1 8 . 1 1 54 54 THR N N 54 111.182 111.182 117.116 -5.934 18478 3384 1 8 . 1 1 54 54 THR HA H 54 5.648 5.648 4.329 1.319 18478 3385 1 8 . 1 1 54 54 THR C C 54 177.234 177.234 174.184 3.050 18478 3386 1 8 . 1 1 54 54 THR CA C 54 59.894 59.894 61.500 -1.606 18478 3387 1 8 . 1 1 54 54 THR H H 54 8.139 8.139 8.843 -0.704 18478 3388 1 8 . 1 1 55 55 ALA HA H 55 4.403 4.403 4.207 0.196 18478 3389 1 8 . 1 1 55 55 ALA C C 55 176.601 176.601 177.772 -1.171 18478 3390 1 8 . 1 1 55 55 ALA CA C 55 51.079 51.079 53.196 -2.117 18478 3391 1 8 . 1 1 55 55 ALA CB C 55 23.285 23.285 19.109 4.176 18478 3392 1 8 . 1 1 56 56 PHE N N 56 118.058 118.058 112.651 5.407 18478 3393 1 8 . 1 1 56 56 PHE HA H 56 5.678 5.678 4.600 1.078 18478 3394 1 8 . 1 1 56 56 PHE C C 56 175.962 175.962 175.274 0.688 18478 3395 1 8 . 1 1 56 56 PHE CA C 56 56.008 56.008 58.878 -2.870 18478 3396 1 8 . 1 1 56 56 PHE CB C 56 39.995 39.995 37.847 2.148 18478 3397 1 8 . 1 1 56 56 PHE H H 56 8.523 8.523 8.239 0.284 18478 3398 1 8 . 1 1 57 57 LEU N N 57 123.344 123.344 120.184 3.160 18478 3399 1 8 . 1 1 57 57 LEU HA H 57 4.929 4.929 4.647 0.282 18478 3400 1 8 . 1 1 57 57 LEU C C 57 175.584 175.584 175.159 0.425 18478 3401 1 8 . 1 1 57 57 LEU CA C 57 53.463 53.463 55.130 -1.667 18478 3402 1 8 . 1 1 57 57 LEU CB C 57 46.545 46.545 44.306 2.239 18478 3403 1 8 . 1 1 57 57 LEU H H 57 8.579 8.579 7.774 0.805 18478 3404 1 8 . 1 1 58 58 GLY N N 58 108.499 108.499 107.076 1.423 18478 3405 1 8 . 1 1 58 58 GLY CA C 58 43.755 43.755 45.034 -1.279 18478 3406 1 8 . 1 1 58 58 GLY H H 58 9.318 9.318 7.221 2.097 18478 3407 1 8 . 1 1 59 59 PRO HA H 59 4.048 4.048 4.902 -0.854 18478 3408 1 8 . 1 1 59 59 PRO C C 59 173.763 173.763 174.662 -0.899 18478 3409 1 8 . 1 1 59 59 PRO CA C 59 64.770 64.770 60.435 4.335 18478 3410 1 8 . 1 1 59 59 PRO CB C 59 31.889 31.889 35.621 -3.732 18478 3411 1 8 . 1 1 60 60 LYS HA H 60 4.191 4.191 4.548 -0.357 18478 3412 1 8 . 1 1 60 60 LYS C C 60 174.842 174.842 176.564 -1.722 18478 3413 1 8 . 1 1 60 60 LYS CA C 60 57.875 57.875 56.074 1.801 18478 3414 1 8 . 1 1 60 60 LYS CB C 60 31.576 31.576 32.709 -1.133 18478 3415 1 8 . 1 1 61 61 ASP N N 61 117.768 117.768 123.064 -5.296 18478 3416 1 8 . 1 1 61 61 ASP HA H 61 4.973 4.973 4.307 0.666 18478 3417 1 8 . 1 1 61 61 ASP C C 61 178.178 178.178 177.067 1.111 18478 3418 1 8 . 1 1 61 61 ASP CA C 61 54.687 54.687 55.764 -1.077 18478 3419 1 8 . 1 1 61 61 ASP CB C 61 43.555 43.555 39.733 3.822 18478 3420 1 8 . 1 1 61 61 ASP H H 61 7.722 7.722 8.755 -1.033 18478 3421 1 8 . 1 1 62 62 ILE N N 62 114.244 114.244 121.484 -7.240 18478 3422 1 8 . 1 1 62 62 ILE HA H 62 4.891 4.891 3.447 1.444 18478 3423 1 8 . 1 1 62 62 ILE C C 62 178.027 178.027 177.266 0.761 18478 3424 1 8 . 1 1 62 62 ILE CA C 62 59.994 59.994 63.930 -3.936 18478 3425 1 8 . 1 1 62 62 ILE CB C 62 40.652 40.652 37.066 3.586 18478 3426 1 8 . 1 1 62 62 ILE H H 62 6.784 6.784 7.753 -0.969 18478 3427 1 8 . 1 1 63 63 PHE N N 63 119.819 119.819 119.356 0.463 18478 3428 1 8 . 1 1 63 63 PHE HA H 63 5.214 5.214 4.274 0.940 18478 3429 1 8 . 1 1 63 63 PHE CA C 63 54.735 54.735 59.883 -5.148 18478 3430 1 8 . 1 1 63 63 PHE CB C 63 42.122 42.122 38.665 3.457 18478 3431 1 8 . 1 1 63 63 PHE H H 63 8.734 8.734 7.646 1.088 18478 3432 1 8 . 1 1 64 64 PRO HA H 64 4.771 4.771 4.360 0.411 18478 3433 1 8 . 1 1 64 64 PRO C C 64 174.036 174.036 178.258 -4.222 18478 3434 1 8 . 1 1 64 64 PRO CA C 64 64.474 64.474 64.328 0.146 18478 3435 1 8 . 1 1 64 64 PRO CB C 64 32.662 32.662 32.693 -0.031 18478 3436 1 8 . 1 1 65 65 TYR N N 65 124.335 124.335 121.377 2.958 18478 3437 1 8 . 1 1 65 65 TYR HA H 65 4.530 4.530 4.339 0.191 18478 3438 1 8 . 1 1 65 65 TYR C C 65 173.944 173.944 177.204 -3.260 18478 3439 1 8 . 1 1 65 65 TYR CA C 65 61.205 61.205 61.104 0.101 18478 3440 1 8 . 1 1 65 65 TYR CB C 65 38.844 38.844 38.099 0.745 18478 3441 1 8 . 1 1 65 65 TYR H H 65 8.359 8.359 8.051 0.308 18478 3442 1 8 . 1 1 66 66 SER N N 66 114.836 114.836 112.171 2.665 18478 3443 1 8 . 1 1 66 66 SER HA H 66 3.505 3.505 4.368 -0.863 18478 3444 1 8 . 1 1 66 66 SER C C 66 173.697 173.697 175.428 -1.731 18478 3445 1 8 . 1 1 66 66 SER CA C 66 63.078 63.078 59.713 3.365 18478 3446 1 8 . 1 1 66 66 SER CB C 66 62.223 62.223 63.046 -0.823 18478 3447 1 8 . 1 1 66 66 SER H H 66 8.974 8.974 7.716 1.258 18478 3448 1 8 . 1 1 67 67 GLU N N 67 118.013 118.013 118.669 -0.656 18478 3449 1 8 . 1 1 67 67 GLU HA H 67 4.210 4.210 4.168 0.042 18478 3450 1 8 . 1 1 67 67 GLU C C 67 174.961 174.961 177.556 -2.595 18478 3451 1 8 . 1 1 67 67 GLU CA C 67 58.330 58.330 57.972 0.358 18478 3452 1 8 . 1 1 67 67 GLU CB C 67 30.205 30.205 30.995 -0.790 18478 3453 1 8 . 1 1 67 67 GLU H H 67 8.817 8.817 7.883 0.934 18478 3454 1 8 . 1 1 68 68 ASN N N 68 113.942 113.942 110.773 3.169 18478 3455 1 8 . 1 1 68 68 ASN HA H 68 5.015 5.015 5.091 -0.076 18478 3456 1 8 . 1 1 68 68 ASN C C 68 176.626 176.626 176.277 0.349 18478 3457 1 8 . 1 1 68 68 ASN CA C 68 53.768 53.768 52.024 1.744 18478 3458 1 8 . 1 1 68 68 ASN CB C 68 41.948 41.948 39.218 2.730 18478 3459 1 8 . 1 1 68 68 ASN H H 68 7.448 7.448 7.875 -0.427 18478 3460 1 8 . 1 1 69 69 LYS N N 69 124.584 124.584 121.152 3.432 18478 3461 1 8 . 1 1 69 69 LYS HA H 69 3.794 3.794 3.926 -0.132 18478 3462 1 8 . 1 1 69 69 LYS C C 69 173.330 173.330 174.873 -1.543 18478 3463 1 8 . 1 1 69 69 LYS CA C 69 61.225 61.225 57.504 3.721 18478 3464 1 8 . 1 1 69 69 LYS H H 69 7.592 7.592 8.715 -1.123 18478 3465 1 8 . 1 1 70 70 GLU N N 70 118.408 118.408 117.419 0.989 18478 3466 1 8 . 1 1 70 70 GLU HA H 70 4.005 4.005 4.910 -0.905 18478 3467 1 8 . 1 1 70 70 GLU C C 70 174.588 174.588 173.797 0.791 18478 3468 1 8 . 1 1 70 70 GLU CA C 70 58.695 58.695 52.956 5.739 18478 3469 1 8 . 1 1 70 70 GLU CB C 70 28.928 28.928 30.578 -1.650 18478 3470 1 8 . 1 1 70 70 GLU H H 70 8.478 8.478 7.898 0.580 18478 3471 1 8 . 1 1 71 71 LYS HA H 71 3.847 3.847 4.329 -0.482 18478 3472 1 8 . 1 1 71 71 LYS C C 71 173.420 173.420 175.413 -1.993 18478 3473 1 8 . 1 1 71 71 LYS CA C 71 58.718 58.718 55.559 3.159 18478 3474 1 8 . 1 1 71 71 LYS CB C 71 32.964 32.964 33.796 -0.832 18478 3475 1 8 . 1 1 72 72 TYR N N 72 112.358 112.358 122.770 -10.412 18478 3476 1 8 . 1 1 72 72 TYR HA H 72 4.790 4.790 4.230 0.560 18478 3477 1 8 . 1 1 72 72 TYR C C 72 174.442 174.442 176.003 -1.561 18478 3478 1 8 . 1 1 72 72 TYR CA C 72 55.287 55.287 59.058 -3.771 18478 3479 1 8 . 1 1 72 72 TYR CB C 72 37.244 37.244 38.979 -1.735 18478 3480 1 8 . 1 1 72 72 TYR H H 72 7.341 7.341 8.426 -1.085 18478 3481 1 8 . 1 1 73 73 GLY N N 73 110.612 110.612 108.543 2.069 18478 3482 1 8 . 1 1 73 73 GLY C C 73 177.982 177.982 173.557 4.425 18478 3483 1 8 . 1 1 73 73 GLY CA C 73 46.623 46.623 44.255 2.369 18478 3484 1 8 . 1 1 73 73 GLY H H 73 8.076 8.076 8.135 -0.059 18478 3485 1 8 . 1 1 74 74 LYS N N 74 121.009 121.009 120.037 0.972 18478 3486 1 8 . 1 1 74 74 LYS CA C 74 53.465 53.465 53.856 -0.391 18478 3487 1 8 . 1 1 74 74 LYS CB C 74 32.440 32.440 32.824 -0.384 18478 3488 1 8 . 1 1 74 74 LYS H H 74 7.411 7.411 7.858 -0.447 18478 3489 1 8 . 1 1 75 75 PRO HA H 75 4.452 4.452 4.275 0.177 18478 3490 1 8 . 1 1 75 75 PRO C C 75 174.959 174.959 178.177 -3.218 18478 3491 1 8 . 1 1 75 75 PRO CA C 75 62.861 62.861 64.874 -2.014 18478 3492 1 8 . 1 1 75 75 PRO CB C 75 32.407 32.407 31.988 0.419 18478 3493 1 8 . 1 1 76 76 ASN N N 76 121.045 121.045 119.645 1.400 18478 3494 1 8 . 1 1 76 76 ASN HA H 76 4.445 4.445 4.412 0.033 18478 3495 1 8 . 1 1 76 76 ASN C C 76 174.145 174.145 174.603 -0.458 18478 3496 1 8 . 1 1 76 76 ASN CA C 76 55.701 55.701 52.599 3.102 18478 3497 1 8 . 1 1 76 76 ASN H H 76 8.474 8.474 8.752 -0.278 18478 3498 1 8 . 1 1 77 77 LYS N N 77 111.466 111.466 120.445 -8.979 18478 3499 1 8 . 1 1 77 77 LYS HA H 77 4.369 4.369 4.196 0.173 18478 3500 1 8 . 1 1 77 77 LYS C C 77 173.881 173.881 176.497 -2.616 18478 3501 1 8 . 1 1 77 77 LYS CA C 77 55.995 55.995 56.186 -0.191 18478 3502 1 8 . 1 1 77 77 LYS CB C 77 32.538 32.538 32.350 0.188 18478 3503 1 8 . 1 1 77 77 LYS H H 77 8.543 8.543 7.948 0.595 18478 3504 1 8 . 1 1 78 78 ARG N N 78 122.233 122.233 119.486 2.747 18478 3505 1 8 . 1 1 78 78 ARG HA H 78 4.286 4.286 3.959 0.327 18478 3506 1 8 . 1 1 78 78 ARG C C 78 173.652 173.652 174.459 -0.807 18478 3507 1 8 . 1 1 78 78 ARG CA C 78 55.780 55.780 57.237 -1.458 18478 3508 1 8 . 1 1 78 78 ARG CB C 78 29.554 29.554 29.352 0.202 18478 3509 1 8 . 1 1 78 78 ARG H H 78 8.864 8.864 8.831 0.033 18478 3510 1 8 . 1 1 79 79 LYS N N 79 128.197 128.197 118.609 9.588 18478 3511 1 8 . 1 1 79 79 LYS HA H 79 4.221 4.221 4.577 -0.356 18478 3512 1 8 . 1 1 79 79 LYS C C 79 174.336 174.336 175.628 -1.292 18478 3513 1 8 . 1 1 79 79 LYS CA C 79 58.986 58.986 55.936 3.050 18478 3514 1 8 . 1 1 79 79 LYS CB C 79 32.072 32.072 33.170 -1.098 18478 3515 1 8 . 1 1 79 79 LYS H H 79 8.927 8.927 8.237 0.690 18478 3516 1 8 . 1 1 80 80 GLY N N 80 114.730 114.730 108.626 6.104 18478 3517 1 8 . 1 1 80 80 GLY C C 80 176.536 176.536 175.450 1.086 18478 3518 1 8 . 1 1 80 80 GLY CA C 80 45.992 45.992 45.708 0.284 18478 3519 1 8 . 1 1 80 80 GLY H H 80 8.943 8.943 8.683 0.260 18478 3520 1 8 . 1 1 81 81 PHE N N 81 123.770 123.770 120.161 3.609 18478 3521 1 8 . 1 1 81 81 PHE HA H 81 3.336 3.336 4.170 -0.834 18478 3522 1 8 . 1 1 81 81 PHE C C 81 174.037 174.037 176.328 -2.291 18478 3523 1 8 . 1 1 81 81 PHE CA C 81 63.094 63.094 60.487 2.607 18478 3524 1 8 . 1 1 81 81 PHE CB C 81 39.823 39.823 38.591 1.232 18478 3525 1 8 . 1 1 81 81 PHE H H 81 8.281 8.281 8.309 -0.028 18478 3526 1 8 . 1 1 82 82 ASN N N 82 119.812 119.812 116.426 3.386 18478 3527 1 8 . 1 1 82 82 ASN HA H 82 4.458 4.458 4.298 0.160 18478 3528 1 8 . 1 1 82 82 ASN C C 82 171.290 171.290 176.798 -5.508 18478 3529 1 8 . 1 1 82 82 ASN CA C 82 56.060 56.060 55.969 0.091 18478 3530 1 8 . 1 1 82 82 ASN CB C 82 36.390 36.390 38.396 -2.006 18478 3531 1 8 . 1 1 82 82 ASN H H 82 9.145 9.145 8.477 0.668 18478 3532 1 8 . 1 1 83 83 GLU N N 83 124.411 124.411 118.858 5.553 18478 3533 1 8 . 1 1 83 83 GLU HA H 83 4.186 4.186 3.998 0.188 18478 3534 1 8 . 1 1 83 83 GLU C C 83 172.222 172.222 178.698 -6.476 18478 3535 1 8 . 1 1 83 83 GLU CA C 83 60.922 60.922 59.145 1.776 18478 3536 1 8 . 1 1 83 83 GLU CB C 83 28.132 28.132 29.972 -1.840 18478 3537 1 8 . 1 1 83 83 GLU H H 83 9.560 9.560 7.774 1.786 18478 3538 1 8 . 1 1 84 84 GLY N N 84 111.388 111.388 106.546 4.842 18478 3539 1 8 . 1 1 84 84 GLY C C 84 176.445 176.445 174.868 1.577 18478 3540 1 8 . 1 1 84 84 GLY CA C 84 46.727 46.727 46.590 0.137 18478 3541 1 8 . 1 1 84 84 GLY H H 84 8.364 8.364 7.285 1.079 18478 3542 1 8 . 1 1 85 85 LEU N N 85 121.153 121.153 120.495 0.658 18478 3543 1 8 . 1 1 85 85 LEU HA H 85 4.236 4.236 4.278 -0.042 18478 3544 1 8 . 1 1 85 85 LEU C C 85 172.285 172.285 177.633 -5.348 18478 3545 1 8 . 1 1 85 85 LEU CA C 85 56.795 56.795 56.811 -0.016 18478 3546 1 8 . 1 1 85 85 LEU CB C 85 41.113 41.113 43.052 -1.939 18478 3547 1 8 . 1 1 85 85 LEU H H 85 8.294 8.294 7.704 0.590 18478 3548 1 8 . 1 1 86 86 TRP N N 86 118.898 118.898 118.511 0.387 18478 3549 1 8 . 1 1 86 86 TRP HA H 86 4.161 4.161 4.341 -0.180 18478 3550 1 8 . 1 1 86 86 TRP C C 86 171.741 171.741 176.166 -4.425 18478 3551 1 8 . 1 1 86 86 TRP CA C 86 62.153 62.153 58.456 3.697 18478 3552 1 8 . 1 1 86 86 TRP CB C 86 28.424 28.424 29.627 -1.203 18478 3553 1 8 . 1 1 86 86 TRP H H 86 7.783 7.783 7.345 0.438 18478 3554 1 8 . 1 1 87 87 GLU N N 87 120.718 120.718 119.258 1.460 18478 3555 1 8 . 1 1 87 87 GLU HA H 87 3.416 3.416 4.688 -1.272 18478 3556 1 8 . 1 1 87 87 GLU C C 87 172.957 172.957 174.959 -2.002 18478 3557 1 8 . 1 1 87 87 GLU CA C 87 60.122 60.122 53.163 6.959 18478 3558 1 8 . 1 1 87 87 GLU CB C 87 31.021 31.021 30.319 0.702 18478 3559 1 8 . 1 1 87 87 GLU H H 87 8.779 8.779 7.502 1.277 18478 3560 1 8 . 1 1 88 88 ILE HA H 88 2.478 2.478 4.213 -1.735 18478 3561 1 8 . 1 1 88 88 ILE C C 88 177.873 177.873 177.272 0.601 18478 3562 1 8 . 1 1 88 88 ILE CA C 88 65.248 65.248 62.265 2.983 18478 3563 1 8 . 1 1 88 88 ILE CB C 88 37.327 37.327 38.416 -1.089 18478 3564 1 8 . 1 1 89 89 ASP N N 89 114.411 114.411 119.312 -4.901 18478 3565 1 8 . 1 1 89 89 ASP HA H 89 4.589 4.589 4.482 0.107 18478 3566 1 8 . 1 1 89 89 ASP C C 89 174.207 174.207 177.588 -3.381 18478 3567 1 8 . 1 1 89 89 ASP CA C 89 54.740 54.740 56.546 -1.806 18478 3568 1 8 . 1 1 89 89 ASP CB C 89 42.473 42.473 40.378 2.095 18478 3569 1 8 . 1 1 89 89 ASP H H 89 5.911 5.911 7.800 -1.889 18478 3570 1 8 . 1 1 90 90 ASN N N 90 114.358 114.358 114.040 0.318 18478 3571 1 8 . 1 1 90 90 ASN HA H 90 4.420 4.420 4.398 0.022 18478 3572 1 8 . 1 1 90 90 ASN C C 90 176.991 176.991 177.123 -0.132 18478 3573 1 8 . 1 1 90 90 ASN CA C 90 54.855 54.855 56.591 -1.736 18478 3574 1 8 . 1 1 90 90 ASN CB C 90 40.582 40.582 38.043 2.539 18478 3575 1 8 . 1 1 90 90 ASN H H 90 7.480 7.480 7.789 -0.309 18478 3576 1 8 . 1 1 91 91 ASN N N 91 119.185 119.185 114.893 4.292 18478 3577 1 8 . 1 1 91 91 ASN HA H 91 5.006 5.006 4.821 0.185 18478 3578 1 8 . 1 1 91 91 ASN CA C 91 51.624 51.624 53.907 -2.283 18478 3579 1 8 . 1 1 91 91 ASN CB C 91 38.752 38.752 38.721 0.031 18478 3580 1 8 . 1 1 91 91 ASN H H 91 9.238 9.238 7.769 1.469 18478 3581 1 8 . 1 1 92 92 PRO HA H 92 4.296 4.296 4.193 0.103 18478 3582 1 8 . 1 1 92 92 PRO C C 92 173.690 173.690 176.287 -2.597 18478 3583 1 8 . 1 1 92 92 PRO CA C 92 64.714 64.714 64.627 0.087 18478 3584 1 8 . 1 1 92 92 PRO CB C 92 31.781 31.781 32.382 -0.601 18478 3585 1 9 . 1 1 3 3 GLY C C 3 177.088 177.088 172.897 4.191 18478 3586 1 9 . 1 1 3 3 GLY CA C 3 45.330 45.330 44.937 0.393 18478 3587 1 9 . 1 1 4 4 SER N N 4 115.847 115.847 113.333 2.514 18478 3588 1 9 . 1 1 4 4 SER HA H 4 4.480 4.480 4.695 -0.215 18478 3589 1 9 . 1 1 4 4 SER C C 4 177.991 177.991 172.438 5.553 18478 3590 1 9 . 1 1 4 4 SER CA C 4 58.742 58.742 58.300 0.442 18478 3591 1 9 . 1 1 4 4 SER CB C 4 63.820 63.820 64.987 -1.167 18478 3592 1 9 . 1 1 4 4 SER H H 4 8.207 8.207 7.573 0.634 18478 3593 1 9 . 1 1 5 5 MET N N 5 125.867 125.867 123.166 2.701 18478 3594 1 9 . 1 1 5 5 MET HA H 5 4.580 4.580 4.661 -0.081 18478 3595 1 9 . 1 1 5 5 MET C C 5 174.825 174.825 176.088 -1.263 18478 3596 1 9 . 1 1 5 5 MET CA C 5 54.733 54.733 54.855 -0.122 18478 3597 1 9 . 1 1 5 5 MET CB C 5 33.527 33.527 35.556 -2.029 18478 3598 1 9 . 1 1 5 5 MET H H 5 8.148 8.148 8.756 -0.608 18478 3599 1 9 . 1 1 6 6 THR N N 6 115.828 115.828 115.512 0.316 18478 3600 1 9 . 1 1 6 6 THR HA H 6 3.903 3.903 4.466 -0.563 18478 3601 1 9 . 1 1 6 6 THR C C 6 176.930 176.930 173.089 3.841 18478 3602 1 9 . 1 1 6 6 THR CA C 6 63.034 63.034 61.180 1.854 18478 3603 1 9 . 1 1 6 6 THR CB C 6 69.308 69.308 68.482 0.826 18478 3604 1 9 . 1 1 6 6 THR H H 6 8.408 8.408 8.489 -0.081 18478 3605 1 9 . 1 1 7 7 ARG HA H 7 4.276 4.276 4.253 0.023 18478 3606 1 9 . 1 1 7 7 ARG C C 7 176.546 176.546 176.209 0.337 18478 3607 1 9 . 1 1 7 7 ARG CA C 7 55.813 55.813 56.498 -0.685 18478 3608 1 9 . 1 1 7 7 ARG CB C 7 30.556 30.556 30.564 -0.008 18478 3609 1 9 . 1 1 8 8 ASP N N 8 121.762 121.762 124.539 -2.777 18478 3610 1 9 . 1 1 8 8 ASP HA H 8 4.537 4.537 4.142 0.395 18478 3611 1 9 . 1 1 8 8 ASP C C 8 177.750 177.750 175.651 2.099 18478 3612 1 9 . 1 1 8 8 ASP CA C 8 54.117 54.117 54.639 -0.522 18478 3613 1 9 . 1 1 8 8 ASP H H 8 8.066 8.066 8.426 -0.360 18478 3614 1 9 . 1 1 9 9 PHE N N 9 119.991 119.991 120.107 -0.116 18478 3615 1 9 . 1 1 9 9 PHE HA H 9 4.734 4.734 4.662 0.072 18478 3616 1 9 . 1 1 9 9 PHE C C 9 176.838 176.838 175.186 1.652 18478 3617 1 9 . 1 1 9 9 PHE CA C 9 58.303 58.303 58.084 0.219 18478 3618 1 9 . 1 1 9 9 PHE CB C 9 41.594 41.594 40.348 1.246 18478 3619 1 9 . 1 1 9 9 PHE H H 9 8.103 8.103 7.582 0.521 18478 3620 1 9 . 1 1 10 10 LYS N N 10 122.957 122.957 124.006 -1.049 18478 3621 1 9 . 1 1 10 10 LYS CA C 10 53.167 53.167 55.570 -2.403 18478 3622 1 9 . 1 1 10 10 LYS CB C 10 33.495 33.495 32.121 1.374 18478 3623 1 9 . 1 1 10 10 LYS H H 10 9.087 9.087 8.548 0.539 18478 3624 1 9 . 1 1 11 11 PRO HA H 11 3.903 3.903 4.940 -1.037 18478 3625 1 9 . 1 1 11 11 PRO C C 11 173.988 173.988 174.639 -0.651 18478 3626 1 9 . 1 1 11 11 PRO CA C 11 63.874 63.874 61.142 2.732 18478 3627 1 9 . 1 1 11 11 PRO CB C 11 31.623 31.623 34.858 -3.235 18478 3628 1 9 . 1 1 12 12 GLY N N 12 115.413 115.413 111.127 4.286 18478 3629 1 9 . 1 1 12 12 GLY C C 12 176.966 176.966 172.501 4.465 18478 3630 1 9 . 1 1 12 12 GLY CA C 12 44.651 44.651 42.224 2.427 18478 3631 1 9 . 1 1 12 12 GLY H H 12 9.667 9.667 8.884 0.783 18478 3632 1 9 . 1 1 13 13 ASP N N 13 122.208 122.208 128.668 -6.460 18478 3633 1 9 . 1 1 13 13 ASP HA H 13 4.601 4.601 5.017 -0.416 18478 3634 1 9 . 1 1 13 13 ASP C C 13 176.244 176.244 174.405 1.839 18478 3635 1 9 . 1 1 13 13 ASP CA C 13 55.870 55.870 51.919 3.950 18478 3636 1 9 . 1 1 13 13 ASP CB C 13 40.794 40.794 42.769 -1.975 18478 3637 1 9 . 1 1 13 13 ASP H H 13 8.303 8.303 8.449 -0.146 18478 3638 1 9 . 1 1 14 14 LEU N N 14 121.306 121.306 126.570 -5.264 18478 3639 1 9 . 1 1 14 14 LEU HA H 14 4.982 4.982 4.532 0.450 18478 3640 1 9 . 1 1 14 14 LEU C C 14 173.461 173.461 176.296 -2.835 18478 3641 1 9 . 1 1 14 14 LEU CA C 14 54.516 54.516 53.822 0.695 18478 3642 1 9 . 1 1 14 14 LEU CB C 14 40.999 40.999 41.490 -0.491 18478 3643 1 9 . 1 1 14 14 LEU H H 14 8.618 8.618 7.710 0.908 18478 3644 1 9 . 1 1 15 15 ILE N N 15 118.806 118.806 126.538 -7.732 18478 3645 1 9 . 1 1 15 15 ILE HA H 15 5.356 5.356 4.275 1.081 18478 3646 1 9 . 1 1 15 15 ILE C C 15 175.982 175.982 175.910 0.072 18478 3647 1 9 . 1 1 15 15 ILE CA C 15 60.481 60.481 61.470 -0.989 18478 3648 1 9 . 1 1 15 15 ILE CB C 15 44.142 44.142 39.738 4.404 18478 3649 1 9 . 1 1 15 15 ILE H H 15 8.864 8.864 8.489 0.375 18478 3650 1 9 . 1 1 16 16 PHE N N 16 112.472 112.472 123.614 -11.142 18478 3651 1 9 . 1 1 16 16 PHE HA H 16 5.306 5.306 4.274 1.032 18478 3652 1 9 . 1 1 16 16 PHE C C 16 176.239 176.239 176.246 -0.007 18478 3653 1 9 . 1 1 16 16 PHE CA C 16 58.603 58.603 59.146 -0.543 18478 3654 1 9 . 1 1 16 16 PHE CB C 16 43.305 43.305 38.267 5.038 18478 3655 1 9 . 1 1 16 16 PHE H H 16 9.411 9.411 8.571 0.840 18478 3656 1 9 . 1 1 17 17 ALA N N 17 123.889 123.889 127.117 -3.228 18478 3657 1 9 . 1 1 17 17 ALA HA H 17 5.348 5.348 3.611 1.737 18478 3658 1 9 . 1 1 17 17 ALA C C 17 174.426 174.426 176.424 -1.998 18478 3659 1 9 . 1 1 17 17 ALA CA C 17 50.062 50.062 51.629 -1.567 18478 3660 1 9 . 1 1 17 17 ALA H H 17 9.658 9.658 8.469 1.189 18478 3661 1 9 . 1 1 18 18 LYS N N 18 127.760 127.760 121.122 6.638 18478 3662 1 9 . 1 1 18 18 LYS HA H 18 4.697 4.697 4.718 -0.021 18478 3663 1 9 . 1 1 18 18 LYS C C 18 178.554 178.554 174.567 3.987 18478 3664 1 9 . 1 1 18 18 LYS CA C 18 53.893 53.893 52.154 1.739 18478 3665 1 9 . 1 1 18 18 LYS CB C 18 35.291 35.291 32.581 2.709 18478 3666 1 9 . 1 1 18 18 LYS H H 18 9.421 9.421 7.430 1.991 18478 3667 1 9 . 1 1 19 19 MET HA H 19 4.656 4.656 4.355 0.301 18478 3668 1 9 . 1 1 19 19 MET C C 19 175.741 175.741 174.847 0.894 18478 3669 1 9 . 1 1 19 19 MET CA C 19 53.916 53.916 54.744 -0.828 18478 3670 1 9 . 1 1 19 19 MET CB C 19 35.799 35.799 33.577 2.222 18478 3671 1 9 . 1 1 20 20 LYS N N 20 124.062 124.062 118.513 5.549 18478 3672 1 9 . 1 1 20 20 LYS CA C 20 58.585 58.585 57.362 1.223 18478 3673 1 9 . 1 1 20 20 LYS CB C 20 31.978 31.978 32.243 -0.265 18478 3674 1 9 . 1 1 20 20 LYS H H 20 8.645 8.645 8.134 0.511 18478 3675 1 9 . 1 1 21 21 GLY C C 21 176.205 176.205 172.146 4.059 18478 3676 1 9 . 1 1 21 21 GLY CA C 21 45.142 45.142 41.903 3.239 18478 3677 1 9 . 1 1 22 22 TYR HA H 22 4.573 4.573 4.619 -0.046 18478 3678 1 9 . 1 1 22 22 TYR CA C 22 55.748 55.748 57.769 -2.021 18478 3679 1 9 . 1 1 22 22 TYR CB C 22 41.331 41.331 38.404 2.928 18478 3680 1 9 . 1 1 23 23 PRO HA H 23 4.759 4.759 5.065 -0.306 18478 3681 1 9 . 1 1 23 23 PRO C C 23 174.587 174.587 175.090 -0.503 18478 3682 1 9 . 1 1 23 23 PRO CA C 23 62.072 62.072 61.727 0.345 18478 3683 1 9 . 1 1 23 23 PRO CB C 23 31.077 31.077 34.717 -3.640 18478 3684 1 9 . 1 1 24 24 HIS N N 24 119.190 119.190 115.361 3.829 18478 3685 1 9 . 1 1 24 24 HIS HA H 24 3.983 3.983 5.482 -1.499 18478 3686 1 9 . 1 1 24 24 HIS C C 24 175.555 175.555 173.924 1.631 18478 3687 1 9 . 1 1 24 24 HIS CA C 24 60.973 60.973 54.306 6.667 18478 3688 1 9 . 1 1 24 24 HIS CB C 24 30.689 30.689 33.143 -2.454 18478 3689 1 9 . 1 1 24 24 HIS H H 24 8.158 8.158 8.726 -0.569 18478 3690 1 9 . 1 1 25 25 TRP N N 25 127.435 127.435 121.915 5.520 18478 3691 1 9 . 1 1 25 25 TRP HA H 25 3.760 3.760 5.319 -1.559 18478 3692 1 9 . 1 1 25 25 TRP CA C 25 55.890 55.890 57.649 -1.759 18478 3693 1 9 . 1 1 25 25 TRP CB C 25 32.879 32.879 30.366 2.513 18478 3694 1 9 . 1 1 25 25 TRP H H 25 9.211 9.211 8.708 0.503 18478 3695 1 9 . 1 1 26 26 PRO HA H 26 4.217 4.217 4.595 -0.378 18478 3696 1 9 . 1 1 26 26 PRO C C 26 176.279 176.279 175.961 0.318 18478 3697 1 9 . 1 1 26 26 PRO CA C 26 63.140 63.140 61.539 1.601 18478 3698 1 9 . 1 1 26 26 PRO CB C 26 32.171 32.171 34.217 -2.046 18478 3699 1 9 . 1 1 27 27 ALA N N 27 130.162 130.162 123.457 6.705 18478 3700 1 9 . 1 1 27 27 ALA HA H 27 4.981 4.981 4.474 0.507 18478 3701 1 9 . 1 1 27 27 ALA C C 27 177.227 177.227 177.323 -0.096 18478 3702 1 9 . 1 1 27 27 ALA CA C 27 52.574 52.574 51.329 1.245 18478 3703 1 9 . 1 1 27 27 ALA CB C 27 23.239 23.239 20.133 3.106 18478 3704 1 9 . 1 1 27 27 ALA H H 27 9.394 9.394 8.216 1.178 18478 3705 1 9 . 1 1 28 28 ARG N N 28 117.381 117.381 122.483 -5.102 18478 3706 1 9 . 1 1 28 28 ARG HA H 28 5.421 5.421 4.342 1.079 18478 3707 1 9 . 1 1 28 28 ARG C C 28 176.465 176.465 175.387 1.078 18478 3708 1 9 . 1 1 28 28 ARG CA C 28 53.662 53.662 54.972 -1.310 18478 3709 1 9 . 1 1 28 28 ARG CB C 28 35.058 35.058 30.770 4.288 18478 3710 1 9 . 1 1 28 28 ARG H H 28 8.806 8.806 8.433 0.373 18478 3711 1 9 . 1 1 29 29 VAL HA H 29 4.109 4.109 4.347 -0.238 18478 3712 1 9 . 1 1 29 29 VAL C C 29 175.996 175.996 174.783 1.213 18478 3713 1 9 . 1 1 29 29 VAL CA C 29 62.810 62.810 61.565 1.245 18478 3714 1 9 . 1 1 29 29 VAL CB C 29 31.108 31.108 32.427 -1.319 18478 3715 1 9 . 1 1 30 30 ASP N N 30 133.830 133.830 118.561 15.269 18478 3716 1 9 . 1 1 30 30 ASP HA H 30 5.198 5.198 4.558 0.640 18478 3717 1 9 . 1 1 30 30 ASP C C 30 176.207 176.207 177.485 -1.278 18478 3718 1 9 . 1 1 30 30 ASP CA C 30 53.007 53.007 54.216 -1.209 18478 3719 1 9 . 1 1 30 30 ASP CB C 30 44.130 44.130 41.204 2.926 18478 3720 1 9 . 1 1 30 30 ASP H H 30 8.892 8.892 8.421 0.471 18478 3721 1 9 . 1 1 31 31 GLU N N 31 115.905 115.905 120.496 -4.591 18478 3722 1 9 . 1 1 31 31 GLU HA H 31 4.409 4.409 3.955 0.454 18478 3723 1 9 . 1 1 31 31 GLU C C 31 175.192 175.192 176.239 -1.047 18478 3724 1 9 . 1 1 31 31 GLU CA C 31 55.389 55.389 56.716 -1.327 18478 3725 1 9 . 1 1 31 31 GLU H H 31 7.966 7.966 8.894 -0.928 18478 3726 1 9 . 1 1 32 32 VAL N N 32 122.794 122.794 116.684 6.110 18478 3727 1 9 . 1 1 32 32 VAL HA H 32 4.303 4.303 3.685 0.618 18478 3728 1 9 . 1 1 32 32 VAL CA C 32 60.408 60.408 62.799 -2.391 18478 3729 1 9 . 1 1 32 32 VAL CB C 32 32.333 32.333 30.513 1.820 18478 3730 1 9 . 1 1 32 32 VAL H H 32 8.702 8.702 7.932 0.770 18478 3731 1 9 . 1 1 33 33 PRO HA H 33 4.572 4.572 4.153 0.419 18478 3732 1 9 . 1 1 33 33 PRO C C 33 175.366 175.366 177.633 -2.267 18478 3733 1 9 . 1 1 33 33 PRO CA C 33 63.702 63.702 65.536 -1.834 18478 3734 1 9 . 1 1 33 33 PRO CB C 33 32.736 32.736 32.127 0.609 18478 3735 1 9 . 1 1 34 34 ASP N N 34 119.187 119.187 117.199 1.988 18478 3736 1 9 . 1 1 34 34 ASP HA H 34 4.679 4.679 4.830 -0.151 18478 3737 1 9 . 1 1 34 34 ASP C C 34 175.713 175.713 173.812 1.901 18478 3738 1 9 . 1 1 34 34 ASP CA C 34 53.013 53.013 52.208 0.805 18478 3739 1 9 . 1 1 34 34 ASP CB C 34 40.850 40.850 40.972 -0.122 18478 3740 1 9 . 1 1 34 34 ASP H H 34 8.686 8.686 7.847 0.839 18478 3741 1 9 . 1 1 35 35 GLY C C 35 177.458 177.458 172.724 4.734 18478 3742 1 9 . 1 1 35 35 GLY CA C 35 45.507 45.507 43.998 1.509 18478 3743 1 9 . 1 1 36 36 ALA HA H 36 4.404 4.404 4.255 0.149 18478 3744 1 9 . 1 1 36 36 ALA CA C 36 52.010 52.010 51.903 0.107 18478 3745 1 9 . 1 1 36 36 ALA CB C 36 19.909 19.909 19.808 0.101 18478 3746 1 9 . 1 1 37 37 VAL N N 37 119.594 119.594 122.620 -3.026 18478 3747 1 9 . 1 1 37 37 VAL HA H 37 3.932 3.932 4.067 -0.135 18478 3748 1 9 . 1 1 37 37 VAL C C 37 175.966 175.966 176.096 -0.130 18478 3749 1 9 . 1 1 37 37 VAL CA C 37 62.810 62.810 63.164 -0.354 18478 3750 1 9 . 1 1 37 37 VAL CB C 37 32.267 32.267 32.425 -0.158 18478 3751 1 9 . 1 1 37 37 VAL H H 37 8.037 8.037 8.624 -0.587 18478 3752 1 9 . 1 1 38 38 LYS N N 38 125.676 125.676 121.170 4.506 18478 3753 1 9 . 1 1 38 38 LYS C C 38 173.865 173.865 175.218 -1.353 18478 3754 1 9 . 1 1 38 38 LYS CA C 38 54.278 54.278 56.922 -2.644 18478 3755 1 9 . 1 1 38 38 LYS CB C 38 31.740 31.740 33.579 -1.839 18478 3756 1 9 . 1 1 38 38 LYS H H 38 8.292 8.292 8.410 -0.118 18478 3757 1 9 . 1 1 40 40 PRO HA H 40 4.387 4.387 5.289 -0.902 18478 3758 1 9 . 1 1 40 40 PRO C C 40 175.535 175.535 175.245 0.290 18478 3759 1 9 . 1 1 40 40 PRO CA C 40 62.330 62.330 59.507 2.823 18478 3760 1 9 . 1 1 40 40 PRO CB C 40 32.086 32.086 31.994 0.091 18478 3761 1 9 . 1 1 41 41 THR HA H 41 4.027 4.027 4.639 -0.612 18478 3762 1 9 . 1 1 41 41 THR C C 41 176.795 176.795 173.206 3.589 18478 3763 1 9 . 1 1 41 41 THR CA C 41 63.693 63.693 62.438 1.256 18478 3764 1 9 . 1 1 41 41 THR CB C 41 69.370 69.370 68.855 0.515 18478 3765 1 9 . 1 1 42 42 ASN N N 42 118.513 118.513 122.208 -3.695 18478 3766 1 9 . 1 1 42 42 ASN HA H 42 4.530 4.530 5.183 -0.653 18478 3767 1 9 . 1 1 42 42 ASN C C 42 177.230 177.230 174.862 2.368 18478 3768 1 9 . 1 1 42 42 ASN CA C 42 56.373 56.373 50.426 5.947 18478 3769 1 9 . 1 1 42 42 ASN CB C 42 37.618 37.618 37.788 -0.170 18478 3770 1 9 . 1 1 42 42 ASN H H 42 8.752 8.752 8.520 0.232 18478 3771 1 9 . 1 1 43 43 LYS N N 43 115.898 115.898 128.787 -12.889 18478 3772 1 9 . 1 1 43 43 LYS HA H 43 4.710 4.710 4.689 0.021 18478 3773 1 9 . 1 1 43 43 LYS C C 43 177.032 177.032 175.816 1.216 18478 3774 1 9 . 1 1 43 43 LYS CA C 43 54.957 54.957 55.212 -0.254 18478 3775 1 9 . 1 1 43 43 LYS CB C 43 36.600 36.600 33.352 3.248 18478 3776 1 9 . 1 1 43 43 LYS H H 43 7.723 7.723 8.852 -1.129 18478 3777 1 9 . 1 1 44 44 LEU N N 44 121.006 121.006 129.602 -8.596 18478 3778 1 9 . 1 1 44 44 LEU HA H 44 5.000 5.000 4.404 0.596 18478 3779 1 9 . 1 1 44 44 LEU CA C 44 51.842 51.842 54.389 -2.547 18478 3780 1 9 . 1 1 44 44 LEU CB C 44 44.418 44.418 40.680 3.738 18478 3781 1 9 . 1 1 44 44 LEU H H 44 9.063 9.063 8.551 0.512 18478 3782 1 9 . 1 1 45 45 PRO HA H 45 4.392 4.392 4.353 0.039 18478 3783 1 9 . 1 1 45 45 PRO C C 45 177.051 177.051 177.819 -0.768 18478 3784 1 9 . 1 1 45 45 PRO CA C 45 62.000 62.000 63.821 -1.821 18478 3785 1 9 . 1 1 45 45 PRO CB C 45 30.737 30.737 32.037 -1.300 18478 3786 1 9 . 1 1 46 46 ILE N N 46 125.996 125.996 125.192 0.804 18478 3787 1 9 . 1 1 46 46 ILE HA H 46 4.564 4.564 3.726 0.838 18478 3788 1 9 . 1 1 46 46 ILE C C 46 176.985 176.985 175.834 1.151 18478 3789 1 9 . 1 1 46 46 ILE CA C 46 57.051 57.051 62.802 -5.751 18478 3790 1 9 . 1 1 46 46 ILE H H 46 8.908 8.908 8.812 0.096 18478 3791 1 9 . 1 1 47 47 PHE N N 47 128.276 128.276 117.003 11.273 18478 3792 1 9 . 1 1 47 47 PHE HA H 47 4.827 4.827 4.414 0.413 18478 3793 1 9 . 1 1 47 47 PHE C C 47 177.835 177.835 176.112 1.723 18478 3794 1 9 . 1 1 47 47 PHE CA C 47 56.099 56.099 57.196 -1.097 18478 3795 1 9 . 1 1 47 47 PHE CB C 47 41.217 41.217 40.575 0.642 18478 3796 1 9 . 1 1 47 47 PHE H H 47 8.739 8.739 7.708 1.031 18478 3797 1 9 . 1 1 48 48 PHE N N 48 125.953 125.953 118.702 7.251 18478 3798 1 9 . 1 1 48 48 PHE HA H 48 4.251 4.251 4.475 -0.224 18478 3799 1 9 . 1 1 48 48 PHE C C 48 175.869 175.869 174.602 1.267 18478 3800 1 9 . 1 1 48 48 PHE CA C 48 56.744 56.744 60.209 -3.465 18478 3801 1 9 . 1 1 48 48 PHE CB C 48 38.835 38.835 36.795 2.040 18478 3802 1 9 . 1 1 48 48 PHE H H 48 8.545 8.545 7.987 0.558 18478 3803 1 9 . 1 1 49 49 PHE N N 49 122.197 122.197 117.395 4.802 18478 3804 1 9 . 1 1 49 49 PHE HA H 49 4.400 4.400 4.501 -0.101 18478 3805 1 9 . 1 1 49 49 PHE C C 49 174.016 174.016 174.198 -0.182 18478 3806 1 9 . 1 1 49 49 PHE CA C 49 59.916 59.916 55.380 4.536 18478 3807 1 9 . 1 1 49 49 PHE CB C 49 39.799 39.799 41.866 -2.067 18478 3808 1 9 . 1 1 49 49 PHE H H 49 8.619 8.619 7.449 1.170 18478 3809 1 9 . 1 1 50 50 GLY N N 50 114.083 114.083 108.118 5.965 18478 3810 1 9 . 1 1 50 50 GLY C C 50 175.636 175.636 173.189 2.447 18478 3811 1 9 . 1 1 50 50 GLY CA C 50 46.718 46.718 43.744 2.974 18478 3812 1 9 . 1 1 50 50 GLY H H 50 10.329 10.329 8.085 2.244 18478 3813 1 9 . 1 1 51 51 THR N N 51 111.210 111.210 118.540 -7.330 18478 3814 1 9 . 1 1 51 51 THR HA H 51 3.980 3.980 4.536 -0.556 18478 3815 1 9 . 1 1 51 51 THR C C 51 175.588 175.588 172.092 3.496 18478 3816 1 9 . 1 1 51 51 THR CA C 51 62.223 62.223 61.728 0.494 18478 3817 1 9 . 1 1 51 51 THR CB C 51 68.346 68.346 72.130 -3.784 18478 3818 1 9 . 1 1 51 51 THR H H 51 7.882 7.882 8.395 -0.513 18478 3819 1 9 . 1 1 52 52 HIS N N 52 115.544 115.544 120.937 -5.393 18478 3820 1 9 . 1 1 52 52 HIS HA H 52 3.712 3.712 5.296 -1.584 18478 3821 1 9 . 1 1 52 52 HIS C C 52 177.717 177.717 174.943 2.774 18478 3822 1 9 . 1 1 52 52 HIS CA C 52 54.860 54.860 54.621 0.239 18478 3823 1 9 . 1 1 52 52 HIS CB C 52 26.388 26.388 30.172 -3.784 18478 3824 1 9 . 1 1 52 52 HIS H H 52 7.791 7.791 8.503 -0.712 18478 3825 1 9 . 1 1 53 53 GLU N N 53 117.517 117.517 122.473 -4.956 18478 3826 1 9 . 1 1 53 53 GLU HA H 53 4.298 4.298 4.834 -0.536 18478 3827 1 9 . 1 1 53 53 GLU C C 53 176.958 176.958 176.748 0.210 18478 3828 1 9 . 1 1 53 53 GLU CA C 53 55.403 55.403 55.426 -0.023 18478 3829 1 9 . 1 1 53 53 GLU CB C 53 31.588 31.588 33.130 -1.542 18478 3830 1 9 . 1 1 53 53 GLU H H 53 6.795 6.795 8.214 -1.419 18478 3831 1 9 . 1 1 54 54 THR N N 54 111.182 111.182 116.914 -5.732 18478 3832 1 9 . 1 1 54 54 THR HA H 54 5.648 5.648 4.347 1.301 18478 3833 1 9 . 1 1 54 54 THR C C 54 177.234 177.234 174.328 2.906 18478 3834 1 9 . 1 1 54 54 THR CA C 54 59.894 59.894 61.532 -1.638 18478 3835 1 9 . 1 1 54 54 THR H H 54 8.139 8.139 8.777 -0.638 18478 3836 1 9 . 1 1 55 55 ALA HA H 55 4.403 4.403 4.241 0.162 18478 3837 1 9 . 1 1 55 55 ALA C C 55 176.601 176.601 178.064 -1.463 18478 3838 1 9 . 1 1 55 55 ALA CA C 55 51.079 51.079 53.247 -2.168 18478 3839 1 9 . 1 1 55 55 ALA CB C 55 23.285 23.285 19.068 4.217 18478 3840 1 9 . 1 1 56 56 PHE N N 56 118.058 118.058 113.486 4.572 18478 3841 1 9 . 1 1 56 56 PHE HA H 56 5.678 5.678 4.575 1.103 18478 3842 1 9 . 1 1 56 56 PHE C C 56 175.962 175.962 174.946 1.016 18478 3843 1 9 . 1 1 56 56 PHE CA C 56 56.008 56.008 59.133 -3.125 18478 3844 1 9 . 1 1 56 56 PHE CB C 56 39.995 39.995 37.700 2.295 18478 3845 1 9 . 1 1 56 56 PHE H H 56 8.523 8.523 8.246 0.277 18478 3846 1 9 . 1 1 57 57 LEU N N 57 123.344 123.344 120.615 2.729 18478 3847 1 9 . 1 1 57 57 LEU HA H 57 4.929 4.929 4.699 0.230 18478 3848 1 9 . 1 1 57 57 LEU C C 57 175.584 175.584 174.752 0.832 18478 3849 1 9 . 1 1 57 57 LEU CA C 57 53.463 53.463 54.667 -1.204 18478 3850 1 9 . 1 1 57 57 LEU CB C 57 46.545 46.545 43.193 3.352 18478 3851 1 9 . 1 1 57 57 LEU H H 57 8.579 8.579 7.618 0.961 18478 3852 1 9 . 1 1 58 58 GLY N N 58 108.499 108.499 106.855 1.644 18478 3853 1 9 . 1 1 58 58 GLY CA C 58 43.755 43.755 44.051 -0.296 18478 3854 1 9 . 1 1 58 58 GLY H H 58 9.318 9.318 7.324 1.994 18478 3855 1 9 . 1 1 59 59 PRO HA H 59 4.048 4.048 4.940 -0.892 18478 3856 1 9 . 1 1 59 59 PRO C C 59 173.763 173.763 174.684 -0.921 18478 3857 1 9 . 1 1 59 59 PRO CA C 59 64.770 64.770 60.529 4.240 18478 3858 1 9 . 1 1 59 59 PRO CB C 59 31.889 31.889 35.846 -3.957 18478 3859 1 9 . 1 1 60 60 LYS HA H 60 4.191 4.191 4.540 -0.349 18478 3860 1 9 . 1 1 60 60 LYS C C 60 174.842 174.842 176.522 -1.680 18478 3861 1 9 . 1 1 60 60 LYS CA C 60 57.875 57.875 56.060 1.815 18478 3862 1 9 . 1 1 60 60 LYS CB C 60 31.576 31.576 32.676 -1.100 18478 3863 1 9 . 1 1 61 61 ASP N N 61 117.768 117.768 122.878 -5.110 18478 3864 1 9 . 1 1 61 61 ASP HA H 61 4.973 4.973 4.270 0.703 18478 3865 1 9 . 1 1 61 61 ASP C C 61 178.178 178.178 176.820 1.358 18478 3866 1 9 . 1 1 61 61 ASP CA C 61 54.687 54.687 56.401 -1.714 18478 3867 1 9 . 1 1 61 61 ASP CB C 61 43.555 43.555 39.274 4.281 18478 3868 1 9 . 1 1 61 61 ASP H H 61 7.722 7.722 8.777 -1.055 18478 3869 1 9 . 1 1 62 62 ILE N N 62 114.244 114.244 119.440 -5.196 18478 3870 1 9 . 1 1 62 62 ILE HA H 62 4.891 4.891 3.424 1.467 18478 3871 1 9 . 1 1 62 62 ILE C C 62 178.027 178.027 177.466 0.561 18478 3872 1 9 . 1 1 62 62 ILE CA C 62 59.994 59.994 63.670 -3.676 18478 3873 1 9 . 1 1 62 62 ILE CB C 62 40.652 40.652 36.847 3.805 18478 3874 1 9 . 1 1 62 62 ILE H H 62 6.784 6.784 7.667 -0.883 18478 3875 1 9 . 1 1 63 63 PHE N N 63 119.819 119.819 119.226 0.593 18478 3876 1 9 . 1 1 63 63 PHE HA H 63 5.214 5.214 4.232 0.982 18478 3877 1 9 . 1 1 63 63 PHE CA C 63 54.735 54.735 59.921 -5.186 18478 3878 1 9 . 1 1 63 63 PHE CB C 63 42.122 42.122 38.529 3.593 18478 3879 1 9 . 1 1 63 63 PHE H H 63 8.734 8.734 7.667 1.067 18478 3880 1 9 . 1 1 64 64 PRO HA H 64 4.771 4.771 4.414 0.357 18478 3881 1 9 . 1 1 64 64 PRO C C 64 174.036 174.036 178.399 -4.363 18478 3882 1 9 . 1 1 64 64 PRO CA C 64 64.474 64.474 64.032 0.442 18478 3883 1 9 . 1 1 64 64 PRO CB C 64 32.662 32.662 33.563 -0.901 18478 3884 1 9 . 1 1 65 65 TYR N N 65 124.335 124.335 121.818 2.517 18478 3885 1 9 . 1 1 65 65 TYR HA H 65 4.530 4.530 4.326 0.204 18478 3886 1 9 . 1 1 65 65 TYR C C 65 173.944 173.944 177.416 -3.472 18478 3887 1 9 . 1 1 65 65 TYR CA C 65 61.205 61.205 61.137 0.068 18478 3888 1 9 . 1 1 65 65 TYR CB C 65 38.844 38.844 38.261 0.583 18478 3889 1 9 . 1 1 65 65 TYR H H 65 8.359 8.359 7.953 0.406 18478 3890 1 9 . 1 1 66 66 SER N N 66 114.836 114.836 112.087 2.749 18478 3891 1 9 . 1 1 66 66 SER HA H 66 3.505 3.505 4.372 -0.867 18478 3892 1 9 . 1 1 66 66 SER C C 66 173.697 173.697 175.409 -1.712 18478 3893 1 9 . 1 1 66 66 SER CA C 66 63.078 63.078 59.673 3.405 18478 3894 1 9 . 1 1 66 66 SER CB C 66 62.223 62.223 63.017 -0.794 18478 3895 1 9 . 1 1 66 66 SER H H 66 8.974 8.974 7.700 1.274 18478 3896 1 9 . 1 1 67 67 GLU N N 67 118.013 118.013 118.576 -0.563 18478 3897 1 9 . 1 1 67 67 GLU HA H 67 4.210 4.210 4.115 0.095 18478 3898 1 9 . 1 1 67 67 GLU C C 67 174.961 174.961 177.629 -2.668 18478 3899 1 9 . 1 1 67 67 GLU CA C 67 58.330 58.330 57.874 0.456 18478 3900 1 9 . 1 1 67 67 GLU CB C 67 30.205 30.205 31.157 -0.952 18478 3901 1 9 . 1 1 67 67 GLU H H 67 8.817 8.817 7.996 0.821 18478 3902 1 9 . 1 1 68 68 ASN N N 68 113.942 113.942 111.080 2.862 18478 3903 1 9 . 1 1 68 68 ASN HA H 68 5.015 5.015 4.990 0.025 18478 3904 1 9 . 1 1 68 68 ASN C C 68 176.626 176.626 176.117 0.509 18478 3905 1 9 . 1 1 68 68 ASN CA C 68 53.768 53.768 51.196 2.572 18478 3906 1 9 . 1 1 68 68 ASN CB C 68 41.948 41.948 39.907 2.041 18478 3907 1 9 . 1 1 68 68 ASN H H 68 7.448 7.448 7.722 -0.274 18478 3908 1 9 . 1 1 69 69 LYS N N 69 124.584 124.584 121.777 2.807 18478 3909 1 9 . 1 1 69 69 LYS HA H 69 3.794 3.794 3.977 -0.183 18478 3910 1 9 . 1 1 69 69 LYS C C 69 173.330 173.330 175.285 -1.955 18478 3911 1 9 . 1 1 69 69 LYS CA C 69 61.225 61.225 57.703 3.522 18478 3912 1 9 . 1 1 69 69 LYS H H 69 7.592 7.592 8.595 -1.003 18478 3913 1 9 . 1 1 70 70 GLU N N 70 118.408 118.408 118.074 0.334 18478 3914 1 9 . 1 1 70 70 GLU HA H 70 4.005 4.005 4.814 -0.809 18478 3915 1 9 . 1 1 70 70 GLU C C 70 174.588 174.588 173.433 1.155 18478 3916 1 9 . 1 1 70 70 GLU CA C 70 58.695 58.695 53.197 5.498 18478 3917 1 9 . 1 1 70 70 GLU CB C 70 28.928 28.928 31.311 -2.382 18478 3918 1 9 . 1 1 70 70 GLU H H 70 8.478 8.478 8.243 0.235 18478 3919 1 9 . 1 1 71 71 LYS HA H 71 3.847 3.847 4.454 -0.607 18478 3920 1 9 . 1 1 71 71 LYS C C 71 173.420 173.420 175.401 -1.981 18478 3921 1 9 . 1 1 71 71 LYS CA C 71 58.718 58.718 55.581 3.137 18478 3922 1 9 . 1 1 71 71 LYS CB C 71 32.964 32.964 34.072 -1.109 18478 3923 1 9 . 1 1 72 72 TYR N N 72 112.358 112.358 121.936 -9.578 18478 3924 1 9 . 1 1 72 72 TYR HA H 72 4.790 4.790 4.293 0.497 18478 3925 1 9 . 1 1 72 72 TYR C C 72 174.442 174.442 175.729 -1.287 18478 3926 1 9 . 1 1 72 72 TYR CA C 72 55.287 55.287 59.222 -3.935 18478 3927 1 9 . 1 1 72 72 TYR CB C 72 37.244 37.244 38.785 -1.541 18478 3928 1 9 . 1 1 72 72 TYR H H 72 7.341 7.341 8.320 -0.979 18478 3929 1 9 . 1 1 73 73 GLY N N 73 110.612 110.612 107.795 2.817 18478 3930 1 9 . 1 1 73 73 GLY C C 73 177.982 177.982 173.404 4.578 18478 3931 1 9 . 1 1 73 73 GLY CA C 73 46.623 46.623 44.519 2.104 18478 3932 1 9 . 1 1 73 73 GLY H H 73 8.076 8.076 8.012 0.064 18478 3933 1 9 . 1 1 74 74 LYS N N 74 121.009 121.009 120.814 0.195 18478 3934 1 9 . 1 1 74 74 LYS CA C 74 53.465 53.465 53.957 -0.492 18478 3935 1 9 . 1 1 74 74 LYS CB C 74 32.440 32.440 32.448 -0.008 18478 3936 1 9 . 1 1 74 74 LYS H H 74 7.411 7.411 7.903 -0.492 18478 3937 1 9 . 1 1 75 75 PRO HA H 75 4.452 4.452 4.206 0.246 18478 3938 1 9 . 1 1 75 75 PRO C C 75 174.959 174.959 178.457 -3.498 18478 3939 1 9 . 1 1 75 75 PRO CA C 75 62.861 62.861 64.528 -1.667 18478 3940 1 9 . 1 1 75 75 PRO CB C 75 32.407 32.407 31.865 0.542 18478 3941 1 9 . 1 1 76 76 ASN N N 76 121.045 121.045 120.988 0.057 18478 3942 1 9 . 1 1 76 76 ASN HA H 76 4.445 4.445 4.424 0.021 18478 3943 1 9 . 1 1 76 76 ASN C C 76 174.145 174.145 174.590 -0.445 18478 3944 1 9 . 1 1 76 76 ASN CA C 76 55.701 55.701 52.912 2.789 18478 3945 1 9 . 1 1 76 76 ASN H H 76 8.474 8.474 8.793 -0.319 18478 3946 1 9 . 1 1 77 77 LYS N N 77 111.466 111.466 120.483 -9.017 18478 3947 1 9 . 1 1 77 77 LYS HA H 77 4.369 4.369 4.203 0.166 18478 3948 1 9 . 1 1 77 77 LYS C C 77 173.881 173.881 176.702 -2.821 18478 3949 1 9 . 1 1 77 77 LYS CA C 77 55.995 55.995 56.345 -0.350 18478 3950 1 9 . 1 1 77 77 LYS CB C 77 32.538 32.538 32.355 0.183 18478 3951 1 9 . 1 1 77 77 LYS H H 77 8.543 8.543 7.948 0.595 18478 3952 1 9 . 1 1 78 78 ARG N N 78 122.233 122.233 119.620 2.613 18478 3953 1 9 . 1 1 78 78 ARG HA H 78 4.286 4.286 4.017 0.269 18478 3954 1 9 . 1 1 78 78 ARG C C 78 173.652 173.652 174.716 -1.064 18478 3955 1 9 . 1 1 78 78 ARG CA C 78 55.780 55.780 57.188 -1.408 18478 3956 1 9 . 1 1 78 78 ARG CB C 78 29.554 29.554 29.500 0.054 18478 3957 1 9 . 1 1 78 78 ARG H H 78 8.864 8.864 8.846 0.018 18478 3958 1 9 . 1 1 79 79 LYS N N 79 128.197 128.197 118.815 9.382 18478 3959 1 9 . 1 1 79 79 LYS HA H 79 4.221 4.221 4.570 -0.349 18478 3960 1 9 . 1 1 79 79 LYS C C 79 174.336 174.336 175.844 -1.508 18478 3961 1 9 . 1 1 79 79 LYS CA C 79 58.986 58.986 55.367 3.619 18478 3962 1 9 . 1 1 79 79 LYS CB C 79 32.072 32.072 33.052 -0.980 18478 3963 1 9 . 1 1 79 79 LYS H H 79 8.927 8.927 8.166 0.761 18478 3964 1 9 . 1 1 80 80 GLY N N 80 114.730 114.730 109.668 5.062 18478 3965 1 9 . 1 1 80 80 GLY C C 80 176.536 176.536 175.023 1.513 18478 3966 1 9 . 1 1 80 80 GLY CA C 80 45.992 45.992 45.980 0.012 18478 3967 1 9 . 1 1 80 80 GLY H H 80 8.943 8.943 8.293 0.650 18478 3968 1 9 . 1 1 81 81 PHE N N 81 123.770 123.770 120.272 3.498 18478 3969 1 9 . 1 1 81 81 PHE HA H 81 3.336 3.336 4.256 -0.920 18478 3970 1 9 . 1 1 81 81 PHE C C 81 174.037 174.037 176.194 -2.157 18478 3971 1 9 . 1 1 81 81 PHE CA C 81 63.094 63.094 60.068 3.026 18478 3972 1 9 . 1 1 81 81 PHE CB C 81 39.823 39.823 38.491 1.332 18478 3973 1 9 . 1 1 81 81 PHE H H 81 8.281 8.281 8.224 0.057 18478 3974 1 9 . 1 1 82 82 ASN N N 82 119.812 119.812 116.579 3.233 18478 3975 1 9 . 1 1 82 82 ASN HA H 82 4.458 4.458 4.317 0.141 18478 3976 1 9 . 1 1 82 82 ASN C C 82 171.290 171.290 176.324 -5.034 18478 3977 1 9 . 1 1 82 82 ASN CA C 82 56.060 56.060 56.122 -0.062 18478 3978 1 9 . 1 1 82 82 ASN CB C 82 36.390 36.390 38.392 -2.002 18478 3979 1 9 . 1 1 82 82 ASN H H 82 9.145 9.145 8.518 0.627 18478 3980 1 9 . 1 1 83 83 GLU N N 83 124.411 124.411 118.978 5.433 18478 3981 1 9 . 1 1 83 83 GLU HA H 83 4.186 4.186 4.001 0.185 18478 3982 1 9 . 1 1 83 83 GLU C C 83 172.222 172.222 178.727 -6.505 18478 3983 1 9 . 1 1 83 83 GLU CA C 83 60.922 60.922 59.095 1.827 18478 3984 1 9 . 1 1 83 83 GLU CB C 83 28.132 28.132 29.995 -1.863 18478 3985 1 9 . 1 1 83 83 GLU H H 83 9.560 9.560 7.849 1.711 18478 3986 1 9 . 1 1 84 84 GLY N N 84 111.388 111.388 106.548 4.840 18478 3987 1 9 . 1 1 84 84 GLY C C 84 176.445 176.445 174.777 1.668 18478 3988 1 9 . 1 1 84 84 GLY CA C 84 46.727 46.727 46.578 0.149 18478 3989 1 9 . 1 1 84 84 GLY H H 84 8.364 8.364 7.235 1.129 18478 3990 1 9 . 1 1 85 85 LEU N N 85 121.153 121.153 120.576 0.577 18478 3991 1 9 . 1 1 85 85 LEU HA H 85 4.236 4.236 4.292 -0.056 18478 3992 1 9 . 1 1 85 85 LEU C C 85 172.285 172.285 177.781 -5.496 18478 3993 1 9 . 1 1 85 85 LEU CA C 85 56.795 56.795 56.646 0.149 18478 3994 1 9 . 1 1 85 85 LEU CB C 85 41.113 41.113 42.830 -1.717 18478 3995 1 9 . 1 1 85 85 LEU H H 85 8.294 8.294 7.657 0.637 18478 3996 1 9 . 1 1 86 86 TRP N N 86 118.898 118.898 118.845 0.053 18478 3997 1 9 . 1 1 86 86 TRP HA H 86 4.161 4.161 4.343 -0.182 18478 3998 1 9 . 1 1 86 86 TRP C C 86 171.741 171.741 176.310 -4.569 18478 3999 1 9 . 1 1 86 86 TRP CA C 86 62.153 62.153 58.402 3.751 18478 4000 1 9 . 1 1 86 86 TRP CB C 86 28.424 28.424 29.795 -1.371 18478 4001 1 9 . 1 1 86 86 TRP H H 86 7.783 7.783 7.395 0.388 18478 4002 1 9 . 1 1 87 87 GLU N N 87 120.718 120.718 119.445 1.273 18478 4003 1 9 . 1 1 87 87 GLU HA H 87 3.416 3.416 4.710 -1.294 18478 4004 1 9 . 1 1 87 87 GLU C C 87 172.957 172.957 174.959 -2.002 18478 4005 1 9 . 1 1 87 87 GLU CA C 87 60.122 60.122 53.378 6.744 18478 4006 1 9 . 1 1 87 87 GLU CB C 87 31.021 31.021 30.581 0.440 18478 4007 1 9 . 1 1 87 87 GLU H H 87 8.779 8.779 7.532 1.247 18478 4008 1 9 . 1 1 88 88 ILE HA H 88 2.478 2.478 4.221 -1.743 18478 4009 1 9 . 1 1 88 88 ILE C C 88 177.873 177.873 177.257 0.616 18478 4010 1 9 . 1 1 88 88 ILE CA C 88 65.248 65.248 62.332 2.916 18478 4011 1 9 . 1 1 88 88 ILE CB C 88 37.327 37.327 38.488 -1.161 18478 4012 1 9 . 1 1 89 89 ASP N N 89 114.411 114.411 118.803 -4.392 18478 4013 1 9 . 1 1 89 89 ASP HA H 89 4.589 4.589 4.794 -0.205 18478 4014 1 9 . 1 1 89 89 ASP C C 89 174.207 174.207 177.980 -3.773 18478 4015 1 9 . 1 1 89 89 ASP CA C 89 54.740 54.740 56.258 -1.518 18478 4016 1 9 . 1 1 89 89 ASP CB C 89 42.473 42.473 39.892 2.582 18478 4017 1 9 . 1 1 89 89 ASP H H 89 5.911 5.911 8.213 -2.302 18478 4018 1 9 . 1 1 90 90 ASN N N 90 114.358 114.358 112.888 1.470 18478 4019 1 9 . 1 1 90 90 ASN HA H 90 4.420 4.420 4.364 0.056 18478 4020 1 9 . 1 1 90 90 ASN C C 90 176.991 176.991 177.026 -0.035 18478 4021 1 9 . 1 1 90 90 ASN CA C 90 54.855 54.855 56.656 -1.801 18478 4022 1 9 . 1 1 90 90 ASN CB C 90 40.582 40.582 38.248 2.334 18478 4023 1 9 . 1 1 90 90 ASN H H 90 7.480 7.480 7.643 -0.163 18478 4024 1 9 . 1 1 91 91 ASN N N 91 119.185 119.185 116.148 3.037 18478 4025 1 9 . 1 1 91 91 ASN HA H 91 5.006 5.006 5.083 -0.077 18478 4026 1 9 . 1 1 91 91 ASN CA C 91 51.624 51.624 54.117 -2.493 18478 4027 1 9 . 1 1 91 91 ASN CB C 91 38.752 38.752 38.545 0.207 18478 4028 1 9 . 1 1 91 91 ASN H H 91 9.238 9.238 7.740 1.498 18478 4029 1 9 . 1 1 92 92 PRO HA H 92 4.296 4.296 4.449 -0.153 18478 4030 1 9 . 1 1 92 92 PRO C C 92 173.690 173.690 177.631 -3.941 18478 4031 1 9 . 1 1 92 92 PRO CA C 92 64.714 64.714 62.463 2.251 18478 4032 1 9 . 1 1 92 92 PRO CB C 92 31.781 31.781 32.264 -0.483 18478 4033 1 10 . 1 1 3 3 GLY C C 3 177.088 177.088 173.171 3.917 18478 4034 1 10 . 1 1 3 3 GLY CA C 3 45.330 45.330 44.197 1.133 18478 4035 1 10 . 1 1 4 4 SER N N 4 115.847 115.847 113.621 2.226 18478 4036 1 10 . 1 1 4 4 SER HA H 4 4.480 4.480 4.763 -0.283 18478 4037 1 10 . 1 1 4 4 SER C C 4 177.991 177.991 171.997 5.994 18478 4038 1 10 . 1 1 4 4 SER CA C 4 58.742 58.742 58.244 0.498 18478 4039 1 10 . 1 1 4 4 SER CB C 4 63.820 63.820 65.377 -1.557 18478 4040 1 10 . 1 1 4 4 SER H H 4 8.207 8.207 7.382 0.825 18478 4041 1 10 . 1 1 5 5 MET N N 5 125.867 125.867 122.781 3.086 18478 4042 1 10 . 1 1 5 5 MET HA H 5 4.580 4.580 4.752 -0.172 18478 4043 1 10 . 1 1 5 5 MET C C 5 174.825 174.825 175.220 -0.395 18478 4044 1 10 . 1 1 5 5 MET CA C 5 54.733 54.733 53.570 1.163 18478 4045 1 10 . 1 1 5 5 MET CB C 5 33.527 33.527 36.477 -2.950 18478 4046 1 10 . 1 1 5 5 MET H H 5 8.148 8.148 8.724 -0.576 18478 4047 1 10 . 1 1 6 6 THR N N 6 115.828 115.828 114.759 1.069 18478 4048 1 10 . 1 1 6 6 THR HA H 6 3.903 3.903 4.721 -0.818 18478 4049 1 10 . 1 1 6 6 THR C C 6 176.930 176.930 172.615 4.315 18478 4050 1 10 . 1 1 6 6 THR CA C 6 63.034 63.034 59.418 3.616 18478 4051 1 10 . 1 1 6 6 THR CB C 6 69.308 69.308 68.534 0.774 18478 4052 1 10 . 1 1 6 6 THR H H 6 8.408 8.408 8.370 0.038 18478 4053 1 10 . 1 1 7 7 ARG HA H 7 4.276 4.276 4.265 0.011 18478 4054 1 10 . 1 1 7 7 ARG C C 7 176.546 176.546 176.579 -0.033 18478 4055 1 10 . 1 1 7 7 ARG CA C 7 55.813 55.813 55.937 -0.124 18478 4056 1 10 . 1 1 7 7 ARG CB C 7 30.556 30.556 30.737 -0.181 18478 4057 1 10 . 1 1 8 8 ASP N N 8 121.762 121.762 121.820 -0.058 18478 4058 1 10 . 1 1 8 8 ASP HA H 8 4.537 4.537 4.158 0.379 18478 4059 1 10 . 1 1 8 8 ASP C C 8 177.750 177.750 174.254 3.496 18478 4060 1 10 . 1 1 8 8 ASP CA C 8 54.117 54.117 54.458 -0.341 18478 4061 1 10 . 1 1 8 8 ASP H H 8 8.066 8.066 8.646 -0.580 18478 4062 1 10 . 1 1 9 9 PHE N N 9 119.991 119.991 119.028 0.963 18478 4063 1 10 . 1 1 9 9 PHE HA H 9 4.734 4.734 5.120 -0.386 18478 4064 1 10 . 1 1 9 9 PHE C C 9 176.838 176.838 174.852 1.986 18478 4065 1 10 . 1 1 9 9 PHE CA C 9 58.303 58.303 56.725 1.578 18478 4066 1 10 . 1 1 9 9 PHE CB C 9 41.594 41.594 41.629 -0.035 18478 4067 1 10 . 1 1 9 9 PHE H H 9 8.103 8.103 7.776 0.327 18478 4068 1 10 . 1 1 10 10 LYS N N 10 122.957 122.957 124.721 -1.764 18478 4069 1 10 . 1 1 10 10 LYS CA C 10 53.167 53.167 55.669 -2.502 18478 4070 1 10 . 1 1 10 10 LYS CB C 10 33.495 33.495 32.329 1.166 18478 4071 1 10 . 1 1 10 10 LYS H H 10 9.087 9.087 8.736 0.351 18478 4072 1 10 . 1 1 11 11 PRO HA H 11 3.903 3.903 4.984 -1.081 18478 4073 1 10 . 1 1 11 11 PRO C C 11 173.988 173.988 174.730 -0.742 18478 4074 1 10 . 1 1 11 11 PRO CA C 11 63.874 63.874 61.248 2.626 18478 4075 1 10 . 1 1 11 11 PRO CB C 11 31.623 31.623 34.793 -3.170 18478 4076 1 10 . 1 1 12 12 GLY N N 12 115.413 115.413 110.633 4.780 18478 4077 1 10 . 1 1 12 12 GLY C C 12 176.966 176.966 172.433 4.533 18478 4078 1 10 . 1 1 12 12 GLY CA C 12 44.651 44.651 42.204 2.447 18478 4079 1 10 . 1 1 12 12 GLY H H 12 9.667 9.667 8.851 0.816 18478 4080 1 10 . 1 1 13 13 ASP N N 13 122.208 122.208 128.381 -6.173 18478 4081 1 10 . 1 1 13 13 ASP HA H 13 4.601 4.601 5.072 -0.471 18478 4082 1 10 . 1 1 13 13 ASP C C 13 176.244 176.244 174.395 1.849 18478 4083 1 10 . 1 1 13 13 ASP CA C 13 55.870 55.870 52.004 3.866 18478 4084 1 10 . 1 1 13 13 ASP CB C 13 40.794 40.794 42.983 -2.189 18478 4085 1 10 . 1 1 13 13 ASP H H 13 8.303 8.303 8.418 -0.115 18478 4086 1 10 . 1 1 14 14 LEU N N 14 121.306 121.306 125.672 -4.366 18478 4087 1 10 . 1 1 14 14 LEU HA H 14 4.982 4.982 4.667 0.315 18478 4088 1 10 . 1 1 14 14 LEU C C 14 173.461 173.461 176.365 -2.904 18478 4089 1 10 . 1 1 14 14 LEU CA C 14 54.516 54.516 53.578 0.938 18478 4090 1 10 . 1 1 14 14 LEU CB C 14 40.999 40.999 42.323 -1.324 18478 4091 1 10 . 1 1 14 14 LEU H H 14 8.618 8.618 7.845 0.773 18478 4092 1 10 . 1 1 15 15 ILE N N 15 118.806 118.806 125.104 -6.298 18478 4093 1 10 . 1 1 15 15 ILE HA H 15 5.356 5.356 4.240 1.116 18478 4094 1 10 . 1 1 15 15 ILE C C 15 175.982 175.982 175.513 0.469 18478 4095 1 10 . 1 1 15 15 ILE CA C 15 60.481 60.481 61.751 -1.270 18478 4096 1 10 . 1 1 15 15 ILE CB C 15 44.142 44.142 39.799 4.343 18478 4097 1 10 . 1 1 15 15 ILE H H 15 8.864 8.864 8.633 0.231 18478 4098 1 10 . 1 1 16 16 PHE N N 16 112.472 112.472 123.285 -10.813 18478 4099 1 10 . 1 1 16 16 PHE HA H 16 5.306 5.306 4.290 1.016 18478 4100 1 10 . 1 1 16 16 PHE C C 16 176.239 176.239 175.774 0.465 18478 4101 1 10 . 1 1 16 16 PHE CA C 16 58.603 58.603 58.922 -0.319 18478 4102 1 10 . 1 1 16 16 PHE CB C 16 43.305 43.305 37.888 5.417 18478 4103 1 10 . 1 1 16 16 PHE H H 16 9.411 9.411 8.773 0.638 18478 4104 1 10 . 1 1 17 17 ALA N N 17 123.889 123.889 125.337 -1.448 18478 4105 1 10 . 1 1 17 17 ALA HA H 17 5.348 5.348 3.755 1.593 18478 4106 1 10 . 1 1 17 17 ALA C C 17 174.426 174.426 177.072 -2.646 18478 4107 1 10 . 1 1 17 17 ALA CA C 17 50.062 50.062 51.604 -1.542 18478 4108 1 10 . 1 1 17 17 ALA H H 17 9.658 9.658 8.476 1.182 18478 4109 1 10 . 1 1 18 18 LYS N N 18 127.760 127.760 121.530 6.230 18478 4110 1 10 . 1 1 18 18 LYS HA H 18 4.697 4.697 4.658 0.039 18478 4111 1 10 . 1 1 18 18 LYS C C 18 178.554 178.554 174.777 3.777 18478 4112 1 10 . 1 1 18 18 LYS CA C 18 53.893 53.893 52.341 1.552 18478 4113 1 10 . 1 1 18 18 LYS CB C 18 35.291 35.291 32.621 2.670 18478 4114 1 10 . 1 1 18 18 LYS H H 18 9.421 9.421 7.369 2.052 18478 4115 1 10 . 1 1 19 19 MET HA H 19 4.656 4.656 4.601 0.055 18478 4116 1 10 . 1 1 19 19 MET C C 19 175.741 175.741 174.720 1.021 18478 4117 1 10 . 1 1 19 19 MET CA C 19 53.916 53.916 54.712 -0.795 18478 4118 1 10 . 1 1 19 19 MET CB C 19 35.799 35.799 33.527 2.272 18478 4119 1 10 . 1 1 20 20 LYS N N 20 124.062 124.062 116.919 7.143 18478 4120 1 10 . 1 1 20 20 LYS CA C 20 58.585 58.585 55.931 2.655 18478 4121 1 10 . 1 1 20 20 LYS CB C 20 31.978 31.978 32.648 -0.670 18478 4122 1 10 . 1 1 20 20 LYS H H 20 8.645 8.645 8.058 0.587 18478 4123 1 10 . 1 1 21 21 GLY C C 21 176.205 176.205 172.058 4.147 18478 4124 1 10 . 1 1 21 21 GLY CA C 21 45.142 45.142 42.552 2.590 18478 4125 1 10 . 1 1 22 22 TYR HA H 22 4.573 4.573 4.827 -0.254 18478 4126 1 10 . 1 1 22 22 TYR CA C 22 55.748 55.748 57.742 -1.994 18478 4127 1 10 . 1 1 22 22 TYR CB C 22 41.331 41.331 38.333 2.998 18478 4128 1 10 . 1 1 23 23 PRO HA H 23 4.759 4.759 4.956 -0.197 18478 4129 1 10 . 1 1 23 23 PRO C C 23 174.587 174.587 175.138 -0.551 18478 4130 1 10 . 1 1 23 23 PRO CA C 23 62.072 62.072 61.595 0.477 18478 4131 1 10 . 1 1 23 23 PRO CB C 23 31.077 31.077 34.894 -3.817 18478 4132 1 10 . 1 1 24 24 HIS N N 24 119.190 119.190 117.813 1.377 18478 4133 1 10 . 1 1 24 24 HIS HA H 24 3.983 3.983 5.141 -1.158 18478 4134 1 10 . 1 1 24 24 HIS C C 24 175.555 175.555 173.667 1.888 18478 4135 1 10 . 1 1 24 24 HIS CA C 24 60.973 60.973 54.119 6.854 18478 4136 1 10 . 1 1 24 24 HIS CB C 24 30.689 30.689 33.546 -2.857 18478 4137 1 10 . 1 1 24 24 HIS H H 24 8.158 8.158 8.754 -0.596 18478 4138 1 10 . 1 1 25 25 TRP N N 25 127.435 127.435 127.335 0.100 18478 4139 1 10 . 1 1 25 25 TRP HA H 25 3.760 3.760 4.881 -1.121 18478 4140 1 10 . 1 1 25 25 TRP CA C 25 55.890 55.890 59.046 -3.156 18478 4141 1 10 . 1 1 25 25 TRP CB C 25 32.879 32.879 29.691 3.188 18478 4142 1 10 . 1 1 25 25 TRP H H 25 9.211 9.211 8.836 0.375 18478 4143 1 10 . 1 1 26 26 PRO HA H 26 4.217 4.217 4.636 -0.419 18478 4144 1 10 . 1 1 26 26 PRO C C 26 176.279 176.279 175.785 0.494 18478 4145 1 10 . 1 1 26 26 PRO CA C 26 63.140 63.140 61.648 1.492 18478 4146 1 10 . 1 1 26 26 PRO CB C 26 32.171 32.171 34.700 -2.529 18478 4147 1 10 . 1 1 27 27 ALA N N 27 130.162 130.162 125.283 4.879 18478 4148 1 10 . 1 1 27 27 ALA HA H 27 4.981 4.981 4.391 0.590 18478 4149 1 10 . 1 1 27 27 ALA C C 27 177.227 177.227 177.263 -0.036 18478 4150 1 10 . 1 1 27 27 ALA CA C 27 52.574 52.574 51.550 1.024 18478 4151 1 10 . 1 1 27 27 ALA CB C 27 23.239 23.239 20.262 2.977 18478 4152 1 10 . 1 1 27 27 ALA H H 27 9.394 9.394 8.300 1.094 18478 4153 1 10 . 1 1 28 28 ARG N N 28 117.381 117.381 118.051 -0.670 18478 4154 1 10 . 1 1 28 28 ARG HA H 28 5.421 5.421 4.391 1.030 18478 4155 1 10 . 1 1 28 28 ARG C C 28 176.465 176.465 175.379 1.086 18478 4156 1 10 . 1 1 28 28 ARG CA C 28 53.662 53.662 54.895 -1.233 18478 4157 1 10 . 1 1 28 28 ARG CB C 28 35.058 35.058 29.751 5.307 18478 4158 1 10 . 1 1 28 28 ARG H H 28 8.806 8.806 8.481 0.325 18478 4159 1 10 . 1 1 29 29 VAL HA H 29 4.109 4.109 4.269 -0.160 18478 4160 1 10 . 1 1 29 29 VAL C C 29 175.996 175.996 175.021 0.975 18478 4161 1 10 . 1 1 29 29 VAL CA C 29 62.810 62.810 61.641 1.169 18478 4162 1 10 . 1 1 29 29 VAL CB C 29 31.108 31.108 32.451 -1.343 18478 4163 1 10 . 1 1 30 30 ASP N N 30 133.830 133.830 119.067 14.763 18478 4164 1 10 . 1 1 30 30 ASP HA H 30 5.198 5.198 4.633 0.565 18478 4165 1 10 . 1 1 30 30 ASP C C 30 176.207 176.207 177.621 -1.414 18478 4166 1 10 . 1 1 30 30 ASP CA C 30 53.007 53.007 54.566 -1.559 18478 4167 1 10 . 1 1 30 30 ASP CB C 30 44.130 44.130 40.723 3.407 18478 4168 1 10 . 1 1 30 30 ASP H H 30 8.892 8.892 8.527 0.365 18478 4169 1 10 . 1 1 31 31 GLU N N 31 115.905 115.905 120.838 -4.933 18478 4170 1 10 . 1 1 31 31 GLU HA H 31 4.409 4.409 3.934 0.475 18478 4171 1 10 . 1 1 31 31 GLU C C 31 175.192 175.192 176.183 -0.991 18478 4172 1 10 . 1 1 31 31 GLU CA C 31 55.389 55.389 56.781 -1.391 18478 4173 1 10 . 1 1 31 31 GLU H H 31 7.966 7.966 8.908 -0.942 18478 4174 1 10 . 1 1 32 32 VAL N N 32 122.794 122.794 117.398 5.396 18478 4175 1 10 . 1 1 32 32 VAL HA H 32 4.303 4.303 3.766 0.537 18478 4176 1 10 . 1 1 32 32 VAL CA C 32 60.408 60.408 62.812 -2.404 18478 4177 1 10 . 1 1 32 32 VAL CB C 32 32.333 32.333 30.698 1.635 18478 4178 1 10 . 1 1 32 32 VAL H H 32 8.702 8.702 7.826 0.876 18478 4179 1 10 . 1 1 33 33 PRO HA H 33 4.572 4.572 4.202 0.370 18478 4180 1 10 . 1 1 33 33 PRO C C 33 175.366 175.366 177.033 -1.667 18478 4181 1 10 . 1 1 33 33 PRO CA C 33 63.702 63.702 65.182 -1.480 18478 4182 1 10 . 1 1 33 33 PRO CB C 33 32.736 32.736 32.297 0.439 18478 4183 1 10 . 1 1 34 34 ASP N N 34 119.187 119.187 118.280 0.907 18478 4184 1 10 . 1 1 34 34 ASP HA H 34 4.679 4.679 4.994 -0.315 18478 4185 1 10 . 1 1 34 34 ASP C C 34 175.713 175.713 173.860 1.853 18478 4186 1 10 . 1 1 34 34 ASP CA C 34 53.013 53.013 51.558 1.455 18478 4187 1 10 . 1 1 34 34 ASP CB C 34 40.850 40.850 41.049 -0.199 18478 4188 1 10 . 1 1 34 34 ASP H H 34 8.686 8.686 8.232 0.454 18478 4189 1 10 . 1 1 35 35 GLY C C 35 177.458 177.458 172.732 4.726 18478 4190 1 10 . 1 1 35 35 GLY CA C 35 45.507 45.507 43.608 1.899 18478 4191 1 10 . 1 1 36 36 ALA HA H 36 4.404 4.404 4.427 -0.023 18478 4192 1 10 . 1 1 36 36 ALA CA C 36 52.010 52.010 51.945 0.065 18478 4193 1 10 . 1 1 36 36 ALA CB C 36 19.909 19.909 19.735 0.174 18478 4194 1 10 . 1 1 37 37 VAL N N 37 119.594 119.594 122.019 -2.425 18478 4195 1 10 . 1 1 37 37 VAL HA H 37 3.932 3.932 4.056 -0.124 18478 4196 1 10 . 1 1 37 37 VAL C C 37 175.966 175.966 176.122 -0.156 18478 4197 1 10 . 1 1 37 37 VAL CA C 37 62.810 62.810 62.488 0.322 18478 4198 1 10 . 1 1 37 37 VAL CB C 37 32.267 32.267 32.279 -0.012 18478 4199 1 10 . 1 1 37 37 VAL H H 37 8.037 8.037 8.587 -0.550 18478 4200 1 10 . 1 1 38 38 LYS N N 38 125.676 125.676 120.126 5.550 18478 4201 1 10 . 1 1 38 38 LYS C C 38 173.865 173.865 174.596 -0.731 18478 4202 1 10 . 1 1 38 38 LYS CA C 38 54.278 54.278 56.719 -2.441 18478 4203 1 10 . 1 1 38 38 LYS CB C 38 31.740 31.740 33.618 -1.878 18478 4204 1 10 . 1 1 38 38 LYS H H 38 8.292 8.292 8.406 -0.114 18478 4205 1 10 . 1 1 40 40 PRO HA H 40 4.387 4.387 5.247 -0.860 18478 4206 1 10 . 1 1 40 40 PRO C C 40 175.535 175.535 175.218 0.317 18478 4207 1 10 . 1 1 40 40 PRO CA C 40 62.330 62.330 59.603 2.727 18478 4208 1 10 . 1 1 40 40 PRO CB C 40 32.086 32.086 31.710 0.376 18478 4209 1 10 . 1 1 41 41 THR HA H 41 4.027 4.027 4.349 -0.322 18478 4210 1 10 . 1 1 41 41 THR C C 41 176.795 176.795 173.131 3.664 18478 4211 1 10 . 1 1 41 41 THR CA C 41 63.693 63.693 62.095 1.598 18478 4212 1 10 . 1 1 41 41 THR CB C 41 69.370 69.370 69.099 0.271 18478 4213 1 10 . 1 1 42 42 ASN N N 42 118.513 118.513 121.239 -2.726 18478 4214 1 10 . 1 1 42 42 ASN HA H 42 4.530 4.530 4.946 -0.416 18478 4215 1 10 . 1 1 42 42 ASN C C 42 177.230 177.230 174.597 2.633 18478 4216 1 10 . 1 1 42 42 ASN CA C 42 56.373 56.373 50.459 5.914 18478 4217 1 10 . 1 1 42 42 ASN CB C 42 37.618 37.618 37.644 -0.026 18478 4218 1 10 . 1 1 42 42 ASN H H 42 8.752 8.752 8.652 0.100 18478 4219 1 10 . 1 1 43 43 LYS N N 43 115.898 115.898 128.243 -12.345 18478 4220 1 10 . 1 1 43 43 LYS HA H 43 4.710 4.710 4.703 0.007 18478 4221 1 10 . 1 1 43 43 LYS C C 43 177.032 177.032 176.551 0.481 18478 4222 1 10 . 1 1 43 43 LYS CA C 43 54.957 54.957 55.475 -0.518 18478 4223 1 10 . 1 1 43 43 LYS CB C 43 36.600 36.600 32.532 4.068 18478 4224 1 10 . 1 1 43 43 LYS H H 43 7.723 7.723 9.105 -1.382 18478 4225 1 10 . 1 1 44 44 LEU N N 44 121.006 121.006 128.028 -7.022 18478 4226 1 10 . 1 1 44 44 LEU HA H 44 5.000 5.000 4.413 0.587 18478 4227 1 10 . 1 1 44 44 LEU CA C 44 51.842 51.842 54.971 -3.129 18478 4228 1 10 . 1 1 44 44 LEU CB C 44 44.418 44.418 40.689 3.729 18478 4229 1 10 . 1 1 44 44 LEU H H 44 9.063 9.063 8.744 0.319 18478 4230 1 10 . 1 1 45 45 PRO HA H 45 4.392 4.392 4.702 -0.310 18478 4231 1 10 . 1 1 45 45 PRO C C 45 177.051 177.051 177.794 -0.743 18478 4232 1 10 . 1 1 45 45 PRO CA C 45 62.000 62.000 64.153 -2.154 18478 4233 1 10 . 1 1 45 45 PRO CB C 45 30.737 30.737 32.454 -1.717 18478 4234 1 10 . 1 1 46 46 ILE N N 46 125.996 125.996 125.092 0.904 18478 4235 1 10 . 1 1 46 46 ILE HA H 46 4.564 4.564 3.604 0.960 18478 4236 1 10 . 1 1 46 46 ILE C C 46 176.985 176.985 175.664 1.321 18478 4237 1 10 . 1 1 46 46 ILE CA C 46 57.051 57.051 62.334 -5.283 18478 4238 1 10 . 1 1 46 46 ILE H H 46 8.908 8.908 9.162 -0.254 18478 4239 1 10 . 1 1 47 47 PHE N N 47 128.276 128.276 118.443 9.833 18478 4240 1 10 . 1 1 47 47 PHE HA H 47 4.827 4.827 4.232 0.595 18478 4241 1 10 . 1 1 47 47 PHE C C 47 177.835 177.835 176.087 1.748 18478 4242 1 10 . 1 1 47 47 PHE CA C 47 56.099 56.099 57.374 -1.275 18478 4243 1 10 . 1 1 47 47 PHE CB C 47 41.217 41.217 40.765 0.452 18478 4244 1 10 . 1 1 47 47 PHE H H 47 8.739 8.739 7.559 1.180 18478 4245 1 10 . 1 1 48 48 PHE N N 48 125.953 125.953 118.275 7.678 18478 4246 1 10 . 1 1 48 48 PHE HA H 48 4.251 4.251 4.274 -0.023 18478 4247 1 10 . 1 1 48 48 PHE C C 48 175.869 175.869 174.312 1.557 18478 4248 1 10 . 1 1 48 48 PHE CA C 48 56.744 56.744 59.026 -2.282 18478 4249 1 10 . 1 1 48 48 PHE CB C 48 38.835 38.835 36.517 2.318 18478 4250 1 10 . 1 1 48 48 PHE H H 48 8.545 8.545 8.175 0.370 18478 4251 1 10 . 1 1 49 49 PHE N N 49 122.197 122.197 118.244 3.953 18478 4252 1 10 . 1 1 49 49 PHE HA H 49 4.400 4.400 4.602 -0.202 18478 4253 1 10 . 1 1 49 49 PHE C C 49 174.016 174.016 174.162 -0.146 18478 4254 1 10 . 1 1 49 49 PHE CA C 49 59.916 59.916 56.347 3.569 18478 4255 1 10 . 1 1 49 49 PHE CB C 49 39.799 39.799 41.806 -2.007 18478 4256 1 10 . 1 1 49 49 PHE H H 49 8.619 8.619 7.585 1.034 18478 4257 1 10 . 1 1 50 50 GLY N N 50 114.083 114.083 107.664 6.419 18478 4258 1 10 . 1 1 50 50 GLY C C 50 175.636 175.636 173.322 2.314 18478 4259 1 10 . 1 1 50 50 GLY CA C 50 46.718 46.718 43.982 2.736 18478 4260 1 10 . 1 1 50 50 GLY H H 50 10.329 10.329 7.996 2.333 18478 4261 1 10 . 1 1 51 51 THR N N 51 111.210 111.210 118.426 -7.216 18478 4262 1 10 . 1 1 51 51 THR HA H 51 3.980 3.980 4.552 -0.572 18478 4263 1 10 . 1 1 51 51 THR C C 51 175.588 175.588 171.844 3.744 18478 4264 1 10 . 1 1 51 51 THR CA C 51 62.223 62.223 61.230 0.993 18478 4265 1 10 . 1 1 51 51 THR CB C 51 68.346 68.346 72.149 -3.803 18478 4266 1 10 . 1 1 51 51 THR H H 51 7.882 7.882 8.311 -0.429 18478 4267 1 10 . 1 1 52 52 HIS N N 52 115.544 115.544 120.244 -4.700 18478 4268 1 10 . 1 1 52 52 HIS HA H 52 3.712 3.712 5.364 -1.652 18478 4269 1 10 . 1 1 52 52 HIS C C 52 177.717 177.717 175.414 2.303 18478 4270 1 10 . 1 1 52 52 HIS CA C 52 54.860 54.860 54.779 0.081 18478 4271 1 10 . 1 1 52 52 HIS CB C 52 26.388 26.388 30.404 -4.016 18478 4272 1 10 . 1 1 52 52 HIS H H 52 7.791 7.791 8.517 -0.726 18478 4273 1 10 . 1 1 53 53 GLU N N 53 117.517 117.517 123.457 -5.940 18478 4274 1 10 . 1 1 53 53 GLU HA H 53 4.298 4.298 4.727 -0.429 18478 4275 1 10 . 1 1 53 53 GLU C C 53 176.958 176.958 176.499 0.459 18478 4276 1 10 . 1 1 53 53 GLU CA C 53 55.403 55.403 55.515 -0.112 18478 4277 1 10 . 1 1 53 53 GLU CB C 53 31.588 31.588 33.159 -1.571 18478 4278 1 10 . 1 1 53 53 GLU H H 53 6.795 6.795 8.630 -1.835 18478 4279 1 10 . 1 1 54 54 THR N N 54 111.182 111.182 117.178 -5.996 18478 4280 1 10 . 1 1 54 54 THR HA H 54 5.648 5.648 4.367 1.281 18478 4281 1 10 . 1 1 54 54 THR C C 54 177.234 177.234 174.114 3.120 18478 4282 1 10 . 1 1 54 54 THR CA C 54 59.894 59.894 61.598 -1.704 18478 4283 1 10 . 1 1 54 54 THR H H 54 8.139 8.139 8.839 -0.700 18478 4284 1 10 . 1 1 55 55 ALA HA H 55 4.403 4.403 4.163 0.240 18478 4285 1 10 . 1 1 55 55 ALA C C 55 176.601 176.601 178.103 -1.502 18478 4286 1 10 . 1 1 55 55 ALA CA C 55 51.079 51.079 53.188 -2.109 18478 4287 1 10 . 1 1 55 55 ALA CB C 55 23.285 23.285 19.020 4.265 18478 4288 1 10 . 1 1 56 56 PHE N N 56 118.058 118.058 113.604 4.454 18478 4289 1 10 . 1 1 56 56 PHE HA H 56 5.678 5.678 4.565 1.113 18478 4290 1 10 . 1 1 56 56 PHE C C 56 175.962 175.962 175.166 0.796 18478 4291 1 10 . 1 1 56 56 PHE CA C 56 56.008 56.008 59.233 -3.225 18478 4292 1 10 . 1 1 56 56 PHE CB C 56 39.995 39.995 37.719 2.276 18478 4293 1 10 . 1 1 56 56 PHE H H 56 8.523 8.523 8.268 0.255 18478 4294 1 10 . 1 1 57 57 LEU N N 57 123.344 123.344 120.683 2.661 18478 4295 1 10 . 1 1 57 57 LEU HA H 57 4.929 4.929 4.694 0.235 18478 4296 1 10 . 1 1 57 57 LEU C C 57 175.584 175.584 174.797 0.787 18478 4297 1 10 . 1 1 57 57 LEU CA C 57 53.463 53.463 54.892 -1.429 18478 4298 1 10 . 1 1 57 57 LEU CB C 57 46.545 46.545 43.529 3.015 18478 4299 1 10 . 1 1 57 57 LEU H H 57 8.579 8.579 7.586 0.993 18478 4300 1 10 . 1 1 58 58 GLY N N 58 108.499 108.499 106.919 1.580 18478 4301 1 10 . 1 1 58 58 GLY CA C 58 43.755 43.755 44.053 -0.298 18478 4302 1 10 . 1 1 58 58 GLY H H 58 9.318 9.318 7.368 1.950 18478 4303 1 10 . 1 1 59 59 PRO HA H 59 4.048 4.048 4.967 -0.919 18478 4304 1 10 . 1 1 59 59 PRO C C 59 173.763 173.763 174.722 -0.959 18478 4305 1 10 . 1 1 59 59 PRO CA C 59 64.770 64.770 60.489 4.281 18478 4306 1 10 . 1 1 59 59 PRO CB C 59 31.889 31.889 35.846 -3.957 18478 4307 1 10 . 1 1 60 60 LYS HA H 60 4.191 4.191 4.575 -0.384 18478 4308 1 10 . 1 1 60 60 LYS C C 60 174.842 174.842 176.540 -1.698 18478 4309 1 10 . 1 1 60 60 LYS CA C 60 57.875 57.875 56.099 1.776 18478 4310 1 10 . 1 1 60 60 LYS CB C 60 31.576 31.576 32.699 -1.123 18478 4311 1 10 . 1 1 61 61 ASP N N 61 117.768 117.768 123.520 -5.752 18478 4312 1 10 . 1 1 61 61 ASP HA H 61 4.973 4.973 4.386 0.587 18478 4313 1 10 . 1 1 61 61 ASP C C 61 178.178 178.178 177.007 1.171 18478 4314 1 10 . 1 1 61 61 ASP CA C 61 54.687 54.687 55.601 -0.914 18478 4315 1 10 . 1 1 61 61 ASP CB C 61 43.555 43.555 39.426 4.129 18478 4316 1 10 . 1 1 61 61 ASP H H 61 7.722 7.722 8.823 -1.101 18478 4317 1 10 . 1 1 62 62 ILE N N 62 114.244 114.244 119.755 -5.511 18478 4318 1 10 . 1 1 62 62 ILE HA H 62 4.891 4.891 3.399 1.492 18478 4319 1 10 . 1 1 62 62 ILE C C 62 178.027 178.027 177.148 0.879 18478 4320 1 10 . 1 1 62 62 ILE CA C 62 59.994 59.994 63.312 -3.317 18478 4321 1 10 . 1 1 62 62 ILE CB C 62 40.652 40.652 36.993 3.659 18478 4322 1 10 . 1 1 62 62 ILE H H 62 6.784 6.784 7.658 -0.874 18478 4323 1 10 . 1 1 63 63 PHE N N 63 119.819 119.819 120.405 -0.586 18478 4324 1 10 . 1 1 63 63 PHE HA H 63 5.214 5.214 4.288 0.926 18478 4325 1 10 . 1 1 63 63 PHE CA C 63 54.735 54.735 59.870 -5.135 18478 4326 1 10 . 1 1 63 63 PHE CB C 63 42.122 42.122 38.812 3.309 18478 4327 1 10 . 1 1 63 63 PHE H H 63 8.734 8.734 7.578 1.156 18478 4328 1 10 . 1 1 64 64 PRO HA H 64 4.771 4.771 4.356 0.415 18478 4329 1 10 . 1 1 64 64 PRO C C 64 174.036 174.036 178.335 -4.299 18478 4330 1 10 . 1 1 64 64 PRO CA C 64 64.474 64.474 64.655 -0.181 18478 4331 1 10 . 1 1 64 64 PRO CB C 64 32.662 32.662 33.041 -0.379 18478 4332 1 10 . 1 1 65 65 TYR N N 65 124.335 124.335 121.661 2.674 18478 4333 1 10 . 1 1 65 65 TYR HA H 65 4.530 4.530 4.292 0.238 18478 4334 1 10 . 1 1 65 65 TYR C C 65 173.944 173.944 177.534 -3.590 18478 4335 1 10 . 1 1 65 65 TYR CA C 65 61.205 61.205 60.856 0.349 18478 4336 1 10 . 1 1 65 65 TYR CB C 65 38.844 38.844 38.069 0.775 18478 4337 1 10 . 1 1 65 65 TYR H H 65 8.359 8.359 7.918 0.441 18478 4338 1 10 . 1 1 66 66 SER N N 66 114.836 114.836 112.276 2.560 18478 4339 1 10 . 1 1 66 66 SER HA H 66 3.505 3.505 4.364 -0.859 18478 4340 1 10 . 1 1 66 66 SER C C 66 173.697 173.697 175.427 -1.730 18478 4341 1 10 . 1 1 66 66 SER CA C 66 63.078 63.078 59.611 3.467 18478 4342 1 10 . 1 1 66 66 SER CB C 66 62.223 62.223 63.024 -0.801 18478 4343 1 10 . 1 1 66 66 SER H H 66 8.974 8.974 7.682 1.292 18478 4344 1 10 . 1 1 67 67 GLU N N 67 118.013 118.013 118.678 -0.665 18478 4345 1 10 . 1 1 67 67 GLU HA H 67 4.210 4.210 4.171 0.039 18478 4346 1 10 . 1 1 67 67 GLU C C 67 174.961 174.961 177.496 -2.535 18478 4347 1 10 . 1 1 67 67 GLU CA C 67 58.330 58.330 57.955 0.376 18478 4348 1 10 . 1 1 67 67 GLU CB C 67 30.205 30.205 30.995 -0.790 18478 4349 1 10 . 1 1 67 67 GLU H H 67 8.817 8.817 7.874 0.943 18478 4350 1 10 . 1 1 68 68 ASN N N 68 113.942 113.942 112.200 1.742 18478 4351 1 10 . 1 1 68 68 ASN HA H 68 5.015 5.015 5.036 -0.021 18478 4352 1 10 . 1 1 68 68 ASN C C 68 176.626 176.626 176.546 0.080 18478 4353 1 10 . 1 1 68 68 ASN CA C 68 53.768 53.768 51.827 1.941 18478 4354 1 10 . 1 1 68 68 ASN CB C 68 41.948 41.948 39.623 2.325 18478 4355 1 10 . 1 1 68 68 ASN H H 68 7.448 7.448 7.751 -0.303 18478 4356 1 10 . 1 1 69 69 LYS N N 69 124.584 124.584 121.234 3.350 18478 4357 1 10 . 1 1 69 69 LYS HA H 69 3.794 3.794 3.994 -0.200 18478 4358 1 10 . 1 1 69 69 LYS C C 69 173.330 173.330 175.346 -2.016 18478 4359 1 10 . 1 1 69 69 LYS CA C 69 61.225 61.225 57.152 4.073 18478 4360 1 10 . 1 1 69 69 LYS H H 69 7.592 7.592 8.551 -0.959 18478 4361 1 10 . 1 1 70 70 GLU N N 70 118.408 118.408 117.825 0.583 18478 4362 1 10 . 1 1 70 70 GLU HA H 70 4.005 4.005 4.852 -0.847 18478 4363 1 10 . 1 1 70 70 GLU C C 70 174.588 174.588 173.469 1.119 18478 4364 1 10 . 1 1 70 70 GLU CA C 70 58.695 58.695 53.044 5.651 18478 4365 1 10 . 1 1 70 70 GLU CB C 70 28.928 28.928 31.158 -2.230 18478 4366 1 10 . 1 1 70 70 GLU H H 70 8.478 8.478 8.245 0.233 18478 4367 1 10 . 1 1 71 71 LYS HA H 71 3.847 3.847 4.382 -0.535 18478 4368 1 10 . 1 1 71 71 LYS C C 71 173.420 173.420 175.375 -1.955 18478 4369 1 10 . 1 1 71 71 LYS CA C 71 58.718 58.718 55.662 3.056 18478 4370 1 10 . 1 1 71 71 LYS CB C 71 32.964 32.964 33.905 -0.941 18478 4371 1 10 . 1 1 72 72 TYR N N 72 112.358 112.358 122.930 -10.572 18478 4372 1 10 . 1 1 72 72 TYR HA H 72 4.790 4.790 4.248 0.542 18478 4373 1 10 . 1 1 72 72 TYR C C 72 174.442 174.442 175.384 -0.942 18478 4374 1 10 . 1 1 72 72 TYR CA C 72 55.287 55.287 59.133 -3.845 18478 4375 1 10 . 1 1 72 72 TYR CB C 72 37.244 37.244 38.895 -1.651 18478 4376 1 10 . 1 1 72 72 TYR H H 72 7.341 7.341 8.511 -1.170 18478 4377 1 10 . 1 1 73 73 GLY N N 73 110.612 110.612 108.092 2.520 18478 4378 1 10 . 1 1 73 73 GLY C C 73 177.982 177.982 173.462 4.520 18478 4379 1 10 . 1 1 73 73 GLY CA C 73 46.623 46.623 44.280 2.343 18478 4380 1 10 . 1 1 73 73 GLY H H 73 8.076 8.076 8.333 -0.257 18478 4381 1 10 . 1 1 74 74 LYS N N 74 121.009 121.009 120.254 0.755 18478 4382 1 10 . 1 1 74 74 LYS CA C 74 53.465 53.465 53.951 -0.486 18478 4383 1 10 . 1 1 74 74 LYS CB C 74 32.440 32.440 33.043 -0.603 18478 4384 1 10 . 1 1 74 74 LYS H H 74 7.411 7.411 7.915 -0.504 18478 4385 1 10 . 1 1 75 75 PRO HA H 75 4.452 4.452 4.247 0.205 18478 4386 1 10 . 1 1 75 75 PRO C C 75 174.959 174.959 178.233 -3.274 18478 4387 1 10 . 1 1 75 75 PRO CA C 75 62.861 62.861 64.347 -1.486 18478 4388 1 10 . 1 1 75 75 PRO CB C 75 32.407 32.407 31.787 0.620 18478 4389 1 10 . 1 1 76 76 ASN N N 76 121.045 121.045 118.890 2.155 18478 4390 1 10 . 1 1 76 76 ASN HA H 76 4.445 4.445 4.333 0.112 18478 4391 1 10 . 1 1 76 76 ASN C C 76 174.145 174.145 174.447 -0.302 18478 4392 1 10 . 1 1 76 76 ASN CA C 76 55.701 55.701 52.978 2.723 18478 4393 1 10 . 1 1 76 76 ASN H H 76 8.474 8.474 8.852 -0.378 18478 4394 1 10 . 1 1 77 77 LYS N N 77 111.466 111.466 120.124 -8.658 18478 4395 1 10 . 1 1 77 77 LYS HA H 77 4.369 4.369 4.244 0.125 18478 4396 1 10 . 1 1 77 77 LYS C C 77 173.881 173.881 176.478 -2.597 18478 4397 1 10 . 1 1 77 77 LYS CA C 77 55.995 55.995 56.174 -0.179 18478 4398 1 10 . 1 1 77 77 LYS CB C 77 32.538 32.538 32.343 0.195 18478 4399 1 10 . 1 1 77 77 LYS H H 77 8.543 8.543 7.899 0.644 18478 4400 1 10 . 1 1 78 78 ARG N N 78 122.233 122.233 119.840 2.393 18478 4401 1 10 . 1 1 78 78 ARG HA H 78 4.286 4.286 4.052 0.234 18478 4402 1 10 . 1 1 78 78 ARG C C 78 173.652 173.652 174.492 -0.840 18478 4403 1 10 . 1 1 78 78 ARG CA C 78 55.780 55.780 57.222 -1.442 18478 4404 1 10 . 1 1 78 78 ARG CB C 78 29.554 29.554 29.360 0.194 18478 4405 1 10 . 1 1 78 78 ARG H H 78 8.864 8.864 8.932 -0.068 18478 4406 1 10 . 1 1 79 79 LYS N N 79 128.197 128.197 117.938 10.259 18478 4407 1 10 . 1 1 79 79 LYS HA H 79 4.221 4.221 4.536 -0.315 18478 4408 1 10 . 1 1 79 79 LYS C C 79 174.336 174.336 175.847 -1.511 18478 4409 1 10 . 1 1 79 79 LYS CA C 79 58.986 58.986 55.497 3.489 18478 4410 1 10 . 1 1 79 79 LYS CB C 79 32.072 32.072 32.855 -0.783 18478 4411 1 10 . 1 1 79 79 LYS H H 79 8.927 8.927 8.323 0.604 18478 4412 1 10 . 1 1 80 80 GLY N N 80 114.730 114.730 108.944 5.786 18478 4413 1 10 . 1 1 80 80 GLY C C 80 176.536 176.536 175.188 1.348 18478 4414 1 10 . 1 1 80 80 GLY CA C 80 45.992 45.992 46.086 -0.094 18478 4415 1 10 . 1 1 80 80 GLY H H 80 8.943 8.943 8.414 0.529 18478 4416 1 10 . 1 1 81 81 PHE N N 81 123.770 123.770 120.332 3.438 18478 4417 1 10 . 1 1 81 81 PHE HA H 81 3.336 3.336 4.231 -0.895 18478 4418 1 10 . 1 1 81 81 PHE C C 81 174.037 174.037 176.163 -2.126 18478 4419 1 10 . 1 1 81 81 PHE CA C 81 63.094 63.094 60.040 3.054 18478 4420 1 10 . 1 1 81 81 PHE CB C 81 39.823 39.823 38.495 1.328 18478 4421 1 10 . 1 1 81 81 PHE H H 81 8.281 8.281 8.247 0.034 18478 4422 1 10 . 1 1 82 82 ASN N N 82 119.812 119.812 116.593 3.219 18478 4423 1 10 . 1 1 82 82 ASN HA H 82 4.458 4.458 4.317 0.141 18478 4424 1 10 . 1 1 82 82 ASN C C 82 171.290 171.290 176.372 -5.082 18478 4425 1 10 . 1 1 82 82 ASN CA C 82 56.060 56.060 56.062 -0.002 18478 4426 1 10 . 1 1 82 82 ASN CB C 82 36.390 36.390 38.370 -1.980 18478 4427 1 10 . 1 1 82 82 ASN H H 82 9.145 9.145 8.521 0.624 18478 4428 1 10 . 1 1 83 83 GLU N N 83 124.411 124.411 118.900 5.511 18478 4429 1 10 . 1 1 83 83 GLU HA H 83 4.186 4.186 3.997 0.189 18478 4430 1 10 . 1 1 83 83 GLU C C 83 172.222 172.222 178.710 -6.488 18478 4431 1 10 . 1 1 83 83 GLU CA C 83 60.922 60.922 59.155 1.767 18478 4432 1 10 . 1 1 83 83 GLU CB C 83 28.132 28.132 29.997 -1.865 18478 4433 1 10 . 1 1 83 83 GLU H H 83 9.560 9.560 7.870 1.690 18478 4434 1 10 . 1 1 84 84 GLY N N 84 111.388 111.388 107.082 4.306 18478 4435 1 10 . 1 1 84 84 GLY C C 84 176.445 176.445 174.074 2.371 18478 4436 1 10 . 1 1 84 84 GLY CA C 84 46.727 46.727 46.463 0.264 18478 4437 1 10 . 1 1 84 84 GLY H H 84 8.364 8.364 7.262 1.102 18478 4438 1 10 . 1 1 85 85 LEU N N 85 121.153 121.153 119.788 1.365 18478 4439 1 10 . 1 1 85 85 LEU HA H 85 4.236 4.236 4.246 -0.010 18478 4440 1 10 . 1 1 85 85 LEU C C 85 172.285 172.285 177.989 -5.704 18478 4441 1 10 . 1 1 85 85 LEU CA C 85 56.795 56.795 56.657 0.138 18478 4442 1 10 . 1 1 85 85 LEU CB C 85 41.113 41.113 42.783 -1.670 18478 4443 1 10 . 1 1 85 85 LEU H H 85 8.294 8.294 7.692 0.602 18478 4444 1 10 . 1 1 86 86 TRP N N 86 118.898 118.898 119.071 -0.173 18478 4445 1 10 . 1 1 86 86 TRP HA H 86 4.161 4.161 4.339 -0.178 18478 4446 1 10 . 1 1 86 86 TRP C C 86 171.741 171.741 176.341 -4.600 18478 4447 1 10 . 1 1 86 86 TRP CA C 86 62.153 62.153 58.485 3.668 18478 4448 1 10 . 1 1 86 86 TRP CB C 86 28.424 28.424 29.732 -1.308 18478 4449 1 10 . 1 1 86 86 TRP H H 86 7.783 7.783 7.352 0.431 18478 4450 1 10 . 1 1 87 87 GLU N N 87 120.718 120.718 119.208 1.510 18478 4451 1 10 . 1 1 87 87 GLU HA H 87 3.416 3.416 4.698 -1.282 18478 4452 1 10 . 1 1 87 87 GLU C C 87 172.957 172.957 174.951 -1.994 18478 4453 1 10 . 1 1 87 87 GLU CA C 87 60.122 60.122 53.180 6.942 18478 4454 1 10 . 1 1 87 87 GLU CB C 87 31.021 31.021 30.421 0.600 18478 4455 1 10 . 1 1 87 87 GLU H H 87 8.779 8.779 7.519 1.260 18478 4456 1 10 . 1 1 88 88 ILE HA H 88 2.478 2.478 4.249 -1.771 18478 4457 1 10 . 1 1 88 88 ILE C C 88 177.873 177.873 177.170 0.703 18478 4458 1 10 . 1 1 88 88 ILE CA C 88 65.248 65.248 62.258 2.990 18478 4459 1 10 . 1 1 88 88 ILE CB C 88 37.327 37.327 38.438 -1.111 18478 4460 1 10 . 1 1 89 89 ASP N N 89 114.411 114.411 118.565 -4.154 18478 4461 1 10 . 1 1 89 89 ASP HA H 89 4.589 4.589 4.489 0.100 18478 4462 1 10 . 1 1 89 89 ASP C C 89 174.207 174.207 177.967 -3.760 18478 4463 1 10 . 1 1 89 89 ASP CA C 89 54.740 54.740 56.767 -2.027 18478 4464 1 10 . 1 1 89 89 ASP CB C 89 42.473 42.473 40.261 2.212 18478 4465 1 10 . 1 1 89 89 ASP H H 89 5.911 5.911 8.185 -2.274 18478 4466 1 10 . 1 1 90 90 ASN N N 90 114.358 114.358 115.628 -1.270 18478 4467 1 10 . 1 1 90 90 ASN HA H 90 4.420 4.420 4.384 0.036 18478 4468 1 10 . 1 1 90 90 ASN C C 90 176.991 176.991 177.705 -0.714 18478 4469 1 10 . 1 1 90 90 ASN CA C 90 54.855 54.855 56.422 -1.567 18478 4470 1 10 . 1 1 90 90 ASN CB C 90 40.582 40.582 37.792 2.790 18478 4471 1 10 . 1 1 90 90 ASN H H 90 7.480 7.480 7.772 -0.292 18478 4472 1 10 . 1 1 91 91 ASN N N 91 119.185 119.185 115.974 3.211 18478 4473 1 10 . 1 1 91 91 ASN HA H 91 5.006 5.006 5.153 -0.147 18478 4474 1 10 . 1 1 91 91 ASN CA C 91 51.624 51.624 54.982 -3.358 18478 4475 1 10 . 1 1 91 91 ASN CB C 91 38.752 38.752 38.074 0.678 18478 4476 1 10 . 1 1 91 91 ASN H H 91 9.238 9.238 7.806 1.432 18478 4477 1 10 . 1 1 92 92 PRO HA H 92 4.296 4.296 4.199 0.097 18478 4478 1 10 . 1 1 92 92 PRO C C 92 173.690 173.690 176.805 -3.115 18478 4479 1 10 . 1 1 92 92 PRO CA C 92 64.714 64.714 65.572 -0.858 18478 4480 1 10 . 1 1 92 92 PRO CB C 92 31.781 31.781 32.804 -1.023 18478 4481 1 11 . 1 1 3 3 GLY C C 3 177.088 177.088 173.512 3.576 18478 4482 1 11 . 1 1 3 3 GLY CA C 3 45.330 45.330 46.531 -1.201 18478 4483 1 11 . 1 1 4 4 SER N N 4 115.847 115.847 111.664 4.183 18478 4484 1 11 . 1 1 4 4 SER HA H 4 4.480 4.480 4.634 -0.154 18478 4485 1 11 . 1 1 4 4 SER C C 4 177.991 177.991 172.886 5.105 18478 4486 1 11 . 1 1 4 4 SER CA C 4 58.742 58.742 57.486 1.256 18478 4487 1 11 . 1 1 4 4 SER CB C 4 63.820 63.820 65.085 -1.265 18478 4488 1 11 . 1 1 4 4 SER H H 4 8.207 8.207 7.888 0.319 18478 4489 1 11 . 1 1 5 5 MET N N 5 125.867 125.867 119.308 6.559 18478 4490 1 11 . 1 1 5 5 MET HA H 5 4.580 4.580 4.673 -0.093 18478 4491 1 11 . 1 1 5 5 MET C C 5 174.825 174.825 175.659 -0.834 18478 4492 1 11 . 1 1 5 5 MET CA C 5 54.733 54.733 53.794 0.939 18478 4493 1 11 . 1 1 5 5 MET CB C 5 33.527 33.527 36.557 -3.030 18478 4494 1 11 . 1 1 5 5 MET H H 5 8.148 8.148 8.440 -0.292 18478 4495 1 11 . 1 1 6 6 THR N N 6 115.828 115.828 117.090 -1.262 18478 4496 1 11 . 1 1 6 6 THR HA H 6 3.903 3.903 4.460 -0.557 18478 4497 1 11 . 1 1 6 6 THR C C 6 176.930 176.930 173.234 3.696 18478 4498 1 11 . 1 1 6 6 THR CA C 6 63.034 63.034 60.591 2.443 18478 4499 1 11 . 1 1 6 6 THR CB C 6 69.308 69.308 69.135 0.173 18478 4500 1 11 . 1 1 6 6 THR H H 6 8.408 8.408 8.519 -0.111 18478 4501 1 11 . 1 1 7 7 ARG HA H 7 4.276 4.276 4.263 0.013 18478 4502 1 11 . 1 1 7 7 ARG C C 7 176.546 176.546 176.332 0.214 18478 4503 1 11 . 1 1 7 7 ARG CA C 7 55.813 55.813 56.290 -0.477 18478 4504 1 11 . 1 1 7 7 ARG CB C 7 30.556 30.556 30.564 -0.008 18478 4505 1 11 . 1 1 8 8 ASP N N 8 121.762 121.762 125.285 -3.523 18478 4506 1 11 . 1 1 8 8 ASP HA H 8 4.537 4.537 4.265 0.272 18478 4507 1 11 . 1 1 8 8 ASP C C 8 177.750 177.750 175.910 1.840 18478 4508 1 11 . 1 1 8 8 ASP CA C 8 54.117 54.117 53.911 0.206 18478 4509 1 11 . 1 1 8 8 ASP H H 8 8.066 8.066 8.999 -0.933 18478 4510 1 11 . 1 1 9 9 PHE N N 9 119.991 119.991 120.704 -0.713 18478 4511 1 11 . 1 1 9 9 PHE HA H 9 4.734 4.734 4.568 0.166 18478 4512 1 11 . 1 1 9 9 PHE C C 9 176.838 176.838 174.816 2.022 18478 4513 1 11 . 1 1 9 9 PHE CA C 9 58.303 58.303 58.885 -0.582 18478 4514 1 11 . 1 1 9 9 PHE CB C 9 41.594 41.594 40.044 1.550 18478 4515 1 11 . 1 1 9 9 PHE H H 9 8.103 8.103 7.626 0.477 18478 4516 1 11 . 1 1 10 10 LYS N N 10 122.957 122.957 125.660 -2.703 18478 4517 1 11 . 1 1 10 10 LYS CA C 10 53.167 53.167 55.842 -2.675 18478 4518 1 11 . 1 1 10 10 LYS CB C 10 33.495 33.495 31.224 2.272 18478 4519 1 11 . 1 1 10 10 LYS H H 10 9.087 9.087 8.733 0.354 18478 4520 1 11 . 1 1 11 11 PRO HA H 11 3.903 3.903 5.018 -1.115 18478 4521 1 11 . 1 1 11 11 PRO C C 11 173.988 173.988 174.808 -0.820 18478 4522 1 11 . 1 1 11 11 PRO CA C 11 63.874 63.874 60.659 3.215 18478 4523 1 11 . 1 1 11 11 PRO CB C 11 31.623 31.623 35.016 -3.393 18478 4524 1 11 . 1 1 12 12 GLY N N 12 115.413 115.413 110.431 4.982 18478 4525 1 11 . 1 1 12 12 GLY C C 12 176.966 176.966 172.529 4.437 18478 4526 1 11 . 1 1 12 12 GLY CA C 12 44.651 44.651 42.251 2.400 18478 4527 1 11 . 1 1 12 12 GLY H H 12 9.667 9.667 9.001 0.666 18478 4528 1 11 . 1 1 13 13 ASP N N 13 122.208 122.208 128.293 -6.085 18478 4529 1 11 . 1 1 13 13 ASP HA H 13 4.601 4.601 4.963 -0.362 18478 4530 1 11 . 1 1 13 13 ASP C C 13 176.244 176.244 174.686 1.558 18478 4531 1 11 . 1 1 13 13 ASP CA C 13 55.870 55.870 52.019 3.851 18478 4532 1 11 . 1 1 13 13 ASP CB C 13 40.794 40.794 42.601 -1.807 18478 4533 1 11 . 1 1 13 13 ASP H H 13 8.303 8.303 8.451 -0.148 18478 4534 1 11 . 1 1 14 14 LEU N N 14 121.306 121.306 126.662 -5.356 18478 4535 1 11 . 1 1 14 14 LEU HA H 14 4.982 4.982 4.624 0.358 18478 4536 1 11 . 1 1 14 14 LEU C C 14 173.461 173.461 175.986 -2.525 18478 4537 1 11 . 1 1 14 14 LEU CA C 14 54.516 54.516 53.523 0.993 18478 4538 1 11 . 1 1 14 14 LEU CB C 14 40.999 40.999 41.719 -0.720 18478 4539 1 11 . 1 1 14 14 LEU H H 14 8.618 8.618 7.770 0.848 18478 4540 1 11 . 1 1 15 15 ILE N N 15 118.806 118.806 125.247 -6.441 18478 4541 1 11 . 1 1 15 15 ILE HA H 15 5.356 5.356 4.228 1.128 18478 4542 1 11 . 1 1 15 15 ILE C C 15 175.982 175.982 176.039 -0.057 18478 4543 1 11 . 1 1 15 15 ILE CA C 15 60.481 60.481 61.341 -0.860 18478 4544 1 11 . 1 1 15 15 ILE CB C 15 44.142 44.142 39.879 4.263 18478 4545 1 11 . 1 1 15 15 ILE H H 15 8.864 8.864 8.494 0.370 18478 4546 1 11 . 1 1 16 16 PHE N N 16 112.472 112.472 123.395 -10.923 18478 4547 1 11 . 1 1 16 16 PHE HA H 16 5.306 5.306 4.363 0.943 18478 4548 1 11 . 1 1 16 16 PHE C C 16 176.239 176.239 176.415 -0.176 18478 4549 1 11 . 1 1 16 16 PHE CA C 16 58.603 58.603 58.984 -0.381 18478 4550 1 11 . 1 1 16 16 PHE CB C 16 43.305 43.305 37.506 5.799 18478 4551 1 11 . 1 1 16 16 PHE H H 16 9.411 9.411 8.572 0.839 18478 4552 1 11 . 1 1 17 17 ALA N N 17 123.889 123.889 125.991 -2.102 18478 4553 1 11 . 1 1 17 17 ALA HA H 17 5.348 5.348 3.693 1.655 18478 4554 1 11 . 1 1 17 17 ALA C C 17 174.426 174.426 176.598 -2.172 18478 4555 1 11 . 1 1 17 17 ALA CA C 17 50.062 50.062 51.802 -1.740 18478 4556 1 11 . 1 1 17 17 ALA H H 17 9.658 9.658 8.592 1.066 18478 4557 1 11 . 1 1 18 18 LYS N N 18 127.760 127.760 121.584 6.176 18478 4558 1 11 . 1 1 18 18 LYS HA H 18 4.697 4.697 4.680 0.017 18478 4559 1 11 . 1 1 18 18 LYS C C 18 178.554 178.554 174.660 3.894 18478 4560 1 11 . 1 1 18 18 LYS CA C 18 53.893 53.893 52.356 1.537 18478 4561 1 11 . 1 1 18 18 LYS CB C 18 35.291 35.291 32.749 2.542 18478 4562 1 11 . 1 1 18 18 LYS H H 18 9.421 9.421 7.445 1.976 18478 4563 1 11 . 1 1 19 19 MET HA H 19 4.656 4.656 4.599 0.057 18478 4564 1 11 . 1 1 19 19 MET C C 19 175.741 175.741 174.730 1.011 18478 4565 1 11 . 1 1 19 19 MET CA C 19 53.916 53.916 54.844 -0.929 18478 4566 1 11 . 1 1 19 19 MET CB C 19 35.799 35.799 33.516 2.283 18478 4567 1 11 . 1 1 20 20 LYS N N 20 124.062 124.062 118.838 5.224 18478 4568 1 11 . 1 1 20 20 LYS CA C 20 58.585 58.585 56.322 2.263 18478 4569 1 11 . 1 1 20 20 LYS CB C 20 31.978 31.978 32.969 -0.991 18478 4570 1 11 . 1 1 20 20 LYS H H 20 8.645 8.645 8.137 0.508 18478 4571 1 11 . 1 1 21 21 GLY C C 21 176.205 176.205 172.246 3.959 18478 4572 1 11 . 1 1 21 21 GLY CA C 21 45.142 45.142 41.545 3.596 18478 4573 1 11 . 1 1 22 22 TYR HA H 22 4.573 4.573 4.834 -0.261 18478 4574 1 11 . 1 1 22 22 TYR CA C 22 55.748 55.748 57.833 -2.085 18478 4575 1 11 . 1 1 22 22 TYR CB C 22 41.331 41.331 37.897 3.434 18478 4576 1 11 . 1 1 23 23 PRO HA H 23 4.759 4.759 5.073 -0.314 18478 4577 1 11 . 1 1 23 23 PRO C C 23 174.587 174.587 175.192 -0.605 18478 4578 1 11 . 1 1 23 23 PRO CA C 23 62.072 62.072 61.297 0.775 18478 4579 1 11 . 1 1 23 23 PRO CB C 23 31.077 31.077 35.247 -4.170 18478 4580 1 11 . 1 1 24 24 HIS N N 24 119.190 119.190 115.724 3.466 18478 4581 1 11 . 1 1 24 24 HIS HA H 24 3.983 3.983 5.834 -1.851 18478 4582 1 11 . 1 1 24 24 HIS C C 24 175.555 175.555 174.313 1.242 18478 4583 1 11 . 1 1 24 24 HIS CA C 24 60.973 60.973 54.241 6.732 18478 4584 1 11 . 1 1 24 24 HIS CB C 24 30.689 30.689 33.151 -2.462 18478 4585 1 11 . 1 1 24 24 HIS H H 24 8.158 8.158 8.552 -0.394 18478 4586 1 11 . 1 1 25 25 TRP N N 25 127.435 127.435 122.117 5.318 18478 4587 1 11 . 1 1 25 25 TRP HA H 25 3.760 3.760 5.261 -1.501 18478 4588 1 11 . 1 1 25 25 TRP CA C 25 55.890 55.890 57.519 -1.629 18478 4589 1 11 . 1 1 25 25 TRP CB C 25 32.879 32.879 30.680 2.199 18478 4590 1 11 . 1 1 25 25 TRP H H 25 9.211 9.211 8.783 0.428 18478 4591 1 11 . 1 1 26 26 PRO HA H 26 4.217 4.217 4.605 -0.388 18478 4592 1 11 . 1 1 26 26 PRO C C 26 176.279 176.279 176.410 -0.131 18478 4593 1 11 . 1 1 26 26 PRO CA C 26 63.140 63.140 61.691 1.449 18478 4594 1 11 . 1 1 26 26 PRO CB C 26 32.171 32.171 34.402 -2.231 18478 4595 1 11 . 1 1 27 27 ALA N N 27 130.162 130.162 123.511 6.651 18478 4596 1 11 . 1 1 27 27 ALA HA H 27 4.981 4.981 4.190 0.791 18478 4597 1 11 . 1 1 27 27 ALA C C 27 177.227 177.227 176.953 0.274 18478 4598 1 11 . 1 1 27 27 ALA CA C 27 52.574 52.574 51.583 0.992 18478 4599 1 11 . 1 1 27 27 ALA CB C 27 23.239 23.239 19.463 3.776 18478 4600 1 11 . 1 1 27 27 ALA H H 27 9.394 9.394 8.295 1.099 18478 4601 1 11 . 1 1 28 28 ARG N N 28 117.381 117.381 116.801 0.580 18478 4602 1 11 . 1 1 28 28 ARG HA H 28 5.421 5.421 4.599 0.822 18478 4603 1 11 . 1 1 28 28 ARG C C 28 176.465 176.465 175.028 1.437 18478 4604 1 11 . 1 1 28 28 ARG CA C 28 53.662 53.662 53.517 0.145 18478 4605 1 11 . 1 1 28 28 ARG CB C 28 35.058 35.058 30.280 4.778 18478 4606 1 11 . 1 1 28 28 ARG H H 28 8.806 8.806 8.408 0.398 18478 4607 1 11 . 1 1 29 29 VAL HA H 29 4.109 4.109 4.226 -0.117 18478 4608 1 11 . 1 1 29 29 VAL C C 29 175.996 175.996 174.794 1.202 18478 4609 1 11 . 1 1 29 29 VAL CA C 29 62.810 62.810 61.772 1.038 18478 4610 1 11 . 1 1 29 29 VAL CB C 29 31.108 31.108 32.377 -1.269 18478 4611 1 11 . 1 1 30 30 ASP N N 30 133.830 133.830 118.873 14.957 18478 4612 1 11 . 1 1 30 30 ASP HA H 30 5.198 5.198 4.655 0.543 18478 4613 1 11 . 1 1 30 30 ASP C C 30 176.207 176.207 177.220 -1.013 18478 4614 1 11 . 1 1 30 30 ASP CA C 30 53.007 53.007 54.178 -1.171 18478 4615 1 11 . 1 1 30 30 ASP CB C 30 44.130 44.130 40.995 3.135 18478 4616 1 11 . 1 1 30 30 ASP H H 30 8.892 8.892 8.445 0.447 18478 4617 1 11 . 1 1 31 31 GLU N N 31 115.905 115.905 120.778 -4.873 18478 4618 1 11 . 1 1 31 31 GLU HA H 31 4.409 4.409 3.987 0.422 18478 4619 1 11 . 1 1 31 31 GLU C C 31 175.192 175.192 176.238 -1.046 18478 4620 1 11 . 1 1 31 31 GLU CA C 31 55.389 55.389 56.410 -1.021 18478 4621 1 11 . 1 1 31 31 GLU H H 31 7.966 7.966 8.859 -0.893 18478 4622 1 11 . 1 1 32 32 VAL N N 32 122.794 122.794 117.553 5.241 18478 4623 1 11 . 1 1 32 32 VAL HA H 32 4.303 4.303 3.829 0.474 18478 4624 1 11 . 1 1 32 32 VAL CA C 32 60.408 60.408 62.719 -2.311 18478 4625 1 11 . 1 1 32 32 VAL CB C 32 32.333 32.333 30.953 1.380 18478 4626 1 11 . 1 1 32 32 VAL H H 32 8.702 8.702 7.933 0.769 18478 4627 1 11 . 1 1 33 33 PRO HA H 33 4.572 4.572 4.218 0.354 18478 4628 1 11 . 1 1 33 33 PRO C C 33 175.366 175.366 178.141 -2.775 18478 4629 1 11 . 1 1 33 33 PRO CA C 33 63.702 63.702 65.162 -1.460 18478 4630 1 11 . 1 1 33 33 PRO CB C 33 32.736 32.736 31.841 0.895 18478 4631 1 11 . 1 1 34 34 ASP N N 34 119.187 119.187 118.469 0.718 18478 4632 1 11 . 1 1 34 34 ASP HA H 34 4.679 4.679 4.922 -0.243 18478 4633 1 11 . 1 1 34 34 ASP C C 34 175.713 175.713 173.998 1.715 18478 4634 1 11 . 1 1 34 34 ASP CA C 34 53.013 53.013 52.409 0.604 18478 4635 1 11 . 1 1 34 34 ASP CB C 34 40.850 40.850 41.400 -0.550 18478 4636 1 11 . 1 1 34 34 ASP H H 34 8.686 8.686 7.938 0.748 18478 4637 1 11 . 1 1 35 35 GLY C C 35 177.458 177.458 172.615 4.843 18478 4638 1 11 . 1 1 35 35 GLY CA C 35 45.507 45.507 43.692 1.815 18478 4639 1 11 . 1 1 36 36 ALA HA H 36 4.404 4.404 4.370 0.034 18478 4640 1 11 . 1 1 36 36 ALA CA C 36 52.010 52.010 51.774 0.236 18478 4641 1 11 . 1 1 36 36 ALA CB C 36 19.909 19.909 19.698 0.211 18478 4642 1 11 . 1 1 37 37 VAL N N 37 119.594 119.594 123.750 -4.156 18478 4643 1 11 . 1 1 37 37 VAL HA H 37 3.932 3.932 4.139 -0.207 18478 4644 1 11 . 1 1 37 37 VAL C C 37 175.966 175.966 176.126 -0.160 18478 4645 1 11 . 1 1 37 37 VAL CA C 37 62.810 62.810 63.126 -0.316 18478 4646 1 11 . 1 1 37 37 VAL CB C 37 32.267 32.267 32.414 -0.147 18478 4647 1 11 . 1 1 37 37 VAL H H 37 8.037 8.037 8.674 -0.637 18478 4648 1 11 . 1 1 38 38 LYS N N 38 125.676 125.676 119.717 5.959 18478 4649 1 11 . 1 1 38 38 LYS C C 38 173.865 173.865 174.545 -0.680 18478 4650 1 11 . 1 1 38 38 LYS CA C 38 54.278 54.278 56.974 -2.696 18478 4651 1 11 . 1 1 38 38 LYS CB C 38 31.740 31.740 35.035 -3.295 18478 4652 1 11 . 1 1 38 38 LYS H H 38 8.292 8.292 8.420 -0.128 18478 4653 1 11 . 1 1 40 40 PRO HA H 40 4.387 4.387 5.196 -0.809 18478 4654 1 11 . 1 1 40 40 PRO C C 40 175.535 175.535 175.282 0.253 18478 4655 1 11 . 1 1 40 40 PRO CA C 40 62.330 62.330 59.605 2.725 18478 4656 1 11 . 1 1 40 40 PRO CB C 40 32.086 32.086 31.528 0.558 18478 4657 1 11 . 1 1 41 41 THR HA H 41 4.027 4.027 4.492 -0.465 18478 4658 1 11 . 1 1 41 41 THR C C 41 176.795 176.795 173.008 3.787 18478 4659 1 11 . 1 1 41 41 THR CA C 41 63.693 63.693 62.255 1.438 18478 4660 1 11 . 1 1 41 41 THR CB C 41 69.370 69.370 68.883 0.487 18478 4661 1 11 . 1 1 42 42 ASN N N 42 118.513 118.513 122.073 -3.560 18478 4662 1 11 . 1 1 42 42 ASN HA H 42 4.530 4.530 5.290 -0.760 18478 4663 1 11 . 1 1 42 42 ASN C C 42 177.230 177.230 174.921 2.309 18478 4664 1 11 . 1 1 42 42 ASN CA C 42 56.373 56.373 50.407 5.966 18478 4665 1 11 . 1 1 42 42 ASN CB C 42 37.618 37.618 38.098 -0.480 18478 4666 1 11 . 1 1 42 42 ASN H H 42 8.752 8.752 8.634 0.118 18478 4667 1 11 . 1 1 43 43 LYS N N 43 115.898 115.898 128.824 -12.926 18478 4668 1 11 . 1 1 43 43 LYS HA H 43 4.710 4.710 4.749 -0.039 18478 4669 1 11 . 1 1 43 43 LYS C C 43 177.032 177.032 176.113 0.919 18478 4670 1 11 . 1 1 43 43 LYS CA C 43 54.957 54.957 55.096 -0.139 18478 4671 1 11 . 1 1 43 43 LYS CB C 43 36.600 36.600 33.416 3.184 18478 4672 1 11 . 1 1 43 43 LYS H H 43 7.723 7.723 8.592 -0.869 18478 4673 1 11 . 1 1 44 44 LEU N N 44 121.006 121.006 128.908 -7.902 18478 4674 1 11 . 1 1 44 44 LEU HA H 44 5.000 5.000 4.286 0.714 18478 4675 1 11 . 1 1 44 44 LEU CA C 44 51.842 51.842 55.175 -3.333 18478 4676 1 11 . 1 1 44 44 LEU CB C 44 44.418 44.418 41.667 2.751 18478 4677 1 11 . 1 1 44 44 LEU H H 44 9.063 9.063 8.722 0.341 18478 4678 1 11 . 1 1 45 45 PRO HA H 45 4.392 4.392 4.495 -0.103 18478 4679 1 11 . 1 1 45 45 PRO C C 45 177.051 177.051 177.820 -0.769 18478 4680 1 11 . 1 1 45 45 PRO CA C 45 62.000 62.000 64.211 -2.211 18478 4681 1 11 . 1 1 45 45 PRO CB C 45 30.737 30.737 32.439 -1.702 18478 4682 1 11 . 1 1 46 46 ILE N N 46 125.996 125.996 126.320 -0.324 18478 4683 1 11 . 1 1 46 46 ILE HA H 46 4.564 4.564 4.047 0.517 18478 4684 1 11 . 1 1 46 46 ILE C C 46 176.985 176.985 175.554 1.431 18478 4685 1 11 . 1 1 46 46 ILE CA C 46 57.051 57.051 62.374 -5.323 18478 4686 1 11 . 1 1 46 46 ILE H H 46 8.908 8.908 8.192 0.716 18478 4687 1 11 . 1 1 47 47 PHE N N 47 128.276 128.276 117.635 10.641 18478 4688 1 11 . 1 1 47 47 PHE HA H 47 4.827 4.827 4.169 0.658 18478 4689 1 11 . 1 1 47 47 PHE C C 47 177.835 177.835 176.049 1.786 18478 4690 1 11 . 1 1 47 47 PHE CA C 47 56.099 56.099 57.869 -1.770 18478 4691 1 11 . 1 1 47 47 PHE CB C 47 41.217 41.217 39.669 1.548 18478 4692 1 11 . 1 1 47 47 PHE H H 47 8.739 8.739 7.605 1.134 18478 4693 1 11 . 1 1 48 48 PHE N N 48 125.953 125.953 116.311 9.642 18478 4694 1 11 . 1 1 48 48 PHE HA H 48 4.251 4.251 4.311 -0.060 18478 4695 1 11 . 1 1 48 48 PHE C C 48 175.869 175.869 174.388 1.481 18478 4696 1 11 . 1 1 48 48 PHE CA C 48 56.744 56.744 59.608 -2.864 18478 4697 1 11 . 1 1 48 48 PHE CB C 48 38.835 38.835 36.066 2.769 18478 4698 1 11 . 1 1 48 48 PHE H H 48 8.545 8.545 7.569 0.976 18478 4699 1 11 . 1 1 49 49 PHE N N 49 122.197 122.197 117.515 4.682 18478 4700 1 11 . 1 1 49 49 PHE HA H 49 4.400 4.400 4.455 -0.055 18478 4701 1 11 . 1 1 49 49 PHE C C 49 174.016 174.016 174.869 -0.853 18478 4702 1 11 . 1 1 49 49 PHE CA C 49 59.916 59.916 56.133 3.783 18478 4703 1 11 . 1 1 49 49 PHE CB C 49 39.799 39.799 40.182 -0.383 18478 4704 1 11 . 1 1 49 49 PHE H H 49 8.619 8.619 7.532 1.087 18478 4705 1 11 . 1 1 50 50 GLY N N 50 114.083 114.083 107.935 6.148 18478 4706 1 11 . 1 1 50 50 GLY C C 50 175.636 175.636 173.077 2.559 18478 4707 1 11 . 1 1 50 50 GLY CA C 50 46.718 46.718 43.500 3.218 18478 4708 1 11 . 1 1 50 50 GLY H H 50 10.329 10.329 7.902 2.427 18478 4709 1 11 . 1 1 51 51 THR N N 51 111.210 111.210 118.597 -7.387 18478 4710 1 11 . 1 1 51 51 THR HA H 51 3.980 3.980 4.529 -0.549 18478 4711 1 11 . 1 1 51 51 THR C C 51 175.588 175.588 171.985 3.603 18478 4712 1 11 . 1 1 51 51 THR CA C 51 62.223 62.223 61.465 0.758 18478 4713 1 11 . 1 1 51 51 THR CB C 51 68.346 68.346 72.286 -3.940 18478 4714 1 11 . 1 1 51 51 THR H H 51 7.882 7.882 8.393 -0.511 18478 4715 1 11 . 1 1 52 52 HIS N N 52 115.544 115.544 120.890 -5.346 18478 4716 1 11 . 1 1 52 52 HIS HA H 52 3.712 3.712 5.442 -1.730 18478 4717 1 11 . 1 1 52 52 HIS C C 52 177.717 177.717 175.369 2.348 18478 4718 1 11 . 1 1 52 52 HIS CA C 52 54.860 54.860 54.795 0.064 18478 4719 1 11 . 1 1 52 52 HIS CB C 52 26.388 26.388 30.453 -4.065 18478 4720 1 11 . 1 1 52 52 HIS H H 52 7.791 7.791 8.597 -0.806 18478 4721 1 11 . 1 1 53 53 GLU N N 53 117.517 117.517 123.422 -5.905 18478 4722 1 11 . 1 1 53 53 GLU HA H 53 4.298 4.298 4.694 -0.396 18478 4723 1 11 . 1 1 53 53 GLU C C 53 176.958 176.958 176.519 0.439 18478 4724 1 11 . 1 1 53 53 GLU CA C 53 55.403 55.403 55.474 -0.071 18478 4725 1 11 . 1 1 53 53 GLU CB C 53 31.588 31.588 33.471 -1.883 18478 4726 1 11 . 1 1 53 53 GLU H H 53 6.795 6.795 8.621 -1.826 18478 4727 1 11 . 1 1 54 54 THR N N 54 111.182 111.182 117.313 -6.131 18478 4728 1 11 . 1 1 54 54 THR HA H 54 5.648 5.648 4.367 1.281 18478 4729 1 11 . 1 1 54 54 THR C C 54 177.234 177.234 174.072 3.162 18478 4730 1 11 . 1 1 54 54 THR CA C 54 59.894 59.894 61.562 -1.668 18478 4731 1 11 . 1 1 54 54 THR H H 54 8.139 8.139 8.841 -0.702 18478 4732 1 11 . 1 1 55 55 ALA HA H 55 4.403 4.403 3.966 0.437 18478 4733 1 11 . 1 1 55 55 ALA C C 55 176.601 176.601 178.014 -1.413 18478 4734 1 11 . 1 1 55 55 ALA CA C 55 51.079 51.079 53.071 -1.992 18478 4735 1 11 . 1 1 55 55 ALA CB C 55 23.285 23.285 18.987 4.298 18478 4736 1 11 . 1 1 56 56 PHE N N 56 118.058 118.058 113.708 4.350 18478 4737 1 11 . 1 1 56 56 PHE HA H 56 5.678 5.678 4.559 1.119 18478 4738 1 11 . 1 1 56 56 PHE C C 56 175.962 175.962 175.088 0.874 18478 4739 1 11 . 1 1 56 56 PHE CA C 56 56.008 56.008 59.119 -3.111 18478 4740 1 11 . 1 1 56 56 PHE CB C 56 39.995 39.995 37.689 2.306 18478 4741 1 11 . 1 1 56 56 PHE H H 56 8.523 8.523 8.254 0.269 18478 4742 1 11 . 1 1 57 57 LEU N N 57 123.344 123.344 120.670 2.674 18478 4743 1 11 . 1 1 57 57 LEU HA H 57 4.929 4.929 4.702 0.227 18478 4744 1 11 . 1 1 57 57 LEU C C 57 175.584 175.584 174.800 0.784 18478 4745 1 11 . 1 1 57 57 LEU CA C 57 53.463 53.463 54.904 -1.441 18478 4746 1 11 . 1 1 57 57 LEU CB C 57 46.545 46.545 43.699 2.846 18478 4747 1 11 . 1 1 57 57 LEU H H 57 8.579 8.579 7.555 1.024 18478 4748 1 11 . 1 1 58 58 GLY N N 58 108.499 108.499 107.167 1.332 18478 4749 1 11 . 1 1 58 58 GLY CA C 58 43.755 43.755 44.197 -0.442 18478 4750 1 11 . 1 1 58 58 GLY H H 58 9.318 9.318 7.295 2.023 18478 4751 1 11 . 1 1 59 59 PRO HA H 59 4.048 4.048 4.958 -0.910 18478 4752 1 11 . 1 1 59 59 PRO C C 59 173.763 173.763 174.722 -0.959 18478 4753 1 11 . 1 1 59 59 PRO CA C 59 64.770 64.770 60.487 4.283 18478 4754 1 11 . 1 1 59 59 PRO CB C 59 31.889 31.889 35.748 -3.858 18478 4755 1 11 . 1 1 60 60 LYS HA H 60 4.191 4.191 4.593 -0.402 18478 4756 1 11 . 1 1 60 60 LYS C C 60 174.842 174.842 176.613 -1.771 18478 4757 1 11 . 1 1 60 60 LYS CA C 60 57.875 57.875 56.036 1.839 18478 4758 1 11 . 1 1 60 60 LYS CB C 60 31.576 31.576 32.900 -1.324 18478 4759 1 11 . 1 1 61 61 ASP N N 61 117.768 117.768 122.836 -5.068 18478 4760 1 11 . 1 1 61 61 ASP HA H 61 4.973 4.973 4.287 0.686 18478 4761 1 11 . 1 1 61 61 ASP C C 61 178.178 178.178 176.935 1.243 18478 4762 1 11 . 1 1 61 61 ASP CA C 61 54.687 54.687 56.334 -1.647 18478 4763 1 11 . 1 1 61 61 ASP CB C 61 43.555 43.555 39.358 4.197 18478 4764 1 11 . 1 1 61 61 ASP H H 61 7.722 7.722 8.884 -1.162 18478 4765 1 11 . 1 1 62 62 ILE N N 62 114.244 114.244 120.441 -6.197 18478 4766 1 11 . 1 1 62 62 ILE HA H 62 4.891 4.891 3.417 1.474 18478 4767 1 11 . 1 1 62 62 ILE C C 62 178.027 178.027 177.956 0.071 18478 4768 1 11 . 1 1 62 62 ILE CA C 62 59.994 59.994 63.913 -3.918 18478 4769 1 11 . 1 1 62 62 ILE CB C 62 40.652 40.652 36.781 3.871 18478 4770 1 11 . 1 1 62 62 ILE H H 62 6.784 6.784 7.541 -0.757 18478 4771 1 11 . 1 1 63 63 PHE N N 63 119.819 119.819 118.845 0.974 18478 4772 1 11 . 1 1 63 63 PHE HA H 63 5.214 5.214 4.214 1.000 18478 4773 1 11 . 1 1 63 63 PHE CA C 63 54.735 54.735 59.605 -4.870 18478 4774 1 11 . 1 1 63 63 PHE CB C 63 42.122 42.122 38.455 3.667 18478 4775 1 11 . 1 1 63 63 PHE H H 63 8.734 8.734 7.669 1.065 18478 4776 1 11 . 1 1 64 64 PRO HA H 64 4.771 4.771 4.333 0.438 18478 4777 1 11 . 1 1 64 64 PRO C C 64 174.036 174.036 178.403 -4.367 18478 4778 1 11 . 1 1 64 64 PRO CA C 64 64.474 64.474 63.823 0.651 18478 4779 1 11 . 1 1 64 64 PRO CB C 64 32.662 32.662 33.458 -0.796 18478 4780 1 11 . 1 1 65 65 TYR N N 65 124.335 124.335 121.467 2.868 18478 4781 1 11 . 1 1 65 65 TYR HA H 65 4.530 4.530 4.297 0.233 18478 4782 1 11 . 1 1 65 65 TYR C C 65 173.944 173.944 177.245 -3.301 18478 4783 1 11 . 1 1 65 65 TYR CA C 65 61.205 61.205 61.117 0.088 18478 4784 1 11 . 1 1 65 65 TYR CB C 65 38.844 38.844 38.021 0.823 18478 4785 1 11 . 1 1 65 65 TYR H H 65 8.359 8.359 7.876 0.483 18478 4786 1 11 . 1 1 66 66 SER N N 66 114.836 114.836 112.095 2.741 18478 4787 1 11 . 1 1 66 66 SER HA H 66 3.505 3.505 4.353 -0.848 18478 4788 1 11 . 1 1 66 66 SER C C 66 173.697 173.697 175.418 -1.721 18478 4789 1 11 . 1 1 66 66 SER CA C 66 63.078 63.078 59.663 3.415 18478 4790 1 11 . 1 1 66 66 SER CB C 66 62.223 62.223 62.990 -0.767 18478 4791 1 11 . 1 1 66 66 SER H H 66 8.974 8.974 7.682 1.292 18478 4792 1 11 . 1 1 67 67 GLU N N 67 118.013 118.013 118.666 -0.653 18478 4793 1 11 . 1 1 67 67 GLU HA H 67 4.210 4.210 4.159 0.051 18478 4794 1 11 . 1 1 67 67 GLU C C 67 174.961 174.961 177.528 -2.567 18478 4795 1 11 . 1 1 67 67 GLU CA C 67 58.330 58.330 57.917 0.413 18478 4796 1 11 . 1 1 67 67 GLU CB C 67 30.205 30.205 30.954 -0.749 18478 4797 1 11 . 1 1 67 67 GLU H H 67 8.817 8.817 7.869 0.948 18478 4798 1 11 . 1 1 68 68 ASN N N 68 113.942 113.942 110.702 3.240 18478 4799 1 11 . 1 1 68 68 ASN HA H 68 5.015 5.015 5.023 -0.008 18478 4800 1 11 . 1 1 68 68 ASN C C 68 176.626 176.626 176.000 0.626 18478 4801 1 11 . 1 1 68 68 ASN CA C 68 53.768 53.768 51.291 2.477 18478 4802 1 11 . 1 1 68 68 ASN CB C 68 41.948 41.948 38.848 3.100 18478 4803 1 11 . 1 1 68 68 ASN H H 68 7.448 7.448 7.657 -0.209 18478 4804 1 11 . 1 1 69 69 LYS N N 69 124.584 124.584 120.928 3.656 18478 4805 1 11 . 1 1 69 69 LYS HA H 69 3.794 3.794 3.981 -0.187 18478 4806 1 11 . 1 1 69 69 LYS C C 69 173.330 173.330 175.678 -2.348 18478 4807 1 11 . 1 1 69 69 LYS CA C 69 61.225 61.225 57.401 3.824 18478 4808 1 11 . 1 1 69 69 LYS H H 69 7.592 7.592 8.470 -0.878 18478 4809 1 11 . 1 1 70 70 GLU N N 70 118.408 118.408 117.977 0.431 18478 4810 1 11 . 1 1 70 70 GLU HA H 70 4.005 4.005 4.727 -0.722 18478 4811 1 11 . 1 1 70 70 GLU C C 70 174.588 174.588 173.383 1.205 18478 4812 1 11 . 1 1 70 70 GLU CA C 70 58.695 58.695 53.135 5.560 18478 4813 1 11 . 1 1 70 70 GLU CB C 70 28.928 28.928 31.266 -2.338 18478 4814 1 11 . 1 1 70 70 GLU H H 70 8.478 8.478 8.202 0.276 18478 4815 1 11 . 1 1 71 71 LYS HA H 71 3.847 3.847 4.440 -0.593 18478 4816 1 11 . 1 1 71 71 LYS C C 71 173.420 173.420 175.428 -2.008 18478 4817 1 11 . 1 1 71 71 LYS CA C 71 58.718 58.718 55.754 2.964 18478 4818 1 11 . 1 1 71 71 LYS CB C 71 32.964 32.964 34.003 -1.039 18478 4819 1 11 . 1 1 72 72 TYR N N 72 112.358 112.358 123.075 -10.717 18478 4820 1 11 . 1 1 72 72 TYR HA H 72 4.790 4.790 4.273 0.517 18478 4821 1 11 . 1 1 72 72 TYR C C 72 174.442 174.442 175.962 -1.520 18478 4822 1 11 . 1 1 72 72 TYR CA C 72 55.287 55.287 60.055 -4.768 18478 4823 1 11 . 1 1 72 72 TYR CB C 72 37.244 37.244 38.717 -1.473 18478 4824 1 11 . 1 1 72 72 TYR H H 72 7.341 7.341 8.500 -1.159 18478 4825 1 11 . 1 1 73 73 GLY N N 73 110.612 110.612 107.258 3.354 18478 4826 1 11 . 1 1 73 73 GLY C C 73 177.982 177.982 173.290 4.692 18478 4827 1 11 . 1 1 73 73 GLY CA C 73 46.623 46.623 44.361 2.262 18478 4828 1 11 . 1 1 73 73 GLY H H 73 8.076 8.076 8.328 -0.252 18478 4829 1 11 . 1 1 74 74 LYS N N 74 121.009 121.009 119.734 1.275 18478 4830 1 11 . 1 1 74 74 LYS CA C 74 53.465 53.465 54.134 -0.669 18478 4831 1 11 . 1 1 74 74 LYS CB C 74 32.440 32.440 33.282 -0.842 18478 4832 1 11 . 1 1 74 74 LYS H H 74 7.411 7.411 7.920 -0.509 18478 4833 1 11 . 1 1 75 75 PRO HA H 75 4.452 4.452 4.382 0.070 18478 4834 1 11 . 1 1 75 75 PRO C C 75 174.959 174.959 177.403 -2.444 18478 4835 1 11 . 1 1 75 75 PRO CA C 75 62.861 62.861 64.502 -1.641 18478 4836 1 11 . 1 1 75 75 PRO CB C 75 32.407 32.407 32.038 0.370 18478 4837 1 11 . 1 1 76 76 ASN N N 76 121.045 121.045 121.103 -0.058 18478 4838 1 11 . 1 1 76 76 ASN HA H 76 4.445 4.445 4.449 -0.004 18478 4839 1 11 . 1 1 76 76 ASN C C 76 174.145 174.145 175.094 -0.949 18478 4840 1 11 . 1 1 76 76 ASN CA C 76 55.701 55.701 52.515 3.186 18478 4841 1 11 . 1 1 76 76 ASN H H 76 8.474 8.474 8.777 -0.303 18478 4842 1 11 . 1 1 77 77 LYS N N 77 111.466 111.466 121.847 -10.381 18478 4843 1 11 . 1 1 77 77 LYS HA H 77 4.369 4.369 4.116 0.253 18478 4844 1 11 . 1 1 77 77 LYS C C 77 173.881 173.881 176.839 -2.958 18478 4845 1 11 . 1 1 77 77 LYS CA C 77 55.995 55.995 56.582 -0.587 18478 4846 1 11 . 1 1 77 77 LYS CB C 77 32.538 32.538 32.723 -0.185 18478 4847 1 11 . 1 1 77 77 LYS H H 77 8.543 8.543 7.757 0.786 18478 4848 1 11 . 1 1 78 78 ARG N N 78 122.233 122.233 120.216 2.017 18478 4849 1 11 . 1 1 78 78 ARG HA H 78 4.286 4.286 3.993 0.293 18478 4850 1 11 . 1 1 78 78 ARG C C 78 173.652 173.652 174.658 -1.006 18478 4851 1 11 . 1 1 78 78 ARG CA C 78 55.780 55.780 57.260 -1.480 18478 4852 1 11 . 1 1 78 78 ARG CB C 78 29.554 29.554 29.663 -0.109 18478 4853 1 11 . 1 1 78 78 ARG H H 78 8.864 8.864 8.897 -0.033 18478 4854 1 11 . 1 1 79 79 LYS N N 79 128.197 128.197 118.754 9.443 18478 4855 1 11 . 1 1 79 79 LYS HA H 79 4.221 4.221 4.542 -0.321 18478 4856 1 11 . 1 1 79 79 LYS C C 79 174.336 174.336 175.613 -1.277 18478 4857 1 11 . 1 1 79 79 LYS CA C 79 58.986 58.986 55.457 3.529 18478 4858 1 11 . 1 1 79 79 LYS CB C 79 32.072 32.072 33.263 -1.191 18478 4859 1 11 . 1 1 79 79 LYS H H 79 8.927 8.927 8.015 0.912 18478 4860 1 11 . 1 1 80 80 GLY N N 80 114.730 114.730 109.637 5.093 18478 4861 1 11 . 1 1 80 80 GLY C C 80 176.536 176.536 174.942 1.594 18478 4862 1 11 . 1 1 80 80 GLY CA C 80 45.992 45.992 45.895 0.097 18478 4863 1 11 . 1 1 80 80 GLY H H 80 8.943 8.943 8.265 0.678 18478 4864 1 11 . 1 1 81 81 PHE N N 81 123.770 123.770 119.864 3.906 18478 4865 1 11 . 1 1 81 81 PHE HA H 81 3.336 3.336 4.185 -0.849 18478 4866 1 11 . 1 1 81 81 PHE C C 81 174.037 174.037 176.242 -2.205 18478 4867 1 11 . 1 1 81 81 PHE CA C 81 63.094 63.094 59.988 3.106 18478 4868 1 11 . 1 1 81 81 PHE CB C 81 39.823 39.823 38.371 1.452 18478 4869 1 11 . 1 1 81 81 PHE H H 81 8.281 8.281 8.050 0.231 18478 4870 1 11 . 1 1 82 82 ASN N N 82 119.812 119.812 116.501 3.311 18478 4871 1 11 . 1 1 82 82 ASN HA H 82 4.458 4.458 4.338 0.120 18478 4872 1 11 . 1 1 82 82 ASN C C 82 171.290 171.290 176.766 -5.476 18478 4873 1 11 . 1 1 82 82 ASN CA C 82 56.060 56.060 55.998 0.062 18478 4874 1 11 . 1 1 82 82 ASN CB C 82 36.390 36.390 38.590 -2.200 18478 4875 1 11 . 1 1 82 82 ASN H H 82 9.145 9.145 8.327 0.818 18478 4876 1 11 . 1 1 83 83 GLU N N 83 124.411 124.411 119.322 5.089 18478 4877 1 11 . 1 1 83 83 GLU HA H 83 4.186 4.186 4.122 0.064 18478 4878 1 11 . 1 1 83 83 GLU C C 83 172.222 172.222 178.952 -6.730 18478 4879 1 11 . 1 1 83 83 GLU CA C 83 60.922 60.922 59.401 1.521 18478 4880 1 11 . 1 1 83 83 GLU CB C 83 28.132 28.132 29.865 -1.733 18478 4881 1 11 . 1 1 83 83 GLU H H 83 9.560 9.560 7.908 1.652 18478 4882 1 11 . 1 1 84 84 GLY N N 84 111.388 111.388 107.084 4.304 18478 4883 1 11 . 1 1 84 84 GLY C C 84 176.445 176.445 174.350 2.095 18478 4884 1 11 . 1 1 84 84 GLY CA C 84 46.727 46.727 46.689 0.038 18478 4885 1 11 . 1 1 84 84 GLY H H 84 8.364 8.364 7.206 1.158 18478 4886 1 11 . 1 1 85 85 LEU N N 85 121.153 121.153 120.535 0.618 18478 4887 1 11 . 1 1 85 85 LEU HA H 85 4.236 4.236 4.242 -0.006 18478 4888 1 11 . 1 1 85 85 LEU C C 85 172.285 172.285 177.552 -5.267 18478 4889 1 11 . 1 1 85 85 LEU CA C 85 56.795 56.795 57.015 -0.220 18478 4890 1 11 . 1 1 85 85 LEU CB C 85 41.113 41.113 43.273 -2.160 18478 4891 1 11 . 1 1 85 85 LEU H H 85 8.294 8.294 7.319 0.975 18478 4892 1 11 . 1 1 86 86 TRP N N 86 118.898 118.898 118.501 0.397 18478 4893 1 11 . 1 1 86 86 TRP HA H 86 4.161 4.161 4.249 -0.088 18478 4894 1 11 . 1 1 86 86 TRP C C 86 171.741 171.741 176.373 -4.632 18478 4895 1 11 . 1 1 86 86 TRP CA C 86 62.153 62.153 58.531 3.622 18478 4896 1 11 . 1 1 86 86 TRP CB C 86 28.424 28.424 29.407 -0.983 18478 4897 1 11 . 1 1 86 86 TRP H H 86 7.783 7.783 7.618 0.165 18478 4898 1 11 . 1 1 87 87 GLU N N 87 120.718 120.718 119.207 1.511 18478 4899 1 11 . 1 1 87 87 GLU HA H 87 3.416 3.416 4.736 -1.320 18478 4900 1 11 . 1 1 87 87 GLU C C 87 172.957 172.957 174.944 -1.987 18478 4901 1 11 . 1 1 87 87 GLU CA C 87 60.122 60.122 53.327 6.795 18478 4902 1 11 . 1 1 87 87 GLU CB C 87 31.021 31.021 30.373 0.648 18478 4903 1 11 . 1 1 87 87 GLU H H 87 8.779 8.779 7.562 1.217 18478 4904 1 11 . 1 1 88 88 ILE HA H 88 2.478 2.478 4.173 -1.695 18478 4905 1 11 . 1 1 88 88 ILE C C 88 177.873 177.873 177.008 0.865 18478 4906 1 11 . 1 1 88 88 ILE CA C 88 65.248 65.248 62.376 2.872 18478 4907 1 11 . 1 1 88 88 ILE CB C 88 37.327 37.327 38.279 -0.952 18478 4908 1 11 . 1 1 89 89 ASP N N 89 114.411 114.411 118.810 -4.399 18478 4909 1 11 . 1 1 89 89 ASP HA H 89 4.589 4.589 4.525 0.064 18478 4910 1 11 . 1 1 89 89 ASP C C 89 174.207 174.207 177.220 -3.013 18478 4911 1 11 . 1 1 89 89 ASP CA C 89 54.740 54.740 56.339 -1.599 18478 4912 1 11 . 1 1 89 89 ASP CB C 89 42.473 42.473 40.020 2.453 18478 4913 1 11 . 1 1 89 89 ASP H H 89 5.911 5.911 7.752 -1.841 18478 4914 1 11 . 1 1 90 90 ASN N N 90 114.358 114.358 113.151 1.207 18478 4915 1 11 . 1 1 90 90 ASN HA H 90 4.420 4.420 4.441 -0.021 18478 4916 1 11 . 1 1 90 90 ASN C C 90 176.991 176.991 177.412 -0.421 18478 4917 1 11 . 1 1 90 90 ASN CA C 90 54.855 54.855 56.056 -1.201 18478 4918 1 11 . 1 1 90 90 ASN CB C 90 40.582 40.582 37.910 2.672 18478 4919 1 11 . 1 1 90 90 ASN H H 90 7.480 7.480 7.731 -0.251 18478 4920 1 11 . 1 1 91 91 ASN N N 91 119.185 119.185 115.478 3.707 18478 4921 1 11 . 1 1 91 91 ASN HA H 91 5.006 5.006 4.895 0.111 18478 4922 1 11 . 1 1 91 91 ASN CA C 91 51.624 51.624 54.367 -2.743 18478 4923 1 11 . 1 1 91 91 ASN CB C 91 38.752 38.752 39.094 -0.342 18478 4924 1 11 . 1 1 91 91 ASN H H 91 9.238 9.238 7.667 1.571 18478 4925 1 11 . 1 1 92 92 PRO HA H 92 4.296 4.296 4.415 -0.119 18478 4926 1 11 . 1 1 92 92 PRO C C 92 173.690 173.690 175.380 -1.690 18478 4927 1 11 . 1 1 92 92 PRO CA C 92 64.714 64.714 63.341 1.373 18478 4928 1 11 . 1 1 92 92 PRO CB C 92 31.781 31.781 31.123 0.658 18478 4929 1 12 . 1 1 3 3 GLY C C 3 177.088 177.088 172.838 4.250 18478 4930 1 12 . 1 1 3 3 GLY CA C 3 45.330 45.330 44.344 0.986 18478 4931 1 12 . 1 1 4 4 SER N N 4 115.847 115.847 114.091 1.756 18478 4932 1 12 . 1 1 4 4 SER HA H 4 4.480 4.480 4.619 -0.139 18478 4933 1 12 . 1 1 4 4 SER C C 4 177.991 177.991 172.089 5.902 18478 4934 1 12 . 1 1 4 4 SER CA C 4 58.742 58.742 58.966 -0.224 18478 4935 1 12 . 1 1 4 4 SER CB C 4 63.820 63.820 65.093 -1.272 18478 4936 1 12 . 1 1 4 4 SER H H 4 8.207 8.207 7.607 0.600 18478 4937 1 12 . 1 1 5 5 MET N N 5 125.867 125.867 122.068 3.799 18478 4938 1 12 . 1 1 5 5 MET HA H 5 4.580 4.580 4.685 -0.105 18478 4939 1 12 . 1 1 5 5 MET C C 5 174.825 174.825 176.605 -1.780 18478 4940 1 12 . 1 1 5 5 MET CA C 5 54.733 54.733 54.495 0.238 18478 4941 1 12 . 1 1 5 5 MET CB C 5 33.527 33.527 35.743 -2.216 18478 4942 1 12 . 1 1 5 5 MET H H 5 8.148 8.148 8.789 -0.641 18478 4943 1 12 . 1 1 6 6 THR N N 6 115.828 115.828 115.451 0.377 18478 4944 1 12 . 1 1 6 6 THR HA H 6 3.903 3.903 4.451 -0.548 18478 4945 1 12 . 1 1 6 6 THR C C 6 176.930 176.930 172.922 4.008 18478 4946 1 12 . 1 1 6 6 THR CA C 6 63.034 63.034 60.826 2.208 18478 4947 1 12 . 1 1 6 6 THR CB C 6 69.308 69.308 68.276 1.032 18478 4948 1 12 . 1 1 6 6 THR H H 6 8.408 8.408 8.472 -0.064 18478 4949 1 12 . 1 1 7 7 ARG HA H 7 4.276 4.276 4.248 0.028 18478 4950 1 12 . 1 1 7 7 ARG C C 7 176.546 176.546 176.230 0.316 18478 4951 1 12 . 1 1 7 7 ARG CA C 7 55.813 55.813 56.320 -0.507 18478 4952 1 12 . 1 1 7 7 ARG CB C 7 30.556 30.556 30.741 -0.185 18478 4953 1 12 . 1 1 8 8 ASP N N 8 121.762 121.762 124.958 -3.196 18478 4954 1 12 . 1 1 8 8 ASP HA H 8 4.537 4.537 4.178 0.359 18478 4955 1 12 . 1 1 8 8 ASP C C 8 177.750 177.750 175.161 2.589 18478 4956 1 12 . 1 1 8 8 ASP CA C 8 54.117 54.117 54.853 -0.736 18478 4957 1 12 . 1 1 8 8 ASP H H 8 8.066 8.066 8.507 -0.441 18478 4958 1 12 . 1 1 9 9 PHE N N 9 119.991 119.991 119.382 0.609 18478 4959 1 12 . 1 1 9 9 PHE HA H 9 4.734 4.734 5.066 -0.332 18478 4960 1 12 . 1 1 9 9 PHE C C 9 176.838 176.838 175.330 1.508 18478 4961 1 12 . 1 1 9 9 PHE CA C 9 58.303 58.303 57.654 0.649 18478 4962 1 12 . 1 1 9 9 PHE CB C 9 41.594 41.594 41.010 0.584 18478 4963 1 12 . 1 1 9 9 PHE H H 9 8.103 8.103 7.587 0.516 18478 4964 1 12 . 1 1 10 10 LYS N N 10 122.957 122.957 123.766 -0.809 18478 4965 1 12 . 1 1 10 10 LYS CA C 10 53.167 53.167 55.916 -2.749 18478 4966 1 12 . 1 1 10 10 LYS CB C 10 33.495 33.495 32.221 1.274 18478 4967 1 12 . 1 1 10 10 LYS H H 10 9.087 9.087 8.864 0.223 18478 4968 1 12 . 1 1 11 11 PRO HA H 11 3.903 3.903 4.961 -1.058 18478 4969 1 12 . 1 1 11 11 PRO C C 11 173.988 173.988 174.662 -0.674 18478 4970 1 12 . 1 1 11 11 PRO CA C 11 63.874 63.874 61.415 2.459 18478 4971 1 12 . 1 1 11 11 PRO CB C 11 31.623 31.623 35.125 -3.502 18478 4972 1 12 . 1 1 12 12 GLY N N 12 115.413 115.413 111.490 3.923 18478 4973 1 12 . 1 1 12 12 GLY C C 12 176.966 176.966 172.629 4.337 18478 4974 1 12 . 1 1 12 12 GLY CA C 12 44.651 44.651 42.056 2.595 18478 4975 1 12 . 1 1 12 12 GLY H H 12 9.667 9.667 9.010 0.657 18478 4976 1 12 . 1 1 13 13 ASP N N 13 122.208 122.208 128.330 -6.122 18478 4977 1 12 . 1 1 13 13 ASP HA H 13 4.601 4.601 4.747 -0.146 18478 4978 1 12 . 1 1 13 13 ASP C C 13 176.244 176.244 174.291 1.953 18478 4979 1 12 . 1 1 13 13 ASP CA C 13 55.870 55.870 52.155 3.715 18478 4980 1 12 . 1 1 13 13 ASP CB C 13 40.794 40.794 42.962 -2.168 18478 4981 1 12 . 1 1 13 13 ASP H H 13 8.303 8.303 8.420 -0.117 18478 4982 1 12 . 1 1 14 14 LEU N N 14 121.306 121.306 126.607 -5.301 18478 4983 1 12 . 1 1 14 14 LEU HA H 14 4.982 4.982 4.632 0.350 18478 4984 1 12 . 1 1 14 14 LEU C C 14 173.461 173.461 176.145 -2.684 18478 4985 1 12 . 1 1 14 14 LEU CA C 14 54.516 54.516 53.712 0.804 18478 4986 1 12 . 1 1 14 14 LEU CB C 14 40.999 40.999 41.983 -0.984 18478 4987 1 12 . 1 1 14 14 LEU H H 14 8.618 8.618 7.716 0.902 18478 4988 1 12 . 1 1 15 15 ILE N N 15 118.806 118.806 125.485 -6.679 18478 4989 1 12 . 1 1 15 15 ILE HA H 15 5.356 5.356 4.239 1.117 18478 4990 1 12 . 1 1 15 15 ILE C C 15 175.982 175.982 176.454 -0.472 18478 4991 1 12 . 1 1 15 15 ILE CA C 15 60.481 60.481 60.974 -0.493 18478 4992 1 12 . 1 1 15 15 ILE CB C 15 44.142 44.142 39.695 4.447 18478 4993 1 12 . 1 1 15 15 ILE H H 15 8.864 8.864 8.522 0.342 18478 4994 1 12 . 1 1 16 16 PHE N N 16 112.472 112.472 122.825 -10.353 18478 4995 1 12 . 1 1 16 16 PHE HA H 16 5.306 5.306 4.278 1.028 18478 4996 1 12 . 1 1 16 16 PHE C C 16 176.239 176.239 176.098 0.141 18478 4997 1 12 . 1 1 16 16 PHE CA C 16 58.603 58.603 59.036 -0.433 18478 4998 1 12 . 1 1 16 16 PHE CB C 16 43.305 43.305 38.017 5.288 18478 4999 1 12 . 1 1 16 16 PHE H H 16 9.411 9.411 8.685 0.726 18478 5000 1 12 . 1 1 17 17 ALA N N 17 123.889 123.889 126.507 -2.618 18478 5001 1 12 . 1 1 17 17 ALA HA H 17 5.348 5.348 3.799 1.549 18478 5002 1 12 . 1 1 17 17 ALA C C 17 174.426 174.426 176.902 -2.476 18478 5003 1 12 . 1 1 17 17 ALA CA C 17 50.062 50.062 51.655 -1.593 18478 5004 1 12 . 1 1 17 17 ALA H H 17 9.658 9.658 8.392 1.266 18478 5005 1 12 . 1 1 18 18 LYS N N 18 127.760 127.760 121.559 6.201 18478 5006 1 12 . 1 1 18 18 LYS HA H 18 4.697 4.697 4.701 -0.004 18478 5007 1 12 . 1 1 18 18 LYS C C 18 178.554 178.554 174.531 4.023 18478 5008 1 12 . 1 1 18 18 LYS CA C 18 53.893 53.893 52.187 1.706 18478 5009 1 12 . 1 1 18 18 LYS CB C 18 35.291 35.291 32.397 2.894 18478 5010 1 12 . 1 1 18 18 LYS H H 18 9.421 9.421 7.414 2.007 18478 5011 1 12 . 1 1 19 19 MET HA H 19 4.656 4.656 4.593 0.063 18478 5012 1 12 . 1 1 19 19 MET C C 19 175.741 175.741 174.823 0.918 18478 5013 1 12 . 1 1 19 19 MET CA C 19 53.916 53.916 54.707 -0.791 18478 5014 1 12 . 1 1 19 19 MET CB C 19 35.799 35.799 33.622 2.177 18478 5015 1 12 . 1 1 20 20 LYS N N 20 124.062 124.062 117.637 6.425 18478 5016 1 12 . 1 1 20 20 LYS CA C 20 58.585 58.585 55.674 2.911 18478 5017 1 12 . 1 1 20 20 LYS CB C 20 31.978 31.978 33.118 -1.140 18478 5018 1 12 . 1 1 20 20 LYS H H 20 8.645 8.645 7.960 0.685 18478 5019 1 12 . 1 1 21 21 GLY C C 21 176.205 176.205 172.044 4.161 18478 5020 1 12 . 1 1 21 21 GLY CA C 21 45.142 45.142 42.343 2.799 18478 5021 1 12 . 1 1 22 22 TYR HA H 22 4.573 4.573 4.682 -0.109 18478 5022 1 12 . 1 1 22 22 TYR CA C 22 55.748 55.748 57.911 -2.163 18478 5023 1 12 . 1 1 22 22 TYR CB C 22 41.331 41.331 37.947 3.384 18478 5024 1 12 . 1 1 23 23 PRO HA H 23 4.759 4.759 4.905 -0.146 18478 5025 1 12 . 1 1 23 23 PRO C C 23 174.587 174.587 175.231 -0.644 18478 5026 1 12 . 1 1 23 23 PRO CA C 23 62.072 62.072 61.265 0.807 18478 5027 1 12 . 1 1 23 23 PRO CB C 23 31.077 31.077 34.855 -3.778 18478 5028 1 12 . 1 1 24 24 HIS N N 24 119.190 119.190 114.421 4.769 18478 5029 1 12 . 1 1 24 24 HIS HA H 24 3.983 3.983 5.613 -1.630 18478 5030 1 12 . 1 1 24 24 HIS C C 24 175.555 175.555 173.884 1.671 18478 5031 1 12 . 1 1 24 24 HIS CA C 24 60.973 60.973 54.264 6.708 18478 5032 1 12 . 1 1 24 24 HIS CB C 24 30.689 30.689 32.802 -2.113 18478 5033 1 12 . 1 1 24 24 HIS H H 24 8.158 8.158 8.449 -0.291 18478 5034 1 12 . 1 1 25 25 TRP N N 25 127.435 127.435 121.492 5.943 18478 5035 1 12 . 1 1 25 25 TRP HA H 25 3.760 3.760 5.271 -1.511 18478 5036 1 12 . 1 1 25 25 TRP CA C 25 55.890 55.890 56.903 -1.013 18478 5037 1 12 . 1 1 25 25 TRP CB C 25 32.879 32.879 30.117 2.762 18478 5038 1 12 . 1 1 25 25 TRP H H 25 9.211 9.211 8.692 0.519 18478 5039 1 12 . 1 1 26 26 PRO HA H 26 4.217 4.217 4.541 -0.324 18478 5040 1 12 . 1 1 26 26 PRO C C 26 176.279 176.279 176.172 0.107 18478 5041 1 12 . 1 1 26 26 PRO CA C 26 63.140 63.140 62.063 1.077 18478 5042 1 12 . 1 1 26 26 PRO CB C 26 32.171 32.171 34.417 -2.246 18478 5043 1 12 . 1 1 27 27 ALA N N 27 130.162 130.162 123.437 6.725 18478 5044 1 12 . 1 1 27 27 ALA HA H 27 4.981 4.981 4.414 0.567 18478 5045 1 12 . 1 1 27 27 ALA C C 27 177.227 177.227 177.070 0.157 18478 5046 1 12 . 1 1 27 27 ALA CA C 27 52.574 52.574 51.377 1.198 18478 5047 1 12 . 1 1 27 27 ALA CB C 27 23.239 23.239 20.647 2.592 18478 5048 1 12 . 1 1 27 27 ALA H H 27 9.394 9.394 8.183 1.211 18478 5049 1 12 . 1 1 28 28 ARG N N 28 117.381 117.381 122.175 -4.794 18478 5050 1 12 . 1 1 28 28 ARG HA H 28 5.421 5.421 4.294 1.127 18478 5051 1 12 . 1 1 28 28 ARG C C 28 176.465 176.465 175.675 0.790 18478 5052 1 12 . 1 1 28 28 ARG CA C 28 53.662 53.662 56.506 -2.844 18478 5053 1 12 . 1 1 28 28 ARG CB C 28 35.058 35.058 29.676 5.382 18478 5054 1 12 . 1 1 28 28 ARG H H 28 8.806 8.806 8.373 0.433 18478 5055 1 12 . 1 1 29 29 VAL HA H 29 4.109 4.109 4.194 -0.085 18478 5056 1 12 . 1 1 29 29 VAL C C 29 175.996 175.996 174.599 1.397 18478 5057 1 12 . 1 1 29 29 VAL CA C 29 62.810 62.810 61.814 0.996 18478 5058 1 12 . 1 1 29 29 VAL CB C 29 31.108 31.108 32.617 -1.509 18478 5059 1 12 . 1 1 30 30 ASP N N 30 133.830 133.830 118.870 14.960 18478 5060 1 12 . 1 1 30 30 ASP HA H 30 5.198 5.198 4.650 0.548 18478 5061 1 12 . 1 1 30 30 ASP C C 30 176.207 176.207 177.199 -0.992 18478 5062 1 12 . 1 1 30 30 ASP CA C 30 53.007 53.007 53.929 -0.922 18478 5063 1 12 . 1 1 30 30 ASP CB C 30 44.130 44.130 42.588 1.542 18478 5064 1 12 . 1 1 30 30 ASP H H 30 8.892 8.892 8.383 0.509 18478 5065 1 12 . 1 1 31 31 GLU N N 31 115.905 115.905 123.407 -7.502 18478 5066 1 12 . 1 1 31 31 GLU HA H 31 4.409 4.409 3.951 0.458 18478 5067 1 12 . 1 1 31 31 GLU C C 31 175.192 175.192 175.745 -0.553 18478 5068 1 12 . 1 1 31 31 GLU CA C 31 55.389 55.389 56.920 -1.531 18478 5069 1 12 . 1 1 31 31 GLU H H 31 7.966 7.966 8.870 -0.904 18478 5070 1 12 . 1 1 32 32 VAL N N 32 122.794 122.794 117.896 4.898 18478 5071 1 12 . 1 1 32 32 VAL HA H 32 4.303 4.303 3.874 0.429 18478 5072 1 12 . 1 1 32 32 VAL CA C 32 60.408 60.408 62.984 -2.576 18478 5073 1 12 . 1 1 32 32 VAL CB C 32 32.333 32.333 30.437 1.896 18478 5074 1 12 . 1 1 32 32 VAL H H 32 8.702 8.702 8.003 0.699 18478 5075 1 12 . 1 1 33 33 PRO HA H 33 4.572 4.572 4.317 0.255 18478 5076 1 12 . 1 1 33 33 PRO C C 33 175.366 175.366 177.863 -2.497 18478 5077 1 12 . 1 1 33 33 PRO CA C 33 63.702 63.702 64.739 -1.037 18478 5078 1 12 . 1 1 33 33 PRO CB C 33 32.736 32.736 32.155 0.581 18478 5079 1 12 . 1 1 34 34 ASP N N 34 119.187 119.187 119.697 -0.510 18478 5080 1 12 . 1 1 34 34 ASP HA H 34 4.679 4.679 4.914 -0.235 18478 5081 1 12 . 1 1 34 34 ASP C C 34 175.713 175.713 173.754 1.959 18478 5082 1 12 . 1 1 34 34 ASP CA C 34 53.013 53.013 52.539 0.474 18478 5083 1 12 . 1 1 34 34 ASP CB C 34 40.850 40.850 41.387 -0.537 18478 5084 1 12 . 1 1 34 34 ASP H H 34 8.686 8.686 7.919 0.767 18478 5085 1 12 . 1 1 35 35 GLY C C 35 177.458 177.458 173.367 4.091 18478 5086 1 12 . 1 1 35 35 GLY CA C 35 45.507 45.507 43.901 1.606 18478 5087 1 12 . 1 1 36 36 ALA HA H 36 4.404 4.404 4.240 0.164 18478 5088 1 12 . 1 1 36 36 ALA CA C 36 52.010 52.010 51.644 0.366 18478 5089 1 12 . 1 1 36 36 ALA CB C 36 19.909 19.909 19.794 0.115 18478 5090 1 12 . 1 1 37 37 VAL N N 37 119.594 119.594 121.058 -1.464 18478 5091 1 12 . 1 1 37 37 VAL HA H 37 3.932 3.932 4.096 -0.164 18478 5092 1 12 . 1 1 37 37 VAL C C 37 175.966 175.966 175.576 0.390 18478 5093 1 12 . 1 1 37 37 VAL CA C 37 62.810 62.810 64.274 -1.464 18478 5094 1 12 . 1 1 37 37 VAL CB C 37 32.267 32.267 32.488 -0.221 18478 5095 1 12 . 1 1 37 37 VAL H H 37 8.037 8.037 8.536 -0.499 18478 5096 1 12 . 1 1 38 38 LYS N N 38 125.676 125.676 120.422 5.254 18478 5097 1 12 . 1 1 38 38 LYS C C 38 173.865 173.865 174.698 -0.833 18478 5098 1 12 . 1 1 38 38 LYS CA C 38 54.278 54.278 56.895 -2.617 18478 5099 1 12 . 1 1 38 38 LYS CB C 38 31.740 31.740 34.330 -2.590 18478 5100 1 12 . 1 1 38 38 LYS H H 38 8.292 8.292 8.396 -0.104 18478 5101 1 12 . 1 1 40 40 PRO HA H 40 4.387 4.387 5.304 -0.917 18478 5102 1 12 . 1 1 40 40 PRO C C 40 175.535 175.535 175.250 0.285 18478 5103 1 12 . 1 1 40 40 PRO CA C 40 62.330 62.330 59.630 2.700 18478 5104 1 12 . 1 1 40 40 PRO CB C 40 32.086 32.086 31.834 0.252 18478 5105 1 12 . 1 1 41 41 THR HA H 41 4.027 4.027 4.464 -0.437 18478 5106 1 12 . 1 1 41 41 THR C C 41 176.795 176.795 173.211 3.584 18478 5107 1 12 . 1 1 41 41 THR CA C 41 63.693 63.693 62.150 1.544 18478 5108 1 12 . 1 1 41 41 THR CB C 41 69.370 69.370 69.180 0.190 18478 5109 1 12 . 1 1 42 42 ASN N N 42 118.513 118.513 121.597 -3.084 18478 5110 1 12 . 1 1 42 42 ASN HA H 42 4.530 4.530 5.200 -0.670 18478 5111 1 12 . 1 1 42 42 ASN C C 42 177.230 177.230 174.770 2.460 18478 5112 1 12 . 1 1 42 42 ASN CA C 42 56.373 56.373 50.415 5.958 18478 5113 1 12 . 1 1 42 42 ASN CB C 42 37.618 37.618 38.113 -0.495 18478 5114 1 12 . 1 1 42 42 ASN H H 42 8.752 8.752 8.711 0.041 18478 5115 1 12 . 1 1 43 43 LYS N N 43 115.898 115.898 128.780 -12.882 18478 5116 1 12 . 1 1 43 43 LYS HA H 43 4.710 4.710 4.636 0.074 18478 5117 1 12 . 1 1 43 43 LYS C C 43 177.032 177.032 175.606 1.426 18478 5118 1 12 . 1 1 43 43 LYS CA C 43 54.957 54.957 54.974 -0.017 18478 5119 1 12 . 1 1 43 43 LYS CB C 43 36.600 36.600 32.917 3.683 18478 5120 1 12 . 1 1 43 43 LYS H H 43 7.723 7.723 8.704 -0.981 18478 5121 1 12 . 1 1 44 44 LEU N N 44 121.006 121.006 128.861 -7.855 18478 5122 1 12 . 1 1 44 44 LEU HA H 44 5.000 5.000 4.255 0.745 18478 5123 1 12 . 1 1 44 44 LEU CA C 44 51.842 51.842 55.284 -3.442 18478 5124 1 12 . 1 1 44 44 LEU CB C 44 44.418 44.418 42.065 2.353 18478 5125 1 12 . 1 1 44 44 LEU H H 44 9.063 9.063 8.539 0.524 18478 5126 1 12 . 1 1 45 45 PRO HA H 45 4.392 4.392 4.563 -0.171 18478 5127 1 12 . 1 1 45 45 PRO C C 45 177.051 177.051 178.740 -1.689 18478 5128 1 12 . 1 1 45 45 PRO CA C 45 62.000 62.000 65.183 -3.183 18478 5129 1 12 . 1 1 45 45 PRO CB C 45 30.737 30.737 32.555 -1.818 18478 5130 1 12 . 1 1 46 46 ILE N N 46 125.996 125.996 124.392 1.604 18478 5131 1 12 . 1 1 46 46 ILE HA H 46 4.564 4.564 4.011 0.553 18478 5132 1 12 . 1 1 46 46 ILE C C 46 176.985 176.985 176.919 0.066 18478 5133 1 12 . 1 1 46 46 ILE CA C 46 57.051 57.051 62.836 -5.785 18478 5134 1 12 . 1 1 46 46 ILE H H 46 8.908 8.908 9.078 -0.170 18478 5135 1 12 . 1 1 47 47 PHE N N 47 128.276 128.276 118.965 9.311 18478 5136 1 12 . 1 1 47 47 PHE HA H 47 4.827 4.827 4.273 0.554 18478 5137 1 12 . 1 1 47 47 PHE C C 47 177.835 177.835 176.222 1.613 18478 5138 1 12 . 1 1 47 47 PHE CA C 47 56.099 56.099 58.423 -2.324 18478 5139 1 12 . 1 1 47 47 PHE CB C 47 41.217 41.217 39.791 1.426 18478 5140 1 12 . 1 1 47 47 PHE H H 47 8.739 8.739 7.498 1.241 18478 5141 1 12 . 1 1 48 48 PHE N N 48 125.953 125.953 119.920 6.033 18478 5142 1 12 . 1 1 48 48 PHE HA H 48 4.251 4.251 3.895 0.356 18478 5143 1 12 . 1 1 48 48 PHE C C 48 175.869 175.869 173.554 2.315 18478 5144 1 12 . 1 1 48 48 PHE CA C 48 56.744 56.744 59.883 -3.139 18478 5145 1 12 . 1 1 48 48 PHE CB C 48 38.835 38.835 37.420 1.415 18478 5146 1 12 . 1 1 48 48 PHE H H 48 8.545 8.545 8.027 0.518 18478 5147 1 12 . 1 1 49 49 PHE N N 49 122.197 122.197 117.323 4.874 18478 5148 1 12 . 1 1 49 49 PHE HA H 49 4.400 4.400 4.238 0.162 18478 5149 1 12 . 1 1 49 49 PHE C C 49 174.016 174.016 174.393 -0.377 18478 5150 1 12 . 1 1 49 49 PHE CA C 49 59.916 59.916 58.186 1.730 18478 5151 1 12 . 1 1 49 49 PHE CB C 49 39.799 39.799 39.784 0.015 18478 5152 1 12 . 1 1 49 49 PHE H H 49 8.619 8.619 7.402 1.217 18478 5153 1 12 . 1 1 50 50 GLY N N 50 114.083 114.083 108.251 5.832 18478 5154 1 12 . 1 1 50 50 GLY C C 50 175.636 175.636 173.304 2.332 18478 5155 1 12 . 1 1 50 50 GLY CA C 50 46.718 46.718 44.223 2.495 18478 5156 1 12 . 1 1 50 50 GLY H H 50 10.329 10.329 8.072 2.257 18478 5157 1 12 . 1 1 51 51 THR N N 51 111.210 111.210 121.216 -10.006 18478 5158 1 12 . 1 1 51 51 THR HA H 51 3.980 3.980 4.663 -0.683 18478 5159 1 12 . 1 1 51 51 THR C C 51 175.588 175.588 171.841 3.747 18478 5160 1 12 . 1 1 51 51 THR CA C 51 62.223 62.223 60.739 1.484 18478 5161 1 12 . 1 1 51 51 THR CB C 51 68.346 68.346 72.370 -4.024 18478 5162 1 12 . 1 1 51 51 THR H H 51 7.882 7.882 8.639 -0.757 18478 5163 1 12 . 1 1 52 52 HIS N N 52 115.544 115.544 119.609 -4.065 18478 5164 1 12 . 1 1 52 52 HIS HA H 52 3.712 3.712 5.431 -1.719 18478 5165 1 12 . 1 1 52 52 HIS C C 52 177.717 177.717 175.190 2.527 18478 5166 1 12 . 1 1 52 52 HIS CA C 52 54.860 54.860 54.416 0.445 18478 5167 1 12 . 1 1 52 52 HIS CB C 52 26.388 26.388 30.403 -4.015 18478 5168 1 12 . 1 1 52 52 HIS H H 52 7.791 7.791 8.504 -0.713 18478 5169 1 12 . 1 1 53 53 GLU N N 53 117.517 117.517 123.065 -5.548 18478 5170 1 12 . 1 1 53 53 GLU HA H 53 4.298 4.298 4.763 -0.465 18478 5171 1 12 . 1 1 53 53 GLU C C 53 176.958 176.958 176.410 0.548 18478 5172 1 12 . 1 1 53 53 GLU CA C 53 55.403 55.403 55.196 0.207 18478 5173 1 12 . 1 1 53 53 GLU CB C 53 31.588 31.588 33.395 -1.808 18478 5174 1 12 . 1 1 53 53 GLU H H 53 6.795 6.795 8.406 -1.611 18478 5175 1 12 . 1 1 54 54 THR N N 54 111.182 111.182 116.524 -5.342 18478 5176 1 12 . 1 1 54 54 THR HA H 54 5.648 5.648 4.386 1.262 18478 5177 1 12 . 1 1 54 54 THR C C 54 177.234 177.234 174.237 2.997 18478 5178 1 12 . 1 1 54 54 THR CA C 54 59.894 59.894 61.376 -1.482 18478 5179 1 12 . 1 1 54 54 THR H H 54 8.139 8.139 8.805 -0.666 18478 5180 1 12 . 1 1 55 55 ALA HA H 55 4.403 4.403 4.206 0.197 18478 5181 1 12 . 1 1 55 55 ALA C C 55 176.601 176.601 178.232 -1.631 18478 5182 1 12 . 1 1 55 55 ALA CA C 55 51.079 51.079 53.255 -2.176 18478 5183 1 12 . 1 1 55 55 ALA CB C 55 23.285 23.285 19.184 4.101 18478 5184 1 12 . 1 1 56 56 PHE N N 56 118.058 118.058 115.411 2.647 18478 5185 1 12 . 1 1 56 56 PHE HA H 56 5.678 5.678 4.616 1.062 18478 5186 1 12 . 1 1 56 56 PHE C C 56 175.962 175.962 175.166 0.796 18478 5187 1 12 . 1 1 56 56 PHE CA C 56 56.008 56.008 59.066 -3.058 18478 5188 1 12 . 1 1 56 56 PHE CB C 56 39.995 39.995 37.880 2.115 18478 5189 1 12 . 1 1 56 56 PHE H H 56 8.523 8.523 8.207 0.316 18478 5190 1 12 . 1 1 57 57 LEU N N 57 123.344 123.344 120.022 3.322 18478 5191 1 12 . 1 1 57 57 LEU HA H 57 4.929 4.929 4.689 0.240 18478 5192 1 12 . 1 1 57 57 LEU C C 57 175.584 175.584 175.032 0.552 18478 5193 1 12 . 1 1 57 57 LEU CA C 57 53.463 53.463 55.122 -1.659 18478 5194 1 12 . 1 1 57 57 LEU CB C 57 46.545 46.545 44.210 2.335 18478 5195 1 12 . 1 1 57 57 LEU H H 57 8.579 8.579 7.588 0.991 18478 5196 1 12 . 1 1 58 58 GLY N N 58 108.499 108.499 107.449 1.050 18478 5197 1 12 . 1 1 58 58 GLY CA C 58 43.755 43.755 44.344 -0.589 18478 5198 1 12 . 1 1 58 58 GLY H H 58 9.318 9.318 7.352 1.966 18478 5199 1 12 . 1 1 59 59 PRO HA H 59 4.048 4.048 4.921 -0.873 18478 5200 1 12 . 1 1 59 59 PRO C C 59 173.763 173.763 174.669 -0.906 18478 5201 1 12 . 1 1 59 59 PRO CA C 59 64.770 64.770 60.461 4.309 18478 5202 1 12 . 1 1 59 59 PRO CB C 59 31.889 31.889 35.794 -3.905 18478 5203 1 12 . 1 1 60 60 LYS HA H 60 4.191 4.191 4.562 -0.371 18478 5204 1 12 . 1 1 60 60 LYS C C 60 174.842 174.842 176.597 -1.755 18478 5205 1 12 . 1 1 60 60 LYS CA C 60 57.875 57.875 56.081 1.794 18478 5206 1 12 . 1 1 60 60 LYS CB C 60 31.576 31.576 32.711 -1.135 18478 5207 1 12 . 1 1 61 61 ASP N N 61 117.768 117.768 124.971 -7.203 18478 5208 1 12 . 1 1 61 61 ASP HA H 61 4.973 4.973 4.333 0.640 18478 5209 1 12 . 1 1 61 61 ASP C C 61 178.178 178.178 176.811 1.367 18478 5210 1 12 . 1 1 61 61 ASP CA C 61 54.687 54.687 55.529 -0.842 18478 5211 1 12 . 1 1 61 61 ASP CB C 61 43.555 43.555 39.498 4.057 18478 5212 1 12 . 1 1 61 61 ASP H H 61 7.722 7.722 8.879 -1.157 18478 5213 1 12 . 1 1 62 62 ILE N N 62 114.244 114.244 120.331 -6.087 18478 5214 1 12 . 1 1 62 62 ILE HA H 62 4.891 4.891 3.394 1.497 18478 5215 1 12 . 1 1 62 62 ILE C C 62 178.027 178.027 177.208 0.819 18478 5216 1 12 . 1 1 62 62 ILE CA C 62 59.994 59.994 63.673 -3.679 18478 5217 1 12 . 1 1 62 62 ILE CB C 62 40.652 40.652 37.129 3.523 18478 5218 1 12 . 1 1 62 62 ILE H H 62 6.784 6.784 7.654 -0.870 18478 5219 1 12 . 1 1 63 63 PHE N N 63 119.819 119.819 119.535 0.284 18478 5220 1 12 . 1 1 63 63 PHE HA H 63 5.214 5.214 4.255 0.959 18478 5221 1 12 . 1 1 63 63 PHE CA C 63 54.735 54.735 59.936 -5.201 18478 5222 1 12 . 1 1 63 63 PHE CB C 63 42.122 42.122 38.912 3.210 18478 5223 1 12 . 1 1 63 63 PHE H H 63 8.734 8.734 7.590 1.144 18478 5224 1 12 . 1 1 64 64 PRO HA H 64 4.771 4.771 4.358 0.413 18478 5225 1 12 . 1 1 64 64 PRO C C 64 174.036 174.036 178.684 -4.648 18478 5226 1 12 . 1 1 64 64 PRO CA C 64 64.474 64.474 64.059 0.414 18478 5227 1 12 . 1 1 64 64 PRO CB C 64 32.662 32.662 32.670 -0.008 18478 5228 1 12 . 1 1 65 65 TYR N N 65 124.335 124.335 121.916 2.419 18478 5229 1 12 . 1 1 65 65 TYR HA H 65 4.530 4.530 4.310 0.220 18478 5230 1 12 . 1 1 65 65 TYR C C 65 173.944 173.944 177.524 -3.580 18478 5231 1 12 . 1 1 65 65 TYR CA C 65 61.205 61.205 60.832 0.373 18478 5232 1 12 . 1 1 65 65 TYR CB C 65 38.844 38.844 38.077 0.767 18478 5233 1 12 . 1 1 65 65 TYR H H 65 8.359 8.359 7.841 0.518 18478 5234 1 12 . 1 1 66 66 SER N N 66 114.836 114.836 112.280 2.556 18478 5235 1 12 . 1 1 66 66 SER HA H 66 3.505 3.505 4.351 -0.846 18478 5236 1 12 . 1 1 66 66 SER C C 66 173.697 173.697 175.390 -1.693 18478 5237 1 12 . 1 1 66 66 SER CA C 66 63.078 63.078 59.616 3.462 18478 5238 1 12 . 1 1 66 66 SER CB C 66 62.223 62.223 63.012 -0.789 18478 5239 1 12 . 1 1 66 66 SER H H 66 8.974 8.974 7.668 1.306 18478 5240 1 12 . 1 1 67 67 GLU N N 67 118.013 118.013 118.658 -0.645 18478 5241 1 12 . 1 1 67 67 GLU HA H 67 4.210 4.210 4.161 0.049 18478 5242 1 12 . 1 1 67 67 GLU C C 67 174.961 174.961 177.499 -2.538 18478 5243 1 12 . 1 1 67 67 GLU CA C 67 58.330 58.330 57.956 0.374 18478 5244 1 12 . 1 1 67 67 GLU CB C 67 30.205 30.205 31.009 -0.804 18478 5245 1 12 . 1 1 67 67 GLU H H 67 8.817 8.817 7.866 0.951 18478 5246 1 12 . 1 1 68 68 ASN N N 68 113.942 113.942 112.182 1.760 18478 5247 1 12 . 1 1 68 68 ASN HA H 68 5.015 5.015 5.015 0.000 18478 5248 1 12 . 1 1 68 68 ASN C C 68 176.626 176.626 176.529 0.097 18478 5249 1 12 . 1 1 68 68 ASN CA C 68 53.768 53.768 51.811 1.957 18478 5250 1 12 . 1 1 68 68 ASN CB C 68 41.948 41.948 39.582 2.366 18478 5251 1 12 . 1 1 68 68 ASN H H 68 7.448 7.448 7.728 -0.280 18478 5252 1 12 . 1 1 69 69 LYS N N 69 124.584 124.584 121.064 3.520 18478 5253 1 12 . 1 1 69 69 LYS HA H 69 3.794 3.794 3.895 -0.101 18478 5254 1 12 . 1 1 69 69 LYS C C 69 173.330 173.330 174.849 -1.519 18478 5255 1 12 . 1 1 69 69 LYS CA C 69 61.225 61.225 57.480 3.745 18478 5256 1 12 . 1 1 69 69 LYS H H 69 7.592 7.592 8.684 -1.092 18478 5257 1 12 . 1 1 70 70 GLU N N 70 118.408 118.408 117.434 0.974 18478 5258 1 12 . 1 1 70 70 GLU HA H 70 4.005 4.005 4.828 -0.823 18478 5259 1 12 . 1 1 70 70 GLU C C 70 174.588 174.588 173.740 0.848 18478 5260 1 12 . 1 1 70 70 GLU CA C 70 58.695 58.695 52.879 5.816 18478 5261 1 12 . 1 1 70 70 GLU CB C 70 28.928 28.928 30.510 -1.582 18478 5262 1 12 . 1 1 70 70 GLU H H 70 8.478 8.478 7.851 0.627 18478 5263 1 12 . 1 1 71 71 LYS HA H 71 3.847 3.847 4.370 -0.523 18478 5264 1 12 . 1 1 71 71 LYS C C 71 173.420 173.420 175.438 -2.018 18478 5265 1 12 . 1 1 71 71 LYS CA C 71 58.718 58.718 55.626 3.092 18478 5266 1 12 . 1 1 71 71 LYS CB C 71 32.964 32.964 33.832 -0.868 18478 5267 1 12 . 1 1 72 72 TYR N N 72 112.358 112.358 122.882 -10.524 18478 5268 1 12 . 1 1 72 72 TYR HA H 72 4.790 4.790 4.349 0.441 18478 5269 1 12 . 1 1 72 72 TYR C C 72 174.442 174.442 176.301 -1.859 18478 5270 1 12 . 1 1 72 72 TYR CA C 72 55.287 55.287 59.257 -3.970 18478 5271 1 12 . 1 1 72 72 TYR CB C 72 37.244 37.244 38.741 -1.497 18478 5272 1 12 . 1 1 72 72 TYR H H 72 7.341 7.341 8.350 -1.009 18478 5273 1 12 . 1 1 73 73 GLY N N 73 110.612 110.612 107.600 3.012 18478 5274 1 12 . 1 1 73 73 GLY C C 73 177.982 177.982 173.084 4.898 18478 5275 1 12 . 1 1 73 73 GLY CA C 73 46.623 46.623 44.639 1.984 18478 5276 1 12 . 1 1 73 73 GLY H H 73 8.076 8.076 8.090 -0.014 18478 5277 1 12 . 1 1 74 74 LYS N N 74 121.009 121.009 120.121 0.888 18478 5278 1 12 . 1 1 74 74 LYS CA C 74 53.465 53.465 54.000 -0.535 18478 5279 1 12 . 1 1 74 74 LYS CB C 74 32.440 32.440 33.293 -0.853 18478 5280 1 12 . 1 1 74 74 LYS H H 74 7.411 7.411 7.915 -0.504 18478 5281 1 12 . 1 1 75 75 PRO HA H 75 4.452 4.452 4.379 0.073 18478 5282 1 12 . 1 1 75 75 PRO C C 75 174.959 174.959 178.003 -3.044 18478 5283 1 12 . 1 1 75 75 PRO CA C 75 62.861 62.861 64.452 -1.591 18478 5284 1 12 . 1 1 75 75 PRO CB C 75 32.407 32.407 32.115 0.292 18478 5285 1 12 . 1 1 76 76 ASN N N 76 121.045 121.045 122.023 -0.978 18478 5286 1 12 . 1 1 76 76 ASN HA H 76 4.445 4.445 4.503 -0.058 18478 5287 1 12 . 1 1 76 76 ASN C C 76 174.145 174.145 174.687 -0.542 18478 5288 1 12 . 1 1 76 76 ASN CA C 76 55.701 55.701 52.966 2.735 18478 5289 1 12 . 1 1 76 76 ASN H H 76 8.474 8.474 8.971 -0.497 18478 5290 1 12 . 1 1 77 77 LYS N N 77 111.466 111.466 120.797 -9.331 18478 5291 1 12 . 1 1 77 77 LYS HA H 77 4.369 4.369 4.186 0.183 18478 5292 1 12 . 1 1 77 77 LYS C C 77 173.881 173.881 176.199 -2.318 18478 5293 1 12 . 1 1 77 77 LYS CA C 77 55.995 55.995 56.429 -0.434 18478 5294 1 12 . 1 1 77 77 LYS CB C 77 32.538 32.538 32.298 0.240 18478 5295 1 12 . 1 1 77 77 LYS H H 77 8.543 8.543 7.957 0.586 18478 5296 1 12 . 1 1 78 78 ARG N N 78 122.233 122.233 121.008 1.225 18478 5297 1 12 . 1 1 78 78 ARG HA H 78 4.286 4.286 4.006 0.280 18478 5298 1 12 . 1 1 78 78 ARG C C 78 173.652 173.652 174.887 -1.235 18478 5299 1 12 . 1 1 78 78 ARG CA C 78 55.780 55.780 57.544 -1.764 18478 5300 1 12 . 1 1 78 78 ARG CB C 78 29.554 29.554 29.302 0.252 18478 5301 1 12 . 1 1 78 78 ARG H H 78 8.864 8.864 8.657 0.207 18478 5302 1 12 . 1 1 79 79 LYS N N 79 128.197 128.197 119.519 8.678 18478 5303 1 12 . 1 1 79 79 LYS HA H 79 4.221 4.221 4.468 -0.247 18478 5304 1 12 . 1 1 79 79 LYS C C 79 174.336 174.336 175.427 -1.091 18478 5305 1 12 . 1 1 79 79 LYS CA C 79 58.986 58.986 55.963 3.023 18478 5306 1 12 . 1 1 79 79 LYS CB C 79 32.072 32.072 33.222 -1.150 18478 5307 1 12 . 1 1 79 79 LYS H H 79 8.927 8.927 7.832 1.095 18478 5308 1 12 . 1 1 80 80 GLY N N 80 114.730 114.730 110.580 4.150 18478 5309 1 12 . 1 1 80 80 GLY C C 80 176.536 176.536 174.478 2.058 18478 5310 1 12 . 1 1 80 80 GLY CA C 80 45.992 45.992 45.262 0.730 18478 5311 1 12 . 1 1 80 80 GLY H H 80 8.943 8.943 8.411 0.532 18478 5312 1 12 . 1 1 81 81 PHE N N 81 123.770 123.770 118.410 5.360 18478 5313 1 12 . 1 1 81 81 PHE HA H 81 3.336 3.336 4.393 -1.057 18478 5314 1 12 . 1 1 81 81 PHE C C 81 174.037 174.037 176.396 -2.359 18478 5315 1 12 . 1 1 81 81 PHE CA C 81 63.094 63.094 59.331 3.763 18478 5316 1 12 . 1 1 81 81 PHE CB C 81 39.823 39.823 38.836 0.987 18478 5317 1 12 . 1 1 81 81 PHE H H 81 8.281 8.281 7.889 0.392 18478 5318 1 12 . 1 1 82 82 ASN N N 82 119.812 119.812 117.944 1.868 18478 5319 1 12 . 1 1 82 82 ASN HA H 82 4.458 4.458 4.429 0.029 18478 5320 1 12 . 1 1 82 82 ASN C C 82 171.290 171.290 176.880 -5.590 18478 5321 1 12 . 1 1 82 82 ASN CA C 82 56.060 56.060 56.290 -0.230 18478 5322 1 12 . 1 1 82 82 ASN CB C 82 36.390 36.390 38.444 -2.054 18478 5323 1 12 . 1 1 82 82 ASN H H 82 9.145 9.145 8.394 0.751 18478 5324 1 12 . 1 1 83 83 GLU N N 83 124.411 124.411 118.345 6.066 18478 5325 1 12 . 1 1 83 83 GLU HA H 83 4.186 4.186 4.100 0.086 18478 5326 1 12 . 1 1 83 83 GLU C C 83 172.222 172.222 178.600 -6.378 18478 5327 1 12 . 1 1 83 83 GLU CA C 83 60.922 60.922 59.468 1.454 18478 5328 1 12 . 1 1 83 83 GLU CB C 83 28.132 28.132 29.331 -1.199 18478 5329 1 12 . 1 1 83 83 GLU H H 83 9.560 9.560 8.470 1.090 18478 5330 1 12 . 1 1 84 84 GLY N N 84 111.388 111.388 106.666 4.722 18478 5331 1 12 . 1 1 84 84 GLY C C 84 176.445 176.445 174.076 2.369 18478 5332 1 12 . 1 1 84 84 GLY CA C 84 46.727 46.727 46.580 0.147 18478 5333 1 12 . 1 1 84 84 GLY H H 84 8.364 8.364 7.328 1.036 18478 5334 1 12 . 1 1 85 85 LEU N N 85 121.153 121.153 120.145 1.008 18478 5335 1 12 . 1 1 85 85 LEU HA H 85 4.236 4.236 4.235 0.001 18478 5336 1 12 . 1 1 85 85 LEU C C 85 172.285 172.285 178.187 -5.902 18478 5337 1 12 . 1 1 85 85 LEU CA C 85 56.795 56.795 56.630 0.165 18478 5338 1 12 . 1 1 85 85 LEU CB C 85 41.113 41.113 42.703 -1.590 18478 5339 1 12 . 1 1 85 85 LEU H H 85 8.294 8.294 7.259 1.035 18478 5340 1 12 . 1 1 86 86 TRP N N 86 118.898 118.898 119.207 -0.309 18478 5341 1 12 . 1 1 86 86 TRP HA H 86 4.161 4.161 4.266 -0.105 18478 5342 1 12 . 1 1 86 86 TRP C C 86 171.741 171.741 176.321 -4.580 18478 5343 1 12 . 1 1 86 86 TRP CA C 86 62.153 62.153 58.458 3.695 18478 5344 1 12 . 1 1 86 86 TRP CB C 86 28.424 28.424 29.607 -1.183 18478 5345 1 12 . 1 1 86 86 TRP H H 86 7.783 7.783 7.662 0.121 18478 5346 1 12 . 1 1 87 87 GLU N N 87 120.718 120.718 119.295 1.423 18478 5347 1 12 . 1 1 87 87 GLU HA H 87 3.416 3.416 4.719 -1.303 18478 5348 1 12 . 1 1 87 87 GLU C C 87 172.957 172.957 175.016 -2.059 18478 5349 1 12 . 1 1 87 87 GLU CA C 87 60.122 60.122 53.256 6.866 18478 5350 1 12 . 1 1 87 87 GLU CB C 87 31.021 31.021 30.348 0.673 18478 5351 1 12 . 1 1 87 87 GLU H H 87 8.779 8.779 7.534 1.245 18478 5352 1 12 . 1 1 88 88 ILE HA H 88 2.478 2.478 4.287 -1.809 18478 5353 1 12 . 1 1 88 88 ILE C C 88 177.873 177.873 177.366 0.507 18478 5354 1 12 . 1 1 88 88 ILE CA C 88 65.248 65.248 62.382 2.866 18478 5355 1 12 . 1 1 88 88 ILE CB C 88 37.327 37.327 38.522 -1.195 18478 5356 1 12 . 1 1 89 89 ASP N N 89 114.411 114.411 119.742 -5.331 18478 5357 1 12 . 1 1 89 89 ASP HA H 89 4.589 4.589 4.531 0.058 18478 5358 1 12 . 1 1 89 89 ASP C C 89 174.207 174.207 177.819 -3.612 18478 5359 1 12 . 1 1 89 89 ASP CA C 89 54.740 54.740 56.287 -1.547 18478 5360 1 12 . 1 1 89 89 ASP CB C 89 42.473 42.473 40.099 2.374 18478 5361 1 12 . 1 1 89 89 ASP H H 89 5.911 5.911 7.971 -2.060 18478 5362 1 12 . 1 1 90 90 ASN N N 90 114.358 114.358 113.965 0.393 18478 5363 1 12 . 1 1 90 90 ASN HA H 90 4.420 4.420 4.428 -0.008 18478 5364 1 12 . 1 1 90 90 ASN C C 90 176.991 176.991 177.091 -0.100 18478 5365 1 12 . 1 1 90 90 ASN CA C 90 54.855 54.855 56.931 -2.076 18478 5366 1 12 . 1 1 90 90 ASN CB C 90 40.582 40.582 38.004 2.578 18478 5367 1 12 . 1 1 90 90 ASN H H 90 7.480 7.480 7.861 -0.381 18478 5368 1 12 . 1 1 91 91 ASN N N 91 119.185 119.185 115.713 3.472 18478 5369 1 12 . 1 1 91 91 ASN HA H 91 5.006 5.006 5.026 -0.020 18478 5370 1 12 . 1 1 91 91 ASN CA C 91 51.624 51.624 54.376 -2.752 18478 5371 1 12 . 1 1 91 91 ASN CB C 91 38.752 38.752 38.729 0.023 18478 5372 1 12 . 1 1 91 91 ASN H H 91 9.238 9.238 7.876 1.362 18478 5373 1 12 . 1 1 92 92 PRO HA H 92 4.296 4.296 4.319 -0.023 18478 5374 1 12 . 1 1 92 92 PRO C C 92 173.690 173.690 175.742 -2.052 18478 5375 1 12 . 1 1 92 92 PRO CA C 92 64.714 64.714 64.154 0.560 18478 5376 1 12 . 1 1 92 92 PRO CB C 92 31.781 31.781 30.273 1.508 18478 5377 1 13 . 1 1 3 3 GLY C C 3 177.088 177.088 172.419 4.669 18478 5378 1 13 . 1 1 3 3 GLY CA C 3 45.330 45.330 45.829 -0.499 18478 5379 1 13 . 1 1 4 4 SER N N 4 115.847 115.847 111.093 4.754 18478 5380 1 13 . 1 1 4 4 SER HA H 4 4.480 4.480 4.640 -0.160 18478 5381 1 13 . 1 1 4 4 SER C C 4 177.991 177.991 172.388 5.603 18478 5382 1 13 . 1 1 4 4 SER CA C 4 58.742 58.742 58.025 0.717 18478 5383 1 13 . 1 1 4 4 SER CB C 4 63.820 63.820 64.492 -0.672 18478 5384 1 13 . 1 1 4 4 SER H H 4 8.207 8.207 7.689 0.518 18478 5385 1 13 . 1 1 5 5 MET N N 5 125.867 125.867 121.405 4.462 18478 5386 1 13 . 1 1 5 5 MET HA H 5 4.580 4.580 4.600 -0.020 18478 5387 1 13 . 1 1 5 5 MET C C 5 174.825 174.825 176.288 -1.463 18478 5388 1 13 . 1 1 5 5 MET CA C 5 54.733 54.733 54.784 -0.051 18478 5389 1 13 . 1 1 5 5 MET CB C 5 33.527 33.527 34.067 -0.540 18478 5390 1 13 . 1 1 5 5 MET H H 5 8.148 8.148 8.668 -0.520 18478 5391 1 13 . 1 1 6 6 THR N N 6 115.828 115.828 115.340 0.488 18478 5392 1 13 . 1 1 6 6 THR HA H 6 3.903 3.903 4.500 -0.597 18478 5393 1 13 . 1 1 6 6 THR C C 6 176.930 176.930 172.793 4.137 18478 5394 1 13 . 1 1 6 6 THR CA C 6 63.034 63.034 60.852 2.182 18478 5395 1 13 . 1 1 6 6 THR CB C 6 69.308 69.308 68.607 0.701 18478 5396 1 13 . 1 1 6 6 THR H H 6 8.408 8.408 8.506 -0.098 18478 5397 1 13 . 1 1 7 7 ARG HA H 7 4.276 4.276 4.261 0.015 18478 5398 1 13 . 1 1 7 7 ARG C C 7 176.546 176.546 176.516 0.030 18478 5399 1 13 . 1 1 7 7 ARG CA C 7 55.813 55.813 56.139 -0.326 18478 5400 1 13 . 1 1 7 7 ARG CB C 7 30.556 30.556 30.633 -0.077 18478 5401 1 13 . 1 1 8 8 ASP N N 8 121.762 121.762 124.280 -2.518 18478 5402 1 13 . 1 1 8 8 ASP HA H 8 4.537 4.537 4.192 0.345 18478 5403 1 13 . 1 1 8 8 ASP C C 8 177.750 177.750 174.659 3.091 18478 5404 1 13 . 1 1 8 8 ASP CA C 8 54.117 54.117 54.583 -0.466 18478 5405 1 13 . 1 1 8 8 ASP H H 8 8.066 8.066 8.444 -0.378 18478 5406 1 13 . 1 1 9 9 PHE N N 9 119.991 119.991 119.047 0.944 18478 5407 1 13 . 1 1 9 9 PHE HA H 9 4.734 4.734 5.067 -0.333 18478 5408 1 13 . 1 1 9 9 PHE C C 9 176.838 176.838 174.935 1.903 18478 5409 1 13 . 1 1 9 9 PHE CA C 9 58.303 58.303 57.314 0.989 18478 5410 1 13 . 1 1 9 9 PHE CB C 9 41.594 41.594 40.858 0.737 18478 5411 1 13 . 1 1 9 9 PHE H H 9 8.103 8.103 7.593 0.510 18478 5412 1 13 . 1 1 10 10 LYS N N 10 122.957 122.957 125.810 -2.853 18478 5413 1 13 . 1 1 10 10 LYS CA C 10 53.167 53.167 56.677 -3.510 18478 5414 1 13 . 1 1 10 10 LYS CB C 10 33.495 33.495 32.204 1.291 18478 5415 1 13 . 1 1 10 10 LYS H H 10 9.087 9.087 8.680 0.407 18478 5416 1 13 . 1 1 11 11 PRO HA H 11 3.903 3.903 4.886 -0.983 18478 5417 1 13 . 1 1 11 11 PRO C C 11 173.988 173.988 175.043 -1.055 18478 5418 1 13 . 1 1 11 11 PRO CA C 11 63.874 63.874 60.035 3.839 18478 5419 1 13 . 1 1 11 11 PRO CB C 11 31.623 31.623 34.380 -2.757 18478 5420 1 13 . 1 1 12 12 GLY N N 12 115.413 115.413 110.345 5.068 18478 5421 1 13 . 1 1 12 12 GLY C C 12 176.966 176.966 172.554 4.412 18478 5422 1 13 . 1 1 12 12 GLY CA C 12 44.651 44.651 42.218 2.433 18478 5423 1 13 . 1 1 12 12 GLY H H 12 9.667 9.667 8.829 0.838 18478 5424 1 13 . 1 1 13 13 ASP N N 13 122.208 122.208 128.027 -5.819 18478 5425 1 13 . 1 1 13 13 ASP HA H 13 4.601 4.601 4.704 -0.103 18478 5426 1 13 . 1 1 13 13 ASP C C 13 176.244 176.244 174.605 1.639 18478 5427 1 13 . 1 1 13 13 ASP CA C 13 55.870 55.870 52.015 3.855 18478 5428 1 13 . 1 1 13 13 ASP CB C 13 40.794 40.794 42.931 -2.137 18478 5429 1 13 . 1 1 13 13 ASP H H 13 8.303 8.303 8.379 -0.076 18478 5430 1 13 . 1 1 14 14 LEU N N 14 121.306 121.306 125.818 -4.512 18478 5431 1 13 . 1 1 14 14 LEU HA H 14 4.982 4.982 4.683 0.299 18478 5432 1 13 . 1 1 14 14 LEU C C 14 173.461 173.461 175.854 -2.393 18478 5433 1 13 . 1 1 14 14 LEU CA C 14 54.516 54.516 53.480 1.036 18478 5434 1 13 . 1 1 14 14 LEU CB C 14 40.999 40.999 42.283 -1.284 18478 5435 1 13 . 1 1 14 14 LEU H H 14 8.618 8.618 8.073 0.545 18478 5436 1 13 . 1 1 15 15 ILE N N 15 118.806 118.806 125.316 -6.510 18478 5437 1 13 . 1 1 15 15 ILE HA H 15 5.356 5.356 4.290 1.066 18478 5438 1 13 . 1 1 15 15 ILE C C 15 175.982 175.982 175.792 0.190 18478 5439 1 13 . 1 1 15 15 ILE CA C 15 60.481 60.481 60.370 0.111 18478 5440 1 13 . 1 1 15 15 ILE CB C 15 44.142 44.142 39.656 4.487 18478 5441 1 13 . 1 1 15 15 ILE H H 15 8.864 8.864 8.659 0.205 18478 5442 1 13 . 1 1 16 16 PHE N N 16 112.472 112.472 125.842 -13.370 18478 5443 1 13 . 1 1 16 16 PHE HA H 16 5.306 5.306 4.273 1.033 18478 5444 1 13 . 1 1 16 16 PHE C C 16 176.239 176.239 176.429 -0.190 18478 5445 1 13 . 1 1 16 16 PHE CA C 16 58.603 58.603 59.826 -1.223 18478 5446 1 13 . 1 1 16 16 PHE CB C 16 43.305 43.305 38.443 4.862 18478 5447 1 13 . 1 1 16 16 PHE H H 16 9.411 9.411 8.839 0.572 18478 5448 1 13 . 1 1 17 17 ALA N N 17 123.889 123.889 125.742 -1.853 18478 5449 1 13 . 1 1 17 17 ALA HA H 17 5.348 5.348 3.689 1.659 18478 5450 1 13 . 1 1 17 17 ALA C C 17 174.426 174.426 176.651 -2.225 18478 5451 1 13 . 1 1 17 17 ALA CA C 17 50.062 50.062 51.701 -1.639 18478 5452 1 13 . 1 1 17 17 ALA H H 17 9.658 9.658 8.474 1.184 18478 5453 1 13 . 1 1 18 18 LYS N N 18 127.760 127.760 122.361 5.399 18478 5454 1 13 . 1 1 18 18 LYS HA H 18 4.697 4.697 4.658 0.039 18478 5455 1 13 . 1 1 18 18 LYS C C 18 178.554 178.554 174.836 3.718 18478 5456 1 13 . 1 1 18 18 LYS CA C 18 53.893 53.893 52.426 1.467 18478 5457 1 13 . 1 1 18 18 LYS CB C 18 35.291 35.291 32.372 2.919 18478 5458 1 13 . 1 1 18 18 LYS H H 18 9.421 9.421 7.468 1.953 18478 5459 1 13 . 1 1 19 19 MET HA H 19 4.656 4.656 4.589 0.067 18478 5460 1 13 . 1 1 19 19 MET C C 19 175.741 175.741 174.734 1.007 18478 5461 1 13 . 1 1 19 19 MET CA C 19 53.916 53.916 54.879 -0.963 18478 5462 1 13 . 1 1 19 19 MET CB C 19 35.799 35.799 33.435 2.364 18478 5463 1 13 . 1 1 20 20 LYS N N 20 124.062 124.062 118.594 5.468 18478 5464 1 13 . 1 1 20 20 LYS CA C 20 58.585 58.585 56.164 2.421 18478 5465 1 13 . 1 1 20 20 LYS CB C 20 31.978 31.978 32.415 -0.437 18478 5466 1 13 . 1 1 20 20 LYS H H 20 8.645 8.645 8.185 0.460 18478 5467 1 13 . 1 1 21 21 GLY C C 21 176.205 176.205 172.060 4.145 18478 5468 1 13 . 1 1 21 21 GLY CA C 21 45.142 45.142 42.762 2.380 18478 5469 1 13 . 1 1 22 22 TYR HA H 22 4.573 4.573 4.764 -0.191 18478 5470 1 13 . 1 1 22 22 TYR CA C 22 55.748 55.748 57.793 -2.045 18478 5471 1 13 . 1 1 22 22 TYR CB C 22 41.331 41.331 37.849 3.482 18478 5472 1 13 . 1 1 23 23 PRO HA H 23 4.759 4.759 4.809 -0.050 18478 5473 1 13 . 1 1 23 23 PRO C C 23 174.587 174.587 175.036 -0.449 18478 5474 1 13 . 1 1 23 23 PRO CA C 23 62.072 62.072 61.081 0.991 18478 5475 1 13 . 1 1 23 23 PRO CB C 23 31.077 31.077 35.014 -3.938 18478 5476 1 13 . 1 1 24 24 HIS N N 24 119.190 119.190 114.704 4.486 18478 5477 1 13 . 1 1 24 24 HIS HA H 24 3.983 3.983 5.179 -1.196 18478 5478 1 13 . 1 1 24 24 HIS C C 24 175.555 175.555 173.910 1.645 18478 5479 1 13 . 1 1 24 24 HIS CA C 24 60.973 60.973 54.224 6.749 18478 5480 1 13 . 1 1 24 24 HIS CB C 24 30.689 30.689 32.516 -1.827 18478 5481 1 13 . 1 1 24 24 HIS H H 24 8.158 8.158 8.370 -0.212 18478 5482 1 13 . 1 1 25 25 TRP N N 25 127.435 127.435 122.453 4.982 18478 5483 1 13 . 1 1 25 25 TRP HA H 25 3.760 3.760 5.330 -1.570 18478 5484 1 13 . 1 1 25 25 TRP CA C 25 55.890 55.890 57.175 -1.285 18478 5485 1 13 . 1 1 25 25 TRP CB C 25 32.879 32.879 30.351 2.528 18478 5486 1 13 . 1 1 25 25 TRP H H 25 9.211 9.211 8.437 0.774 18478 5487 1 13 . 1 1 26 26 PRO HA H 26 4.217 4.217 4.588 -0.371 18478 5488 1 13 . 1 1 26 26 PRO C C 26 176.279 176.279 176.068 0.211 18478 5489 1 13 . 1 1 26 26 PRO CA C 26 63.140 63.140 61.920 1.220 18478 5490 1 13 . 1 1 26 26 PRO CB C 26 32.171 32.171 34.297 -2.126 18478 5491 1 13 . 1 1 27 27 ALA N N 27 130.162 130.162 126.322 3.840 18478 5492 1 13 . 1 1 27 27 ALA HA H 27 4.981 4.981 4.312 0.669 18478 5493 1 13 . 1 1 27 27 ALA C C 27 177.227 177.227 177.366 -0.139 18478 5494 1 13 . 1 1 27 27 ALA CA C 27 52.574 52.574 51.782 0.792 18478 5495 1 13 . 1 1 27 27 ALA CB C 27 23.239 23.239 20.146 3.092 18478 5496 1 13 . 1 1 27 27 ALA H H 27 9.394 9.394 8.303 1.091 18478 5497 1 13 . 1 1 28 28 ARG N N 28 117.381 117.381 122.304 -4.923 18478 5498 1 13 . 1 1 28 28 ARG HA H 28 5.421 5.421 4.335 1.086 18478 5499 1 13 . 1 1 28 28 ARG C C 28 176.465 176.465 175.151 1.314 18478 5500 1 13 . 1 1 28 28 ARG CA C 28 53.662 53.662 54.796 -1.134 18478 5501 1 13 . 1 1 28 28 ARG CB C 28 35.058 35.058 31.085 3.973 18478 5502 1 13 . 1 1 28 28 ARG H H 28 8.806 8.806 8.515 0.291 18478 5503 1 13 . 1 1 29 29 VAL HA H 29 4.109 4.109 4.309 -0.200 18478 5504 1 13 . 1 1 29 29 VAL C C 29 175.996 175.996 174.898 1.098 18478 5505 1 13 . 1 1 29 29 VAL CA C 29 62.810 62.810 61.546 1.264 18478 5506 1 13 . 1 1 29 29 VAL CB C 29 31.108 31.108 32.564 -1.456 18478 5507 1 13 . 1 1 30 30 ASP N N 30 133.830 133.830 119.132 14.698 18478 5508 1 13 . 1 1 30 30 ASP HA H 30 5.198 5.198 4.587 0.611 18478 5509 1 13 . 1 1 30 30 ASP C C 30 176.207 176.207 177.536 -1.329 18478 5510 1 13 . 1 1 30 30 ASP CA C 30 53.007 53.007 55.224 -2.217 18478 5511 1 13 . 1 1 30 30 ASP CB C 30 44.130 44.130 41.636 2.494 18478 5512 1 13 . 1 1 30 30 ASP H H 30 8.892 8.892 8.502 0.390 18478 5513 1 13 . 1 1 31 31 GLU N N 31 115.905 115.905 120.427 -4.522 18478 5514 1 13 . 1 1 31 31 GLU HA H 31 4.409 4.409 3.950 0.459 18478 5515 1 13 . 1 1 31 31 GLU C C 31 175.192 175.192 176.111 -0.919 18478 5516 1 13 . 1 1 31 31 GLU CA C 31 55.389 55.389 56.736 -1.347 18478 5517 1 13 . 1 1 31 31 GLU H H 31 7.966 7.966 8.909 -0.943 18478 5518 1 13 . 1 1 32 32 VAL N N 32 122.794 122.794 117.222 5.572 18478 5519 1 13 . 1 1 32 32 VAL HA H 32 4.303 4.303 3.717 0.586 18478 5520 1 13 . 1 1 32 32 VAL CA C 32 60.408 60.408 62.782 -2.373 18478 5521 1 13 . 1 1 32 32 VAL CB C 32 32.333 32.333 30.297 2.036 18478 5522 1 13 . 1 1 32 32 VAL H H 32 8.702 8.702 7.842 0.860 18478 5523 1 13 . 1 1 33 33 PRO HA H 33 4.572 4.572 4.202 0.370 18478 5524 1 13 . 1 1 33 33 PRO C C 33 175.366 175.366 177.234 -1.868 18478 5525 1 13 . 1 1 33 33 PRO CA C 33 63.702 63.702 65.168 -1.466 18478 5526 1 13 . 1 1 33 33 PRO CB C 33 32.736 32.736 31.975 0.761 18478 5527 1 13 . 1 1 34 34 ASP N N 34 119.187 119.187 117.854 1.333 18478 5528 1 13 . 1 1 34 34 ASP HA H 34 4.679 4.679 4.908 -0.229 18478 5529 1 13 . 1 1 34 34 ASP C C 34 175.713 175.713 173.904 1.809 18478 5530 1 13 . 1 1 34 34 ASP CA C 34 53.013 53.013 52.262 0.751 18478 5531 1 13 . 1 1 34 34 ASP CB C 34 40.850 40.850 41.295 -0.445 18478 5532 1 13 . 1 1 34 34 ASP H H 34 8.686 8.686 7.964 0.722 18478 5533 1 13 . 1 1 35 35 GLY C C 35 177.458 177.458 172.895 4.563 18478 5534 1 13 . 1 1 35 35 GLY CA C 35 45.507 45.507 43.698 1.809 18478 5535 1 13 . 1 1 36 36 ALA HA H 36 4.404 4.404 4.391 0.013 18478 5536 1 13 . 1 1 36 36 ALA CA C 36 52.010 52.010 51.969 0.041 18478 5537 1 13 . 1 1 36 36 ALA CB C 36 19.909 19.909 19.481 0.428 18478 5538 1 13 . 1 1 37 37 VAL N N 37 119.594 119.594 121.941 -2.347 18478 5539 1 13 . 1 1 37 37 VAL HA H 37 3.932 3.932 4.095 -0.163 18478 5540 1 13 . 1 1 37 37 VAL C C 37 175.966 175.966 176.135 -0.169 18478 5541 1 13 . 1 1 37 37 VAL CA C 37 62.810 62.810 63.744 -0.934 18478 5542 1 13 . 1 1 37 37 VAL CB C 37 32.267 32.267 32.533 -0.266 18478 5543 1 13 . 1 1 37 37 VAL H H 37 8.037 8.037 8.650 -0.613 18478 5544 1 13 . 1 1 38 38 LYS N N 38 125.676 125.676 120.246 5.430 18478 5545 1 13 . 1 1 38 38 LYS C C 38 173.865 173.865 174.498 -0.633 18478 5546 1 13 . 1 1 38 38 LYS CA C 38 54.278 54.278 56.660 -2.382 18478 5547 1 13 . 1 1 38 38 LYS CB C 38 31.740 31.740 33.834 -2.094 18478 5548 1 13 . 1 1 38 38 LYS H H 38 8.292 8.292 8.502 -0.210 18478 5549 1 13 . 1 1 40 40 PRO HA H 40 4.387 4.387 5.238 -0.851 18478 5550 1 13 . 1 1 40 40 PRO C C 40 175.535 175.535 175.175 0.360 18478 5551 1 13 . 1 1 40 40 PRO CA C 40 62.330 62.330 59.587 2.743 18478 5552 1 13 . 1 1 40 40 PRO CB C 40 32.086 32.086 31.787 0.299 18478 5553 1 13 . 1 1 41 41 THR HA H 41 4.027 4.027 4.620 -0.593 18478 5554 1 13 . 1 1 41 41 THR C C 41 176.795 176.795 173.158 3.637 18478 5555 1 13 . 1 1 41 41 THR CA C 41 63.693 63.693 62.440 1.254 18478 5556 1 13 . 1 1 41 41 THR CB C 41 69.370 69.370 68.787 0.584 18478 5557 1 13 . 1 1 42 42 ASN N N 42 118.513 118.513 122.342 -3.829 18478 5558 1 13 . 1 1 42 42 ASN HA H 42 4.530 4.530 5.309 -0.779 18478 5559 1 13 . 1 1 42 42 ASN C C 42 177.230 177.230 175.036 2.194 18478 5560 1 13 . 1 1 42 42 ASN CA C 42 56.373 56.373 50.379 5.994 18478 5561 1 13 . 1 1 42 42 ASN CB C 42 37.618 37.618 37.959 -0.341 18478 5562 1 13 . 1 1 42 42 ASN H H 42 8.752 8.752 8.654 0.098 18478 5563 1 13 . 1 1 43 43 LYS N N 43 115.898 115.898 129.083 -13.185 18478 5564 1 13 . 1 1 43 43 LYS HA H 43 4.710 4.710 4.788 -0.078 18478 5565 1 13 . 1 1 43 43 LYS C C 43 177.032 177.032 175.922 1.110 18478 5566 1 13 . 1 1 43 43 LYS CA C 43 54.957 54.957 55.074 -0.117 18478 5567 1 13 . 1 1 43 43 LYS CB C 43 36.600 36.600 33.360 3.240 18478 5568 1 13 . 1 1 43 43 LYS H H 43 7.723 7.723 8.641 -0.918 18478 5569 1 13 . 1 1 44 44 LEU N N 44 121.006 121.006 128.922 -7.916 18478 5570 1 13 . 1 1 44 44 LEU HA H 44 5.000 5.000 4.343 0.657 18478 5571 1 13 . 1 1 44 44 LEU CA C 44 51.842 51.842 55.527 -3.685 18478 5572 1 13 . 1 1 44 44 LEU CB C 44 44.418 44.418 42.022 2.396 18478 5573 1 13 . 1 1 44 44 LEU H H 44 9.063 9.063 8.631 0.432 18478 5574 1 13 . 1 1 45 45 PRO HA H 45 4.392 4.392 4.523 -0.131 18478 5575 1 13 . 1 1 45 45 PRO C C 45 177.051 177.051 178.763 -1.712 18478 5576 1 13 . 1 1 45 45 PRO CA C 45 62.000 62.000 64.687 -2.687 18478 5577 1 13 . 1 1 45 45 PRO CB C 45 30.737 30.737 32.800 -2.063 18478 5578 1 13 . 1 1 46 46 ILE N N 46 125.996 125.996 124.761 1.235 18478 5579 1 13 . 1 1 46 46 ILE HA H 46 4.564 4.564 3.911 0.653 18478 5580 1 13 . 1 1 46 46 ILE C C 46 176.985 176.985 176.644 0.341 18478 5581 1 13 . 1 1 46 46 ILE CA C 46 57.051 57.051 62.918 -5.867 18478 5582 1 13 . 1 1 46 46 ILE H H 46 8.908 8.908 8.554 0.354 18478 5583 1 13 . 1 1 47 47 PHE N N 47 128.276 128.276 118.809 9.467 18478 5584 1 13 . 1 1 47 47 PHE HA H 47 4.827 4.827 4.252 0.575 18478 5585 1 13 . 1 1 47 47 PHE C C 47 177.835 177.835 176.238 1.597 18478 5586 1 13 . 1 1 47 47 PHE CA C 47 56.099 56.099 58.531 -2.432 18478 5587 1 13 . 1 1 47 47 PHE CB C 47 41.217 41.217 39.839 1.378 18478 5588 1 13 . 1 1 47 47 PHE H H 47 8.739 8.739 7.477 1.262 18478 5589 1 13 . 1 1 48 48 PHE N N 48 125.953 125.953 119.011 6.942 18478 5590 1 13 . 1 1 48 48 PHE HA H 48 4.251 4.251 4.177 0.074 18478 5591 1 13 . 1 1 48 48 PHE C C 48 175.869 175.869 174.253 1.616 18478 5592 1 13 . 1 1 48 48 PHE CA C 48 56.744 56.744 59.853 -3.109 18478 5593 1 13 . 1 1 48 48 PHE CB C 48 38.835 38.835 37.794 1.040 18478 5594 1 13 . 1 1 48 48 PHE H H 48 8.545 8.545 7.981 0.564 18478 5595 1 13 . 1 1 49 49 PHE N N 49 122.197 122.197 118.283 3.914 18478 5596 1 13 . 1 1 49 49 PHE HA H 49 4.400 4.400 4.473 -0.073 18478 5597 1 13 . 1 1 49 49 PHE C C 49 174.016 174.016 174.618 -0.602 18478 5598 1 13 . 1 1 49 49 PHE CA C 49 59.916 59.916 56.515 3.401 18478 5599 1 13 . 1 1 49 49 PHE CB C 49 39.799 39.799 39.876 -0.077 18478 5600 1 13 . 1 1 49 49 PHE H H 49 8.619 8.619 7.605 1.014 18478 5601 1 13 . 1 1 50 50 GLY N N 50 114.083 114.083 107.640 6.443 18478 5602 1 13 . 1 1 50 50 GLY C C 50 175.636 175.636 173.387 2.249 18478 5603 1 13 . 1 1 50 50 GLY CA C 50 46.718 46.718 43.911 2.807 18478 5604 1 13 . 1 1 50 50 GLY H H 50 10.329 10.329 8.032 2.297 18478 5605 1 13 . 1 1 51 51 THR N N 51 111.210 111.210 119.964 -8.754 18478 5606 1 13 . 1 1 51 51 THR HA H 51 3.980 3.980 4.600 -0.620 18478 5607 1 13 . 1 1 51 51 THR C C 51 175.588 175.588 172.048 3.540 18478 5608 1 13 . 1 1 51 51 THR CA C 51 62.223 62.223 61.515 0.708 18478 5609 1 13 . 1 1 51 51 THR CB C 51 68.346 68.346 72.103 -3.757 18478 5610 1 13 . 1 1 51 51 THR H H 51 7.882 7.882 8.606 -0.724 18478 5611 1 13 . 1 1 52 52 HIS N N 52 115.544 115.544 121.001 -5.457 18478 5612 1 13 . 1 1 52 52 HIS HA H 52 3.712 3.712 5.334 -1.622 18478 5613 1 13 . 1 1 52 52 HIS C C 52 177.717 177.717 174.821 2.896 18478 5614 1 13 . 1 1 52 52 HIS CA C 52 54.860 54.860 54.581 0.279 18478 5615 1 13 . 1 1 52 52 HIS CB C 52 26.388 26.388 30.221 -3.833 18478 5616 1 13 . 1 1 52 52 HIS H H 52 7.791 7.791 8.594 -0.803 18478 5617 1 13 . 1 1 53 53 GLU N N 53 117.517 117.517 122.100 -4.583 18478 5618 1 13 . 1 1 53 53 GLU HA H 53 4.298 4.298 4.814 -0.516 18478 5619 1 13 . 1 1 53 53 GLU C C 53 176.958 176.958 176.621 0.337 18478 5620 1 13 . 1 1 53 53 GLU CA C 53 55.403 55.403 55.279 0.124 18478 5621 1 13 . 1 1 53 53 GLU CB C 53 31.588 31.588 33.177 -1.589 18478 5622 1 13 . 1 1 53 53 GLU H H 53 6.795 6.795 8.569 -1.774 18478 5623 1 13 . 1 1 54 54 THR N N 54 111.182 111.182 117.031 -5.849 18478 5624 1 13 . 1 1 54 54 THR HA H 54 5.648 5.648 4.343 1.305 18478 5625 1 13 . 1 1 54 54 THR C C 54 177.234 177.234 174.284 2.950 18478 5626 1 13 . 1 1 54 54 THR CA C 54 59.894 59.894 61.399 -1.505 18478 5627 1 13 . 1 1 54 54 THR H H 54 8.139 8.139 8.808 -0.669 18478 5628 1 13 . 1 1 55 55 ALA HA H 55 4.403 4.403 4.287 0.116 18478 5629 1 13 . 1 1 55 55 ALA C C 55 176.601 176.601 177.884 -1.283 18478 5630 1 13 . 1 1 55 55 ALA CA C 55 51.079 51.079 53.056 -1.977 18478 5631 1 13 . 1 1 55 55 ALA CB C 55 23.285 23.285 19.044 4.241 18478 5632 1 13 . 1 1 56 56 PHE N N 56 118.058 118.058 113.323 4.735 18478 5633 1 13 . 1 1 56 56 PHE HA H 56 5.678 5.678 4.596 1.082 18478 5634 1 13 . 1 1 56 56 PHE C C 56 175.962 175.962 174.753 1.209 18478 5635 1 13 . 1 1 56 56 PHE CA C 56 56.008 56.008 58.518 -2.510 18478 5636 1 13 . 1 1 56 56 PHE CB C 56 39.995 39.995 37.575 2.420 18478 5637 1 13 . 1 1 56 56 PHE H H 56 8.523 8.523 8.267 0.256 18478 5638 1 13 . 1 1 57 57 LEU N N 57 123.344 123.344 120.537 2.807 18478 5639 1 13 . 1 1 57 57 LEU HA H 57 4.929 4.929 4.686 0.243 18478 5640 1 13 . 1 1 57 57 LEU C C 57 175.584 175.584 175.063 0.521 18478 5641 1 13 . 1 1 57 57 LEU CA C 57 53.463 53.463 55.534 -2.071 18478 5642 1 13 . 1 1 57 57 LEU CB C 57 46.545 46.545 44.729 1.816 18478 5643 1 13 . 1 1 57 57 LEU H H 57 8.579 8.579 7.699 0.880 18478 5644 1 13 . 1 1 58 58 GLY N N 58 108.499 108.499 107.499 1.000 18478 5645 1 13 . 1 1 58 58 GLY CA C 58 43.755 43.755 44.962 -1.207 18478 5646 1 13 . 1 1 58 58 GLY H H 58 9.318 9.318 7.232 2.086 18478 5647 1 13 . 1 1 59 59 PRO HA H 59 4.048 4.048 4.879 -0.831 18478 5648 1 13 . 1 1 59 59 PRO C C 59 173.763 173.763 174.630 -0.867 18478 5649 1 13 . 1 1 59 59 PRO CA C 59 64.770 64.770 60.502 4.268 18478 5650 1 13 . 1 1 59 59 PRO CB C 59 31.889 31.889 35.629 -3.740 18478 5651 1 13 . 1 1 60 60 LYS HA H 60 4.191 4.191 4.528 -0.337 18478 5652 1 13 . 1 1 60 60 LYS C C 60 174.842 174.842 176.539 -1.697 18478 5653 1 13 . 1 1 60 60 LYS CA C 60 57.875 57.875 56.043 1.832 18478 5654 1 13 . 1 1 60 60 LYS CB C 60 31.576 31.576 32.796 -1.220 18478 5655 1 13 . 1 1 61 61 ASP N N 61 117.768 117.768 124.678 -6.910 18478 5656 1 13 . 1 1 61 61 ASP HA H 61 4.973 4.973 4.296 0.677 18478 5657 1 13 . 1 1 61 61 ASP C C 61 178.178 178.178 177.912 0.266 18478 5658 1 13 . 1 1 61 61 ASP CA C 61 54.687 54.687 55.448 -0.761 18478 5659 1 13 . 1 1 61 61 ASP CB C 61 43.555 43.555 39.581 3.974 18478 5660 1 13 . 1 1 61 61 ASP H H 61 7.722 7.722 8.718 -0.996 18478 5661 1 13 . 1 1 62 62 ILE N N 62 114.244 114.244 122.003 -7.759 18478 5662 1 13 . 1 1 62 62 ILE HA H 62 4.891 4.891 3.396 1.495 18478 5663 1 13 . 1 1 62 62 ILE C C 62 178.027 178.027 177.712 0.315 18478 5664 1 13 . 1 1 62 62 ILE CA C 62 59.994 59.994 64.347 -4.354 18478 5665 1 13 . 1 1 62 62 ILE CB C 62 40.652 40.652 37.005 3.647 18478 5666 1 13 . 1 1 62 62 ILE H H 62 6.784 6.784 7.948 -1.164 18478 5667 1 13 . 1 1 63 63 PHE N N 63 119.819 119.819 119.757 0.062 18478 5668 1 13 . 1 1 63 63 PHE HA H 63 5.214 5.214 4.218 0.996 18478 5669 1 13 . 1 1 63 63 PHE CA C 63 54.735 54.735 60.099 -5.364 18478 5670 1 13 . 1 1 63 63 PHE CB C 63 42.122 42.122 38.913 3.208 18478 5671 1 13 . 1 1 63 63 PHE H H 63 8.734 8.734 7.627 1.107 18478 5672 1 13 . 1 1 64 64 PRO HA H 64 4.771 4.771 4.376 0.395 18478 5673 1 13 . 1 1 64 64 PRO C C 64 174.036 174.036 178.377 -4.341 18478 5674 1 13 . 1 1 64 64 PRO CA C 64 64.474 64.474 64.121 0.353 18478 5675 1 13 . 1 1 64 64 PRO CB C 64 32.662 32.662 32.464 0.198 18478 5676 1 13 . 1 1 65 65 TYR N N 65 124.335 124.335 121.482 2.853 18478 5677 1 13 . 1 1 65 65 TYR HA H 65 4.530 4.530 4.327 0.203 18478 5678 1 13 . 1 1 65 65 TYR C C 65 173.944 173.944 177.271 -3.327 18478 5679 1 13 . 1 1 65 65 TYR CA C 65 61.205 61.205 61.085 0.120 18478 5680 1 13 . 1 1 65 65 TYR CB C 65 38.844 38.844 38.087 0.757 18478 5681 1 13 . 1 1 65 65 TYR H H 65 8.359 8.359 7.900 0.459 18478 5682 1 13 . 1 1 66 66 SER N N 66 114.836 114.836 112.054 2.782 18478 5683 1 13 . 1 1 66 66 SER HA H 66 3.505 3.505 4.364 -0.859 18478 5684 1 13 . 1 1 66 66 SER C C 66 173.697 173.697 175.396 -1.699 18478 5685 1 13 . 1 1 66 66 SER CA C 66 63.078 63.078 59.663 3.415 18478 5686 1 13 . 1 1 66 66 SER CB C 66 62.223 62.223 63.022 -0.799 18478 5687 1 13 . 1 1 66 66 SER H H 66 8.974 8.974 7.704 1.270 18478 5688 1 13 . 1 1 67 67 GLU N N 67 118.013 118.013 118.718 -0.705 18478 5689 1 13 . 1 1 67 67 GLU HA H 67 4.210 4.210 4.157 0.053 18478 5690 1 13 . 1 1 67 67 GLU C C 67 174.961 174.961 177.496 -2.535 18478 5691 1 13 . 1 1 67 67 GLU CA C 67 58.330 58.330 57.936 0.394 18478 5692 1 13 . 1 1 67 67 GLU CB C 67 30.205 30.205 30.967 -0.762 18478 5693 1 13 . 1 1 67 67 GLU H H 67 8.817 8.817 7.860 0.957 18478 5694 1 13 . 1 1 68 68 ASN N N 68 113.942 113.942 112.230 1.712 18478 5695 1 13 . 1 1 68 68 ASN HA H 68 5.015 5.015 5.024 -0.009 18478 5696 1 13 . 1 1 68 68 ASN C C 68 176.626 176.626 176.524 0.102 18478 5697 1 13 . 1 1 68 68 ASN CA C 68 53.768 53.768 51.758 2.010 18478 5698 1 13 . 1 1 68 68 ASN CB C 68 41.948 41.948 39.600 2.348 18478 5699 1 13 . 1 1 68 68 ASN H H 68 7.448 7.448 7.716 -0.268 18478 5700 1 13 . 1 1 69 69 LYS N N 69 124.584 124.584 121.158 3.426 18478 5701 1 13 . 1 1 69 69 LYS HA H 69 3.794 3.794 3.959 -0.165 18478 5702 1 13 . 1 1 69 69 LYS C C 69 173.330 173.330 175.291 -1.961 18478 5703 1 13 . 1 1 69 69 LYS CA C 69 61.225 61.225 57.127 4.098 18478 5704 1 13 . 1 1 69 69 LYS H H 69 7.592 7.592 8.509 -0.917 18478 5705 1 13 . 1 1 70 70 GLU N N 70 118.408 118.408 117.679 0.729 18478 5706 1 13 . 1 1 70 70 GLU HA H 70 4.005 4.005 4.762 -0.757 18478 5707 1 13 . 1 1 70 70 GLU C C 70 174.588 174.588 173.378 1.210 18478 5708 1 13 . 1 1 70 70 GLU CA C 70 58.695 58.695 53.098 5.597 18478 5709 1 13 . 1 1 70 70 GLU CB C 70 28.928 28.928 31.120 -2.192 18478 5710 1 13 . 1 1 70 70 GLU H H 70 8.478 8.478 8.221 0.257 18478 5711 1 13 . 1 1 71 71 LYS HA H 71 3.847 3.847 4.417 -0.570 18478 5712 1 13 . 1 1 71 71 LYS C C 71 173.420 173.420 175.537 -2.117 18478 5713 1 13 . 1 1 71 71 LYS CA C 71 58.718 58.718 55.561 3.157 18478 5714 1 13 . 1 1 71 71 LYS CB C 71 32.964 32.964 33.995 -1.031 18478 5715 1 13 . 1 1 72 72 TYR N N 72 112.358 112.358 122.127 -9.769 18478 5716 1 13 . 1 1 72 72 TYR HA H 72 4.790 4.790 4.301 0.489 18478 5717 1 13 . 1 1 72 72 TYR C C 72 174.442 174.442 175.506 -1.064 18478 5718 1 13 . 1 1 72 72 TYR CA C 72 55.287 55.287 59.303 -4.016 18478 5719 1 13 . 1 1 72 72 TYR CB C 72 37.244 37.244 39.068 -1.824 18478 5720 1 13 . 1 1 72 72 TYR H H 72 7.341 7.341 8.417 -1.076 18478 5721 1 13 . 1 1 73 73 GLY N N 73 110.612 110.612 108.581 2.031 18478 5722 1 13 . 1 1 73 73 GLY C C 73 177.982 177.982 173.577 4.405 18478 5723 1 13 . 1 1 73 73 GLY CA C 73 46.623 46.623 44.477 2.146 18478 5724 1 13 . 1 1 73 73 GLY H H 73 8.076 8.076 8.337 -0.261 18478 5725 1 13 . 1 1 74 74 LYS N N 74 121.009 121.009 119.971 1.038 18478 5726 1 13 . 1 1 74 74 LYS CA C 74 53.465 53.465 54.026 -0.561 18478 5727 1 13 . 1 1 74 74 LYS CB C 74 32.440 32.440 33.228 -0.789 18478 5728 1 13 . 1 1 74 74 LYS H H 74 7.411 7.411 7.887 -0.476 18478 5729 1 13 . 1 1 75 75 PRO HA H 75 4.452 4.452 4.346 0.106 18478 5730 1 13 . 1 1 75 75 PRO C C 75 174.959 174.959 178.214 -3.255 18478 5731 1 13 . 1 1 75 75 PRO CA C 75 62.861 62.861 64.417 -1.556 18478 5732 1 13 . 1 1 75 75 PRO CB C 75 32.407 32.407 32.041 0.366 18478 5733 1 13 . 1 1 76 76 ASN N N 76 121.045 121.045 121.445 -0.400 18478 5734 1 13 . 1 1 76 76 ASN HA H 76 4.445 4.445 4.456 -0.011 18478 5735 1 13 . 1 1 76 76 ASN C C 76 174.145 174.145 174.637 -0.492 18478 5736 1 13 . 1 1 76 76 ASN CA C 76 55.701 55.701 52.905 2.796 18478 5737 1 13 . 1 1 76 76 ASN H H 76 8.474 8.474 8.830 -0.356 18478 5738 1 13 . 1 1 77 77 LYS N N 77 111.466 111.466 120.532 -9.066 18478 5739 1 13 . 1 1 77 77 LYS HA H 77 4.369 4.369 4.241 0.128 18478 5740 1 13 . 1 1 77 77 LYS C C 77 173.881 173.881 176.746 -2.865 18478 5741 1 13 . 1 1 77 77 LYS CA C 77 55.995 55.995 56.498 -0.503 18478 5742 1 13 . 1 1 77 77 LYS CB C 77 32.538 32.538 32.381 0.157 18478 5743 1 13 . 1 1 77 77 LYS H H 77 8.543 8.543 7.990 0.553 18478 5744 1 13 . 1 1 78 78 ARG N N 78 122.233 122.233 119.781 2.452 18478 5745 1 13 . 1 1 78 78 ARG HA H 78 4.286 4.286 3.933 0.353 18478 5746 1 13 . 1 1 78 78 ARG C C 78 173.652 173.652 174.439 -0.787 18478 5747 1 13 . 1 1 78 78 ARG CA C 78 55.780 55.780 57.116 -1.336 18478 5748 1 13 . 1 1 78 78 ARG CB C 78 29.554 29.554 29.486 0.068 18478 5749 1 13 . 1 1 78 78 ARG H H 78 8.864 8.864 8.777 0.087 18478 5750 1 13 . 1 1 79 79 LYS N N 79 128.197 128.197 119.724 8.473 18478 5751 1 13 . 1 1 79 79 LYS HA H 79 4.221 4.221 4.472 -0.251 18478 5752 1 13 . 1 1 79 79 LYS C C 79 174.336 174.336 175.721 -1.385 18478 5753 1 13 . 1 1 79 79 LYS CA C 79 58.986 58.986 55.922 3.064 18478 5754 1 13 . 1 1 79 79 LYS CB C 79 32.072 32.072 32.782 -0.710 18478 5755 1 13 . 1 1 79 79 LYS H H 79 8.927 8.927 8.119 0.808 18478 5756 1 13 . 1 1 80 80 GLY N N 80 114.730 114.730 110.237 4.493 18478 5757 1 13 . 1 1 80 80 GLY C C 80 176.536 176.536 175.096 1.440 18478 5758 1 13 . 1 1 80 80 GLY CA C 80 45.992 45.992 45.642 0.349 18478 5759 1 13 . 1 1 80 80 GLY H H 80 8.943 8.943 8.497 0.446 18478 5760 1 13 . 1 1 81 81 PHE N N 81 123.770 123.770 117.491 6.279 18478 5761 1 13 . 1 1 81 81 PHE HA H 81 3.336 3.336 4.559 -1.223 18478 5762 1 13 . 1 1 81 81 PHE C C 81 174.037 174.037 176.217 -2.180 18478 5763 1 13 . 1 1 81 81 PHE CA C 81 63.094 63.094 59.716 3.378 18478 5764 1 13 . 1 1 81 81 PHE CB C 81 39.823 39.823 38.931 0.892 18478 5765 1 13 . 1 1 81 81 PHE H H 81 8.281 8.281 8.052 0.229 18478 5766 1 13 . 1 1 82 82 ASN N N 82 119.812 119.812 116.468 3.344 18478 5767 1 13 . 1 1 82 82 ASN HA H 82 4.458 4.458 4.492 -0.034 18478 5768 1 13 . 1 1 82 82 ASN C C 82 171.290 171.290 176.010 -4.720 18478 5769 1 13 . 1 1 82 82 ASN CA C 82 56.060 56.060 56.288 -0.228 18478 5770 1 13 . 1 1 82 82 ASN CB C 82 36.390 36.390 38.546 -2.156 18478 5771 1 13 . 1 1 82 82 ASN H H 82 9.145 9.145 8.596 0.549 18478 5772 1 13 . 1 1 83 83 GLU N N 83 124.411 124.411 118.353 6.058 18478 5773 1 13 . 1 1 83 83 GLU HA H 83 4.186 4.186 4.085 0.101 18478 5774 1 13 . 1 1 83 83 GLU C C 83 172.222 172.222 178.613 -6.391 18478 5775 1 13 . 1 1 83 83 GLU CA C 83 60.922 60.922 59.391 1.531 18478 5776 1 13 . 1 1 83 83 GLU CB C 83 28.132 28.132 29.579 -1.447 18478 5777 1 13 . 1 1 83 83 GLU H H 83 9.560 9.560 8.036 1.524 18478 5778 1 13 . 1 1 84 84 GLY N N 84 111.388 111.388 107.429 3.959 18478 5779 1 13 . 1 1 84 84 GLY C C 84 176.445 176.445 175.055 1.390 18478 5780 1 13 . 1 1 84 84 GLY CA C 84 46.727 46.727 46.515 0.212 18478 5781 1 13 . 1 1 84 84 GLY H H 84 8.364 8.364 7.539 0.825 18478 5782 1 13 . 1 1 85 85 LEU N N 85 121.153 121.153 120.902 0.251 18478 5783 1 13 . 1 1 85 85 LEU HA H 85 4.236 4.236 4.249 -0.013 18478 5784 1 13 . 1 1 85 85 LEU C C 85 172.285 172.285 177.638 -5.353 18478 5785 1 13 . 1 1 85 85 LEU CA C 85 56.795 56.795 57.086 -0.291 18478 5786 1 13 . 1 1 85 85 LEU CB C 85 41.113 41.113 42.821 -1.708 18478 5787 1 13 . 1 1 85 85 LEU H H 85 8.294 8.294 7.765 0.529 18478 5788 1 13 . 1 1 86 86 TRP N N 86 118.898 118.898 117.985 0.913 18478 5789 1 13 . 1 1 86 86 TRP HA H 86 4.161 4.161 4.356 -0.195 18478 5790 1 13 . 1 1 86 86 TRP C C 86 171.741 171.741 176.437 -4.696 18478 5791 1 13 . 1 1 86 86 TRP CA C 86 62.153 62.153 58.490 3.663 18478 5792 1 13 . 1 1 86 86 TRP CB C 86 28.424 28.424 29.787 -1.363 18478 5793 1 13 . 1 1 86 86 TRP H H 86 7.783 7.783 7.380 0.403 18478 5794 1 13 . 1 1 87 87 GLU N N 87 120.718 120.718 119.395 1.323 18478 5795 1 13 . 1 1 87 87 GLU HA H 87 3.416 3.416 4.712 -1.296 18478 5796 1 13 . 1 1 87 87 GLU C C 87 172.957 172.957 175.026 -2.069 18478 5797 1 13 . 1 1 87 87 GLU CA C 87 60.122 60.122 53.121 7.001 18478 5798 1 13 . 1 1 87 87 GLU CB C 87 31.021 31.021 30.917 0.104 18478 5799 1 13 . 1 1 87 87 GLU H H 87 8.779 8.779 7.528 1.251 18478 5800 1 13 . 1 1 88 88 ILE HA H 88 2.478 2.478 4.297 -1.819 18478 5801 1 13 . 1 1 88 88 ILE C C 88 177.873 177.873 176.948 0.925 18478 5802 1 13 . 1 1 88 88 ILE CA C 88 65.248 65.248 62.058 3.190 18478 5803 1 13 . 1 1 88 88 ILE CB C 88 37.327 37.327 38.342 -1.015 18478 5804 1 13 . 1 1 89 89 ASP N N 89 114.411 114.411 118.614 -4.203 18478 5805 1 13 . 1 1 89 89 ASP HA H 89 4.589 4.589 4.536 0.053 18478 5806 1 13 . 1 1 89 89 ASP C C 89 174.207 174.207 177.582 -3.375 18478 5807 1 13 . 1 1 89 89 ASP CA C 89 54.740 54.740 56.436 -1.696 18478 5808 1 13 . 1 1 89 89 ASP CB C 89 42.473 42.473 39.856 2.617 18478 5809 1 13 . 1 1 89 89 ASP H H 89 5.911 5.911 8.246 -2.335 18478 5810 1 13 . 1 1 90 90 ASN N N 90 114.358 114.358 114.045 0.313 18478 5811 1 13 . 1 1 90 90 ASN HA H 90 4.420 4.420 4.428 -0.008 18478 5812 1 13 . 1 1 90 90 ASN C C 90 176.991 176.991 177.127 -0.136 18478 5813 1 13 . 1 1 90 90 ASN CA C 90 54.855 54.855 56.462 -1.607 18478 5814 1 13 . 1 1 90 90 ASN CB C 90 40.582 40.582 37.793 2.789 18478 5815 1 13 . 1 1 90 90 ASN H H 90 7.480 7.480 7.800 -0.320 18478 5816 1 13 . 1 1 91 91 ASN N N 91 119.185 119.185 114.181 5.004 18478 5817 1 13 . 1 1 91 91 ASN HA H 91 5.006 5.006 5.018 -0.012 18478 5818 1 13 . 1 1 91 91 ASN CA C 91 51.624 51.624 53.609 -1.985 18478 5819 1 13 . 1 1 91 91 ASN CB C 91 38.752 38.752 38.931 -0.179 18478 5820 1 13 . 1 1 91 91 ASN H H 91 9.238 9.238 7.780 1.458 18478 5821 1 13 . 1 1 92 92 PRO HA H 92 4.296 4.296 4.255 0.041 18478 5822 1 13 . 1 1 92 92 PRO C C 92 173.690 173.690 176.963 -3.273 18478 5823 1 13 . 1 1 92 92 PRO CA C 92 64.714 64.714 64.282 0.432 18478 5824 1 13 . 1 1 92 92 PRO CB C 92 31.781 31.781 32.236 -0.455 18478 5825 1 14 . 1 1 3 3 GLY C C 3 177.088 177.088 172.155 4.933 18478 5826 1 14 . 1 1 3 3 GLY CA C 3 45.330 45.330 43.111 2.219 18478 5827 1 14 . 1 1 4 4 SER N N 4 115.847 115.847 114.824 1.023 18478 5828 1 14 . 1 1 4 4 SER HA H 4 4.480 4.480 4.735 -0.255 18478 5829 1 14 . 1 1 4 4 SER C C 4 177.991 177.991 172.068 5.923 18478 5830 1 14 . 1 1 4 4 SER CA C 4 58.742 58.742 58.410 0.332 18478 5831 1 14 . 1 1 4 4 SER CB C 4 63.820 63.820 64.794 -0.974 18478 5832 1 14 . 1 1 4 4 SER H H 4 8.207 8.207 7.823 0.384 18478 5833 1 14 . 1 1 5 5 MET N N 5 125.867 125.867 122.608 3.259 18478 5834 1 14 . 1 1 5 5 MET HA H 5 4.580 4.580 4.636 -0.056 18478 5835 1 14 . 1 1 5 5 MET C C 5 174.825 174.825 175.621 -0.796 18478 5836 1 14 . 1 1 5 5 MET CA C 5 54.733 54.733 54.593 0.140 18478 5837 1 14 . 1 1 5 5 MET CB C 5 33.527 33.527 35.900 -2.373 18478 5838 1 14 . 1 1 5 5 MET H H 5 8.148 8.148 8.768 -0.620 18478 5839 1 14 . 1 1 6 6 THR N N 6 115.828 115.828 115.692 0.136 18478 5840 1 14 . 1 1 6 6 THR HA H 6 3.903 3.903 4.422 -0.519 18478 5841 1 14 . 1 1 6 6 THR C C 6 176.930 176.930 173.136 3.794 18478 5842 1 14 . 1 1 6 6 THR CA C 6 63.034 63.034 61.373 1.661 18478 5843 1 14 . 1 1 6 6 THR CB C 6 69.308 69.308 68.346 0.962 18478 5844 1 14 . 1 1 6 6 THR H H 6 8.408 8.408 8.481 -0.073 18478 5845 1 14 . 1 1 7 7 ARG HA H 7 4.276 4.276 4.252 0.024 18478 5846 1 14 . 1 1 7 7 ARG C C 7 176.546 176.546 176.180 0.366 18478 5847 1 14 . 1 1 7 7 ARG CA C 7 55.813 55.813 56.536 -0.723 18478 5848 1 14 . 1 1 7 7 ARG CB C 7 30.556 30.556 30.526 0.030 18478 5849 1 14 . 1 1 8 8 ASP N N 8 121.762 121.762 125.308 -3.546 18478 5850 1 14 . 1 1 8 8 ASP HA H 8 4.537 4.537 4.213 0.324 18478 5851 1 14 . 1 1 8 8 ASP C C 8 177.750 177.750 175.796 1.954 18478 5852 1 14 . 1 1 8 8 ASP CA C 8 54.117 54.117 54.682 -0.565 18478 5853 1 14 . 1 1 8 8 ASP H H 8 8.066 8.066 8.372 -0.306 18478 5854 1 14 . 1 1 9 9 PHE N N 9 119.991 119.991 120.057 -0.066 18478 5855 1 14 . 1 1 9 9 PHE HA H 9 4.734 4.734 4.647 0.087 18478 5856 1 14 . 1 1 9 9 PHE C C 9 176.838 176.838 175.393 1.445 18478 5857 1 14 . 1 1 9 9 PHE CA C 9 58.303 58.303 58.407 -0.104 18478 5858 1 14 . 1 1 9 9 PHE CB C 9 41.594 41.594 40.403 1.191 18478 5859 1 14 . 1 1 9 9 PHE H H 9 8.103 8.103 7.639 0.464 18478 5860 1 14 . 1 1 10 10 LYS N N 10 122.957 122.957 124.470 -1.513 18478 5861 1 14 . 1 1 10 10 LYS CA C 10 53.167 53.167 55.569 -2.402 18478 5862 1 14 . 1 1 10 10 LYS CB C 10 33.495 33.495 31.667 1.828 18478 5863 1 14 . 1 1 10 10 LYS H H 10 9.087 9.087 8.639 0.448 18478 5864 1 14 . 1 1 11 11 PRO HA H 11 3.903 3.903 5.015 -1.112 18478 5865 1 14 . 1 1 11 11 PRO C C 11 173.988 173.988 174.779 -0.791 18478 5866 1 14 . 1 1 11 11 PRO CA C 11 63.874 63.874 60.922 2.952 18478 5867 1 14 . 1 1 11 11 PRO CB C 11 31.623 31.623 35.224 -3.601 18478 5868 1 14 . 1 1 12 12 GLY N N 12 115.413 115.413 111.519 3.894 18478 5869 1 14 . 1 1 12 12 GLY C C 12 176.966 176.966 172.598 4.368 18478 5870 1 14 . 1 1 12 12 GLY CA C 12 44.651 44.651 42.255 2.396 18478 5871 1 14 . 1 1 12 12 GLY H H 12 9.667 9.667 9.001 0.666 18478 5872 1 14 . 1 1 13 13 ASP N N 13 122.208 122.208 128.665 -6.457 18478 5873 1 14 . 1 1 13 13 ASP HA H 13 4.601 4.601 4.727 -0.126 18478 5874 1 14 . 1 1 13 13 ASP C C 13 176.244 176.244 174.344 1.900 18478 5875 1 14 . 1 1 13 13 ASP CA C 13 55.870 55.870 52.097 3.773 18478 5876 1 14 . 1 1 13 13 ASP CB C 13 40.794 40.794 43.032 -2.238 18478 5877 1 14 . 1 1 13 13 ASP H H 13 8.303 8.303 8.412 -0.109 18478 5878 1 14 . 1 1 14 14 LEU N N 14 121.306 121.306 126.470 -5.164 18478 5879 1 14 . 1 1 14 14 LEU HA H 14 4.982 4.982 4.632 0.350 18478 5880 1 14 . 1 1 14 14 LEU C C 14 173.461 173.461 176.107 -2.646 18478 5881 1 14 . 1 1 14 14 LEU CA C 14 54.516 54.516 53.725 0.791 18478 5882 1 14 . 1 1 14 14 LEU CB C 14 40.999 40.999 41.830 -0.831 18478 5883 1 14 . 1 1 14 14 LEU H H 14 8.618 8.618 7.823 0.795 18478 5884 1 14 . 1 1 15 15 ILE N N 15 118.806 118.806 125.793 -6.987 18478 5885 1 14 . 1 1 15 15 ILE HA H 15 5.356 5.356 4.258 1.098 18478 5886 1 14 . 1 1 15 15 ILE C C 15 175.982 175.982 176.352 -0.370 18478 5887 1 14 . 1 1 15 15 ILE CA C 15 60.481 60.481 60.592 -0.111 18478 5888 1 14 . 1 1 15 15 ILE CB C 15 44.142 44.142 40.002 4.140 18478 5889 1 14 . 1 1 15 15 ILE H H 15 8.864 8.864 8.675 0.189 18478 5890 1 14 . 1 1 16 16 PHE N N 16 112.472 112.472 123.947 -11.475 18478 5891 1 14 . 1 1 16 16 PHE HA H 16 5.306 5.306 4.224 1.082 18478 5892 1 14 . 1 1 16 16 PHE C C 16 176.239 176.239 176.059 0.180 18478 5893 1 14 . 1 1 16 16 PHE CA C 16 58.603 58.603 59.436 -0.833 18478 5894 1 14 . 1 1 16 16 PHE CB C 16 43.305 43.305 38.347 4.958 18478 5895 1 14 . 1 1 16 16 PHE H H 16 9.411 9.411 8.780 0.631 18478 5896 1 14 . 1 1 17 17 ALA N N 17 123.889 123.889 124.791 -0.902 18478 5897 1 14 . 1 1 17 17 ALA HA H 17 5.348 5.348 3.730 1.618 18478 5898 1 14 . 1 1 17 17 ALA C C 17 174.426 174.426 176.917 -2.491 18478 5899 1 14 . 1 1 17 17 ALA CA C 17 50.062 50.062 51.621 -1.559 18478 5900 1 14 . 1 1 17 17 ALA H H 17 9.658 9.658 8.409 1.249 18478 5901 1 14 . 1 1 18 18 LYS N N 18 127.760 127.760 121.602 6.158 18478 5902 1 14 . 1 1 18 18 LYS HA H 18 4.697 4.697 4.712 -0.015 18478 5903 1 14 . 1 1 18 18 LYS C C 18 178.554 178.554 174.377 4.177 18478 5904 1 14 . 1 1 18 18 LYS CA C 18 53.893 53.893 52.324 1.569 18478 5905 1 14 . 1 1 18 18 LYS CB C 18 35.291 35.291 32.745 2.546 18478 5906 1 14 . 1 1 18 18 LYS H H 18 9.421 9.421 7.427 1.994 18478 5907 1 14 . 1 1 19 19 MET HA H 19 4.656 4.656 4.339 0.317 18478 5908 1 14 . 1 1 19 19 MET C C 19 175.741 175.741 174.909 0.832 18478 5909 1 14 . 1 1 19 19 MET CA C 19 53.916 53.916 54.738 -0.822 18478 5910 1 14 . 1 1 19 19 MET CB C 19 35.799 35.799 33.739 2.060 18478 5911 1 14 . 1 1 20 20 LYS N N 20 124.062 124.062 118.479 5.583 18478 5912 1 14 . 1 1 20 20 LYS CA C 20 58.585 58.585 57.315 1.270 18478 5913 1 14 . 1 1 20 20 LYS CB C 20 31.978 31.978 32.059 -0.081 18478 5914 1 14 . 1 1 20 20 LYS H H 20 8.645 8.645 8.210 0.435 18478 5915 1 14 . 1 1 21 21 GLY C C 21 176.205 176.205 172.086 4.119 18478 5916 1 14 . 1 1 21 21 GLY CA C 21 45.142 45.142 42.275 2.867 18478 5917 1 14 . 1 1 22 22 TYR HA H 22 4.573 4.573 4.653 -0.080 18478 5918 1 14 . 1 1 22 22 TYR CA C 22 55.748 55.748 57.856 -2.108 18478 5919 1 14 . 1 1 22 22 TYR CB C 22 41.331 41.331 38.153 3.178 18478 5920 1 14 . 1 1 23 23 PRO HA H 23 4.759 4.759 4.894 -0.135 18478 5921 1 14 . 1 1 23 23 PRO C C 23 174.587 174.587 175.235 -0.648 18478 5922 1 14 . 1 1 23 23 PRO CA C 23 62.072 62.072 61.170 0.902 18478 5923 1 14 . 1 1 23 23 PRO CB C 23 31.077 31.077 34.988 -3.911 18478 5924 1 14 . 1 1 24 24 HIS N N 24 119.190 119.190 114.300 4.890 18478 5925 1 14 . 1 1 24 24 HIS HA H 24 3.983 3.983 5.717 -1.734 18478 5926 1 14 . 1 1 24 24 HIS C C 24 175.555 175.555 173.961 1.594 18478 5927 1 14 . 1 1 24 24 HIS CA C 24 60.973 60.973 54.282 6.691 18478 5928 1 14 . 1 1 24 24 HIS CB C 24 30.689 30.689 32.837 -2.148 18478 5929 1 14 . 1 1 24 24 HIS H H 24 8.158 8.158 8.303 -0.145 18478 5930 1 14 . 1 1 25 25 TRP N N 25 127.435 127.435 121.823 5.612 18478 5931 1 14 . 1 1 25 25 TRP HA H 25 3.760 3.760 5.472 -1.712 18478 5932 1 14 . 1 1 25 25 TRP CA C 25 55.890 55.890 56.482 -0.592 18478 5933 1 14 . 1 1 25 25 TRP CB C 25 32.879 32.879 30.277 2.602 18478 5934 1 14 . 1 1 25 25 TRP H H 25 9.211 9.211 8.693 0.518 18478 5935 1 14 . 1 1 26 26 PRO HA H 26 4.217 4.217 4.621 -0.404 18478 5936 1 14 . 1 1 26 26 PRO C C 26 176.279 176.279 176.211 0.068 18478 5937 1 14 . 1 1 26 26 PRO CA C 26 63.140 63.140 61.842 1.298 18478 5938 1 14 . 1 1 26 26 PRO CB C 26 32.171 32.171 34.663 -2.492 18478 5939 1 14 . 1 1 27 27 ALA N N 27 130.162 130.162 122.547 7.615 18478 5940 1 14 . 1 1 27 27 ALA HA H 27 4.981 4.981 4.334 0.647 18478 5941 1 14 . 1 1 27 27 ALA C C 27 177.227 177.227 177.079 0.148 18478 5942 1 14 . 1 1 27 27 ALA CA C 27 52.574 52.574 50.984 1.589 18478 5943 1 14 . 1 1 27 27 ALA CB C 27 23.239 23.239 19.893 3.346 18478 5944 1 14 . 1 1 27 27 ALA H H 27 9.394 9.394 8.055 1.339 18478 5945 1 14 . 1 1 28 28 ARG N N 28 117.381 117.381 120.602 -3.221 18478 5946 1 14 . 1 1 28 28 ARG HA H 28 5.421 5.421 4.602 0.819 18478 5947 1 14 . 1 1 28 28 ARG C C 28 176.465 176.465 175.212 1.253 18478 5948 1 14 . 1 1 28 28 ARG CA C 28 53.662 53.662 53.112 0.550 18478 5949 1 14 . 1 1 28 28 ARG CB C 28 35.058 35.058 30.436 4.622 18478 5950 1 14 . 1 1 28 28 ARG H H 28 8.806 8.806 8.516 0.290 18478 5951 1 14 . 1 1 29 29 VAL HA H 29 4.109 4.109 4.316 -0.207 18478 5952 1 14 . 1 1 29 29 VAL C C 29 175.996 175.996 174.722 1.274 18478 5953 1 14 . 1 1 29 29 VAL CA C 29 62.810 62.810 61.586 1.224 18478 5954 1 14 . 1 1 29 29 VAL CB C 29 31.108 31.108 32.834 -1.726 18478 5955 1 14 . 1 1 30 30 ASP N N 30 133.830 133.830 119.847 13.983 18478 5956 1 14 . 1 1 30 30 ASP HA H 30 5.198 5.198 4.652 0.546 18478 5957 1 14 . 1 1 30 30 ASP C C 30 176.207 176.207 177.580 -1.373 18478 5958 1 14 . 1 1 30 30 ASP CA C 30 53.007 53.007 54.575 -1.568 18478 5959 1 14 . 1 1 30 30 ASP CB C 30 44.130 44.130 41.621 2.509 18478 5960 1 14 . 1 1 30 30 ASP H H 30 8.892 8.892 8.485 0.407 18478 5961 1 14 . 1 1 31 31 GLU N N 31 115.905 115.905 120.339 -4.434 18478 5962 1 14 . 1 1 31 31 GLU HA H 31 4.409 4.409 3.961 0.448 18478 5963 1 14 . 1 1 31 31 GLU C C 31 175.192 175.192 176.058 -0.866 18478 5964 1 14 . 1 1 31 31 GLU CA C 31 55.389 55.389 56.711 -1.322 18478 5965 1 14 . 1 1 31 31 GLU H H 31 7.966 7.966 8.863 -0.897 18478 5966 1 14 . 1 1 32 32 VAL N N 32 122.794 122.794 117.073 5.721 18478 5967 1 14 . 1 1 32 32 VAL HA H 32 4.303 4.303 3.733 0.570 18478 5968 1 14 . 1 1 32 32 VAL CA C 32 60.408 60.408 62.749 -2.341 18478 5969 1 14 . 1 1 32 32 VAL CB C 32 32.333 32.333 30.707 1.626 18478 5970 1 14 . 1 1 32 32 VAL H H 32 8.702 8.702 7.978 0.724 18478 5971 1 14 . 1 1 33 33 PRO HA H 33 4.572 4.572 4.125 0.447 18478 5972 1 14 . 1 1 33 33 PRO C C 33 175.366 175.366 177.862 -2.496 18478 5973 1 14 . 1 1 33 33 PRO CA C 33 63.702 63.702 65.594 -1.892 18478 5974 1 14 . 1 1 33 33 PRO CB C 33 32.736 32.736 31.975 0.761 18478 5975 1 14 . 1 1 34 34 ASP N N 34 119.187 119.187 114.785 4.402 18478 5976 1 14 . 1 1 34 34 ASP HA H 34 4.679 4.679 4.875 -0.196 18478 5977 1 14 . 1 1 34 34 ASP C C 34 175.713 175.713 173.672 2.041 18478 5978 1 14 . 1 1 34 34 ASP CA C 34 53.013 53.013 52.897 0.116 18478 5979 1 14 . 1 1 34 34 ASP CB C 34 40.850 40.850 39.853 0.996 18478 5980 1 14 . 1 1 34 34 ASP H H 34 8.686 8.686 7.842 0.844 18478 5981 1 14 . 1 1 35 35 GLY C C 35 177.458 177.458 172.768 4.690 18478 5982 1 14 . 1 1 35 35 GLY CA C 35 45.507 45.507 43.969 1.538 18478 5983 1 14 . 1 1 36 36 ALA HA H 36 4.404 4.404 4.137 0.267 18478 5984 1 14 . 1 1 36 36 ALA CA C 36 52.010 52.010 51.715 0.295 18478 5985 1 14 . 1 1 36 36 ALA CB C 36 19.909 19.909 19.723 0.186 18478 5986 1 14 . 1 1 37 37 VAL N N 37 119.594 119.594 122.101 -2.507 18478 5987 1 14 . 1 1 37 37 VAL HA H 37 3.932 3.932 4.059 -0.127 18478 5988 1 14 . 1 1 37 37 VAL C C 37 175.966 175.966 176.406 -0.440 18478 5989 1 14 . 1 1 37 37 VAL CA C 37 62.810 62.810 63.918 -1.108 18478 5990 1 14 . 1 1 37 37 VAL CB C 37 32.267 32.267 32.424 -0.157 18478 5991 1 14 . 1 1 37 37 VAL H H 37 8.037 8.037 8.347 -0.310 18478 5992 1 14 . 1 1 38 38 LYS N N 38 125.676 125.676 119.148 6.528 18478 5993 1 14 . 1 1 38 38 LYS C C 38 173.865 173.865 175.292 -1.427 18478 5994 1 14 . 1 1 38 38 LYS CA C 38 54.278 54.278 56.353 -2.075 18478 5995 1 14 . 1 1 38 38 LYS CB C 38 31.740 31.740 33.177 -1.437 18478 5996 1 14 . 1 1 38 38 LYS H H 38 8.292 8.292 8.348 -0.056 18478 5997 1 14 . 1 1 40 40 PRO HA H 40 4.387 4.387 5.395 -1.008 18478 5998 1 14 . 1 1 40 40 PRO C C 40 175.535 175.535 175.222 0.313 18478 5999 1 14 . 1 1 40 40 PRO CA C 40 62.330 62.330 59.200 3.130 18478 6000 1 14 . 1 1 40 40 PRO CB C 40 32.086 32.086 32.205 -0.119 18478 6001 1 14 . 1 1 41 41 THR HA H 41 4.027 4.027 4.388 -0.361 18478 6002 1 14 . 1 1 41 41 THR C C 41 176.795 176.795 173.264 3.531 18478 6003 1 14 . 1 1 41 41 THR CA C 41 63.693 63.693 62.096 1.597 18478 6004 1 14 . 1 1 41 41 THR CB C 41 69.370 69.370 69.103 0.267 18478 6005 1 14 . 1 1 42 42 ASN N N 42 118.513 118.513 121.812 -3.299 18478 6006 1 14 . 1 1 42 42 ASN HA H 42 4.530 4.530 5.290 -0.760 18478 6007 1 14 . 1 1 42 42 ASN C C 42 177.230 177.230 174.843 2.387 18478 6008 1 14 . 1 1 42 42 ASN CA C 42 56.373 56.373 50.309 6.064 18478 6009 1 14 . 1 1 42 42 ASN CB C 42 37.618 37.618 38.180 -0.562 18478 6010 1 14 . 1 1 42 42 ASN H H 42 8.752 8.752 8.787 -0.035 18478 6011 1 14 . 1 1 43 43 LYS N N 43 115.898 115.898 128.939 -13.041 18478 6012 1 14 . 1 1 43 43 LYS HA H 43 4.710 4.710 4.732 -0.022 18478 6013 1 14 . 1 1 43 43 LYS C C 43 177.032 177.032 175.547 1.485 18478 6014 1 14 . 1 1 43 43 LYS CA C 43 54.957 54.957 54.574 0.383 18478 6015 1 14 . 1 1 43 43 LYS CB C 43 36.600 36.600 33.066 3.534 18478 6016 1 14 . 1 1 43 43 LYS H H 43 7.723 7.723 8.829 -1.106 18478 6017 1 14 . 1 1 44 44 LEU N N 44 121.006 121.006 129.261 -8.255 18478 6018 1 14 . 1 1 44 44 LEU HA H 44 5.000 5.000 4.237 0.763 18478 6019 1 14 . 1 1 44 44 LEU CA C 44 51.842 51.842 55.302 -3.460 18478 6020 1 14 . 1 1 44 44 LEU CB C 44 44.418 44.418 41.982 2.436 18478 6021 1 14 . 1 1 44 44 LEU H H 44 9.063 9.063 8.521 0.542 18478 6022 1 14 . 1 1 45 45 PRO HA H 45 4.392 4.392 4.466 -0.074 18478 6023 1 14 . 1 1 45 45 PRO C C 45 177.051 177.051 178.612 -1.561 18478 6024 1 14 . 1 1 45 45 PRO CA C 45 62.000 62.000 65.204 -3.204 18478 6025 1 14 . 1 1 45 45 PRO CB C 45 30.737 30.737 32.739 -2.002 18478 6026 1 14 . 1 1 46 46 ILE N N 46 125.996 125.996 123.877 2.119 18478 6027 1 14 . 1 1 46 46 ILE HA H 46 4.564 4.564 3.795 0.769 18478 6028 1 14 . 1 1 46 46 ILE C C 46 176.985 176.985 176.476 0.509 18478 6029 1 14 . 1 1 46 46 ILE CA C 46 57.051 57.051 62.643 -5.592 18478 6030 1 14 . 1 1 46 46 ILE H H 46 8.908 8.908 9.012 -0.104 18478 6031 1 14 . 1 1 47 47 PHE N N 47 128.276 128.276 119.569 8.707 18478 6032 1 14 . 1 1 47 47 PHE HA H 47 4.827 4.827 4.066 0.761 18478 6033 1 14 . 1 1 47 47 PHE C C 47 177.835 177.835 175.828 2.007 18478 6034 1 14 . 1 1 47 47 PHE CA C 47 56.099 56.099 58.596 -2.498 18478 6035 1 14 . 1 1 47 47 PHE CB C 47 41.217 41.217 39.958 1.259 18478 6036 1 14 . 1 1 47 47 PHE H H 47 8.739 8.739 7.361 1.378 18478 6037 1 14 . 1 1 48 48 PHE N N 48 125.953 125.953 116.947 9.006 18478 6038 1 14 . 1 1 48 48 PHE HA H 48 4.251 4.251 3.776 0.475 18478 6039 1 14 . 1 1 48 48 PHE C C 48 175.869 175.869 173.901 1.968 18478 6040 1 14 . 1 1 48 48 PHE CA C 48 56.744 56.744 59.187 -2.443 18478 6041 1 14 . 1 1 48 48 PHE CB C 48 38.835 38.835 36.085 2.750 18478 6042 1 14 . 1 1 48 48 PHE H H 48 8.545 8.545 7.521 1.024 18478 6043 1 14 . 1 1 49 49 PHE N N 49 122.197 122.197 117.554 4.643 18478 6044 1 14 . 1 1 49 49 PHE HA H 49 4.400 4.400 4.602 -0.202 18478 6045 1 14 . 1 1 49 49 PHE C C 49 174.016 174.016 174.874 -0.858 18478 6046 1 14 . 1 1 49 49 PHE CA C 49 59.916 59.916 56.018 3.898 18478 6047 1 14 . 1 1 49 49 PHE CB C 49 39.799 39.799 40.671 -0.872 18478 6048 1 14 . 1 1 49 49 PHE H H 49 8.619 8.619 7.351 1.268 18478 6049 1 14 . 1 1 50 50 GLY N N 50 114.083 114.083 107.643 6.440 18478 6050 1 14 . 1 1 50 50 GLY C C 50 175.636 175.636 173.291 2.345 18478 6051 1 14 . 1 1 50 50 GLY CA C 50 46.718 46.718 43.973 2.745 18478 6052 1 14 . 1 1 50 50 GLY H H 50 10.329 10.329 8.205 2.124 18478 6053 1 14 . 1 1 51 51 THR N N 51 111.210 111.210 119.038 -7.828 18478 6054 1 14 . 1 1 51 51 THR HA H 51 3.980 3.980 4.670 -0.690 18478 6055 1 14 . 1 1 51 51 THR C C 51 175.588 175.588 172.423 3.165 18478 6056 1 14 . 1 1 51 51 THR CA C 51 62.223 62.223 61.180 1.043 18478 6057 1 14 . 1 1 51 51 THR CB C 51 68.346 68.346 72.305 -3.959 18478 6058 1 14 . 1 1 51 51 THR H H 51 7.882 7.882 8.468 -0.586 18478 6059 1 14 . 1 1 52 52 HIS N N 52 115.544 115.544 119.981 -4.437 18478 6060 1 14 . 1 1 52 52 HIS HA H 52 3.712 3.712 5.359 -1.647 18478 6061 1 14 . 1 1 52 52 HIS C C 52 177.717 177.717 174.473 3.244 18478 6062 1 14 . 1 1 52 52 HIS CA C 52 54.860 54.860 54.376 0.484 18478 6063 1 14 . 1 1 52 52 HIS CB C 52 26.388 26.388 30.249 -3.861 18478 6064 1 14 . 1 1 52 52 HIS H H 52 7.791 7.791 8.684 -0.893 18478 6065 1 14 . 1 1 53 53 GLU N N 53 117.517 117.517 122.011 -4.494 18478 6066 1 14 . 1 1 53 53 GLU HA H 53 4.298 4.298 4.864 -0.566 18478 6067 1 14 . 1 1 53 53 GLU C C 53 176.958 176.958 176.488 0.470 18478 6068 1 14 . 1 1 53 53 GLU CA C 53 55.403 55.403 55.068 0.335 18478 6069 1 14 . 1 1 53 53 GLU CB C 53 31.588 31.588 33.430 -1.842 18478 6070 1 14 . 1 1 53 53 GLU H H 53 6.795 6.795 8.340 -1.545 18478 6071 1 14 . 1 1 54 54 THR N N 54 111.182 111.182 116.492 -5.310 18478 6072 1 14 . 1 1 54 54 THR HA H 54 5.648 5.648 4.374 1.274 18478 6073 1 14 . 1 1 54 54 THR C C 54 177.234 177.234 174.335 2.899 18478 6074 1 14 . 1 1 54 54 THR CA C 54 59.894 59.894 61.040 -1.146 18478 6075 1 14 . 1 1 54 54 THR H H 54 8.139 8.139 8.694 -0.555 18478 6076 1 14 . 1 1 55 55 ALA HA H 55 4.403 4.403 4.145 0.258 18478 6077 1 14 . 1 1 55 55 ALA C C 55 176.601 176.601 178.133 -1.532 18478 6078 1 14 . 1 1 55 55 ALA CA C 55 51.079 51.079 53.150 -2.071 18478 6079 1 14 . 1 1 55 55 ALA CB C 55 23.285 23.285 19.083 4.202 18478 6080 1 14 . 1 1 56 56 PHE N N 56 118.058 118.058 114.009 4.049 18478 6081 1 14 . 1 1 56 56 PHE HA H 56 5.678 5.678 4.576 1.102 18478 6082 1 14 . 1 1 56 56 PHE C C 56 175.962 175.962 175.102 0.860 18478 6083 1 14 . 1 1 56 56 PHE CA C 56 56.008 56.008 59.313 -3.305 18478 6084 1 14 . 1 1 56 56 PHE CB C 56 39.995 39.995 37.613 2.382 18478 6085 1 14 . 1 1 56 56 PHE H H 56 8.523 8.523 8.259 0.264 18478 6086 1 14 . 1 1 57 57 LEU N N 57 123.344 123.344 120.705 2.639 18478 6087 1 14 . 1 1 57 57 LEU HA H 57 4.929 4.929 4.723 0.206 18478 6088 1 14 . 1 1 57 57 LEU C C 57 175.584 175.584 174.830 0.754 18478 6089 1 14 . 1 1 57 57 LEU CA C 57 53.463 53.463 54.976 -1.513 18478 6090 1 14 . 1 1 57 57 LEU CB C 57 46.545 46.545 44.336 2.209 18478 6091 1 14 . 1 1 57 57 LEU H H 57 8.579 8.579 7.671 0.908 18478 6092 1 14 . 1 1 58 58 GLY N N 58 108.499 108.499 107.344 1.155 18478 6093 1 14 . 1 1 58 58 GLY CA C 58 43.755 43.755 44.344 -0.589 18478 6094 1 14 . 1 1 58 58 GLY H H 58 9.318 9.318 7.318 2.000 18478 6095 1 14 . 1 1 59 59 PRO HA H 59 4.048 4.048 4.947 -0.899 18478 6096 1 14 . 1 1 59 59 PRO C C 59 173.763 173.763 174.746 -0.983 18478 6097 1 14 . 1 1 59 59 PRO CA C 59 64.770 64.770 60.376 4.394 18478 6098 1 14 . 1 1 59 59 PRO CB C 59 31.889 31.889 35.719 -3.830 18478 6099 1 14 . 1 1 60 60 LYS HA H 60 4.191 4.191 4.590 -0.399 18478 6100 1 14 . 1 1 60 60 LYS C C 60 174.842 174.842 176.580 -1.738 18478 6101 1 14 . 1 1 60 60 LYS CA C 60 57.875 57.875 56.120 1.755 18478 6102 1 14 . 1 1 60 60 LYS CB C 60 31.576 31.576 32.699 -1.123 18478 6103 1 14 . 1 1 61 61 ASP N N 61 117.768 117.768 124.036 -6.268 18478 6104 1 14 . 1 1 61 61 ASP HA H 61 4.973 4.973 4.356 0.617 18478 6105 1 14 . 1 1 61 61 ASP C C 61 178.178 178.178 176.991 1.187 18478 6106 1 14 . 1 1 61 61 ASP CA C 61 54.687 54.687 55.932 -1.245 18478 6107 1 14 . 1 1 61 61 ASP CB C 61 43.555 43.555 39.373 4.182 18478 6108 1 14 . 1 1 61 61 ASP H H 61 7.722 7.722 8.830 -1.108 18478 6109 1 14 . 1 1 62 62 ILE N N 62 114.244 114.244 119.557 -5.313 18478 6110 1 14 . 1 1 62 62 ILE HA H 62 4.891 4.891 3.350 1.541 18478 6111 1 14 . 1 1 62 62 ILE C C 62 178.027 178.027 177.339 0.688 18478 6112 1 14 . 1 1 62 62 ILE CA C 62 59.994 59.994 63.856 -3.862 18478 6113 1 14 . 1 1 62 62 ILE CB C 62 40.652 40.652 36.843 3.808 18478 6114 1 14 . 1 1 62 62 ILE H H 62 6.784 6.784 7.664 -0.880 18478 6115 1 14 . 1 1 63 63 PHE N N 63 119.819 119.819 120.228 -0.409 18478 6116 1 14 . 1 1 63 63 PHE HA H 63 5.214 5.214 4.327 0.887 18478 6117 1 14 . 1 1 63 63 PHE CA C 63 54.735 54.735 59.670 -4.935 18478 6118 1 14 . 1 1 63 63 PHE CB C 63 42.122 42.122 38.908 3.214 18478 6119 1 14 . 1 1 63 63 PHE H H 63 8.734 8.734 7.651 1.083 18478 6120 1 14 . 1 1 64 64 PRO HA H 64 4.771 4.771 4.342 0.429 18478 6121 1 14 . 1 1 64 64 PRO C C 64 174.036 174.036 178.724 -4.688 18478 6122 1 14 . 1 1 64 64 PRO CA C 64 64.474 64.474 64.396 0.078 18478 6123 1 14 . 1 1 64 64 PRO CB C 64 32.662 32.662 33.405 -0.743 18478 6124 1 14 . 1 1 65 65 TYR N N 65 124.335 124.335 121.654 2.681 18478 6125 1 14 . 1 1 65 65 TYR HA H 65 4.530 4.530 4.256 0.274 18478 6126 1 14 . 1 1 65 65 TYR C C 65 173.944 173.944 177.532 -3.588 18478 6127 1 14 . 1 1 65 65 TYR CA C 65 61.205 61.205 60.831 0.374 18478 6128 1 14 . 1 1 65 65 TYR CB C 65 38.844 38.844 38.066 0.778 18478 6129 1 14 . 1 1 65 65 TYR H H 65 8.359 8.359 7.888 0.471 18478 6130 1 14 . 1 1 66 66 SER N N 66 114.836 114.836 112.235 2.601 18478 6131 1 14 . 1 1 66 66 SER HA H 66 3.505 3.505 4.351 -0.846 18478 6132 1 14 . 1 1 66 66 SER C C 66 173.697 173.697 175.463 -1.766 18478 6133 1 14 . 1 1 66 66 SER CA C 66 63.078 63.078 59.616 3.462 18478 6134 1 14 . 1 1 66 66 SER CB C 66 62.223 62.223 63.007 -0.784 18478 6135 1 14 . 1 1 66 66 SER H H 66 8.974 8.974 7.664 1.310 18478 6136 1 14 . 1 1 67 67 GLU N N 67 118.013 118.013 118.650 -0.637 18478 6137 1 14 . 1 1 67 67 GLU HA H 67 4.210 4.210 4.150 0.060 18478 6138 1 14 . 1 1 67 67 GLU C C 67 174.961 174.961 177.460 -2.499 18478 6139 1 14 . 1 1 67 67 GLU CA C 67 58.330 58.330 57.930 0.400 18478 6140 1 14 . 1 1 67 67 GLU CB C 67 30.205 30.205 30.928 -0.723 18478 6141 1 14 . 1 1 67 67 GLU H H 67 8.817 8.817 7.842 0.975 18478 6142 1 14 . 1 1 68 68 ASN N N 68 113.942 113.942 111.098 2.844 18478 6143 1 14 . 1 1 68 68 ASN HA H 68 5.015 5.015 4.938 0.077 18478 6144 1 14 . 1 1 68 68 ASN C C 68 176.626 176.626 175.895 0.731 18478 6145 1 14 . 1 1 68 68 ASN CA C 68 53.768 53.768 51.106 2.662 18478 6146 1 14 . 1 1 68 68 ASN CB C 68 41.948 41.948 39.271 2.677 18478 6147 1 14 . 1 1 68 68 ASN H H 68 7.448 7.448 7.664 -0.216 18478 6148 1 14 . 1 1 69 69 LYS N N 69 124.584 124.584 120.752 3.832 18478 6149 1 14 . 1 1 69 69 LYS HA H 69 3.794 3.794 3.957 -0.163 18478 6150 1 14 . 1 1 69 69 LYS C C 69 173.330 173.330 175.029 -1.699 18478 6151 1 14 . 1 1 69 69 LYS CA C 69 61.225 61.225 57.362 3.863 18478 6152 1 14 . 1 1 69 69 LYS H H 69 7.592 7.592 8.586 -0.994 18478 6153 1 14 . 1 1 70 70 GLU N N 70 118.408 118.408 117.736 0.672 18478 6154 1 14 . 1 1 70 70 GLU HA H 70 4.005 4.005 4.829 -0.824 18478 6155 1 14 . 1 1 70 70 GLU C C 70 174.588 174.588 173.712 0.876 18478 6156 1 14 . 1 1 70 70 GLU CA C 70 58.695 58.695 53.011 5.684 18478 6157 1 14 . 1 1 70 70 GLU CB C 70 28.928 28.928 30.967 -2.039 18478 6158 1 14 . 1 1 70 70 GLU H H 70 8.478 8.478 7.887 0.591 18478 6159 1 14 . 1 1 71 71 LYS HA H 71 3.847 3.847 4.398 -0.551 18478 6160 1 14 . 1 1 71 71 LYS C C 71 173.420 173.420 175.421 -2.001 18478 6161 1 14 . 1 1 71 71 LYS CA C 71 58.718 58.718 55.717 3.001 18478 6162 1 14 . 1 1 71 71 LYS CB C 71 32.964 32.964 34.029 -1.065 18478 6163 1 14 . 1 1 72 72 TYR N N 72 112.358 112.358 122.931 -10.573 18478 6164 1 14 . 1 1 72 72 TYR HA H 72 4.790 4.790 4.359 0.431 18478 6165 1 14 . 1 1 72 72 TYR C C 72 174.442 174.442 176.276 -1.834 18478 6166 1 14 . 1 1 72 72 TYR CA C 72 55.287 55.287 59.501 -4.213 18478 6167 1 14 . 1 1 72 72 TYR CB C 72 37.244 37.244 38.691 -1.447 18478 6168 1 14 . 1 1 72 72 TYR H H 72 7.341 7.341 8.225 -0.884 18478 6169 1 14 . 1 1 73 73 GLY N N 73 110.612 110.612 107.217 3.395 18478 6170 1 14 . 1 1 73 73 GLY C C 73 177.982 177.982 173.106 4.876 18478 6171 1 14 . 1 1 73 73 GLY CA C 73 46.623 46.623 44.540 2.083 18478 6172 1 14 . 1 1 73 73 GLY H H 73 8.076 8.076 8.087 -0.011 18478 6173 1 14 . 1 1 74 74 LYS N N 74 121.009 121.009 120.589 0.420 18478 6174 1 14 . 1 1 74 74 LYS CA C 74 53.465 53.465 54.083 -0.618 18478 6175 1 14 . 1 1 74 74 LYS CB C 74 32.440 32.440 33.138 -0.698 18478 6176 1 14 . 1 1 74 74 LYS H H 74 7.411 7.411 7.937 -0.526 18478 6177 1 14 . 1 1 75 75 PRO HA H 75 4.452 4.452 4.368 0.084 18478 6178 1 14 . 1 1 75 75 PRO C C 75 174.959 174.959 177.773 -2.814 18478 6179 1 14 . 1 1 75 75 PRO CA C 75 62.861 62.861 64.135 -1.274 18478 6180 1 14 . 1 1 75 75 PRO CB C 75 32.407 32.407 31.442 0.965 18478 6181 1 14 . 1 1 76 76 ASN N N 76 121.045 121.045 118.970 2.075 18478 6182 1 14 . 1 1 76 76 ASN HA H 76 4.445 4.445 4.342 0.103 18478 6183 1 14 . 1 1 76 76 ASN C C 76 174.145 174.145 174.561 -0.416 18478 6184 1 14 . 1 1 76 76 ASN CA C 76 55.701 55.701 52.816 2.885 18478 6185 1 14 . 1 1 76 76 ASN H H 76 8.474 8.474 8.885 -0.411 18478 6186 1 14 . 1 1 77 77 LYS N N 77 111.466 111.466 120.376 -8.910 18478 6187 1 14 . 1 1 77 77 LYS HA H 77 4.369 4.369 4.177 0.192 18478 6188 1 14 . 1 1 77 77 LYS C C 77 173.881 173.881 176.132 -2.251 18478 6189 1 14 . 1 1 77 77 LYS CA C 77 55.995 55.995 56.752 -0.757 18478 6190 1 14 . 1 1 77 77 LYS CB C 77 32.538 32.538 32.352 0.186 18478 6191 1 14 . 1 1 77 77 LYS H H 77 8.543 8.543 7.805 0.738 18478 6192 1 14 . 1 1 78 78 ARG N N 78 122.233 122.233 121.337 0.896 18478 6193 1 14 . 1 1 78 78 ARG HA H 78 4.286 4.286 4.073 0.213 18478 6194 1 14 . 1 1 78 78 ARG C C 78 173.652 173.652 174.946 -1.294 18478 6195 1 14 . 1 1 78 78 ARG CA C 78 55.780 55.780 57.728 -1.948 18478 6196 1 14 . 1 1 78 78 ARG CB C 78 29.554 29.554 29.592 -0.038 18478 6197 1 14 . 1 1 78 78 ARG H H 78 8.864 8.864 8.745 0.119 18478 6198 1 14 . 1 1 79 79 LYS N N 79 128.197 128.197 119.750 8.447 18478 6199 1 14 . 1 1 79 79 LYS HA H 79 4.221 4.221 4.474 -0.253 18478 6200 1 14 . 1 1 79 79 LYS C C 79 174.336 174.336 175.125 -0.789 18478 6201 1 14 . 1 1 79 79 LYS CA C 79 58.986 58.986 55.972 3.014 18478 6202 1 14 . 1 1 79 79 LYS CB C 79 32.072 32.072 33.107 -1.035 18478 6203 1 14 . 1 1 79 79 LYS H H 79 8.927 8.927 7.745 1.182 18478 6204 1 14 . 1 1 80 80 GLY N N 80 114.730 114.730 109.490 5.240 18478 6205 1 14 . 1 1 80 80 GLY C C 80 176.536 176.536 174.417 2.119 18478 6206 1 14 . 1 1 80 80 GLY CA C 80 45.992 45.992 45.344 0.648 18478 6207 1 14 . 1 1 80 80 GLY H H 80 8.943 8.943 8.433 0.510 18478 6208 1 14 . 1 1 81 81 PHE N N 81 123.770 123.770 118.719 5.051 18478 6209 1 14 . 1 1 81 81 PHE HA H 81 3.336 3.336 4.392 -1.056 18478 6210 1 14 . 1 1 81 81 PHE C C 81 174.037 174.037 176.336 -2.299 18478 6211 1 14 . 1 1 81 81 PHE CA C 81 63.094 63.094 59.521 3.573 18478 6212 1 14 . 1 1 81 81 PHE CB C 81 39.823 39.823 38.826 0.997 18478 6213 1 14 . 1 1 81 81 PHE H H 81 8.281 8.281 7.907 0.374 18478 6214 1 14 . 1 1 82 82 ASN N N 82 119.812 119.812 117.516 2.296 18478 6215 1 14 . 1 1 82 82 ASN HA H 82 4.458 4.458 4.341 0.117 18478 6216 1 14 . 1 1 82 82 ASN C C 82 171.290 171.290 176.491 -5.201 18478 6217 1 14 . 1 1 82 82 ASN CA C 82 56.060 56.060 56.156 -0.096 18478 6218 1 14 . 1 1 82 82 ASN CB C 82 36.390 36.390 38.298 -1.908 18478 6219 1 14 . 1 1 82 82 ASN H H 82 9.145 9.145 8.493 0.652 18478 6220 1 14 . 1 1 83 83 GLU N N 83 124.411 124.411 118.002 6.409 18478 6221 1 14 . 1 1 83 83 GLU HA H 83 4.186 4.186 4.112 0.074 18478 6222 1 14 . 1 1 83 83 GLU C C 83 172.222 172.222 178.646 -6.424 18478 6223 1 14 . 1 1 83 83 GLU CA C 83 60.922 60.922 59.442 1.480 18478 6224 1 14 . 1 1 83 83 GLU CB C 83 28.132 28.132 28.999 -0.867 18478 6225 1 14 . 1 1 83 83 GLU H H 83 9.560 9.560 8.524 1.036 18478 6226 1 14 . 1 1 84 84 GLY N N 84 111.388 111.388 106.421 4.967 18478 6227 1 14 . 1 1 84 84 GLY C C 84 176.445 176.445 175.049 1.396 18478 6228 1 14 . 1 1 84 84 GLY CA C 84 46.727 46.727 46.561 0.166 18478 6229 1 14 . 1 1 84 84 GLY H H 84 8.364 8.364 7.295 1.069 18478 6230 1 14 . 1 1 85 85 LEU N N 85 121.153 121.153 120.660 0.493 18478 6231 1 14 . 1 1 85 85 LEU HA H 85 4.236 4.236 4.264 -0.028 18478 6232 1 14 . 1 1 85 85 LEU C C 85 172.285 172.285 177.578 -5.293 18478 6233 1 14 . 1 1 85 85 LEU CA C 85 56.795 56.795 56.660 0.135 18478 6234 1 14 . 1 1 85 85 LEU CB C 85 41.113 41.113 43.065 -1.952 18478 6235 1 14 . 1 1 85 85 LEU H H 85 8.294 8.294 7.501 0.793 18478 6236 1 14 . 1 1 86 86 TRP N N 86 118.898 118.898 118.246 0.652 18478 6237 1 14 . 1 1 86 86 TRP HA H 86 4.161 4.161 4.293 -0.132 18478 6238 1 14 . 1 1 86 86 TRP C C 86 171.741 171.741 176.386 -4.645 18478 6239 1 14 . 1 1 86 86 TRP CA C 86 62.153 62.153 58.578 3.575 18478 6240 1 14 . 1 1 86 86 TRP CB C 86 28.424 28.424 29.628 -1.204 18478 6241 1 14 . 1 1 86 86 TRP H H 86 7.783 7.783 7.533 0.250 18478 6242 1 14 . 1 1 87 87 GLU N N 87 120.718 120.718 119.010 1.708 18478 6243 1 14 . 1 1 87 87 GLU HA H 87 3.416 3.416 4.717 -1.301 18478 6244 1 14 . 1 1 87 87 GLU C C 87 172.957 172.957 175.070 -2.113 18478 6245 1 14 . 1 1 87 87 GLU CA C 87 60.122 60.122 53.166 6.956 18478 6246 1 14 . 1 1 87 87 GLU CB C 87 31.021 31.021 30.933 0.088 18478 6247 1 14 . 1 1 87 87 GLU H H 87 8.779 8.779 7.498 1.281 18478 6248 1 14 . 1 1 88 88 ILE HA H 88 2.478 2.478 4.234 -1.756 18478 6249 1 14 . 1 1 88 88 ILE C C 88 177.873 177.873 176.904 0.969 18478 6250 1 14 . 1 1 88 88 ILE CA C 88 65.248 65.248 62.198 3.050 18478 6251 1 14 . 1 1 88 88 ILE CB C 88 37.327 37.327 38.342 -1.015 18478 6252 1 14 . 1 1 89 89 ASP N N 89 114.411 114.411 118.193 -3.782 18478 6253 1 14 . 1 1 89 89 ASP HA H 89 4.589 4.589 4.509 0.080 18478 6254 1 14 . 1 1 89 89 ASP C C 89 174.207 174.207 177.630 -3.423 18478 6255 1 14 . 1 1 89 89 ASP CA C 89 54.740 54.740 56.445 -1.705 18478 6256 1 14 . 1 1 89 89 ASP CB C 89 42.473 42.473 39.889 2.584 18478 6257 1 14 . 1 1 89 89 ASP H H 89 5.911 5.911 8.218 -2.307 18478 6258 1 14 . 1 1 90 90 ASN N N 90 114.358 114.358 114.497 -0.139 18478 6259 1 14 . 1 1 90 90 ASN HA H 90 4.420 4.420 4.461 -0.041 18478 6260 1 14 . 1 1 90 90 ASN C C 90 176.991 176.991 177.327 -0.336 18478 6261 1 14 . 1 1 90 90 ASN CA C 90 54.855 54.855 56.666 -1.811 18478 6262 1 14 . 1 1 90 90 ASN CB C 90 40.582 40.582 37.726 2.856 18478 6263 1 14 . 1 1 90 90 ASN H H 90 7.480 7.480 7.870 -0.390 18478 6264 1 14 . 1 1 91 91 ASN N N 91 119.185 119.185 115.215 3.970 18478 6265 1 14 . 1 1 91 91 ASN HA H 91 5.006 5.006 5.212 -0.206 18478 6266 1 14 . 1 1 91 91 ASN CA C 91 51.624 51.624 54.068 -2.444 18478 6267 1 14 . 1 1 91 91 ASN CB C 91 38.752 38.752 38.700 0.052 18478 6268 1 14 . 1 1 91 91 ASN H H 91 9.238 9.238 7.749 1.489 18478 6269 1 14 . 1 1 92 92 PRO HA H 92 4.296 4.296 4.172 0.124 18478 6270 1 14 . 1 1 92 92 PRO C C 92 173.690 173.690 176.018 -2.328 18478 6271 1 14 . 1 1 92 92 PRO CA C 92 64.714 64.714 63.896 0.818 18478 6272 1 14 . 1 1 92 92 PRO CB C 92 31.781 31.781 31.778 0.003 18478 6273 1 15 . 1 1 3 3 GLY C C 3 177.088 177.088 172.158 4.930 18478 6274 1 15 . 1 1 3 3 GLY CA C 3 45.330 45.330 43.086 2.244 18478 6275 1 15 . 1 1 4 4 SER N N 4 115.847 115.847 114.906 0.941 18478 6276 1 15 . 1 1 4 4 SER HA H 4 4.480 4.480 4.677 -0.197 18478 6277 1 15 . 1 1 4 4 SER C C 4 177.991 177.991 171.803 6.188 18478 6278 1 15 . 1 1 4 4 SER CA C 4 58.742 58.742 58.564 0.178 18478 6279 1 15 . 1 1 4 4 SER CB C 4 63.820 63.820 65.287 -1.466 18478 6280 1 15 . 1 1 4 4 SER H H 4 8.207 8.207 7.739 0.468 18478 6281 1 15 . 1 1 5 5 MET N N 5 125.867 125.867 122.180 3.687 18478 6282 1 15 . 1 1 5 5 MET HA H 5 4.580 4.580 4.694 -0.114 18478 6283 1 15 . 1 1 5 5 MET C C 5 174.825 174.825 175.476 -0.651 18478 6284 1 15 . 1 1 5 5 MET CA C 5 54.733 54.733 54.238 0.495 18478 6285 1 15 . 1 1 5 5 MET CB C 5 33.527 33.527 35.714 -2.187 18478 6286 1 15 . 1 1 5 5 MET H H 5 8.148 8.148 8.847 -0.699 18478 6287 1 15 . 1 1 6 6 THR N N 6 115.828 115.828 116.416 -0.588 18478 6288 1 15 . 1 1 6 6 THR HA H 6 3.903 3.903 4.412 -0.509 18478 6289 1 15 . 1 1 6 6 THR C C 6 176.930 176.930 172.929 4.001 18478 6290 1 15 . 1 1 6 6 THR CA C 6 63.034 63.034 60.299 2.735 18478 6291 1 15 . 1 1 6 6 THR CB C 6 69.308 69.308 69.219 0.089 18478 6292 1 15 . 1 1 6 6 THR H H 6 8.408 8.408 8.318 0.090 18478 6293 1 15 . 1 1 7 7 ARG HA H 7 4.276 4.276 4.276 -0.000 18478 6294 1 15 . 1 1 7 7 ARG C C 7 176.546 176.546 176.669 -0.123 18478 6295 1 15 . 1 1 7 7 ARG CA C 7 55.813 55.813 56.096 -0.283 18478 6296 1 15 . 1 1 7 7 ARG CB C 7 30.556 30.556 30.805 -0.249 18478 6297 1 15 . 1 1 8 8 ASP N N 8 121.762 121.762 124.080 -2.318 18478 6298 1 15 . 1 1 8 8 ASP HA H 8 4.537 4.537 4.198 0.339 18478 6299 1 15 . 1 1 8 8 ASP C C 8 177.750 177.750 174.800 2.950 18478 6300 1 15 . 1 1 8 8 ASP CA C 8 54.117 54.117 54.497 -0.380 18478 6301 1 15 . 1 1 8 8 ASP H H 8 8.066 8.066 8.641 -0.575 18478 6302 1 15 . 1 1 9 9 PHE N N 9 119.991 119.991 118.053 1.938 18478 6303 1 15 . 1 1 9 9 PHE HA H 9 4.734 4.734 5.075 -0.341 18478 6304 1 15 . 1 1 9 9 PHE C C 9 176.838 176.838 174.282 2.556 18478 6305 1 15 . 1 1 9 9 PHE CA C 9 58.303 58.303 56.953 1.350 18478 6306 1 15 . 1 1 9 9 PHE CB C 9 41.594 41.594 42.758 -1.164 18478 6307 1 15 . 1 1 9 9 PHE H H 9 8.103 8.103 7.594 0.509 18478 6308 1 15 . 1 1 10 10 LYS N N 10 122.957 122.957 120.762 2.195 18478 6309 1 15 . 1 1 10 10 LYS CA C 10 53.167 53.167 55.629 -2.462 18478 6310 1 15 . 1 1 10 10 LYS CB C 10 33.495 33.495 34.435 -0.940 18478 6311 1 15 . 1 1 10 10 LYS H H 10 9.087 9.087 8.606 0.481 18478 6312 1 15 . 1 1 11 11 PRO HA H 11 3.903 3.903 5.439 -1.536 18478 6313 1 15 . 1 1 11 11 PRO C C 11 173.988 173.988 175.261 -1.273 18478 6314 1 15 . 1 1 11 11 PRO CA C 11 63.874 63.874 60.157 3.716 18478 6315 1 15 . 1 1 11 11 PRO CB C 11 31.623 31.623 35.088 -3.465 18478 6316 1 15 . 1 1 12 12 GLY N N 12 115.413 115.413 110.419 4.994 18478 6317 1 15 . 1 1 12 12 GLY C C 12 176.966 176.966 172.492 4.474 18478 6318 1 15 . 1 1 12 12 GLY CA C 12 44.651 44.651 42.437 2.214 18478 6319 1 15 . 1 1 12 12 GLY H H 12 9.667 9.667 8.965 0.702 18478 6320 1 15 . 1 1 13 13 ASP N N 13 122.208 122.208 127.951 -5.743 18478 6321 1 15 . 1 1 13 13 ASP HA H 13 4.601 4.601 4.849 -0.248 18478 6322 1 15 . 1 1 13 13 ASP C C 13 176.244 176.244 174.702 1.542 18478 6323 1 15 . 1 1 13 13 ASP CA C 13 55.870 55.870 52.048 3.822 18478 6324 1 15 . 1 1 13 13 ASP CB C 13 40.794 40.794 43.563 -2.769 18478 6325 1 15 . 1 1 13 13 ASP H H 13 8.303 8.303 8.590 -0.287 18478 6326 1 15 . 1 1 14 14 LEU N N 14 121.306 121.306 125.804 -4.498 18478 6327 1 15 . 1 1 14 14 LEU HA H 14 4.982 4.982 4.702 0.280 18478 6328 1 15 . 1 1 14 14 LEU C C 14 173.461 173.461 175.896 -2.435 18478 6329 1 15 . 1 1 14 14 LEU CA C 14 54.516 54.516 53.585 0.931 18478 6330 1 15 . 1 1 14 14 LEU CB C 14 40.999 40.999 42.388 -1.389 18478 6331 1 15 . 1 1 14 14 LEU H H 14 8.618 8.618 7.922 0.696 18478 6332 1 15 . 1 1 15 15 ILE N N 15 118.806 118.806 125.454 -6.648 18478 6333 1 15 . 1 1 15 15 ILE HA H 15 5.356 5.356 4.283 1.073 18478 6334 1 15 . 1 1 15 15 ILE C C 15 175.982 175.982 175.740 0.242 18478 6335 1 15 . 1 1 15 15 ILE CA C 15 60.481 60.481 60.518 -0.037 18478 6336 1 15 . 1 1 15 15 ILE CB C 15 44.142 44.142 39.567 4.575 18478 6337 1 15 . 1 1 15 15 ILE H H 15 8.864 8.864 8.606 0.258 18478 6338 1 15 . 1 1 16 16 PHE N N 16 112.472 112.472 125.737 -13.265 18478 6339 1 15 . 1 1 16 16 PHE HA H 16 5.306 5.306 4.156 1.150 18478 6340 1 15 . 1 1 16 16 PHE C C 16 176.239 176.239 176.274 -0.035 18478 6341 1 15 . 1 1 16 16 PHE CA C 16 58.603 58.603 59.870 -1.267 18478 6342 1 15 . 1 1 16 16 PHE CB C 16 43.305 43.305 38.440 4.865 18478 6343 1 15 . 1 1 16 16 PHE H H 16 9.411 9.411 8.794 0.617 18478 6344 1 15 . 1 1 17 17 ALA N N 17 123.889 123.889 125.041 -1.152 18478 6345 1 15 . 1 1 17 17 ALA HA H 17 5.348 5.348 3.677 1.671 18478 6346 1 15 . 1 1 17 17 ALA C C 17 174.426 174.426 176.048 -1.622 18478 6347 1 15 . 1 1 17 17 ALA CA C 17 50.062 50.062 51.678 -1.616 18478 6348 1 15 . 1 1 17 17 ALA H H 17 9.658 9.658 8.328 1.330 18478 6349 1 15 . 1 1 18 18 LYS N N 18 127.760 127.760 121.679 6.081 18478 6350 1 15 . 1 1 18 18 LYS HA H 18 4.697 4.697 4.697 0.000 18478 6351 1 15 . 1 1 18 18 LYS C C 18 178.554 178.554 174.525 4.029 18478 6352 1 15 . 1 1 18 18 LYS CA C 18 53.893 53.893 52.183 1.710 18478 6353 1 15 . 1 1 18 18 LYS CB C 18 35.291 35.291 32.154 3.137 18478 6354 1 15 . 1 1 18 18 LYS H H 18 9.421 9.421 7.714 1.707 18478 6355 1 15 . 1 1 19 19 MET HA H 19 4.656 4.656 4.564 0.092 18478 6356 1 15 . 1 1 19 19 MET C C 19 175.741 175.741 174.674 1.067 18478 6357 1 15 . 1 1 19 19 MET CA C 19 53.916 53.916 54.684 -0.768 18478 6358 1 15 . 1 1 19 19 MET CB C 19 35.799 35.799 33.433 2.366 18478 6359 1 15 . 1 1 20 20 LYS N N 20 124.062 124.062 116.830 7.232 18478 6360 1 15 . 1 1 20 20 LYS CA C 20 58.585 58.585 56.056 2.529 18478 6361 1 15 . 1 1 20 20 LYS CB C 20 31.978 31.978 32.266 -0.288 18478 6362 1 15 . 1 1 20 20 LYS H H 20 8.645 8.645 8.128 0.517 18478 6363 1 15 . 1 1 21 21 GLY C C 21 176.205 176.205 172.302 3.903 18478 6364 1 15 . 1 1 21 21 GLY CA C 21 45.142 45.142 42.837 2.305 18478 6365 1 15 . 1 1 22 22 TYR HA H 22 4.573 4.573 4.955 -0.382 18478 6366 1 15 . 1 1 22 22 TYR CA C 22 55.748 55.748 57.911 -2.163 18478 6367 1 15 . 1 1 22 22 TYR CB C 22 41.331 41.331 38.389 2.942 18478 6368 1 15 . 1 1 23 23 PRO HA H 23 4.759 4.759 5.165 -0.406 18478 6369 1 15 . 1 1 23 23 PRO C C 23 174.587 174.587 175.268 -0.681 18478 6370 1 15 . 1 1 23 23 PRO CA C 23 62.072 62.072 61.738 0.334 18478 6371 1 15 . 1 1 23 23 PRO CB C 23 31.077 31.077 35.230 -4.153 18478 6372 1 15 . 1 1 24 24 HIS N N 24 119.190 119.190 118.571 0.619 18478 6373 1 15 . 1 1 24 24 HIS HA H 24 3.983 3.983 5.133 -1.150 18478 6374 1 15 . 1 1 24 24 HIS C C 24 175.555 175.555 173.782 1.773 18478 6375 1 15 . 1 1 24 24 HIS CA C 24 60.973 60.973 54.324 6.649 18478 6376 1 15 . 1 1 24 24 HIS CB C 24 30.689 30.689 33.216 -2.527 18478 6377 1 15 . 1 1 24 24 HIS H H 24 8.158 8.158 8.705 -0.547 18478 6378 1 15 . 1 1 25 25 TRP N N 25 127.435 127.435 128.505 -1.070 18478 6379 1 15 . 1 1 25 25 TRP HA H 25 3.760 3.760 4.639 -0.879 18478 6380 1 15 . 1 1 25 25 TRP CA C 25 55.890 55.890 58.747 -2.857 18478 6381 1 15 . 1 1 25 25 TRP CB C 25 32.879 32.879 30.090 2.789 18478 6382 1 15 . 1 1 25 25 TRP H H 25 9.211 9.211 8.775 0.436 18478 6383 1 15 . 1 1 26 26 PRO HA H 26 4.217 4.217 4.751 -0.534 18478 6384 1 15 . 1 1 26 26 PRO C C 26 176.279 176.279 175.796 0.483 18478 6385 1 15 . 1 1 26 26 PRO CA C 26 63.140 63.140 61.491 1.649 18478 6386 1 15 . 1 1 26 26 PRO CB C 26 32.171 32.171 35.077 -2.906 18478 6387 1 15 . 1 1 27 27 ALA N N 27 130.162 130.162 122.345 7.817 18478 6388 1 15 . 1 1 27 27 ALA HA H 27 4.981 4.981 4.394 0.587 18478 6389 1 15 . 1 1 27 27 ALA C C 27 177.227 177.227 177.096 0.131 18478 6390 1 15 . 1 1 27 27 ALA CA C 27 52.574 52.574 51.049 1.525 18478 6391 1 15 . 1 1 27 27 ALA CB C 27 23.239 23.239 20.553 2.686 18478 6392 1 15 . 1 1 27 27 ALA H H 27 9.394 9.394 8.230 1.164 18478 6393 1 15 . 1 1 28 28 ARG N N 28 117.381 117.381 115.731 1.650 18478 6394 1 15 . 1 1 28 28 ARG HA H 28 5.421 5.421 4.448 0.973 18478 6395 1 15 . 1 1 28 28 ARG C C 28 176.465 176.465 175.786 0.679 18478 6396 1 15 . 1 1 28 28 ARG CA C 28 53.662 53.662 54.794 -1.132 18478 6397 1 15 . 1 1 28 28 ARG CB C 28 35.058 35.058 30.078 4.980 18478 6398 1 15 . 1 1 28 28 ARG H H 28 8.806 8.806 8.438 0.368 18478 6399 1 15 . 1 1 29 29 VAL HA H 29 4.109 4.109 4.254 -0.145 18478 6400 1 15 . 1 1 29 29 VAL C C 29 175.996 175.996 174.582 1.414 18478 6401 1 15 . 1 1 29 29 VAL CA C 29 62.810 62.810 61.930 0.880 18478 6402 1 15 . 1 1 29 29 VAL CB C 29 31.108 31.108 32.446 -1.338 18478 6403 1 15 . 1 1 30 30 ASP N N 30 133.830 133.830 117.669 16.161 18478 6404 1 15 . 1 1 30 30 ASP HA H 30 5.198 5.198 4.662 0.536 18478 6405 1 15 . 1 1 30 30 ASP C C 30 176.207 176.207 177.016 -0.809 18478 6406 1 15 . 1 1 30 30 ASP CA C 30 53.007 53.007 53.539 -0.532 18478 6407 1 15 . 1 1 30 30 ASP CB C 30 44.130 44.130 41.142 2.988 18478 6408 1 15 . 1 1 30 30 ASP H H 30 8.892 8.892 8.370 0.522 18478 6409 1 15 . 1 1 31 31 GLU N N 31 115.905 115.905 121.689 -5.784 18478 6410 1 15 . 1 1 31 31 GLU HA H 31 4.409 4.409 3.966 0.443 18478 6411 1 15 . 1 1 31 31 GLU C C 31 175.192 175.192 176.103 -0.911 18478 6412 1 15 . 1 1 31 31 GLU CA C 31 55.389 55.389 56.465 -1.077 18478 6413 1 15 . 1 1 31 31 GLU H H 31 7.966 7.966 8.885 -0.919 18478 6414 1 15 . 1 1 32 32 VAL N N 32 122.794 122.794 117.873 4.921 18478 6415 1 15 . 1 1 32 32 VAL HA H 32 4.303 4.303 3.903 0.400 18478 6416 1 15 . 1 1 32 32 VAL CA C 32 60.408 60.408 63.147 -2.739 18478 6417 1 15 . 1 1 32 32 VAL CB C 32 32.333 32.333 30.654 1.679 18478 6418 1 15 . 1 1 32 32 VAL H H 32 8.702 8.702 8.072 0.630 18478 6419 1 15 . 1 1 33 33 PRO HA H 33 4.572 4.572 4.323 0.249 18478 6420 1 15 . 1 1 33 33 PRO C C 33 175.366 175.366 177.738 -2.372 18478 6421 1 15 . 1 1 33 33 PRO CA C 33 63.702 63.702 64.533 -0.831 18478 6422 1 15 . 1 1 33 33 PRO CB C 33 32.736 32.736 32.604 0.132 18478 6423 1 15 . 1 1 34 34 ASP N N 34 119.187 119.187 119.716 -0.529 18478 6424 1 15 . 1 1 34 34 ASP HA H 34 4.679 4.679 4.906 -0.227 18478 6425 1 15 . 1 1 34 34 ASP C C 34 175.713 175.713 173.861 1.852 18478 6426 1 15 . 1 1 34 34 ASP CA C 34 53.013 53.013 52.187 0.826 18478 6427 1 15 . 1 1 34 34 ASP CB C 34 40.850 40.850 41.148 -0.298 18478 6428 1 15 . 1 1 34 34 ASP H H 34 8.686 8.686 8.036 0.650 18478 6429 1 15 . 1 1 35 35 GLY C C 35 177.458 177.458 173.305 4.153 18478 6430 1 15 . 1 1 35 35 GLY CA C 35 45.507 45.507 43.793 1.714 18478 6431 1 15 . 1 1 36 36 ALA HA H 36 4.404 4.404 4.061 0.343 18478 6432 1 15 . 1 1 36 36 ALA CA C 36 52.010 52.010 51.550 0.460 18478 6433 1 15 . 1 1 36 36 ALA CB C 36 19.909 19.909 19.607 0.302 18478 6434 1 15 . 1 1 37 37 VAL N N 37 119.594 119.594 123.352 -3.758 18478 6435 1 15 . 1 1 37 37 VAL HA H 37 3.932 3.932 4.106 -0.174 18478 6436 1 15 . 1 1 37 37 VAL C C 37 175.966 175.966 175.980 -0.014 18478 6437 1 15 . 1 1 37 37 VAL CA C 37 62.810 62.810 64.300 -1.490 18478 6438 1 15 . 1 1 37 37 VAL CB C 37 32.267 32.267 32.417 -0.150 18478 6439 1 15 . 1 1 37 37 VAL H H 37 8.037 8.037 8.394 -0.357 18478 6440 1 15 . 1 1 38 38 LYS N N 38 125.676 125.676 120.478 5.198 18478 6441 1 15 . 1 1 38 38 LYS C C 38 173.865 173.865 174.805 -0.940 18478 6442 1 15 . 1 1 38 38 LYS CA C 38 54.278 54.278 56.348 -2.070 18478 6443 1 15 . 1 1 38 38 LYS CB C 38 31.740 31.740 33.585 -1.845 18478 6444 1 15 . 1 1 38 38 LYS H H 38 8.292 8.292 8.377 -0.085 18478 6445 1 15 . 1 1 40 40 PRO HA H 40 4.387 4.387 5.284 -0.897 18478 6446 1 15 . 1 1 40 40 PRO C C 40 175.535 175.535 175.322 0.213 18478 6447 1 15 . 1 1 40 40 PRO CA C 40 62.330 62.330 59.347 2.983 18478 6448 1 15 . 1 1 40 40 PRO CB C 40 32.086 32.086 32.111 -0.025 18478 6449 1 15 . 1 1 41 41 THR HA H 41 4.027 4.027 4.420 -0.393 18478 6450 1 15 . 1 1 41 41 THR C C 41 176.795 176.795 172.927 3.868 18478 6451 1 15 . 1 1 41 41 THR CA C 41 63.693 63.693 62.118 1.575 18478 6452 1 15 . 1 1 41 41 THR CB C 41 69.370 69.370 68.901 0.469 18478 6453 1 15 . 1 1 42 42 ASN N N 42 118.513 118.513 121.552 -3.039 18478 6454 1 15 . 1 1 42 42 ASN HA H 42 4.530 4.530 4.846 -0.316 18478 6455 1 15 . 1 1 42 42 ASN C C 42 177.230 177.230 174.613 2.617 18478 6456 1 15 . 1 1 42 42 ASN CA C 42 56.373 56.373 50.182 6.191 18478 6457 1 15 . 1 1 42 42 ASN CB C 42 37.618 37.618 37.213 0.405 18478 6458 1 15 . 1 1 42 42 ASN H H 42 8.752 8.752 8.578 0.174 18478 6459 1 15 . 1 1 43 43 LYS N N 43 115.898 115.898 128.566 -12.668 18478 6460 1 15 . 1 1 43 43 LYS HA H 43 4.710 4.710 4.527 0.183 18478 6461 1 15 . 1 1 43 43 LYS C C 43 177.032 177.032 176.384 0.648 18478 6462 1 15 . 1 1 43 43 LYS CA C 43 54.957 54.957 55.218 -0.261 18478 6463 1 15 . 1 1 43 43 LYS CB C 43 36.600 36.600 32.194 4.407 18478 6464 1 15 . 1 1 43 43 LYS H H 43 7.723 7.723 8.995 -1.272 18478 6465 1 15 . 1 1 44 44 LEU N N 44 121.006 121.006 128.231 -7.225 18478 6466 1 15 . 1 1 44 44 LEU HA H 44 5.000 5.000 4.392 0.608 18478 6467 1 15 . 1 1 44 44 LEU CA C 44 51.842 51.842 54.877 -3.035 18478 6468 1 15 . 1 1 44 44 LEU CB C 44 44.418 44.418 40.561 3.857 18478 6469 1 15 . 1 1 44 44 LEU H H 44 9.063 9.063 8.358 0.705 18478 6470 1 15 . 1 1 45 45 PRO HA H 45 4.392 4.392 4.512 -0.120 18478 6471 1 15 . 1 1 45 45 PRO C C 45 177.051 177.051 178.008 -0.957 18478 6472 1 15 . 1 1 45 45 PRO CA C 45 62.000 62.000 63.624 -1.624 18478 6473 1 15 . 1 1 45 45 PRO CB C 45 30.737 30.737 32.719 -1.982 18478 6474 1 15 . 1 1 46 46 ILE N N 46 125.996 125.996 125.343 0.653 18478 6475 1 15 . 1 1 46 46 ILE HA H 46 4.564 4.564 3.617 0.947 18478 6476 1 15 . 1 1 46 46 ILE C C 46 176.985 176.985 175.567 1.418 18478 6477 1 15 . 1 1 46 46 ILE CA C 46 57.051 57.051 62.670 -5.619 18478 6478 1 15 . 1 1 46 46 ILE H H 46 8.908 8.908 8.783 0.125 18478 6479 1 15 . 1 1 47 47 PHE N N 47 128.276 128.276 117.825 10.451 18478 6480 1 15 . 1 1 47 47 PHE HA H 47 4.827 4.827 4.137 0.690 18478 6481 1 15 . 1 1 47 47 PHE C C 47 177.835 177.835 176.049 1.786 18478 6482 1 15 . 1 1 47 47 PHE CA C 47 56.099 56.099 57.503 -1.404 18478 6483 1 15 . 1 1 47 47 PHE CB C 47 41.217 41.217 40.538 0.679 18478 6484 1 15 . 1 1 47 47 PHE H H 47 8.739 8.739 7.498 1.241 18478 6485 1 15 . 1 1 48 48 PHE N N 48 125.953 125.953 117.956 7.997 18478 6486 1 15 . 1 1 48 48 PHE HA H 48 4.251 4.251 4.463 -0.212 18478 6487 1 15 . 1 1 48 48 PHE C C 48 175.869 175.869 174.784 1.085 18478 6488 1 15 . 1 1 48 48 PHE CA C 48 56.744 56.744 59.528 -2.784 18478 6489 1 15 . 1 1 48 48 PHE CB C 48 38.835 38.835 36.397 2.438 18478 6490 1 15 . 1 1 48 48 PHE H H 48 8.545 8.545 7.999 0.546 18478 6491 1 15 . 1 1 49 49 PHE N N 49 122.197 122.197 118.708 3.489 18478 6492 1 15 . 1 1 49 49 PHE HA H 49 4.400 4.400 4.884 -0.484 18478 6493 1 15 . 1 1 49 49 PHE C C 49 174.016 174.016 174.242 -0.226 18478 6494 1 15 . 1 1 49 49 PHE CA C 49 59.916 59.916 55.558 4.358 18478 6495 1 15 . 1 1 49 49 PHE CB C 49 39.799 39.799 42.433 -2.634 18478 6496 1 15 . 1 1 49 49 PHE H H 49 8.619 8.619 7.606 1.013 18478 6497 1 15 . 1 1 50 50 GLY N N 50 114.083 114.083 108.062 6.021 18478 6498 1 15 . 1 1 50 50 GLY C C 50 175.636 175.636 173.300 2.336 18478 6499 1 15 . 1 1 50 50 GLY CA C 50 46.718 46.718 43.900 2.818 18478 6500 1 15 . 1 1 50 50 GLY H H 50 10.329 10.329 8.186 2.143 18478 6501 1 15 . 1 1 51 51 THR N N 51 111.210 111.210 118.535 -7.325 18478 6502 1 15 . 1 1 51 51 THR HA H 51 3.980 3.980 4.554 -0.574 18478 6503 1 15 . 1 1 51 51 THR C C 51 175.588 175.588 172.272 3.316 18478 6504 1 15 . 1 1 51 51 THR CA C 51 62.223 62.223 61.524 0.699 18478 6505 1 15 . 1 1 51 51 THR CB C 51 68.346 68.346 72.303 -3.957 18478 6506 1 15 . 1 1 51 51 THR H H 51 7.882 7.882 8.086 -0.204 18478 6507 1 15 . 1 1 52 52 HIS N N 52 115.544 115.544 120.345 -4.801 18478 6508 1 15 . 1 1 52 52 HIS HA H 52 3.712 3.712 5.274 -1.562 18478 6509 1 15 . 1 1 52 52 HIS C C 52 177.717 177.717 175.428 2.289 18478 6510 1 15 . 1 1 52 52 HIS CA C 52 54.860 54.860 54.808 0.052 18478 6511 1 15 . 1 1 52 52 HIS CB C 52 26.388 26.388 30.012 -3.623 18478 6512 1 15 . 1 1 52 52 HIS H H 52 7.791 7.791 8.464 -0.673 18478 6513 1 15 . 1 1 53 53 GLU N N 53 117.517 117.517 123.607 -6.090 18478 6514 1 15 . 1 1 53 53 GLU HA H 53 4.298 4.298 4.744 -0.446 18478 6515 1 15 . 1 1 53 53 GLU C C 53 176.958 176.958 176.595 0.363 18478 6516 1 15 . 1 1 53 53 GLU CA C 53 55.403 55.403 55.196 0.207 18478 6517 1 15 . 1 1 53 53 GLU CB C 53 31.588 31.588 33.323 -1.735 18478 6518 1 15 . 1 1 53 53 GLU H H 53 6.795 6.795 8.830 -2.035 18478 6519 1 15 . 1 1 54 54 THR N N 54 111.182 111.182 116.642 -5.460 18478 6520 1 15 . 1 1 54 54 THR HA H 54 5.648 5.648 4.325 1.323 18478 6521 1 15 . 1 1 54 54 THR C C 54 177.234 177.234 174.334 2.900 18478 6522 1 15 . 1 1 54 54 THR CA C 54 59.894 59.894 61.053 -1.159 18478 6523 1 15 . 1 1 54 54 THR H H 54 8.139 8.139 8.672 -0.533 18478 6524 1 15 . 1 1 55 55 ALA HA H 55 4.403 4.403 4.047 0.356 18478 6525 1 15 . 1 1 55 55 ALA C C 55 176.601 176.601 177.972 -1.371 18478 6526 1 15 . 1 1 55 55 ALA CA C 55 51.079 51.079 53.075 -1.996 18478 6527 1 15 . 1 1 55 55 ALA CB C 55 23.285 23.285 19.074 4.211 18478 6528 1 15 . 1 1 56 56 PHE N N 56 118.058 118.058 114.309 3.749 18478 6529 1 15 . 1 1 56 56 PHE HA H 56 5.678 5.678 4.559 1.119 18478 6530 1 15 . 1 1 56 56 PHE C C 56 175.962 175.962 174.795 1.167 18478 6531 1 15 . 1 1 56 56 PHE CA C 56 56.008 56.008 58.818 -2.810 18478 6532 1 15 . 1 1 56 56 PHE CB C 56 39.995 39.995 37.341 2.654 18478 6533 1 15 . 1 1 56 56 PHE H H 56 8.523 8.523 8.329 0.194 18478 6534 1 15 . 1 1 57 57 LEU N N 57 123.344 123.344 120.831 2.513 18478 6535 1 15 . 1 1 57 57 LEU HA H 57 4.929 4.929 4.701 0.228 18478 6536 1 15 . 1 1 57 57 LEU C C 57 175.584 175.584 174.633 0.951 18478 6537 1 15 . 1 1 57 57 LEU CA C 57 53.463 53.463 54.863 -1.400 18478 6538 1 15 . 1 1 57 57 LEU CB C 57 46.545 46.545 43.600 2.945 18478 6539 1 15 . 1 1 57 57 LEU H H 57 8.579 8.579 7.561 1.018 18478 6540 1 15 . 1 1 58 58 GLY N N 58 108.499 108.499 107.216 1.283 18478 6541 1 15 . 1 1 58 58 GLY CA C 58 43.755 43.755 44.291 -0.536 18478 6542 1 15 . 1 1 58 58 GLY H H 58 9.318 9.318 7.264 2.054 18478 6543 1 15 . 1 1 59 59 PRO HA H 59 4.048 4.048 4.953 -0.905 18478 6544 1 15 . 1 1 59 59 PRO C C 59 173.763 173.763 174.696 -0.933 18478 6545 1 15 . 1 1 59 59 PRO CA C 59 64.770 64.770 60.476 4.294 18478 6546 1 15 . 1 1 59 59 PRO CB C 59 31.889 31.889 35.767 -3.878 18478 6547 1 15 . 1 1 60 60 LYS HA H 60 4.191 4.191 4.592 -0.401 18478 6548 1 15 . 1 1 60 60 LYS C C 60 174.842 174.842 176.664 -1.822 18478 6549 1 15 . 1 1 60 60 LYS CA C 60 57.875 57.875 56.038 1.837 18478 6550 1 15 . 1 1 60 60 LYS CB C 60 31.576 31.576 32.932 -1.356 18478 6551 1 15 . 1 1 61 61 ASP N N 61 117.768 117.768 125.168 -7.400 18478 6552 1 15 . 1 1 61 61 ASP HA H 61 4.973 4.973 4.397 0.576 18478 6553 1 15 . 1 1 61 61 ASP C C 61 178.178 178.178 177.900 0.278 18478 6554 1 15 . 1 1 61 61 ASP CA C 61 54.687 54.687 55.424 -0.737 18478 6555 1 15 . 1 1 61 61 ASP CB C 61 43.555 43.555 39.810 3.745 18478 6556 1 15 . 1 1 61 61 ASP H H 61 7.722 7.722 8.831 -1.109 18478 6557 1 15 . 1 1 62 62 ILE N N 62 114.244 114.244 121.773 -7.529 18478 6558 1 15 . 1 1 62 62 ILE HA H 62 4.891 4.891 3.507 1.384 18478 6559 1 15 . 1 1 62 62 ILE C C 62 178.027 178.027 177.627 0.400 18478 6560 1 15 . 1 1 62 62 ILE CA C 62 59.994 59.994 64.466 -4.473 18478 6561 1 15 . 1 1 62 62 ILE CB C 62 40.652 40.652 36.974 3.679 18478 6562 1 15 . 1 1 62 62 ILE H H 62 6.784 6.784 7.989 -1.205 18478 6563 1 15 . 1 1 63 63 PHE N N 63 119.819 119.819 119.796 0.023 18478 6564 1 15 . 1 1 63 63 PHE HA H 63 5.214 5.214 4.296 0.918 18478 6565 1 15 . 1 1 63 63 PHE CA C 63 54.735 54.735 60.018 -5.283 18478 6566 1 15 . 1 1 63 63 PHE CB C 63 42.122 42.122 38.839 3.283 18478 6567 1 15 . 1 1 63 63 PHE H H 63 8.734 8.734 7.651 1.083 18478 6568 1 15 . 1 1 64 64 PRO HA H 64 4.771 4.771 4.371 0.400 18478 6569 1 15 . 1 1 64 64 PRO C C 64 174.036 174.036 178.317 -4.281 18478 6570 1 15 . 1 1 64 64 PRO CA C 64 64.474 64.474 64.633 -0.159 18478 6571 1 15 . 1 1 64 64 PRO CB C 64 32.662 32.662 33.304 -0.642 18478 6572 1 15 . 1 1 65 65 TYR N N 65 124.335 124.335 121.652 2.683 18478 6573 1 15 . 1 1 65 65 TYR HA H 65 4.530 4.530 4.308 0.222 18478 6574 1 15 . 1 1 65 65 TYR C C 65 173.944 173.944 177.381 -3.437 18478 6575 1 15 . 1 1 65 65 TYR CA C 65 61.205 61.205 61.087 0.118 18478 6576 1 15 . 1 1 65 65 TYR CB C 65 38.844 38.844 38.324 0.520 18478 6577 1 15 . 1 1 65 65 TYR H H 65 8.359 8.359 8.049 0.310 18478 6578 1 15 . 1 1 66 66 SER N N 66 114.836 114.836 112.099 2.737 18478 6579 1 15 . 1 1 66 66 SER HA H 66 3.505 3.505 4.377 -0.872 18478 6580 1 15 . 1 1 66 66 SER C C 66 173.697 173.697 175.415 -1.718 18478 6581 1 15 . 1 1 66 66 SER CA C 66 63.078 63.078 59.669 3.409 18478 6582 1 15 . 1 1 66 66 SER CB C 66 62.223 62.223 63.031 -0.808 18478 6583 1 15 . 1 1 66 66 SER H H 66 8.974 8.974 7.715 1.259 18478 6584 1 15 . 1 1 67 67 GLU N N 67 118.013 118.013 118.644 -0.631 18478 6585 1 15 . 1 1 67 67 GLU HA H 67 4.210 4.210 4.183 0.027 18478 6586 1 15 . 1 1 67 67 GLU C C 67 174.961 174.961 177.503 -2.542 18478 6587 1 15 . 1 1 67 67 GLU CA C 67 58.330 58.330 57.934 0.396 18478 6588 1 15 . 1 1 67 67 GLU CB C 67 30.205 30.205 31.086 -0.881 18478 6589 1 15 . 1 1 67 67 GLU H H 67 8.817 8.817 7.900 0.917 18478 6590 1 15 . 1 1 68 68 ASN N N 68 113.942 113.942 111.108 2.834 18478 6591 1 15 . 1 1 68 68 ASN HA H 68 5.015 5.015 5.035 -0.020 18478 6592 1 15 . 1 1 68 68 ASN C C 68 176.626 176.626 176.074 0.552 18478 6593 1 15 . 1 1 68 68 ASN CA C 68 53.768 53.768 51.316 2.452 18478 6594 1 15 . 1 1 68 68 ASN CB C 68 41.948 41.948 39.257 2.691 18478 6595 1 15 . 1 1 68 68 ASN H H 68 7.448 7.448 7.689 -0.241 18478 6596 1 15 . 1 1 69 69 LYS N N 69 124.584 124.584 121.563 3.021 18478 6597 1 15 . 1 1 69 69 LYS HA H 69 3.794 3.794 3.993 -0.199 18478 6598 1 15 . 1 1 69 69 LYS C C 69 173.330 173.330 175.316 -1.986 18478 6599 1 15 . 1 1 69 69 LYS CA C 69 61.225 61.225 57.670 3.555 18478 6600 1 15 . 1 1 69 69 LYS H H 69 7.592 7.592 8.607 -1.015 18478 6601 1 15 . 1 1 70 70 GLU N N 70 118.408 118.408 117.806 0.602 18478 6602 1 15 . 1 1 70 70 GLU HA H 70 4.005 4.005 4.838 -0.833 18478 6603 1 15 . 1 1 70 70 GLU C C 70 174.588 174.588 173.465 1.123 18478 6604 1 15 . 1 1 70 70 GLU CA C 70 58.695 58.695 52.933 5.762 18478 6605 1 15 . 1 1 70 70 GLU CB C 70 28.928 28.928 30.988 -2.060 18478 6606 1 15 . 1 1 70 70 GLU H H 70 8.478 8.478 8.239 0.239 18478 6607 1 15 . 1 1 71 71 LYS HA H 71 3.847 3.847 4.415 -0.568 18478 6608 1 15 . 1 1 71 71 LYS C C 71 173.420 173.420 175.286 -1.866 18478 6609 1 15 . 1 1 71 71 LYS CA C 71 58.718 58.718 55.379 3.339 18478 6610 1 15 . 1 1 71 71 LYS CB C 71 32.964 32.964 33.784 -0.820 18478 6611 1 15 . 1 1 72 72 TYR N N 72 112.358 112.358 122.979 -10.621 18478 6612 1 15 . 1 1 72 72 TYR HA H 72 4.790 4.790 4.294 0.496 18478 6613 1 15 . 1 1 72 72 TYR C C 72 174.442 174.442 176.139 -1.697 18478 6614 1 15 . 1 1 72 72 TYR CA C 72 55.287 55.287 59.267 -3.981 18478 6615 1 15 . 1 1 72 72 TYR CB C 72 37.244 37.244 38.445 -1.201 18478 6616 1 15 . 1 1 72 72 TYR H H 72 7.341 7.341 8.234 -0.893 18478 6617 1 15 . 1 1 73 73 GLY N N 73 110.612 110.612 107.872 2.740 18478 6618 1 15 . 1 1 73 73 GLY C C 73 177.982 177.982 173.501 4.481 18478 6619 1 15 . 1 1 73 73 GLY CA C 73 46.623 46.623 44.420 2.203 18478 6620 1 15 . 1 1 73 73 GLY H H 73 8.076 8.076 8.116 -0.040 18478 6621 1 15 . 1 1 74 74 LYS N N 74 121.009 121.009 120.762 0.247 18478 6622 1 15 . 1 1 74 74 LYS CA C 74 53.465 53.465 54.208 -0.743 18478 6623 1 15 . 1 1 74 74 LYS CB C 74 32.440 32.440 32.796 -0.356 18478 6624 1 15 . 1 1 74 74 LYS H H 74 7.411 7.411 7.883 -0.472 18478 6625 1 15 . 1 1 75 75 PRO HA H 75 4.452 4.452 4.322 0.130 18478 6626 1 15 . 1 1 75 75 PRO C C 75 174.959 174.959 178.005 -3.046 18478 6627 1 15 . 1 1 75 75 PRO CA C 75 62.861 62.861 64.469 -1.607 18478 6628 1 15 . 1 1 75 75 PRO CB C 75 32.407 32.407 31.677 0.730 18478 6629 1 15 . 1 1 76 76 ASN N N 76 121.045 121.045 119.331 1.714 18478 6630 1 15 . 1 1 76 76 ASN HA H 76 4.445 4.445 4.393 0.052 18478 6631 1 15 . 1 1 76 76 ASN C C 76 174.145 174.145 174.690 -0.545 18478 6632 1 15 . 1 1 76 76 ASN CA C 76 55.701 55.701 52.847 2.854 18478 6633 1 15 . 1 1 76 76 ASN H H 76 8.474 8.474 8.821 -0.347 18478 6634 1 15 . 1 1 77 77 LYS N N 77 111.466 111.466 120.493 -9.027 18478 6635 1 15 . 1 1 77 77 LYS HA H 77 4.369 4.369 4.174 0.195 18478 6636 1 15 . 1 1 77 77 LYS C C 77 173.881 173.881 176.680 -2.799 18478 6637 1 15 . 1 1 77 77 LYS CA C 77 55.995 55.995 56.353 -0.358 18478 6638 1 15 . 1 1 77 77 LYS CB C 77 32.538 32.538 32.344 0.193 18478 6639 1 15 . 1 1 77 77 LYS H H 77 8.543 8.543 7.903 0.640 18478 6640 1 15 . 1 1 78 78 ARG N N 78 122.233 122.233 119.778 2.455 18478 6641 1 15 . 1 1 78 78 ARG HA H 78 4.286 4.286 4.010 0.276 18478 6642 1 15 . 1 1 78 78 ARG C C 78 173.652 173.652 174.673 -1.021 18478 6643 1 15 . 1 1 78 78 ARG CA C 78 55.780 55.780 57.146 -1.366 18478 6644 1 15 . 1 1 78 78 ARG CB C 78 29.554 29.554 29.518 0.036 18478 6645 1 15 . 1 1 78 78 ARG H H 78 8.864 8.864 8.818 0.046 18478 6646 1 15 . 1 1 79 79 LYS N N 79 128.197 128.197 119.045 9.152 18478 6647 1 15 . 1 1 79 79 LYS HA H 79 4.221 4.221 4.558 -0.337 18478 6648 1 15 . 1 1 79 79 LYS C C 79 174.336 174.336 175.900 -1.564 18478 6649 1 15 . 1 1 79 79 LYS CA C 79 58.986 58.986 55.218 3.768 18478 6650 1 15 . 1 1 79 79 LYS CB C 79 32.072 32.072 32.804 -0.732 18478 6651 1 15 . 1 1 79 79 LYS H H 79 8.927 8.927 8.152 0.775 18478 6652 1 15 . 1 1 80 80 GLY N N 80 114.730 114.730 110.147 4.583 18478 6653 1 15 . 1 1 80 80 GLY C C 80 176.536 176.536 175.120 1.416 18478 6654 1 15 . 1 1 80 80 GLY CA C 80 45.992 45.992 45.962 0.031 18478 6655 1 15 . 1 1 80 80 GLY H H 80 8.943 8.943 8.270 0.673 18478 6656 1 15 . 1 1 81 81 PHE N N 81 123.770 123.770 120.512 3.258 18478 6657 1 15 . 1 1 81 81 PHE HA H 81 3.336 3.336 4.276 -0.940 18478 6658 1 15 . 1 1 81 81 PHE C C 81 174.037 174.037 176.192 -2.155 18478 6659 1 15 . 1 1 81 81 PHE CA C 81 63.094 63.094 60.285 2.809 18478 6660 1 15 . 1 1 81 81 PHE CB C 81 39.823 39.823 38.474 1.349 18478 6661 1 15 . 1 1 81 81 PHE H H 81 8.281 8.281 8.278 0.003 18478 6662 1 15 . 1 1 82 82 ASN N N 82 119.812 119.812 116.598 3.214 18478 6663 1 15 . 1 1 82 82 ASN HA H 82 4.458 4.458 4.306 0.152 18478 6664 1 15 . 1 1 82 82 ASN C C 82 171.290 171.290 176.432 -5.142 18478 6665 1 15 . 1 1 82 82 ASN CA C 82 56.060 56.060 56.032 0.028 18478 6666 1 15 . 1 1 82 82 ASN CB C 82 36.390 36.390 38.362 -1.972 18478 6667 1 15 . 1 1 82 82 ASN H H 82 9.145 9.145 8.490 0.655 18478 6668 1 15 . 1 1 83 83 GLU N N 83 124.411 124.411 119.012 5.399 18478 6669 1 15 . 1 1 83 83 GLU HA H 83 4.186 4.186 3.987 0.199 18478 6670 1 15 . 1 1 83 83 GLU C C 83 172.222 172.222 178.722 -6.500 18478 6671 1 15 . 1 1 83 83 GLU CA C 83 60.922 60.922 59.132 1.790 18478 6672 1 15 . 1 1 83 83 GLU CB C 83 28.132 28.132 29.968 -1.836 18478 6673 1 15 . 1 1 83 83 GLU H H 83 9.560 9.560 8.183 1.377 18478 6674 1 15 . 1 1 84 84 GLY N N 84 111.388 111.388 106.663 4.725 18478 6675 1 15 . 1 1 84 84 GLY C C 84 176.445 176.445 174.869 1.576 18478 6676 1 15 . 1 1 84 84 GLY CA C 84 46.727 46.727 46.541 0.186 18478 6677 1 15 . 1 1 84 84 GLY H H 84 8.364 8.364 7.270 1.094 18478 6678 1 15 . 1 1 85 85 LEU N N 85 121.153 121.153 120.888 0.265 18478 6679 1 15 . 1 1 85 85 LEU HA H 85 4.236 4.236 4.284 -0.048 18478 6680 1 15 . 1 1 85 85 LEU C C 85 172.285 172.285 177.688 -5.403 18478 6681 1 15 . 1 1 85 85 LEU CA C 85 56.795 56.795 56.805 -0.010 18478 6682 1 15 . 1 1 85 85 LEU CB C 85 41.113 41.113 42.796 -1.683 18478 6683 1 15 . 1 1 85 85 LEU H H 85 8.294 8.294 7.743 0.551 18478 6684 1 15 . 1 1 86 86 TRP N N 86 118.898 118.898 118.647 0.251 18478 6685 1 15 . 1 1 86 86 TRP HA H 86 4.161 4.161 4.330 -0.169 18478 6686 1 15 . 1 1 86 86 TRP C C 86 171.741 171.741 176.455 -4.714 18478 6687 1 15 . 1 1 86 86 TRP CA C 86 62.153 62.153 58.470 3.683 18478 6688 1 15 . 1 1 86 86 TRP CB C 86 28.424 28.424 29.795 -1.371 18478 6689 1 15 . 1 1 86 86 TRP H H 86 7.783 7.783 7.333 0.450 18478 6690 1 15 . 1 1 87 87 GLU N N 87 120.718 120.718 119.743 0.975 18478 6691 1 15 . 1 1 87 87 GLU HA H 87 3.416 3.416 4.676 -1.260 18478 6692 1 15 . 1 1 87 87 GLU C C 87 172.957 172.957 174.977 -2.020 18478 6693 1 15 . 1 1 87 87 GLU CA C 87 60.122 60.122 53.253 6.869 18478 6694 1 15 . 1 1 87 87 GLU CB C 87 31.021 31.021 30.487 0.534 18478 6695 1 15 . 1 1 87 87 GLU H H 87 8.779 8.779 7.535 1.244 18478 6696 1 15 . 1 1 88 88 ILE HA H 88 2.478 2.478 4.266 -1.788 18478 6697 1 15 . 1 1 88 88 ILE C C 88 177.873 177.873 177.379 0.494 18478 6698 1 15 . 1 1 88 88 ILE CA C 88 65.248 65.248 62.205 3.043 18478 6699 1 15 . 1 1 88 88 ILE CB C 88 37.327 37.327 38.447 -1.120 18478 6700 1 15 . 1 1 89 89 ASP N N 89 114.411 114.411 118.914 -4.503 18478 6701 1 15 . 1 1 89 89 ASP HA H 89 4.589 4.589 4.442 0.147 18478 6702 1 15 . 1 1 89 89 ASP C C 89 174.207 174.207 177.279 -3.072 18478 6703 1 15 . 1 1 89 89 ASP CA C 89 54.740 54.740 56.303 -1.563 18478 6704 1 15 . 1 1 89 89 ASP CB C 89 42.473 42.473 40.332 2.141 18478 6705 1 15 . 1 1 89 89 ASP H H 89 5.911 5.911 7.731 -1.820 18478 6706 1 15 . 1 1 90 90 ASN N N 90 114.358 114.358 111.376 2.982 18478 6707 1 15 . 1 1 90 90 ASN HA H 90 4.420 4.420 4.432 -0.012 18478 6708 1 15 . 1 1 90 90 ASN C C 90 176.991 176.991 177.483 -0.492 18478 6709 1 15 . 1 1 90 90 ASN CA C 90 54.855 54.855 55.827 -0.972 18478 6710 1 15 . 1 1 90 90 ASN CB C 90 40.582 40.582 38.479 2.103 18478 6711 1 15 . 1 1 90 90 ASN H H 90 7.480 7.480 7.603 -0.123 18478 6712 1 15 . 1 1 91 91 ASN N N 91 119.185 119.185 115.443 3.742 18478 6713 1 15 . 1 1 91 91 ASN HA H 91 5.006 5.006 4.781 0.225 18478 6714 1 15 . 1 1 91 91 ASN CA C 91 51.624 51.624 53.947 -2.323 18478 6715 1 15 . 1 1 91 91 ASN CB C 91 38.752 38.752 38.880 -0.128 18478 6716 1 15 . 1 1 91 91 ASN H H 91 9.238 9.238 7.820 1.418 18478 6717 1 15 . 1 1 92 92 PRO HA H 92 4.296 4.296 4.128 0.168 18478 6718 1 15 . 1 1 92 92 PRO C C 92 173.690 173.690 175.881 -2.191 18478 6719 1 15 . 1 1 92 92 PRO CA C 92 64.714 64.714 63.955 0.759 18478 6720 1 15 . 1 1 92 92 PRO CB C 92 31.781 31.781 32.970 -1.189 18478 6721 1 16 . 1 1 3 3 GLY C C 3 177.088 177.088 172.588 4.500 18478 6722 1 16 . 1 1 3 3 GLY CA C 3 45.330 45.330 46.231 -0.901 18478 6723 1 16 . 1 1 4 4 SER N N 4 115.847 115.847 110.271 5.576 18478 6724 1 16 . 1 1 4 4 SER HA H 4 4.480 4.480 4.753 -0.273 18478 6725 1 16 . 1 1 4 4 SER C C 4 177.991 177.991 172.026 5.965 18478 6726 1 16 . 1 1 4 4 SER CA C 4 58.742 58.742 57.988 0.754 18478 6727 1 16 . 1 1 4 4 SER CB C 4 63.820 63.820 65.804 -1.984 18478 6728 1 16 . 1 1 4 4 SER H H 4 8.207 8.207 7.817 0.390 18478 6729 1 16 . 1 1 5 5 MET N N 5 125.867 125.867 120.699 5.168 18478 6730 1 16 . 1 1 5 5 MET HA H 5 4.580 4.580 4.754 -0.174 18478 6731 1 16 . 1 1 5 5 MET C C 5 174.825 174.825 175.784 -0.959 18478 6732 1 16 . 1 1 5 5 MET CA C 5 54.733 54.733 53.582 1.151 18478 6733 1 16 . 1 1 5 5 MET CB C 5 33.527 33.527 35.674 -2.147 18478 6734 1 16 . 1 1 5 5 MET H H 5 8.148 8.148 8.714 -0.566 18478 6735 1 16 . 1 1 6 6 THR N N 6 115.828 115.828 116.720 -0.892 18478 6736 1 16 . 1 1 6 6 THR HA H 6 3.903 3.903 4.371 -0.468 18478 6737 1 16 . 1 1 6 6 THR C C 6 176.930 176.930 173.120 3.810 18478 6738 1 16 . 1 1 6 6 THR CA C 6 63.034 63.034 62.212 0.822 18478 6739 1 16 . 1 1 6 6 THR CB C 6 69.308 69.308 68.706 0.602 18478 6740 1 16 . 1 1 6 6 THR H H 6 8.408 8.408 8.496 -0.088 18478 6741 1 16 . 1 1 7 7 ARG HA H 7 4.276 4.276 4.250 0.026 18478 6742 1 16 . 1 1 7 7 ARG C C 7 176.546 176.546 176.019 0.527 18478 6743 1 16 . 1 1 7 7 ARG CA C 7 55.813 55.813 56.630 -0.817 18478 6744 1 16 . 1 1 7 7 ARG CB C 7 30.556 30.556 30.332 0.224 18478 6745 1 16 . 1 1 8 8 ASP N N 8 121.762 121.762 125.550 -3.788 18478 6746 1 16 . 1 1 8 8 ASP HA H 8 4.537 4.537 4.223 0.314 18478 6747 1 16 . 1 1 8 8 ASP C C 8 177.750 177.750 175.445 2.305 18478 6748 1 16 . 1 1 8 8 ASP CA C 8 54.117 54.117 54.590 -0.473 18478 6749 1 16 . 1 1 8 8 ASP H H 8 8.066 8.066 8.344 -0.278 18478 6750 1 16 . 1 1 9 9 PHE N N 9 119.991 119.991 118.233 1.758 18478 6751 1 16 . 1 1 9 9 PHE HA H 9 4.734 4.734 4.759 -0.025 18478 6752 1 16 . 1 1 9 9 PHE C C 9 176.838 176.838 175.614 1.224 18478 6753 1 16 . 1 1 9 9 PHE CA C 9 58.303 58.303 56.562 1.741 18478 6754 1 16 . 1 1 9 9 PHE CB C 9 41.594 41.594 40.847 0.747 18478 6755 1 16 . 1 1 9 9 PHE H H 9 8.103 8.103 7.569 0.534 18478 6756 1 16 . 1 1 10 10 LYS N N 10 122.957 122.957 121.961 0.996 18478 6757 1 16 . 1 1 10 10 LYS CA C 10 53.167 53.167 56.215 -3.048 18478 6758 1 16 . 1 1 10 10 LYS CB C 10 33.495 33.495 31.869 1.626 18478 6759 1 16 . 1 1 10 10 LYS H H 10 9.087 9.087 8.629 0.458 18478 6760 1 16 . 1 1 11 11 PRO HA H 11 3.903 3.903 5.013 -1.110 18478 6761 1 16 . 1 1 11 11 PRO C C 11 173.988 173.988 174.749 -0.761 18478 6762 1 16 . 1 1 11 11 PRO CA C 11 63.874 63.874 61.082 2.792 18478 6763 1 16 . 1 1 11 11 PRO CB C 11 31.623 31.623 35.117 -3.494 18478 6764 1 16 . 1 1 12 12 GLY N N 12 115.413 115.413 110.621 4.792 18478 6765 1 16 . 1 1 12 12 GLY C C 12 176.966 176.966 172.539 4.427 18478 6766 1 16 . 1 1 12 12 GLY CA C 12 44.651 44.651 42.286 2.365 18478 6767 1 16 . 1 1 12 12 GLY H H 12 9.667 9.667 9.049 0.618 18478 6768 1 16 . 1 1 13 13 ASP N N 13 122.208 122.208 128.631 -6.423 18478 6769 1 16 . 1 1 13 13 ASP HA H 13 4.601 4.601 4.660 -0.059 18478 6770 1 16 . 1 1 13 13 ASP C C 13 176.244 176.244 174.276 1.968 18478 6771 1 16 . 1 1 13 13 ASP CA C 13 55.870 55.870 52.163 3.707 18478 6772 1 16 . 1 1 13 13 ASP CB C 13 40.794 40.794 42.514 -1.720 18478 6773 1 16 . 1 1 13 13 ASP H H 13 8.303 8.303 8.556 -0.253 18478 6774 1 16 . 1 1 14 14 LEU N N 14 121.306 121.306 126.454 -5.148 18478 6775 1 16 . 1 1 14 14 LEU HA H 14 4.982 4.982 4.562 0.420 18478 6776 1 16 . 1 1 14 14 LEU C C 14 173.461 173.461 176.171 -2.710 18478 6777 1 16 . 1 1 14 14 LEU CA C 14 54.516 54.516 53.989 0.527 18478 6778 1 16 . 1 1 14 14 LEU CB C 14 40.999 40.999 41.997 -0.998 18478 6779 1 16 . 1 1 14 14 LEU H H 14 8.618 8.618 7.814 0.804 18478 6780 1 16 . 1 1 15 15 ILE N N 15 118.806 118.806 125.567 -6.761 18478 6781 1 16 . 1 1 15 15 ILE HA H 15 5.356 5.356 4.322 1.034 18478 6782 1 16 . 1 1 15 15 ILE C C 15 175.982 175.982 175.907 0.075 18478 6783 1 16 . 1 1 15 15 ILE CA C 15 60.481 60.481 59.827 0.654 18478 6784 1 16 . 1 1 15 15 ILE CB C 15 44.142 44.142 40.590 3.552 18478 6785 1 16 . 1 1 15 15 ILE H H 15 8.864 8.864 8.625 0.239 18478 6786 1 16 . 1 1 16 16 PHE N N 16 112.472 112.472 122.909 -10.437 18478 6787 1 16 . 1 1 16 16 PHE HA H 16 5.306 5.306 4.400 0.906 18478 6788 1 16 . 1 1 16 16 PHE C C 16 176.239 176.239 176.296 -0.057 18478 6789 1 16 . 1 1 16 16 PHE CA C 16 58.603 58.603 58.816 -0.212 18478 6790 1 16 . 1 1 16 16 PHE CB C 16 43.305 43.305 37.949 5.356 18478 6791 1 16 . 1 1 16 16 PHE H H 16 9.411 9.411 8.566 0.845 18478 6792 1 16 . 1 1 17 17 ALA N N 17 123.889 123.889 125.873 -1.984 18478 6793 1 16 . 1 1 17 17 ALA HA H 17 5.348 5.348 3.563 1.785 18478 6794 1 16 . 1 1 17 17 ALA C C 17 174.426 174.426 176.280 -1.854 18478 6795 1 16 . 1 1 17 17 ALA CA C 17 50.062 50.062 51.723 -1.661 18478 6796 1 16 . 1 1 17 17 ALA H H 17 9.658 9.658 8.574 1.084 18478 6797 1 16 . 1 1 18 18 LYS N N 18 127.760 127.760 120.711 7.049 18478 6798 1 16 . 1 1 18 18 LYS HA H 18 4.697 4.697 4.711 -0.014 18478 6799 1 16 . 1 1 18 18 LYS C C 18 178.554 178.554 174.414 4.140 18478 6800 1 16 . 1 1 18 18 LYS CA C 18 53.893 53.893 52.256 1.637 18478 6801 1 16 . 1 1 18 18 LYS CB C 18 35.291 35.291 32.710 2.581 18478 6802 1 16 . 1 1 18 18 LYS H H 18 9.421 9.421 7.340 2.081 18478 6803 1 16 . 1 1 19 19 MET HA H 19 4.656 4.656 4.356 0.300 18478 6804 1 16 . 1 1 19 19 MET C C 19 175.741 175.741 174.863 0.878 18478 6805 1 16 . 1 1 19 19 MET CA C 19 53.916 53.916 54.768 -0.852 18478 6806 1 16 . 1 1 19 19 MET CB C 19 35.799 35.799 33.661 2.138 18478 6807 1 16 . 1 1 20 20 LYS N N 20 124.062 124.062 119.178 4.884 18478 6808 1 16 . 1 1 20 20 LYS CA C 20 58.585 58.585 57.239 1.345 18478 6809 1 16 . 1 1 20 20 LYS CB C 20 31.978 31.978 32.510 -0.532 18478 6810 1 16 . 1 1 20 20 LYS H H 20 8.645 8.645 8.151 0.494 18478 6811 1 16 . 1 1 21 21 GLY C C 21 176.205 176.205 172.068 4.137 18478 6812 1 16 . 1 1 21 21 GLY CA C 21 45.142 45.142 41.574 3.568 18478 6813 1 16 . 1 1 22 22 TYR HA H 22 4.573 4.573 4.831 -0.258 18478 6814 1 16 . 1 1 22 22 TYR CA C 22 55.748 55.748 57.888 -2.140 18478 6815 1 16 . 1 1 22 22 TYR CB C 22 41.331 41.331 38.131 3.200 18478 6816 1 16 . 1 1 23 23 PRO HA H 23 4.759 4.759 4.875 -0.116 18478 6817 1 16 . 1 1 23 23 PRO C C 23 174.587 174.587 175.227 -0.640 18478 6818 1 16 . 1 1 23 23 PRO CA C 23 62.072 62.072 61.234 0.838 18478 6819 1 16 . 1 1 23 23 PRO CB C 23 31.077 31.077 34.917 -3.840 18478 6820 1 16 . 1 1 24 24 HIS N N 24 119.190 119.190 114.810 4.380 18478 6821 1 16 . 1 1 24 24 HIS HA H 24 3.983 3.983 5.621 -1.638 18478 6822 1 16 . 1 1 24 24 HIS C C 24 175.555 175.555 173.884 1.671 18478 6823 1 16 . 1 1 24 24 HIS CA C 24 60.973 60.973 54.234 6.739 18478 6824 1 16 . 1 1 24 24 HIS CB C 24 30.689 30.689 32.649 -1.960 18478 6825 1 16 . 1 1 24 24 HIS H H 24 8.158 8.158 8.354 -0.196 18478 6826 1 16 . 1 1 25 25 TRP N N 25 127.435 127.435 122.298 5.137 18478 6827 1 16 . 1 1 25 25 TRP HA H 25 3.760 3.760 5.419 -1.659 18478 6828 1 16 . 1 1 25 25 TRP CA C 25 55.890 55.890 56.724 -0.834 18478 6829 1 16 . 1 1 25 25 TRP CB C 25 32.879 32.879 30.598 2.281 18478 6830 1 16 . 1 1 25 25 TRP H H 25 9.211 9.211 8.799 0.412 18478 6831 1 16 . 1 1 26 26 PRO HA H 26 4.217 4.217 4.561 -0.344 18478 6832 1 16 . 1 1 26 26 PRO C C 26 176.279 176.279 176.177 0.102 18478 6833 1 16 . 1 1 26 26 PRO CA C 26 63.140 63.140 61.608 1.532 18478 6834 1 16 . 1 1 26 26 PRO CB C 26 32.171 32.171 34.351 -2.180 18478 6835 1 16 . 1 1 27 27 ALA N N 27 130.162 130.162 123.055 7.107 18478 6836 1 16 . 1 1 27 27 ALA HA H 27 4.981 4.981 4.218 0.763 18478 6837 1 16 . 1 1 27 27 ALA C C 27 177.227 177.227 177.041 0.186 18478 6838 1 16 . 1 1 27 27 ALA CA C 27 52.574 52.574 51.032 1.542 18478 6839 1 16 . 1 1 27 27 ALA CB C 27 23.239 23.239 19.567 3.672 18478 6840 1 16 . 1 1 27 27 ALA H H 27 9.394 9.394 8.136 1.258 18478 6841 1 16 . 1 1 28 28 ARG N N 28 117.381 117.381 121.654 -4.273 18478 6842 1 16 . 1 1 28 28 ARG HA H 28 5.421 5.421 4.449 0.972 18478 6843 1 16 . 1 1 28 28 ARG C C 28 176.465 176.465 175.088 1.377 18478 6844 1 16 . 1 1 28 28 ARG CA C 28 53.662 53.662 54.508 -0.846 18478 6845 1 16 . 1 1 28 28 ARG CB C 28 35.058 35.058 30.710 4.348 18478 6846 1 16 . 1 1 28 28 ARG H H 28 8.806 8.806 8.384 0.422 18478 6847 1 16 . 1 1 29 29 VAL HA H 29 4.109 4.109 4.293 -0.184 18478 6848 1 16 . 1 1 29 29 VAL C C 29 175.996 175.996 174.614 1.382 18478 6849 1 16 . 1 1 29 29 VAL CA C 29 62.810 62.810 61.523 1.287 18478 6850 1 16 . 1 1 29 29 VAL CB C 29 31.108 31.108 32.939 -1.831 18478 6851 1 16 . 1 1 30 30 ASP N N 30 133.830 133.830 119.896 13.934 18478 6852 1 16 . 1 1 30 30 ASP HA H 30 5.198 5.198 4.627 0.571 18478 6853 1 16 . 1 1 30 30 ASP C C 30 176.207 176.207 177.419 -1.212 18478 6854 1 16 . 1 1 30 30 ASP CA C 30 53.007 53.007 54.655 -1.648 18478 6855 1 16 . 1 1 30 30 ASP CB C 30 44.130 44.130 41.355 2.775 18478 6856 1 16 . 1 1 30 30 ASP H H 30 8.892 8.892 8.460 0.432 18478 6857 1 16 . 1 1 31 31 GLU N N 31 115.905 115.905 120.483 -4.578 18478 6858 1 16 . 1 1 31 31 GLU HA H 31 4.409 4.409 3.970 0.439 18478 6859 1 16 . 1 1 31 31 GLU C C 31 175.192 175.192 176.121 -0.929 18478 6860 1 16 . 1 1 31 31 GLU CA C 31 55.389 55.389 56.470 -1.081 18478 6861 1 16 . 1 1 31 31 GLU H H 31 7.966 7.966 8.877 -0.911 18478 6862 1 16 . 1 1 32 32 VAL N N 32 122.794 122.794 117.074 5.720 18478 6863 1 16 . 1 1 32 32 VAL HA H 32 4.303 4.303 3.764 0.539 18478 6864 1 16 . 1 1 32 32 VAL CA C 32 60.408 60.408 62.816 -2.408 18478 6865 1 16 . 1 1 32 32 VAL CB C 32 32.333 32.333 30.528 1.805 18478 6866 1 16 . 1 1 32 32 VAL H H 32 8.702 8.702 7.947 0.755 18478 6867 1 16 . 1 1 33 33 PRO HA H 33 4.572 4.572 4.170 0.403 18478 6868 1 16 . 1 1 33 33 PRO C C 33 175.366 175.366 178.012 -2.646 18478 6869 1 16 . 1 1 33 33 PRO CA C 33 63.702 63.702 65.032 -1.330 18478 6870 1 16 . 1 1 33 33 PRO CB C 33 32.736 32.736 31.954 0.782 18478 6871 1 16 . 1 1 34 34 ASP N N 34 119.187 119.187 119.140 0.047 18478 6872 1 16 . 1 1 34 34 ASP HA H 34 4.679 4.679 4.924 -0.245 18478 6873 1 16 . 1 1 34 34 ASP C C 34 175.713 175.713 173.754 1.959 18478 6874 1 16 . 1 1 34 34 ASP CA C 34 53.013 53.013 52.258 0.755 18478 6875 1 16 . 1 1 34 34 ASP CB C 34 40.850 40.850 40.905 -0.055 18478 6876 1 16 . 1 1 34 34 ASP H H 34 8.686 8.686 7.914 0.772 18478 6877 1 16 . 1 1 35 35 GLY C C 35 177.458 177.458 172.902 4.556 18478 6878 1 16 . 1 1 35 35 GLY CA C 35 45.507 45.507 43.887 1.620 18478 6879 1 16 . 1 1 36 36 ALA HA H 36 4.404 4.404 4.356 0.048 18478 6880 1 16 . 1 1 36 36 ALA CA C 36 52.010 52.010 51.833 0.177 18478 6881 1 16 . 1 1 36 36 ALA CB C 36 19.909 19.909 19.749 0.160 18478 6882 1 16 . 1 1 37 37 VAL N N 37 119.594 119.594 121.235 -1.641 18478 6883 1 16 . 1 1 37 37 VAL HA H 37 3.932 3.932 4.179 -0.247 18478 6884 1 16 . 1 1 37 37 VAL C C 37 175.966 175.966 176.023 -0.057 18478 6885 1 16 . 1 1 37 37 VAL CA C 37 62.810 62.810 64.201 -1.391 18478 6886 1 16 . 1 1 37 37 VAL CB C 37 32.267 32.267 32.935 -0.668 18478 6887 1 16 . 1 1 37 37 VAL H H 37 8.037 8.037 8.678 -0.641 18478 6888 1 16 . 1 1 38 38 LYS N N 38 125.676 125.676 121.083 4.593 18478 6889 1 16 . 1 1 38 38 LYS C C 38 173.865 173.865 174.472 -0.607 18478 6890 1 16 . 1 1 38 38 LYS CA C 38 54.278 54.278 56.648 -2.370 18478 6891 1 16 . 1 1 38 38 LYS CB C 38 31.740 31.740 33.793 -2.053 18478 6892 1 16 . 1 1 38 38 LYS H H 38 8.292 8.292 8.431 -0.139 18478 6893 1 16 . 1 1 40 40 PRO HA H 40 4.387 4.387 5.234 -0.847 18478 6894 1 16 . 1 1 40 40 PRO C C 40 175.535 175.535 175.311 0.224 18478 6895 1 16 . 1 1 40 40 PRO CA C 40 62.330 62.330 59.667 2.663 18478 6896 1 16 . 1 1 40 40 PRO CB C 40 32.086 32.086 31.758 0.328 18478 6897 1 16 . 1 1 41 41 THR HA H 41 4.027 4.027 4.495 -0.468 18478 6898 1 16 . 1 1 41 41 THR C C 41 176.795 176.795 173.079 3.716 18478 6899 1 16 . 1 1 41 41 THR CA C 41 63.693 63.693 62.214 1.479 18478 6900 1 16 . 1 1 41 41 THR CB C 41 69.370 69.370 69.023 0.347 18478 6901 1 16 . 1 1 42 42 ASN N N 42 118.513 118.513 121.932 -3.419 18478 6902 1 16 . 1 1 42 42 ASN HA H 42 4.530 4.530 5.283 -0.753 18478 6903 1 16 . 1 1 42 42 ASN C C 42 177.230 177.230 174.868 2.362 18478 6904 1 16 . 1 1 42 42 ASN CA C 42 56.373 56.373 50.319 6.054 18478 6905 1 16 . 1 1 42 42 ASN CB C 42 37.618 37.618 38.179 -0.561 18478 6906 1 16 . 1 1 42 42 ASN H H 42 8.752 8.752 8.737 0.015 18478 6907 1 16 . 1 1 43 43 LYS N N 43 115.898 115.898 129.108 -13.210 18478 6908 1 16 . 1 1 43 43 LYS HA H 43 4.710 4.710 4.733 -0.023 18478 6909 1 16 . 1 1 43 43 LYS C C 43 177.032 177.032 175.504 1.528 18478 6910 1 16 . 1 1 43 43 LYS CA C 43 54.957 54.957 54.400 0.557 18478 6911 1 16 . 1 1 43 43 LYS CB C 43 36.600 36.600 32.983 3.617 18478 6912 1 16 . 1 1 43 43 LYS H H 43 7.723 7.723 8.731 -1.008 18478 6913 1 16 . 1 1 44 44 LEU N N 44 121.006 121.006 129.261 -8.255 18478 6914 1 16 . 1 1 44 44 LEU HA H 44 5.000 5.000 4.209 0.791 18478 6915 1 16 . 1 1 44 44 LEU CA C 44 51.842 51.842 55.277 -3.435 18478 6916 1 16 . 1 1 44 44 LEU CB C 44 44.418 44.418 42.071 2.347 18478 6917 1 16 . 1 1 44 44 LEU H H 44 9.063 9.063 8.589 0.474 18478 6918 1 16 . 1 1 45 45 PRO HA H 45 4.392 4.392 4.452 -0.060 18478 6919 1 16 . 1 1 45 45 PRO C C 45 177.051 177.051 178.693 -1.642 18478 6920 1 16 . 1 1 45 45 PRO CA C 45 62.000 62.000 65.161 -3.161 18478 6921 1 16 . 1 1 45 45 PRO CB C 45 30.737 30.737 32.536 -1.799 18478 6922 1 16 . 1 1 46 46 ILE N N 46 125.996 125.996 124.333 1.663 18478 6923 1 16 . 1 1 46 46 ILE HA H 46 4.564 4.564 4.144 0.420 18478 6924 1 16 . 1 1 46 46 ILE C C 46 176.985 176.985 176.947 0.038 18478 6925 1 16 . 1 1 46 46 ILE CA C 46 57.051 57.051 62.845 -5.794 18478 6926 1 16 . 1 1 46 46 ILE H H 46 8.908 8.908 9.035 -0.127 18478 6927 1 16 . 1 1 47 47 PHE N N 47 128.276 128.276 118.983 9.293 18478 6928 1 16 . 1 1 47 47 PHE HA H 47 4.827 4.827 4.292 0.535 18478 6929 1 16 . 1 1 47 47 PHE C C 47 177.835 177.835 176.351 1.484 18478 6930 1 16 . 1 1 47 47 PHE CA C 47 56.099 56.099 58.372 -2.273 18478 6931 1 16 . 1 1 47 47 PHE CB C 47 41.217 41.217 39.736 1.481 18478 6932 1 16 . 1 1 47 47 PHE H H 47 8.739 8.739 7.442 1.297 18478 6933 1 16 . 1 1 48 48 PHE N N 48 125.953 125.953 118.216 7.737 18478 6934 1 16 . 1 1 48 48 PHE HA H 48 4.251 4.251 3.661 0.590 18478 6935 1 16 . 1 1 48 48 PHE C C 48 175.869 175.869 173.715 2.154 18478 6936 1 16 . 1 1 48 48 PHE CA C 48 56.744 56.744 59.873 -3.129 18478 6937 1 16 . 1 1 48 48 PHE CB C 48 38.835 38.835 36.209 2.626 18478 6938 1 16 . 1 1 48 48 PHE H H 48 8.545 8.545 7.840 0.705 18478 6939 1 16 . 1 1 49 49 PHE N N 49 122.197 122.197 117.137 5.060 18478 6940 1 16 . 1 1 49 49 PHE HA H 49 4.400 4.400 4.475 -0.075 18478 6941 1 16 . 1 1 49 49 PHE C C 49 174.016 174.016 174.777 -0.761 18478 6942 1 16 . 1 1 49 49 PHE CA C 49 59.916 59.916 57.450 2.466 18478 6943 1 16 . 1 1 49 49 PHE CB C 49 39.799 39.799 40.446 -0.647 18478 6944 1 16 . 1 1 49 49 PHE H H 49 8.619 8.619 7.439 1.180 18478 6945 1 16 . 1 1 50 50 GLY N N 50 114.083 114.083 108.008 6.075 18478 6946 1 16 . 1 1 50 50 GLY C C 50 175.636 175.636 173.175 2.461 18478 6947 1 16 . 1 1 50 50 GLY CA C 50 46.718 46.718 43.955 2.763 18478 6948 1 16 . 1 1 50 50 GLY H H 50 10.329 10.329 8.133 2.196 18478 6949 1 16 . 1 1 51 51 THR N N 51 111.210 111.210 121.063 -9.853 18478 6950 1 16 . 1 1 51 51 THR HA H 51 3.980 3.980 4.668 -0.688 18478 6951 1 16 . 1 1 51 51 THR C C 51 175.588 175.588 171.998 3.590 18478 6952 1 16 . 1 1 51 51 THR CA C 51 62.223 62.223 60.971 1.252 18478 6953 1 16 . 1 1 51 51 THR CB C 51 68.346 68.346 72.380 -4.034 18478 6954 1 16 . 1 1 51 51 THR H H 51 7.882 7.882 8.717 -0.835 18478 6955 1 16 . 1 1 52 52 HIS N N 52 115.544 115.544 119.947 -4.403 18478 6956 1 16 . 1 1 52 52 HIS HA H 52 3.712 3.712 5.367 -1.655 18478 6957 1 16 . 1 1 52 52 HIS C C 52 177.717 177.717 175.225 2.492 18478 6958 1 16 . 1 1 52 52 HIS CA C 52 54.860 54.860 54.519 0.341 18478 6959 1 16 . 1 1 52 52 HIS CB C 52 26.388 26.388 30.040 -3.652 18478 6960 1 16 . 1 1 52 52 HIS H H 52 7.791 7.791 8.520 -0.729 18478 6961 1 16 . 1 1 53 53 GLU N N 53 117.517 117.517 123.763 -6.246 18478 6962 1 16 . 1 1 53 53 GLU HA H 53 4.298 4.298 4.781 -0.483 18478 6963 1 16 . 1 1 53 53 GLU C C 53 176.958 176.958 176.708 0.250 18478 6964 1 16 . 1 1 53 53 GLU CA C 53 55.403 55.403 55.039 0.364 18478 6965 1 16 . 1 1 53 53 GLU CB C 53 31.588 31.588 32.926 -1.338 18478 6966 1 16 . 1 1 53 53 GLU H H 53 6.795 6.795 8.287 -1.492 18478 6967 1 16 . 1 1 54 54 THR N N 54 111.182 111.182 116.865 -5.683 18478 6968 1 16 . 1 1 54 54 THR HA H 54 5.648 5.648 4.302 1.346 18478 6969 1 16 . 1 1 54 54 THR C C 54 177.234 177.234 174.283 2.951 18478 6970 1 16 . 1 1 54 54 THR CA C 54 59.894 59.894 61.231 -1.337 18478 6971 1 16 . 1 1 54 54 THR H H 54 8.139 8.139 8.718 -0.579 18478 6972 1 16 . 1 1 55 55 ALA HA H 55 4.403 4.403 4.064 0.339 18478 6973 1 16 . 1 1 55 55 ALA C C 55 176.601 176.601 177.771 -1.170 18478 6974 1 16 . 1 1 55 55 ALA CA C 55 51.079 51.079 52.988 -1.909 18478 6975 1 16 . 1 1 55 55 ALA CB C 55 23.285 23.285 19.076 4.209 18478 6976 1 16 . 1 1 56 56 PHE N N 56 118.058 118.058 113.058 5.000 18478 6977 1 16 . 1 1 56 56 PHE HA H 56 5.678 5.678 4.618 1.060 18478 6978 1 16 . 1 1 56 56 PHE C C 56 175.962 175.962 174.712 1.250 18478 6979 1 16 . 1 1 56 56 PHE CA C 56 56.008 56.008 58.272 -2.264 18478 6980 1 16 . 1 1 56 56 PHE CB C 56 39.995 39.995 37.592 2.403 18478 6981 1 16 . 1 1 56 56 PHE H H 56 8.523 8.523 8.205 0.318 18478 6982 1 16 . 1 1 57 57 LEU N N 57 123.344 123.344 120.665 2.679 18478 6983 1 16 . 1 1 57 57 LEU HA H 57 4.929 4.929 4.645 0.284 18478 6984 1 16 . 1 1 57 57 LEU C C 57 175.584 175.584 174.865 0.719 18478 6985 1 16 . 1 1 57 57 LEU CA C 57 53.463 53.463 55.167 -1.704 18478 6986 1 16 . 1 1 57 57 LEU CB C 57 46.545 46.545 44.110 2.435 18478 6987 1 16 . 1 1 57 57 LEU H H 57 8.579 8.579 7.604 0.975 18478 6988 1 16 . 1 1 58 58 GLY N N 58 108.499 108.499 107.111 1.388 18478 6989 1 16 . 1 1 58 58 GLY CA C 58 43.755 43.755 45.064 -1.309 18478 6990 1 16 . 1 1 58 58 GLY H H 58 9.318 9.318 7.175 2.143 18478 6991 1 16 . 1 1 59 59 PRO HA H 59 4.048 4.048 4.940 -0.892 18478 6992 1 16 . 1 1 59 59 PRO C C 59 173.763 173.763 174.704 -0.941 18478 6993 1 16 . 1 1 59 59 PRO CA C 59 64.770 64.770 60.622 4.148 18478 6994 1 16 . 1 1 59 59 PRO CB C 59 31.889 31.889 35.718 -3.829 18478 6995 1 16 . 1 1 60 60 LYS HA H 60 4.191 4.191 4.628 -0.437 18478 6996 1 16 . 1 1 60 60 LYS C C 60 174.842 174.842 176.636 -1.794 18478 6997 1 16 . 1 1 60 60 LYS CA C 60 57.875 57.875 56.094 1.781 18478 6998 1 16 . 1 1 60 60 LYS CB C 60 31.576 31.576 32.903 -1.327 18478 6999 1 16 . 1 1 61 61 ASP N N 61 117.768 117.768 122.825 -5.057 18478 7000 1 16 . 1 1 61 61 ASP HA H 61 4.973 4.973 4.319 0.654 18478 7001 1 16 . 1 1 61 61 ASP C C 61 178.178 178.178 177.114 1.064 18478 7002 1 16 . 1 1 61 61 ASP CA C 61 54.687 54.687 55.728 -1.041 18478 7003 1 16 . 1 1 61 61 ASP CB C 61 43.555 43.555 39.885 3.670 18478 7004 1 16 . 1 1 61 61 ASP H H 61 7.722 7.722 8.872 -1.150 18478 7005 1 16 . 1 1 62 62 ILE N N 62 114.244 114.244 121.887 -7.643 18478 7006 1 16 . 1 1 62 62 ILE HA H 62 4.891 4.891 3.299 1.592 18478 7007 1 16 . 1 1 62 62 ILE C C 62 178.027 178.027 177.622 0.405 18478 7008 1 16 . 1 1 62 62 ILE CA C 62 59.994 59.994 64.332 -4.338 18478 7009 1 16 . 1 1 62 62 ILE CB C 62 40.652 40.652 36.978 3.674 18478 7010 1 16 . 1 1 62 62 ILE H H 62 6.784 6.784 7.615 -0.831 18478 7011 1 16 . 1 1 63 63 PHE N N 63 119.819 119.819 119.944 -0.125 18478 7012 1 16 . 1 1 63 63 PHE HA H 63 5.214 5.214 4.194 1.020 18478 7013 1 16 . 1 1 63 63 PHE CA C 63 54.735 54.735 60.104 -5.369 18478 7014 1 16 . 1 1 63 63 PHE CB C 63 42.122 42.122 38.886 3.236 18478 7015 1 16 . 1 1 63 63 PHE H H 63 8.734 8.734 7.515 1.219 18478 7016 1 16 . 1 1 64 64 PRO HA H 64 4.771 4.771 4.293 0.478 18478 7017 1 16 . 1 1 64 64 PRO C C 64 174.036 174.036 178.667 -4.631 18478 7018 1 16 . 1 1 64 64 PRO CA C 64 64.474 64.474 64.514 -0.040 18478 7019 1 16 . 1 1 64 64 PRO CB C 64 32.662 32.662 32.481 0.181 18478 7020 1 16 . 1 1 65 65 TYR N N 65 124.335 124.335 121.616 2.719 18478 7021 1 16 . 1 1 65 65 TYR HA H 65 4.530 4.530 4.324 0.206 18478 7022 1 16 . 1 1 65 65 TYR C C 65 173.944 173.944 177.355 -3.411 18478 7023 1 16 . 1 1 65 65 TYR CA C 65 61.205 61.205 60.675 0.530 18478 7024 1 16 . 1 1 65 65 TYR CB C 65 38.844 38.844 37.807 1.036 18478 7025 1 16 . 1 1 65 65 TYR H H 65 8.359 8.359 7.758 0.601 18478 7026 1 16 . 1 1 66 66 SER N N 66 114.836 114.836 112.267 2.569 18478 7027 1 16 . 1 1 66 66 SER HA H 66 3.505 3.505 4.330 -0.825 18478 7028 1 16 . 1 1 66 66 SER C C 66 173.697 173.697 175.418 -1.721 18478 7029 1 16 . 1 1 66 66 SER CA C 66 63.078 63.078 59.570 3.508 18478 7030 1 16 . 1 1 66 66 SER CB C 66 62.223 62.223 63.074 -0.851 18478 7031 1 16 . 1 1 66 66 SER H H 66 8.974 8.974 7.705 1.269 18478 7032 1 16 . 1 1 67 67 GLU N N 67 118.013 118.013 118.576 -0.563 18478 7033 1 16 . 1 1 67 67 GLU HA H 67 4.210 4.210 4.167 0.043 18478 7034 1 16 . 1 1 67 67 GLU C C 67 174.961 174.961 177.466 -2.505 18478 7035 1 16 . 1 1 67 67 GLU CA C 67 58.330 58.330 57.746 0.584 18478 7036 1 16 . 1 1 67 67 GLU CB C 67 30.205 30.205 30.935 -0.730 18478 7037 1 16 . 1 1 67 67 GLU H H 67 8.817 8.817 7.889 0.928 18478 7038 1 16 . 1 1 68 68 ASN N N 68 113.942 113.942 112.042 1.900 18478 7039 1 16 . 1 1 68 68 ASN HA H 68 5.015 5.015 5.001 0.014 18478 7040 1 16 . 1 1 68 68 ASN C C 68 176.626 176.626 176.477 0.149 18478 7041 1 16 . 1 1 68 68 ASN CA C 68 53.768 53.768 51.989 1.778 18478 7042 1 16 . 1 1 68 68 ASN CB C 68 41.948 41.948 39.679 2.269 18478 7043 1 16 . 1 1 68 68 ASN H H 68 7.448 7.448 7.751 -0.303 18478 7044 1 16 . 1 1 69 69 LYS N N 69 124.584 124.584 120.588 3.996 18478 7045 1 16 . 1 1 69 69 LYS HA H 69 3.794 3.794 3.902 -0.108 18478 7046 1 16 . 1 1 69 69 LYS C C 69 173.330 173.330 174.888 -1.558 18478 7047 1 16 . 1 1 69 69 LYS CA C 69 61.225 61.225 57.386 3.839 18478 7048 1 16 . 1 1 69 69 LYS H H 69 7.592 7.592 8.692 -1.100 18478 7049 1 16 . 1 1 70 70 GLU N N 70 118.408 118.408 117.711 0.697 18478 7050 1 16 . 1 1 70 70 GLU HA H 70 4.005 4.005 4.804 -0.799 18478 7051 1 16 . 1 1 70 70 GLU C C 70 174.588 174.588 173.672 0.916 18478 7052 1 16 . 1 1 70 70 GLU CA C 70 58.695 58.695 52.999 5.696 18478 7053 1 16 . 1 1 70 70 GLU CB C 70 28.928 28.928 30.659 -1.731 18478 7054 1 16 . 1 1 70 70 GLU H H 70 8.478 8.478 7.940 0.538 18478 7055 1 16 . 1 1 71 71 LYS HA H 71 3.847 3.847 4.344 -0.497 18478 7056 1 16 . 1 1 71 71 LYS C C 71 173.420 173.420 175.471 -2.051 18478 7057 1 16 . 1 1 71 71 LYS CA C 71 58.718 58.718 55.435 3.283 18478 7058 1 16 . 1 1 71 71 LYS CB C 71 32.964 32.964 33.868 -0.904 18478 7059 1 16 . 1 1 72 72 TYR N N 72 112.358 112.358 122.180 -9.822 18478 7060 1 16 . 1 1 72 72 TYR HA H 72 4.790 4.790 4.307 0.483 18478 7061 1 16 . 1 1 72 72 TYR C C 72 174.442 174.442 175.959 -1.517 18478 7062 1 16 . 1 1 72 72 TYR CA C 72 55.287 55.287 59.136 -3.849 18478 7063 1 16 . 1 1 72 72 TYR CB C 72 37.244 37.244 38.377 -1.133 18478 7064 1 16 . 1 1 72 72 TYR H H 72 7.341 7.341 8.366 -1.025 18478 7065 1 16 . 1 1 73 73 GLY N N 73 110.612 110.612 107.542 3.070 18478 7066 1 16 . 1 1 73 73 GLY C C 73 177.982 177.982 173.366 4.616 18478 7067 1 16 . 1 1 73 73 GLY CA C 73 46.623 46.623 44.464 2.159 18478 7068 1 16 . 1 1 73 73 GLY H H 73 8.076 8.076 8.061 0.015 18478 7069 1 16 . 1 1 74 74 LYS N N 74 121.009 121.009 120.977 0.032 18478 7070 1 16 . 1 1 74 74 LYS CA C 74 53.465 53.465 54.400 -0.935 18478 7071 1 16 . 1 1 74 74 LYS CB C 74 32.440 32.440 32.694 -0.254 18478 7072 1 16 . 1 1 74 74 LYS H H 74 7.411 7.411 7.924 -0.513 18478 7073 1 16 . 1 1 75 75 PRO HA H 75 4.452 4.452 4.276 0.176 18478 7074 1 16 . 1 1 75 75 PRO C C 75 174.959 174.959 178.008 -3.049 18478 7075 1 16 . 1 1 75 75 PRO CA C 75 62.861 62.861 64.591 -1.730 18478 7076 1 16 . 1 1 75 75 PRO CB C 75 32.407 32.407 31.562 0.845 18478 7077 1 16 . 1 1 76 76 ASN N N 76 121.045 121.045 119.199 1.846 18478 7078 1 16 . 1 1 76 76 ASN HA H 76 4.445 4.445 4.484 -0.039 18478 7079 1 16 . 1 1 76 76 ASN C C 76 174.145 174.145 174.703 -0.558 18478 7080 1 16 . 1 1 76 76 ASN CA C 76 55.701 55.701 52.955 2.746 18478 7081 1 16 . 1 1 76 76 ASN H H 76 8.474 8.474 9.054 -0.580 18478 7082 1 16 . 1 1 77 77 LYS N N 77 111.466 111.466 120.813 -9.347 18478 7083 1 16 . 1 1 77 77 LYS HA H 77 4.369 4.369 4.220 0.149 18478 7084 1 16 . 1 1 77 77 LYS C C 77 173.881 173.881 176.155 -2.274 18478 7085 1 16 . 1 1 77 77 LYS CA C 77 55.995 55.995 56.251 -0.256 18478 7086 1 16 . 1 1 77 77 LYS CB C 77 32.538 32.538 32.288 0.250 18478 7087 1 16 . 1 1 77 77 LYS H H 77 8.543 8.543 7.935 0.608 18478 7088 1 16 . 1 1 78 78 ARG N N 78 122.233 122.233 120.400 1.833 18478 7089 1 16 . 1 1 78 78 ARG HA H 78 4.286 4.286 3.965 0.321 18478 7090 1 16 . 1 1 78 78 ARG C C 78 173.652 173.652 174.844 -1.192 18478 7091 1 16 . 1 1 78 78 ARG CA C 78 55.780 55.780 57.553 -1.773 18478 7092 1 16 . 1 1 78 78 ARG CB C 78 29.554 29.554 29.239 0.315 18478 7093 1 16 . 1 1 78 78 ARG H H 78 8.864 8.864 8.604 0.260 18478 7094 1 16 . 1 1 79 79 LYS N N 79 128.197 128.197 119.435 8.762 18478 7095 1 16 . 1 1 79 79 LYS HA H 79 4.221 4.221 4.477 -0.256 18478 7096 1 16 . 1 1 79 79 LYS C C 79 174.336 174.336 175.452 -1.116 18478 7097 1 16 . 1 1 79 79 LYS CA C 79 58.986 58.986 55.872 3.114 18478 7098 1 16 . 1 1 79 79 LYS CB C 79 32.072 32.072 33.165 -1.093 18478 7099 1 16 . 1 1 79 79 LYS H H 79 8.927 8.927 7.825 1.102 18478 7100 1 16 . 1 1 80 80 GLY N N 80 114.730 114.730 110.648 4.082 18478 7101 1 16 . 1 1 80 80 GLY C C 80 176.536 176.536 174.441 2.095 18478 7102 1 16 . 1 1 80 80 GLY CA C 80 45.992 45.992 45.280 0.712 18478 7103 1 16 . 1 1 80 80 GLY H H 80 8.943 8.943 8.399 0.544 18478 7104 1 16 . 1 1 81 81 PHE N N 81 123.770 123.770 118.361 5.409 18478 7105 1 16 . 1 1 81 81 PHE HA H 81 3.336 3.336 4.363 -1.027 18478 7106 1 16 . 1 1 81 81 PHE C C 81 174.037 174.037 176.387 -2.350 18478 7107 1 16 . 1 1 81 81 PHE CA C 81 63.094 63.094 59.298 3.796 18478 7108 1 16 . 1 1 81 81 PHE CB C 81 39.823 39.823 38.812 1.011 18478 7109 1 16 . 1 1 81 81 PHE H H 81 8.281 8.281 7.881 0.400 18478 7110 1 16 . 1 1 82 82 ASN N N 82 119.812 119.812 117.927 1.885 18478 7111 1 16 . 1 1 82 82 ASN HA H 82 4.458 4.458 4.433 0.025 18478 7112 1 16 . 1 1 82 82 ASN C C 82 171.290 171.290 176.831 -5.541 18478 7113 1 16 . 1 1 82 82 ASN CA C 82 56.060 56.060 56.236 -0.176 18478 7114 1 16 . 1 1 82 82 ASN CB C 82 36.390 36.390 38.461 -2.071 18478 7115 1 16 . 1 1 82 82 ASN H H 82 9.145 9.145 8.372 0.773 18478 7116 1 16 . 1 1 83 83 GLU N N 83 124.411 124.411 118.436 5.975 18478 7117 1 16 . 1 1 83 83 GLU HA H 83 4.186 4.186 4.092 0.094 18478 7118 1 16 . 1 1 83 83 GLU C C 83 172.222 172.222 178.586 -6.364 18478 7119 1 16 . 1 1 83 83 GLU CA C 83 60.922 60.922 59.463 1.459 18478 7120 1 16 . 1 1 83 83 GLU CB C 83 28.132 28.132 29.331 -1.199 18478 7121 1 16 . 1 1 83 83 GLU H H 83 9.560 9.560 8.470 1.090 18478 7122 1 16 . 1 1 84 84 GLY N N 84 111.388 111.388 106.734 4.654 18478 7123 1 16 . 1 1 84 84 GLY C C 84 176.445 176.445 174.038 2.407 18478 7124 1 16 . 1 1 84 84 GLY CA C 84 46.727 46.727 46.569 0.158 18478 7125 1 16 . 1 1 84 84 GLY H H 84 8.364 8.364 7.338 1.026 18478 7126 1 16 . 1 1 85 85 LEU N N 85 121.153 121.153 119.575 1.578 18478 7127 1 16 . 1 1 85 85 LEU HA H 85 4.236 4.236 4.199 0.037 18478 7128 1 16 . 1 1 85 85 LEU C C 85 172.285 172.285 177.660 -5.375 18478 7129 1 16 . 1 1 85 85 LEU CA C 85 56.795 56.795 56.862 -0.067 18478 7130 1 16 . 1 1 85 85 LEU CB C 85 41.113 41.113 43.077 -1.964 18478 7131 1 16 . 1 1 85 85 LEU H H 85 8.294 8.294 7.307 0.987 18478 7132 1 16 . 1 1 86 86 TRP N N 86 118.898 118.898 118.583 0.315 18478 7133 1 16 . 1 1 86 86 TRP HA H 86 4.161 4.161 4.299 -0.138 18478 7134 1 16 . 1 1 86 86 TRP C C 86 171.741 171.741 176.246 -4.505 18478 7135 1 16 . 1 1 86 86 TRP CA C 86 62.153 62.153 58.605 3.548 18478 7136 1 16 . 1 1 86 86 TRP CB C 86 28.424 28.424 29.476 -1.052 18478 7137 1 16 . 1 1 86 86 TRP H H 86 7.783 7.783 7.600 0.183 18478 7138 1 16 . 1 1 87 87 GLU N N 87 120.718 120.718 119.158 1.560 18478 7139 1 16 . 1 1 87 87 GLU HA H 87 3.416 3.416 4.729 -1.313 18478 7140 1 16 . 1 1 87 87 GLU C C 87 172.957 172.957 175.076 -2.119 18478 7141 1 16 . 1 1 87 87 GLU CA C 87 60.122 60.122 53.203 6.919 18478 7142 1 16 . 1 1 87 87 GLU CB C 87 31.021 31.021 30.332 0.689 18478 7143 1 16 . 1 1 87 87 GLU H H 87 8.779 8.779 7.514 1.265 18478 7144 1 16 . 1 1 88 88 ILE HA H 88 2.478 2.478 4.164 -1.686 18478 7145 1 16 . 1 1 88 88 ILE C C 88 177.873 177.873 177.191 0.682 18478 7146 1 16 . 1 1 88 88 ILE CA C 88 65.248 65.248 62.431 2.817 18478 7147 1 16 . 1 1 88 88 ILE CB C 88 37.327 37.327 38.368 -1.041 18478 7148 1 16 . 1 1 89 89 ASP N N 89 114.411 114.411 117.750 -3.339 18478 7149 1 16 . 1 1 89 89 ASP HA H 89 4.589 4.589 4.489 0.100 18478 7150 1 16 . 1 1 89 89 ASP C C 89 174.207 174.207 177.225 -3.018 18478 7151 1 16 . 1 1 89 89 ASP CA C 89 54.740 54.740 56.382 -1.642 18478 7152 1 16 . 1 1 89 89 ASP CB C 89 42.473 42.473 40.352 2.121 18478 7153 1 16 . 1 1 89 89 ASP H H 89 5.911 5.911 7.993 -2.082 18478 7154 1 16 . 1 1 90 90 ASN N N 90 114.358 114.358 112.747 1.611 18478 7155 1 16 . 1 1 90 90 ASN HA H 90 4.420 4.420 4.433 -0.013 18478 7156 1 16 . 1 1 90 90 ASN C C 90 176.991 176.991 177.486 -0.495 18478 7157 1 16 . 1 1 90 90 ASN CA C 90 54.855 54.855 55.989 -1.135 18478 7158 1 16 . 1 1 90 90 ASN CB C 90 40.582 40.582 38.015 2.567 18478 7159 1 16 . 1 1 90 90 ASN H H 90 7.480 7.480 7.729 -0.249 18478 7160 1 16 . 1 1 91 91 ASN N N 91 119.185 119.185 117.536 1.649 18478 7161 1 16 . 1 1 91 91 ASN HA H 91 5.006 5.006 4.777 0.229 18478 7162 1 16 . 1 1 91 91 ASN CA C 91 51.624 51.624 55.176 -3.552 18478 7163 1 16 . 1 1 91 91 ASN CB C 91 38.752 38.752 39.062 -0.310 18478 7164 1 16 . 1 1 91 91 ASN H H 91 9.238 9.238 7.941 1.297 18478 7165 1 16 . 1 1 92 92 PRO HA H 92 4.296 4.296 4.672 -0.376 18478 7166 1 16 . 1 1 92 92 PRO C C 92 173.690 173.690 175.394 -1.704 18478 7167 1 16 . 1 1 92 92 PRO CA C 92 64.714 64.714 61.407 3.307 18478 7168 1 16 . 1 1 92 92 PRO CB C 92 31.781 31.781 32.748 -0.967 18478 7169 1 17 . 1 1 3 3 GLY C C 3 177.088 177.088 172.590 4.498 18478 7170 1 17 . 1 1 3 3 GLY CA C 3 45.330 45.330 43.624 1.706 18478 7171 1 17 . 1 1 4 4 SER N N 4 115.847 115.847 114.426 1.421 18478 7172 1 17 . 1 1 4 4 SER HA H 4 4.480 4.480 4.665 -0.185 18478 7173 1 17 . 1 1 4 4 SER C C 4 177.991 177.991 171.968 6.023 18478 7174 1 17 . 1 1 4 4 SER CA C 4 58.742 58.742 58.816 -0.074 18478 7175 1 17 . 1 1 4 4 SER CB C 4 63.820 63.820 65.180 -1.360 18478 7176 1 17 . 1 1 4 4 SER H H 4 8.207 8.207 7.449 0.758 18478 7177 1 17 . 1 1 5 5 MET N N 5 125.867 125.867 121.800 4.067 18478 7178 1 17 . 1 1 5 5 MET HA H 5 4.580 4.580 4.725 -0.145 18478 7179 1 17 . 1 1 5 5 MET C C 5 174.825 174.825 176.115 -1.290 18478 7180 1 17 . 1 1 5 5 MET CA C 5 54.733 54.733 54.211 0.522 18478 7181 1 17 . 1 1 5 5 MET CB C 5 33.527 33.527 35.988 -2.461 18478 7182 1 17 . 1 1 5 5 MET H H 5 8.148 8.148 8.820 -0.672 18478 7183 1 17 . 1 1 6 6 THR N N 6 115.828 115.828 116.144 -0.316 18478 7184 1 17 . 1 1 6 6 THR HA H 6 3.903 3.903 4.467 -0.564 18478 7185 1 17 . 1 1 6 6 THR C C 6 176.930 176.930 172.821 4.109 18478 7186 1 17 . 1 1 6 6 THR CA C 6 63.034 63.034 61.289 1.744 18478 7187 1 17 . 1 1 6 6 THR CB C 6 69.308 69.308 68.680 0.628 18478 7188 1 17 . 1 1 6 6 THR H H 6 8.408 8.408 8.474 -0.066 18478 7189 1 17 . 1 1 7 7 ARG HA H 7 4.276 4.276 4.235 0.041 18478 7190 1 17 . 1 1 7 7 ARG C C 7 176.546 176.546 176.327 0.219 18478 7191 1 17 . 1 1 7 7 ARG CA C 7 55.813 55.813 56.401 -0.588 18478 7192 1 17 . 1 1 7 7 ARG CB C 7 30.556 30.556 30.658 -0.102 18478 7193 1 17 . 1 1 8 8 ASP N N 8 121.762 121.762 124.271 -2.509 18478 7194 1 17 . 1 1 8 8 ASP HA H 8 4.537 4.537 4.167 0.370 18478 7195 1 17 . 1 1 8 8 ASP C C 8 177.750 177.750 175.198 2.552 18478 7196 1 17 . 1 1 8 8 ASP CA C 8 54.117 54.117 54.720 -0.603 18478 7197 1 17 . 1 1 8 8 ASP H H 8 8.066 8.066 8.429 -0.363 18478 7198 1 17 . 1 1 9 9 PHE N N 9 119.991 119.991 120.034 -0.043 18478 7199 1 17 . 1 1 9 9 PHE HA H 9 4.734 4.734 4.972 -0.238 18478 7200 1 17 . 1 1 9 9 PHE C C 9 176.838 176.838 175.265 1.573 18478 7201 1 17 . 1 1 9 9 PHE CA C 9 58.303 58.303 57.597 0.706 18478 7202 1 17 . 1 1 9 9 PHE CB C 9 41.594 41.594 40.849 0.745 18478 7203 1 17 . 1 1 9 9 PHE H H 9 8.103 8.103 7.622 0.481 18478 7204 1 17 . 1 1 10 10 LYS N N 10 122.957 122.957 123.798 -0.841 18478 7205 1 17 . 1 1 10 10 LYS CA C 10 53.167 53.167 55.983 -2.816 18478 7206 1 17 . 1 1 10 10 LYS CB C 10 33.495 33.495 31.956 1.539 18478 7207 1 17 . 1 1 10 10 LYS H H 10 9.087 9.087 8.806 0.281 18478 7208 1 17 . 1 1 11 11 PRO HA H 11 3.903 3.903 4.933 -1.030 18478 7209 1 17 . 1 1 11 11 PRO C C 11 173.988 173.988 174.643 -0.655 18478 7210 1 17 . 1 1 11 11 PRO CA C 11 63.874 63.874 61.390 2.484 18478 7211 1 17 . 1 1 11 11 PRO CB C 11 31.623 31.623 35.135 -3.512 18478 7212 1 17 . 1 1 12 12 GLY N N 12 115.413 115.413 111.038 4.375 18478 7213 1 17 . 1 1 12 12 GLY C C 12 176.966 176.966 172.556 4.410 18478 7214 1 17 . 1 1 12 12 GLY CA C 12 44.651 44.651 42.083 2.568 18478 7215 1 17 . 1 1 12 12 GLY H H 12 9.667 9.667 8.936 0.731 18478 7216 1 17 . 1 1 13 13 ASP N N 13 122.208 122.208 128.557 -6.349 18478 7217 1 17 . 1 1 13 13 ASP HA H 13 4.601 4.601 5.030 -0.429 18478 7218 1 17 . 1 1 13 13 ASP C C 13 176.244 176.244 174.419 1.825 18478 7219 1 17 . 1 1 13 13 ASP CA C 13 55.870 55.870 52.030 3.840 18478 7220 1 17 . 1 1 13 13 ASP CB C 13 40.794 40.794 42.794 -2.000 18478 7221 1 17 . 1 1 13 13 ASP H H 13 8.303 8.303 8.424 -0.121 18478 7222 1 17 . 1 1 14 14 LEU N N 14 121.306 121.306 126.725 -5.419 18478 7223 1 17 . 1 1 14 14 LEU HA H 14 4.982 4.982 4.578 0.404 18478 7224 1 17 . 1 1 14 14 LEU C C 14 173.461 173.461 176.346 -2.885 18478 7225 1 17 . 1 1 14 14 LEU CA C 14 54.516 54.516 53.725 0.791 18478 7226 1 17 . 1 1 14 14 LEU CB C 14 40.999 40.999 41.692 -0.693 18478 7227 1 17 . 1 1 14 14 LEU H H 14 8.618 8.618 7.695 0.923 18478 7228 1 17 . 1 1 15 15 ILE N N 15 118.806 118.806 125.718 -6.912 18478 7229 1 17 . 1 1 15 15 ILE HA H 15 5.356 5.356 4.297 1.059 18478 7230 1 17 . 1 1 15 15 ILE C C 15 175.982 175.982 175.934 0.048 18478 7231 1 17 . 1 1 15 15 ILE CA C 15 60.481 60.481 61.354 -0.873 18478 7232 1 17 . 1 1 15 15 ILE CB C 15 44.142 44.142 40.012 4.130 18478 7233 1 17 . 1 1 15 15 ILE H H 15 8.864 8.864 8.521 0.343 18478 7234 1 17 . 1 1 16 16 PHE N N 16 112.472 112.472 122.508 -10.036 18478 7235 1 17 . 1 1 16 16 PHE HA H 16 5.306 5.306 4.475 0.831 18478 7236 1 17 . 1 1 16 16 PHE C C 16 176.239 176.239 175.748 0.491 18478 7237 1 17 . 1 1 16 16 PHE CA C 16 58.603 58.603 58.618 -0.015 18478 7238 1 17 . 1 1 16 16 PHE CB C 16 43.305 43.305 37.426 5.879 18478 7239 1 17 . 1 1 16 16 PHE H H 16 9.411 9.411 8.577 0.834 18478 7240 1 17 . 1 1 17 17 ALA N N 17 123.889 123.889 126.481 -2.592 18478 7241 1 17 . 1 1 17 17 ALA HA H 17 5.348 5.348 3.649 1.699 18478 7242 1 17 . 1 1 17 17 ALA C C 17 174.426 174.426 176.353 -1.927 18478 7243 1 17 . 1 1 17 17 ALA CA C 17 50.062 50.062 51.796 -1.734 18478 7244 1 17 . 1 1 17 17 ALA H H 17 9.658 9.658 8.744 0.914 18478 7245 1 17 . 1 1 18 18 LYS N N 18 127.760 127.760 121.033 6.727 18478 7246 1 17 . 1 1 18 18 LYS HA H 18 4.697 4.697 4.720 -0.023 18478 7247 1 17 . 1 1 18 18 LYS C C 18 178.554 178.554 174.513 4.041 18478 7248 1 17 . 1 1 18 18 LYS CA C 18 53.893 53.893 52.149 1.744 18478 7249 1 17 . 1 1 18 18 LYS CB C 18 35.291 35.291 32.625 2.666 18478 7250 1 17 . 1 1 18 18 LYS H H 18 9.421 9.421 7.383 2.038 18478 7251 1 17 . 1 1 19 19 MET HA H 19 4.656 4.656 4.620 0.036 18478 7252 1 17 . 1 1 19 19 MET C C 19 175.741 175.741 174.801 0.940 18478 7253 1 17 . 1 1 19 19 MET CA C 19 53.916 53.916 54.787 -0.871 18478 7254 1 17 . 1 1 19 19 MET CB C 19 35.799 35.799 33.689 2.110 18478 7255 1 17 . 1 1 20 20 LYS N N 20 124.062 124.062 117.799 6.263 18478 7256 1 17 . 1 1 20 20 LYS CA C 20 58.585 58.585 56.059 2.526 18478 7257 1 17 . 1 1 20 20 LYS CB C 20 31.978 31.978 33.180 -1.202 18478 7258 1 17 . 1 1 20 20 LYS H H 20 8.645 8.645 8.069 0.576 18478 7259 1 17 . 1 1 21 21 GLY C C 21 176.205 176.205 172.268 3.937 18478 7260 1 17 . 1 1 21 21 GLY CA C 21 45.142 45.142 41.726 3.416 18478 7261 1 17 . 1 1 22 22 TYR HA H 22 4.573 4.573 4.725 -0.152 18478 7262 1 17 . 1 1 22 22 TYR CA C 22 55.748 55.748 57.681 -1.933 18478 7263 1 17 . 1 1 22 22 TYR CB C 22 41.331 41.331 37.861 3.470 18478 7264 1 17 . 1 1 23 23 PRO HA H 23 4.759 4.759 5.006 -0.247 18478 7265 1 17 . 1 1 23 23 PRO C C 23 174.587 174.587 175.194 -0.607 18478 7266 1 17 . 1 1 23 23 PRO CA C 23 62.072 62.072 61.724 0.348 18478 7267 1 17 . 1 1 23 23 PRO CB C 23 31.077 31.077 34.616 -3.539 18478 7268 1 17 . 1 1 24 24 HIS N N 24 119.190 119.190 115.186 4.004 18478 7269 1 17 . 1 1 24 24 HIS HA H 24 3.983 3.983 5.488 -1.505 18478 7270 1 17 . 1 1 24 24 HIS C C 24 175.555 175.555 174.000 1.555 18478 7271 1 17 . 1 1 24 24 HIS CA C 24 60.973 60.973 54.182 6.790 18478 7272 1 17 . 1 1 24 24 HIS CB C 24 30.689 30.689 33.116 -2.427 18478 7273 1 17 . 1 1 24 24 HIS H H 24 8.158 8.158 8.712 -0.554 18478 7274 1 17 . 1 1 25 25 TRP N N 25 127.435 127.435 122.246 5.189 18478 7275 1 17 . 1 1 25 25 TRP HA H 25 3.760 3.760 5.226 -1.466 18478 7276 1 17 . 1 1 25 25 TRP CA C 25 55.890 55.890 57.390 -1.500 18478 7277 1 17 . 1 1 25 25 TRP CB C 25 32.879 32.879 30.118 2.761 18478 7278 1 17 . 1 1 25 25 TRP H H 25 9.211 9.211 8.672 0.539 18478 7279 1 17 . 1 1 26 26 PRO HA H 26 4.217 4.217 4.631 -0.414 18478 7280 1 17 . 1 1 26 26 PRO C C 26 176.279 176.279 175.815 0.464 18478 7281 1 17 . 1 1 26 26 PRO CA C 26 63.140 63.140 61.782 1.358 18478 7282 1 17 . 1 1 26 26 PRO CB C 26 32.171 32.171 34.396 -2.225 18478 7283 1 17 . 1 1 27 27 ALA N N 27 130.162 130.162 121.948 8.214 18478 7284 1 17 . 1 1 27 27 ALA HA H 27 4.981 4.981 4.404 0.577 18478 7285 1 17 . 1 1 27 27 ALA C C 27 177.227 177.227 176.931 0.296 18478 7286 1 17 . 1 1 27 27 ALA CA C 27 52.574 52.574 50.669 1.905 18478 7287 1 17 . 1 1 27 27 ALA CB C 27 23.239 23.239 20.358 2.881 18478 7288 1 17 . 1 1 27 27 ALA H H 27 9.394 9.394 8.079 1.315 18478 7289 1 17 . 1 1 28 28 ARG N N 28 117.381 117.381 121.524 -4.143 18478 7290 1 17 . 1 1 28 28 ARG HA H 28 5.421 5.421 4.261 1.160 18478 7291 1 17 . 1 1 28 28 ARG C C 28 176.465 176.465 175.729 0.736 18478 7292 1 17 . 1 1 28 28 ARG CA C 28 53.662 53.662 55.353 -1.691 18478 7293 1 17 . 1 1 28 28 ARG CB C 28 35.058 35.058 29.981 5.077 18478 7294 1 17 . 1 1 28 28 ARG H H 28 8.806 8.806 8.495 0.311 18478 7295 1 17 . 1 1 29 29 VAL HA H 29 4.109 4.109 4.235 -0.126 18478 7296 1 17 . 1 1 29 29 VAL C C 29 175.996 175.996 174.915 1.081 18478 7297 1 17 . 1 1 29 29 VAL CA C 29 62.810 62.810 61.441 1.369 18478 7298 1 17 . 1 1 29 29 VAL CB C 29 31.108 31.108 32.455 -1.347 18478 7299 1 17 . 1 1 30 30 ASP N N 30 133.830 133.830 119.335 14.495 18478 7300 1 17 . 1 1 30 30 ASP HA H 30 5.198 5.198 4.563 0.635 18478 7301 1 17 . 1 1 30 30 ASP C C 30 176.207 176.207 177.646 -1.439 18478 7302 1 17 . 1 1 30 30 ASP CA C 30 53.007 53.007 55.040 -2.033 18478 7303 1 17 . 1 1 30 30 ASP CB C 30 44.130 44.130 40.666 3.464 18478 7304 1 17 . 1 1 30 30 ASP H H 30 8.892 8.892 8.509 0.383 18478 7305 1 17 . 1 1 31 31 GLU N N 31 115.905 115.905 121.242 -5.337 18478 7306 1 17 . 1 1 31 31 GLU HA H 31 4.409 4.409 3.940 0.469 18478 7307 1 17 . 1 1 31 31 GLU C C 31 175.192 175.192 176.078 -0.886 18478 7308 1 17 . 1 1 31 31 GLU CA C 31 55.389 55.389 56.755 -1.366 18478 7309 1 17 . 1 1 31 31 GLU H H 31 7.966 7.966 8.881 -0.915 18478 7310 1 17 . 1 1 32 32 VAL N N 32 122.794 122.794 117.004 5.790 18478 7311 1 17 . 1 1 32 32 VAL HA H 32 4.303 4.303 3.723 0.580 18478 7312 1 17 . 1 1 32 32 VAL CA C 32 60.408 60.408 62.798 -2.390 18478 7313 1 17 . 1 1 32 32 VAL CB C 32 32.333 32.333 30.558 1.775 18478 7314 1 17 . 1 1 32 32 VAL H H 32 8.702 8.702 7.698 1.004 18478 7315 1 17 . 1 1 33 33 PRO HA H 33 4.572 4.572 4.192 0.380 18478 7316 1 17 . 1 1 33 33 PRO C C 33 175.366 175.366 177.181 -1.815 18478 7317 1 17 . 1 1 33 33 PRO CA C 33 63.702 63.702 65.588 -1.885 18478 7318 1 17 . 1 1 33 33 PRO CB C 33 32.736 32.736 32.311 0.425 18478 7319 1 17 . 1 1 34 34 ASP N N 34 119.187 119.187 117.444 1.743 18478 7320 1 17 . 1 1 34 34 ASP HA H 34 4.679 4.679 5.033 -0.354 18478 7321 1 17 . 1 1 34 34 ASP C C 34 175.713 175.713 173.986 1.727 18478 7322 1 17 . 1 1 34 34 ASP CA C 34 53.013 53.013 51.884 1.129 18478 7323 1 17 . 1 1 34 34 ASP CB C 34 40.850 40.850 40.531 0.319 18478 7324 1 17 . 1 1 34 34 ASP H H 34 8.686 8.686 8.017 0.669 18478 7325 1 17 . 1 1 35 35 GLY C C 35 177.458 177.458 172.715 4.743 18478 7326 1 17 . 1 1 35 35 GLY CA C 35 45.507 45.507 43.814 1.693 18478 7327 1 17 . 1 1 36 36 ALA HA H 36 4.404 4.404 4.255 0.149 18478 7328 1 17 . 1 1 36 36 ALA CA C 36 52.010 52.010 51.782 0.228 18478 7329 1 17 . 1 1 36 36 ALA CB C 36 19.909 19.909 19.892 0.017 18478 7330 1 17 . 1 1 37 37 VAL N N 37 119.594 119.594 124.706 -5.112 18478 7331 1 17 . 1 1 37 37 VAL HA H 37 3.932 3.932 4.177 -0.245 18478 7332 1 17 . 1 1 37 37 VAL C C 37 175.966 175.966 175.599 0.367 18478 7333 1 17 . 1 1 37 37 VAL CA C 37 62.810 62.810 64.125 -1.315 18478 7334 1 17 . 1 1 37 37 VAL CB C 37 32.267 32.267 32.848 -0.581 18478 7335 1 17 . 1 1 37 37 VAL H H 37 8.037 8.037 8.242 -0.205 18478 7336 1 17 . 1 1 38 38 LYS N N 38 125.676 125.676 120.566 5.110 18478 7337 1 17 . 1 1 38 38 LYS C C 38 173.865 173.865 174.774 -0.909 18478 7338 1 17 . 1 1 38 38 LYS CA C 38 54.278 54.278 56.643 -2.365 18478 7339 1 17 . 1 1 38 38 LYS CB C 38 31.740 31.740 33.531 -1.791 18478 7340 1 17 . 1 1 38 38 LYS H H 38 8.292 8.292 8.364 -0.072 18478 7341 1 17 . 1 1 40 40 PRO HA H 40 4.387 4.387 5.319 -0.932 18478 7342 1 17 . 1 1 40 40 PRO C C 40 175.535 175.535 175.514 0.021 18478 7343 1 17 . 1 1 40 40 PRO CA C 40 62.330 62.330 59.593 2.737 18478 7344 1 17 . 1 1 40 40 PRO CB C 40 32.086 32.086 31.773 0.313 18478 7345 1 17 . 1 1 41 41 THR HA H 41 4.027 4.027 4.488 -0.461 18478 7346 1 17 . 1 1 41 41 THR C C 41 176.795 176.795 173.025 3.770 18478 7347 1 17 . 1 1 41 41 THR CA C 41 63.693 63.693 62.220 1.473 18478 7348 1 17 . 1 1 41 41 THR CB C 41 69.370 69.370 68.852 0.518 18478 7349 1 17 . 1 1 42 42 ASN N N 42 118.513 118.513 122.403 -3.890 18478 7350 1 17 . 1 1 42 42 ASN HA H 42 4.530 4.530 5.203 -0.673 18478 7351 1 17 . 1 1 42 42 ASN C C 42 177.230 177.230 174.915 2.315 18478 7352 1 17 . 1 1 42 42 ASN CA C 42 56.373 56.373 50.408 5.965 18478 7353 1 17 . 1 1 42 42 ASN CB C 42 37.618 37.618 37.855 -0.236 18478 7354 1 17 . 1 1 42 42 ASN H H 42 8.752 8.752 8.647 0.105 18478 7355 1 17 . 1 1 43 43 LYS N N 43 115.898 115.898 129.039 -13.141 18478 7356 1 17 . 1 1 43 43 LYS HA H 43 4.710 4.710 4.675 0.035 18478 7357 1 17 . 1 1 43 43 LYS C C 43 177.032 177.032 175.844 1.188 18478 7358 1 17 . 1 1 43 43 LYS CA C 43 54.957 54.957 54.802 0.155 18478 7359 1 17 . 1 1 43 43 LYS CB C 43 36.600 36.600 33.007 3.594 18478 7360 1 17 . 1 1 43 43 LYS H H 43 7.723 7.723 8.789 -1.066 18478 7361 1 17 . 1 1 44 44 LEU N N 44 121.006 121.006 130.123 -9.117 18478 7362 1 17 . 1 1 44 44 LEU HA H 44 5.000 5.000 4.304 0.696 18478 7363 1 17 . 1 1 44 44 LEU CA C 44 51.842 51.842 54.729 -2.887 18478 7364 1 17 . 1 1 44 44 LEU CB C 44 44.418 44.418 40.990 3.428 18478 7365 1 17 . 1 1 44 44 LEU H H 44 9.063 9.063 8.470 0.593 18478 7366 1 17 . 1 1 45 45 PRO HA H 45 4.392 4.392 4.527 -0.135 18478 7367 1 17 . 1 1 45 45 PRO C C 45 177.051 177.051 177.686 -0.635 18478 7368 1 17 . 1 1 45 45 PRO CA C 45 62.000 62.000 64.858 -2.858 18478 7369 1 17 . 1 1 45 45 PRO CB C 45 30.737 30.737 32.635 -1.898 18478 7370 1 17 . 1 1 46 46 ILE N N 46 125.996 125.996 126.809 -0.813 18478 7371 1 17 . 1 1 46 46 ILE HA H 46 4.564 4.564 3.562 1.002 18478 7372 1 17 . 1 1 46 46 ILE C C 46 176.985 176.985 176.211 0.774 18478 7373 1 17 . 1 1 46 46 ILE CA C 46 57.051 57.051 61.999 -4.948 18478 7374 1 17 . 1 1 46 46 ILE H H 46 8.908 8.908 8.585 0.323 18478 7375 1 17 . 1 1 47 47 PHE N N 47 128.276 128.276 121.273 7.003 18478 7376 1 17 . 1 1 47 47 PHE HA H 47 4.827 4.827 4.380 0.447 18478 7377 1 17 . 1 1 47 47 PHE C C 47 177.835 177.835 176.267 1.568 18478 7378 1 17 . 1 1 47 47 PHE CA C 47 56.099 56.099 58.028 -1.929 18478 7379 1 17 . 1 1 47 47 PHE CB C 47 41.217 41.217 40.248 0.969 18478 7380 1 17 . 1 1 47 47 PHE H H 47 8.739 8.739 7.661 1.078 18478 7381 1 17 . 1 1 48 48 PHE N N 48 125.953 125.953 119.596 6.357 18478 7382 1 17 . 1 1 48 48 PHE HA H 48 4.251 4.251 3.983 0.268 18478 7383 1 17 . 1 1 48 48 PHE C C 48 175.869 175.869 173.820 2.049 18478 7384 1 17 . 1 1 48 48 PHE CA C 48 56.744 56.744 59.601 -2.857 18478 7385 1 17 . 1 1 48 48 PHE CB C 48 38.835 38.835 38.087 0.748 18478 7386 1 17 . 1 1 48 48 PHE H H 48 8.545 8.545 7.983 0.562 18478 7387 1 17 . 1 1 49 49 PHE N N 49 122.197 122.197 116.842 5.355 18478 7388 1 17 . 1 1 49 49 PHE HA H 49 4.400 4.400 4.427 -0.027 18478 7389 1 17 . 1 1 49 49 PHE C C 49 174.016 174.016 174.226 -0.210 18478 7390 1 17 . 1 1 49 49 PHE CA C 49 59.916 59.916 55.913 4.003 18478 7391 1 17 . 1 1 49 49 PHE CB C 49 39.799 39.799 41.271 -1.472 18478 7392 1 17 . 1 1 49 49 PHE H H 49 8.619 8.619 7.307 1.312 18478 7393 1 17 . 1 1 50 50 GLY N N 50 114.083 114.083 107.461 6.622 18478 7394 1 17 . 1 1 50 50 GLY C C 50 175.636 175.636 173.485 2.151 18478 7395 1 17 . 1 1 50 50 GLY CA C 50 46.718 46.718 43.942 2.776 18478 7396 1 17 . 1 1 50 50 GLY H H 50 10.329 10.329 7.978 2.351 18478 7397 1 17 . 1 1 51 51 THR N N 51 111.210 111.210 118.049 -6.839 18478 7398 1 17 . 1 1 51 51 THR HA H 51 3.980 3.980 4.573 -0.593 18478 7399 1 17 . 1 1 51 51 THR C C 51 175.588 175.588 172.100 3.488 18478 7400 1 17 . 1 1 51 51 THR CA C 51 62.223 62.223 61.399 0.824 18478 7401 1 17 . 1 1 51 51 THR CB C 51 68.346 68.346 71.946 -3.600 18478 7402 1 17 . 1 1 51 51 THR H H 51 7.882 7.882 8.423 -0.541 18478 7403 1 17 . 1 1 52 52 HIS N N 52 115.544 115.544 121.188 -5.644 18478 7404 1 17 . 1 1 52 52 HIS HA H 52 3.712 3.712 5.396 -1.684 18478 7405 1 17 . 1 1 52 52 HIS C C 52 177.717 177.717 175.435 2.282 18478 7406 1 17 . 1 1 52 52 HIS CA C 52 54.860 54.860 54.804 0.056 18478 7407 1 17 . 1 1 52 52 HIS CB C 52 26.388 26.388 30.314 -3.926 18478 7408 1 17 . 1 1 52 52 HIS H H 52 7.791 7.791 8.529 -0.738 18478 7409 1 17 . 1 1 53 53 GLU N N 53 117.517 117.517 123.614 -6.097 18478 7410 1 17 . 1 1 53 53 GLU HA H 53 4.298 4.298 4.758 -0.460 18478 7411 1 17 . 1 1 53 53 GLU C C 53 176.958 176.958 176.654 0.304 18478 7412 1 17 . 1 1 53 53 GLU CA C 53 55.403 55.403 55.378 0.025 18478 7413 1 17 . 1 1 53 53 GLU CB C 53 31.588 31.588 33.295 -1.707 18478 7414 1 17 . 1 1 53 53 GLU H H 53 6.795 6.795 8.517 -1.722 18478 7415 1 17 . 1 1 54 54 THR N N 54 111.182 111.182 116.854 -5.672 18478 7416 1 17 . 1 1 54 54 THR HA H 54 5.648 5.648 4.310 1.338 18478 7417 1 17 . 1 1 54 54 THR C C 54 177.234 177.234 174.485 2.749 18478 7418 1 17 . 1 1 54 54 THR CA C 54 59.894 59.894 61.549 -1.655 18478 7419 1 17 . 1 1 54 54 THR H H 54 8.139 8.139 8.723 -0.584 18478 7420 1 17 . 1 1 55 55 ALA HA H 55 4.403 4.403 4.155 0.248 18478 7421 1 17 . 1 1 55 55 ALA C C 55 176.601 176.601 178.050 -1.449 18478 7422 1 17 . 1 1 55 55 ALA CA C 55 51.079 51.079 53.166 -2.087 18478 7423 1 17 . 1 1 55 55 ALA CB C 55 23.285 23.285 19.021 4.264 18478 7424 1 17 . 1 1 56 56 PHE N N 56 118.058 118.058 113.491 4.567 18478 7425 1 17 . 1 1 56 56 PHE HA H 56 5.678 5.678 4.548 1.130 18478 7426 1 17 . 1 1 56 56 PHE C C 56 175.962 175.962 174.961 1.001 18478 7427 1 17 . 1 1 56 56 PHE CA C 56 56.008 56.008 59.107 -3.099 18478 7428 1 17 . 1 1 56 56 PHE CB C 56 39.995 39.995 37.657 2.338 18478 7429 1 17 . 1 1 56 56 PHE H H 56 8.523 8.523 8.212 0.311 18478 7430 1 17 . 1 1 57 57 LEU N N 57 123.344 123.344 120.695 2.649 18478 7431 1 17 . 1 1 57 57 LEU HA H 57 4.929 4.929 4.698 0.231 18478 7432 1 17 . 1 1 57 57 LEU C C 57 175.584 175.584 174.696 0.888 18478 7433 1 17 . 1 1 57 57 LEU CA C 57 53.463 53.463 54.653 -1.190 18478 7434 1 17 . 1 1 57 57 LEU CB C 57 46.545 46.545 43.254 3.291 18478 7435 1 17 . 1 1 57 57 LEU H H 57 8.579 8.579 7.589 0.990 18478 7436 1 17 . 1 1 58 58 GLY N N 58 108.499 108.499 106.857 1.642 18478 7437 1 17 . 1 1 58 58 GLY CA C 58 43.755 43.755 44.040 -0.285 18478 7438 1 17 . 1 1 58 58 GLY H H 58 9.318 9.318 7.289 2.029 18478 7439 1 17 . 1 1 59 59 PRO HA H 59 4.048 4.048 4.911 -0.863 18478 7440 1 17 . 1 1 59 59 PRO C C 59 173.763 173.763 174.661 -0.898 18478 7441 1 17 . 1 1 59 59 PRO CA C 59 64.770 64.770 60.524 4.246 18478 7442 1 17 . 1 1 59 59 PRO CB C 59 31.889 31.889 35.763 -3.874 18478 7443 1 17 . 1 1 60 60 LYS HA H 60 4.191 4.191 4.548 -0.357 18478 7444 1 17 . 1 1 60 60 LYS C C 60 174.842 174.842 176.574 -1.732 18478 7445 1 17 . 1 1 60 60 LYS CA C 60 57.875 57.875 56.054 1.821 18478 7446 1 17 . 1 1 60 60 LYS CB C 60 31.576 31.576 32.706 -1.130 18478 7447 1 17 . 1 1 61 61 ASP N N 61 117.768 117.768 122.959 -5.191 18478 7448 1 17 . 1 1 61 61 ASP HA H 61 4.973 4.973 4.278 0.695 18478 7449 1 17 . 1 1 61 61 ASP C C 61 178.178 178.178 177.140 1.038 18478 7450 1 17 . 1 1 61 61 ASP CA C 61 54.687 54.687 55.681 -0.994 18478 7451 1 17 . 1 1 61 61 ASP CB C 61 43.555 43.555 39.630 3.925 18478 7452 1 17 . 1 1 61 61 ASP H H 61 7.722 7.722 8.761 -1.039 18478 7453 1 17 . 1 1 62 62 ILE N N 62 114.244 114.244 121.780 -7.536 18478 7454 1 17 . 1 1 62 62 ILE HA H 62 4.891 4.891 3.364 1.527 18478 7455 1 17 . 1 1 62 62 ILE C C 62 178.027 178.027 177.324 0.703 18478 7456 1 17 . 1 1 62 62 ILE CA C 62 59.994 59.994 63.638 -3.644 18478 7457 1 17 . 1 1 62 62 ILE CB C 62 40.652 40.652 37.148 3.504 18478 7458 1 17 . 1 1 62 62 ILE H H 62 6.784 6.784 7.558 -0.774 18478 7459 1 17 . 1 1 63 63 PHE N N 63 119.819 119.819 120.115 -0.296 18478 7460 1 17 . 1 1 63 63 PHE HA H 63 5.214 5.214 4.208 1.006 18478 7461 1 17 . 1 1 63 63 PHE CA C 63 54.735 54.735 60.370 -5.635 18478 7462 1 17 . 1 1 63 63 PHE CB C 63 42.122 42.122 38.809 3.313 18478 7463 1 17 . 1 1 63 63 PHE H H 63 8.734 8.734 7.714 1.020 18478 7464 1 17 . 1 1 64 64 PRO HA H 64 4.771 4.771 4.314 0.457 18478 7465 1 17 . 1 1 64 64 PRO C C 64 174.036 174.036 178.635 -4.599 18478 7466 1 17 . 1 1 64 64 PRO CA C 64 64.474 64.474 64.302 0.172 18478 7467 1 17 . 1 1 64 64 PRO CB C 64 32.662 32.662 32.839 -0.177 18478 7468 1 17 . 1 1 65 65 TYR N N 65 124.335 124.335 121.830 2.505 18478 7469 1 17 . 1 1 65 65 TYR HA H 65 4.530 4.530 4.413 0.117 18478 7470 1 17 . 1 1 65 65 TYR C C 65 173.944 173.944 177.437 -3.493 18478 7471 1 17 . 1 1 65 65 TYR CA C 65 61.205 61.205 60.669 0.537 18478 7472 1 17 . 1 1 65 65 TYR CB C 65 38.844 38.844 37.850 0.994 18478 7473 1 17 . 1 1 65 65 TYR H H 65 8.359 8.359 7.764 0.595 18478 7474 1 17 . 1 1 66 66 SER N N 66 114.836 114.836 112.318 2.518 18478 7475 1 17 . 1 1 66 66 SER HA H 66 3.505 3.505 4.370 -0.865 18478 7476 1 17 . 1 1 66 66 SER C C 66 173.697 173.697 175.512 -1.815 18478 7477 1 17 . 1 1 66 66 SER CA C 66 63.078 63.078 59.640 3.438 18478 7478 1 17 . 1 1 66 66 SER CB C 66 62.223 62.223 63.021 -0.798 18478 7479 1 17 . 1 1 66 66 SER H H 66 8.974 8.974 7.703 1.271 18478 7480 1 17 . 1 1 67 67 GLU N N 67 118.013 118.013 118.573 -0.560 18478 7481 1 17 . 1 1 67 67 GLU HA H 67 4.210 4.210 4.181 0.029 18478 7482 1 17 . 1 1 67 67 GLU C C 67 174.961 174.961 177.516 -2.555 18478 7483 1 17 . 1 1 67 67 GLU CA C 67 58.330 58.330 57.938 0.392 18478 7484 1 17 . 1 1 67 67 GLU CB C 67 30.205 30.205 30.997 -0.792 18478 7485 1 17 . 1 1 67 67 GLU H H 67 8.817 8.817 7.891 0.926 18478 7486 1 17 . 1 1 68 68 ASN N N 68 113.942 113.942 111.132 2.810 18478 7487 1 17 . 1 1 68 68 ASN HA H 68 5.015 5.015 5.009 0.006 18478 7488 1 17 . 1 1 68 68 ASN C C 68 176.626 176.626 175.849 0.777 18478 7489 1 17 . 1 1 68 68 ASN CA C 68 53.768 53.768 51.275 2.493 18478 7490 1 17 . 1 1 68 68 ASN CB C 68 41.948 41.948 39.113 2.835 18478 7491 1 17 . 1 1 68 68 ASN H H 68 7.448 7.448 7.655 -0.207 18478 7492 1 17 . 1 1 69 69 LYS N N 69 124.584 124.584 121.486 3.098 18478 7493 1 17 . 1 1 69 69 LYS HA H 69 3.794 3.794 3.992 -0.198 18478 7494 1 17 . 1 1 69 69 LYS C C 69 173.330 173.330 175.460 -2.130 18478 7495 1 17 . 1 1 69 69 LYS CA C 69 61.225 61.225 57.653 3.572 18478 7496 1 17 . 1 1 69 69 LYS H H 69 7.592 7.592 8.517 -0.925 18478 7497 1 17 . 1 1 70 70 GLU N N 70 118.408 118.408 118.079 0.329 18478 7498 1 17 . 1 1 70 70 GLU HA H 70 4.005 4.005 4.809 -0.804 18478 7499 1 17 . 1 1 70 70 GLU C C 70 174.588 174.588 173.466 1.122 18478 7500 1 17 . 1 1 70 70 GLU CA C 70 58.695 58.695 53.177 5.518 18478 7501 1 17 . 1 1 70 70 GLU CB C 70 28.928 28.928 31.326 -2.398 18478 7502 1 17 . 1 1 70 70 GLU H H 70 8.478 8.478 8.236 0.242 18478 7503 1 17 . 1 1 71 71 LYS HA H 71 3.847 3.847 4.391 -0.544 18478 7504 1 17 . 1 1 71 71 LYS C C 71 173.420 173.420 175.349 -1.929 18478 7505 1 17 . 1 1 71 71 LYS CA C 71 58.718 58.718 55.488 3.230 18478 7506 1 17 . 1 1 71 71 LYS CB C 71 32.964 32.964 34.041 -1.077 18478 7507 1 17 . 1 1 72 72 TYR N N 72 112.358 112.358 122.043 -9.685 18478 7508 1 17 . 1 1 72 72 TYR HA H 72 4.790 4.790 4.285 0.505 18478 7509 1 17 . 1 1 72 72 TYR C C 72 174.442 174.442 175.875 -1.433 18478 7510 1 17 . 1 1 72 72 TYR CA C 72 55.287 55.287 59.193 -3.906 18478 7511 1 17 . 1 1 72 72 TYR CB C 72 37.244 37.244 39.165 -1.921 18478 7512 1 17 . 1 1 72 72 TYR H H 72 7.341 7.341 8.448 -1.107 18478 7513 1 17 . 1 1 73 73 GLY N N 73 110.612 110.612 108.248 2.364 18478 7514 1 17 . 1 1 73 73 GLY C C 73 177.982 177.982 173.323 4.659 18478 7515 1 17 . 1 1 73 73 GLY CA C 73 46.623 46.623 44.447 2.176 18478 7516 1 17 . 1 1 73 73 GLY H H 73 8.076 8.076 8.066 0.010 18478 7517 1 17 . 1 1 74 74 LYS N N 74 121.009 121.009 121.064 -0.055 18478 7518 1 17 . 1 1 74 74 LYS CA C 74 53.465 53.465 54.059 -0.594 18478 7519 1 17 . 1 1 74 74 LYS CB C 74 32.440 32.440 32.899 -0.459 18478 7520 1 17 . 1 1 74 74 LYS H H 74 7.411 7.411 7.956 -0.545 18478 7521 1 17 . 1 1 75 75 PRO HA H 75 4.452 4.452 4.321 0.131 18478 7522 1 17 . 1 1 75 75 PRO C C 75 174.959 174.959 177.886 -2.927 18478 7523 1 17 . 1 1 75 75 PRO CA C 75 62.861 62.861 64.395 -1.534 18478 7524 1 17 . 1 1 75 75 PRO CB C 75 32.407 32.407 31.708 0.699 18478 7525 1 17 . 1 1 76 76 ASN N N 76 121.045 121.045 119.561 1.484 18478 7526 1 17 . 1 1 76 76 ASN HA H 76 4.445 4.445 4.477 -0.032 18478 7527 1 17 . 1 1 76 76 ASN C C 76 174.145 174.145 175.244 -1.099 18478 7528 1 17 . 1 1 76 76 ASN CA C 76 55.701 55.701 52.548 3.153 18478 7529 1 17 . 1 1 76 76 ASN H H 76 8.474 8.474 9.008 -0.534 18478 7530 1 17 . 1 1 77 77 LYS N N 77 111.466 111.466 120.399 -8.933 18478 7531 1 17 . 1 1 77 77 LYS HA H 77 4.369 4.369 4.269 0.100 18478 7532 1 17 . 1 1 77 77 LYS C C 77 173.881 173.881 176.111 -2.230 18478 7533 1 17 . 1 1 77 77 LYS CA C 77 55.995 55.995 55.737 0.258 18478 7534 1 17 . 1 1 77 77 LYS CB C 77 32.538 32.538 32.497 0.041 18478 7535 1 17 . 1 1 77 77 LYS H H 77 8.543 8.543 7.941 0.602 18478 7536 1 17 . 1 1 78 78 ARG N N 78 122.233 122.233 119.354 2.879 18478 7537 1 17 . 1 1 78 78 ARG HA H 78 4.286 4.286 4.036 0.250 18478 7538 1 17 . 1 1 78 78 ARG C C 78 173.652 173.652 174.920 -1.268 18478 7539 1 17 . 1 1 78 78 ARG CA C 78 55.780 55.780 57.323 -1.543 18478 7540 1 17 . 1 1 78 78 ARG CB C 78 29.554 29.554 29.408 0.146 18478 7541 1 17 . 1 1 78 78 ARG H H 78 8.864 8.864 8.708 0.156 18478 7542 1 17 . 1 1 79 79 LYS N N 79 128.197 128.197 119.706 8.491 18478 7543 1 17 . 1 1 79 79 LYS HA H 79 4.221 4.221 4.441 -0.220 18478 7544 1 17 . 1 1 79 79 LYS C C 79 174.336 174.336 176.106 -1.770 18478 7545 1 17 . 1 1 79 79 LYS CA C 79 58.986 58.986 54.822 4.164 18478 7546 1 17 . 1 1 79 79 LYS CB C 79 32.072 32.072 32.486 -0.414 18478 7547 1 17 . 1 1 79 79 LYS H H 79 8.927 8.927 8.115 0.812 18478 7548 1 17 . 1 1 80 80 GLY N N 80 114.730 114.730 108.493 6.237 18478 7549 1 17 . 1 1 80 80 GLY C C 80 176.536 176.536 175.400 1.136 18478 7550 1 17 . 1 1 80 80 GLY CA C 80 45.992 45.992 45.794 0.198 18478 7551 1 17 . 1 1 80 80 GLY H H 80 8.943 8.943 8.172 0.771 18478 7552 1 17 . 1 1 81 81 PHE N N 81 123.770 123.770 119.847 3.923 18478 7553 1 17 . 1 1 81 81 PHE HA H 81 3.336 3.336 4.344 -1.008 18478 7554 1 17 . 1 1 81 81 PHE C C 81 174.037 174.037 176.346 -2.309 18478 7555 1 17 . 1 1 81 81 PHE CA C 81 63.094 63.094 60.262 2.832 18478 7556 1 17 . 1 1 81 81 PHE CB C 81 39.823 39.823 38.646 1.177 18478 7557 1 17 . 1 1 81 81 PHE H H 81 8.281 8.281 8.255 0.026 18478 7558 1 17 . 1 1 82 82 ASN N N 82 119.812 119.812 116.323 3.489 18478 7559 1 17 . 1 1 82 82 ASN HA H 82 4.458 4.458 4.308 0.150 18478 7560 1 17 . 1 1 82 82 ASN C C 82 171.290 171.290 176.391 -5.101 18478 7561 1 17 . 1 1 82 82 ASN CA C 82 56.060 56.060 55.816 0.244 18478 7562 1 17 . 1 1 82 82 ASN CB C 82 36.390 36.390 38.391 -2.001 18478 7563 1 17 . 1 1 82 82 ASN H H 82 9.145 9.145 8.518 0.627 18478 7564 1 17 . 1 1 83 83 GLU N N 83 124.411 124.411 119.025 5.386 18478 7565 1 17 . 1 1 83 83 GLU HA H 83 4.186 4.186 4.001 0.185 18478 7566 1 17 . 1 1 83 83 GLU C C 83 172.222 172.222 178.850 -6.628 18478 7567 1 17 . 1 1 83 83 GLU CA C 83 60.922 60.922 59.478 1.444 18478 7568 1 17 . 1 1 83 83 GLU CB C 83 28.132 28.132 29.498 -1.366 18478 7569 1 17 . 1 1 83 83 GLU H H 83 9.560 9.560 8.229 1.331 18478 7570 1 17 . 1 1 84 84 GLY N N 84 111.388 111.388 105.896 5.492 18478 7571 1 17 . 1 1 84 84 GLY C C 84 176.445 176.445 174.993 1.452 18478 7572 1 17 . 1 1 84 84 GLY CA C 84 46.727 46.727 46.327 0.400 18478 7573 1 17 . 1 1 84 84 GLY H H 84 8.364 8.364 7.505 0.859 18478 7574 1 17 . 1 1 85 85 LEU N N 85 121.153 121.153 120.594 0.559 18478 7575 1 17 . 1 1 85 85 LEU HA H 85 4.236 4.236 4.301 -0.065 18478 7576 1 17 . 1 1 85 85 LEU C C 85 172.285 172.285 177.542 -5.257 18478 7577 1 17 . 1 1 85 85 LEU CA C 85 56.795 56.795 56.844 -0.050 18478 7578 1 17 . 1 1 85 85 LEU CB C 85 41.113 41.113 43.170 -2.057 18478 7579 1 17 . 1 1 85 85 LEU H H 85 8.294 8.294 7.669 0.625 18478 7580 1 17 . 1 1 86 86 TRP N N 86 118.898 118.898 118.095 0.803 18478 7581 1 17 . 1 1 86 86 TRP HA H 86 4.161 4.161 4.385 -0.224 18478 7582 1 17 . 1 1 86 86 TRP C C 86 171.741 171.741 176.004 -4.263 18478 7583 1 17 . 1 1 86 86 TRP CA C 86 62.153 62.153 58.150 4.003 18478 7584 1 17 . 1 1 86 86 TRP CB C 86 28.424 28.424 29.944 -1.520 18478 7585 1 17 . 1 1 86 86 TRP H H 86 7.783 7.783 7.505 0.278 18478 7586 1 17 . 1 1 87 87 GLU N N 87 120.718 120.718 119.497 1.221 18478 7587 1 17 . 1 1 87 87 GLU HA H 87 3.416 3.416 4.621 -1.205 18478 7588 1 17 . 1 1 87 87 GLU C C 87 172.957 172.957 174.897 -1.940 18478 7589 1 17 . 1 1 87 87 GLU CA C 87 60.122 60.122 53.364 6.758 18478 7590 1 17 . 1 1 87 87 GLU CB C 87 31.021 31.021 30.855 0.166 18478 7591 1 17 . 1 1 87 87 GLU H H 87 8.779 8.779 7.523 1.256 18478 7592 1 17 . 1 1 88 88 ILE HA H 88 2.478 2.478 4.316 -1.838 18478 7593 1 17 . 1 1 88 88 ILE C C 88 177.873 177.873 176.987 0.886 18478 7594 1 17 . 1 1 88 88 ILE CA C 88 65.248 65.248 62.491 2.757 18478 7595 1 17 . 1 1 88 88 ILE CB C 88 37.327 37.327 38.250 -0.923 18478 7596 1 17 . 1 1 89 89 ASP N N 89 114.411 114.411 117.514 -3.103 18478 7597 1 17 . 1 1 89 89 ASP HA H 89 4.589 4.589 4.143 0.446 18478 7598 1 17 . 1 1 89 89 ASP C C 89 174.207 174.207 177.602 -3.395 18478 7599 1 17 . 1 1 89 89 ASP CA C 89 54.740 54.740 56.118 -1.379 18478 7600 1 17 . 1 1 89 89 ASP CB C 89 42.473 42.473 39.714 2.759 18478 7601 1 17 . 1 1 89 89 ASP H H 89 5.911 5.911 8.084 -2.173 18478 7602 1 17 . 1 1 90 90 ASN N N 90 114.358 114.358 113.527 0.831 18478 7603 1 17 . 1 1 90 90 ASN HA H 90 4.420 4.420 4.437 -0.017 18478 7604 1 17 . 1 1 90 90 ASN C C 90 176.991 176.991 177.399 -0.408 18478 7605 1 17 . 1 1 90 90 ASN CA C 90 54.855 54.855 55.848 -0.993 18478 7606 1 17 . 1 1 90 90 ASN CB C 90 40.582 40.582 37.788 2.794 18478 7607 1 17 . 1 1 90 90 ASN H H 90 7.480 7.480 7.686 -0.206 18478 7608 1 17 . 1 1 91 91 ASN N N 91 119.185 119.185 116.735 2.450 18478 7609 1 17 . 1 1 91 91 ASN HA H 91 5.006 5.006 4.924 0.082 18478 7610 1 17 . 1 1 91 91 ASN CA C 91 51.624 51.624 54.654 -3.030 18478 7611 1 17 . 1 1 91 91 ASN CB C 91 38.752 38.752 38.815 -0.063 18478 7612 1 17 . 1 1 91 91 ASN H H 91 9.238 9.238 7.681 1.557 18478 7613 1 17 . 1 1 92 92 PRO HA H 92 4.296 4.296 4.153 0.143 18478 7614 1 17 . 1 1 92 92 PRO C C 92 173.690 173.690 176.753 -3.063 18478 7615 1 17 . 1 1 92 92 PRO CA C 92 64.714 64.714 64.000 0.714 18478 7616 1 17 . 1 1 92 92 PRO CB C 92 31.781 31.781 31.826 -0.045 18478 7617 1 18 . 1 1 3 3 GLY C C 3 177.088 177.088 174.050 3.038 18478 7618 1 18 . 1 1 3 3 GLY CA C 3 45.330 45.330 46.959 -1.629 18478 7619 1 18 . 1 1 4 4 SER N N 4 115.847 115.847 110.425 5.422 18478 7620 1 18 . 1 1 4 4 SER HA H 4 4.480 4.480 4.716 -0.236 18478 7621 1 18 . 1 1 4 4 SER C C 4 177.991 177.991 173.138 4.853 18478 7622 1 18 . 1 1 4 4 SER CA C 4 58.742 58.742 57.191 1.551 18478 7623 1 18 . 1 1 4 4 SER CB C 4 63.820 63.820 65.774 -1.954 18478 7624 1 18 . 1 1 4 4 SER H H 4 8.207 8.207 7.859 0.348 18478 7625 1 18 . 1 1 5 5 MET N N 5 125.867 125.867 121.117 4.750 18478 7626 1 18 . 1 1 5 5 MET HA H 5 4.580 4.580 4.510 0.070 18478 7627 1 18 . 1 1 5 5 MET C C 5 174.825 174.825 176.408 -1.583 18478 7628 1 18 . 1 1 5 5 MET CA C 5 54.733 54.733 54.109 0.624 18478 7629 1 18 . 1 1 5 5 MET CB C 5 33.527 33.527 34.537 -1.010 18478 7630 1 18 . 1 1 5 5 MET H H 5 8.148 8.148 8.553 -0.405 18478 7631 1 18 . 1 1 6 6 THR N N 6 115.828 115.828 114.763 1.065 18478 7632 1 18 . 1 1 6 6 THR HA H 6 3.903 3.903 4.637 -0.734 18478 7633 1 18 . 1 1 6 6 THR C C 6 176.930 176.930 172.927 4.003 18478 7634 1 18 . 1 1 6 6 THR CA C 6 63.034 63.034 60.069 2.965 18478 7635 1 18 . 1 1 6 6 THR CB C 6 69.308 69.308 68.698 0.610 18478 7636 1 18 . 1 1 6 6 THR H H 6 8.408 8.408 8.439 -0.031 18478 7637 1 18 . 1 1 7 7 ARG HA H 7 4.276 4.276 4.336 -0.060 18478 7638 1 18 . 1 1 7 7 ARG C C 7 176.546 176.546 176.337 0.209 18478 7639 1 18 . 1 1 7 7 ARG CA C 7 55.813 55.813 56.056 -0.242 18478 7640 1 18 . 1 1 7 7 ARG CB C 7 30.556 30.556 30.852 -0.296 18478 7641 1 18 . 1 1 8 8 ASP N N 8 121.762 121.762 121.648 0.114 18478 7642 1 18 . 1 1 8 8 ASP HA H 8 4.537 4.537 4.147 0.390 18478 7643 1 18 . 1 1 8 8 ASP C C 8 177.750 177.750 174.533 3.217 18478 7644 1 18 . 1 1 8 8 ASP CA C 8 54.117 54.117 54.664 -0.547 18478 7645 1 18 . 1 1 8 8 ASP H H 8 8.066 8.066 8.788 -0.722 18478 7646 1 18 . 1 1 9 9 PHE N N 9 119.991 119.991 118.790 1.201 18478 7647 1 18 . 1 1 9 9 PHE HA H 9 4.734 4.734 5.046 -0.312 18478 7648 1 18 . 1 1 9 9 PHE C C 9 176.838 176.838 174.579 2.259 18478 7649 1 18 . 1 1 9 9 PHE CA C 9 58.303 58.303 57.010 1.293 18478 7650 1 18 . 1 1 9 9 PHE CB C 9 41.594 41.594 41.581 0.013 18478 7651 1 18 . 1 1 9 9 PHE H H 9 8.103 8.103 7.592 0.511 18478 7652 1 18 . 1 1 10 10 LYS N N 10 122.957 122.957 123.858 -0.901 18478 7653 1 18 . 1 1 10 10 LYS CA C 10 53.167 53.167 55.608 -2.441 18478 7654 1 18 . 1 1 10 10 LYS CB C 10 33.495 33.495 32.337 1.158 18478 7655 1 18 . 1 1 10 10 LYS H H 10 9.087 9.087 8.763 0.324 18478 7656 1 18 . 1 1 11 11 PRO HA H 11 3.903 3.903 4.967 -1.064 18478 7657 1 18 . 1 1 11 11 PRO C C 11 173.988 173.988 174.731 -0.743 18478 7658 1 18 . 1 1 11 11 PRO CA C 11 63.874 63.874 61.351 2.523 18478 7659 1 18 . 1 1 11 11 PRO CB C 11 31.623 31.623 35.002 -3.378 18478 7660 1 18 . 1 1 12 12 GLY N N 12 115.413 115.413 110.907 4.506 18478 7661 1 18 . 1 1 12 12 GLY C C 12 176.966 176.966 172.480 4.486 18478 7662 1 18 . 1 1 12 12 GLY CA C 12 44.651 44.651 42.198 2.453 18478 7663 1 18 . 1 1 12 12 GLY H H 12 9.667 9.667 8.964 0.703 18478 7664 1 18 . 1 1 13 13 ASP N N 13 122.208 122.208 128.732 -6.524 18478 7665 1 18 . 1 1 13 13 ASP HA H 13 4.601 4.601 4.972 -0.371 18478 7666 1 18 . 1 1 13 13 ASP C C 13 176.244 176.244 174.413 1.831 18478 7667 1 18 . 1 1 13 13 ASP CA C 13 55.870 55.870 52.045 3.825 18478 7668 1 18 . 1 1 13 13 ASP CB C 13 40.794 40.794 42.450 -1.656 18478 7669 1 18 . 1 1 13 13 ASP H H 13 8.303 8.303 8.570 -0.267 18478 7670 1 18 . 1 1 14 14 LEU N N 14 121.306 121.306 126.436 -5.130 18478 7671 1 18 . 1 1 14 14 LEU HA H 14 4.982 4.982 4.557 0.425 18478 7672 1 18 . 1 1 14 14 LEU C C 14 173.461 173.461 176.339 -2.878 18478 7673 1 18 . 1 1 14 14 LEU CA C 14 54.516 54.516 53.598 0.918 18478 7674 1 18 . 1 1 14 14 LEU CB C 14 40.999 40.999 42.009 -1.010 18478 7675 1 18 . 1 1 14 14 LEU H H 14 8.618 8.618 7.731 0.887 18478 7676 1 18 . 1 1 15 15 ILE N N 15 118.806 118.806 127.208 -8.402 18478 7677 1 18 . 1 1 15 15 ILE HA H 15 5.356 5.356 4.317 1.039 18478 7678 1 18 . 1 1 15 15 ILE C C 15 175.982 175.982 175.518 0.464 18478 7679 1 18 . 1 1 15 15 ILE CA C 15 60.481 60.481 60.249 0.232 18478 7680 1 18 . 1 1 15 15 ILE CB C 15 44.142 44.142 39.325 4.817 18478 7681 1 18 . 1 1 15 15 ILE H H 15 8.864 8.864 8.723 0.141 18478 7682 1 18 . 1 1 16 16 PHE N N 16 112.472 112.472 126.649 -14.177 18478 7683 1 18 . 1 1 16 16 PHE HA H 16 5.306 5.306 4.144 1.162 18478 7684 1 18 . 1 1 16 16 PHE C C 16 176.239 176.239 176.248 -0.009 18478 7685 1 18 . 1 1 16 16 PHE CA C 16 58.603 58.603 59.849 -1.246 18478 7686 1 18 . 1 1 16 16 PHE CB C 16 43.305 43.305 38.906 4.399 18478 7687 1 18 . 1 1 16 16 PHE H H 16 9.411 9.411 8.941 0.470 18478 7688 1 18 . 1 1 17 17 ALA N N 17 123.889 123.889 126.875 -2.986 18478 7689 1 18 . 1 1 17 17 ALA HA H 17 5.348 5.348 3.666 1.682 18478 7690 1 18 . 1 1 17 17 ALA C C 17 174.426 174.426 175.899 -1.473 18478 7691 1 18 . 1 1 17 17 ALA CA C 17 50.062 50.062 51.539 -1.477 18478 7692 1 18 . 1 1 17 17 ALA H H 17 9.658 9.658 8.510 1.148 18478 7693 1 18 . 1 1 18 18 LYS N N 18 127.760 127.760 121.633 6.127 18478 7694 1 18 . 1 1 18 18 LYS HA H 18 4.697 4.697 4.701 -0.004 18478 7695 1 18 . 1 1 18 18 LYS C C 18 178.554 178.554 174.587 3.967 18478 7696 1 18 . 1 1 18 18 LYS CA C 18 53.893 53.893 52.640 1.253 18478 7697 1 18 . 1 1 18 18 LYS CB C 18 35.291 35.291 32.862 2.429 18478 7698 1 18 . 1 1 18 18 LYS H H 18 9.421 9.421 7.924 1.497 18478 7699 1 18 . 1 1 19 19 MET HA H 19 4.656 4.656 4.558 0.098 18478 7700 1 18 . 1 1 19 19 MET C C 19 175.741 175.741 175.285 0.456 18478 7701 1 18 . 1 1 19 19 MET CA C 19 53.916 53.916 54.752 -0.836 18478 7702 1 18 . 1 1 19 19 MET CB C 19 35.799 35.799 33.179 2.620 18478 7703 1 18 . 1 1 20 20 LYS N N 20 124.062 124.062 119.128 4.934 18478 7704 1 18 . 1 1 20 20 LYS CA C 20 58.585 58.585 56.439 2.146 18478 7705 1 18 . 1 1 20 20 LYS CB C 20 31.978 31.978 32.239 -0.261 18478 7706 1 18 . 1 1 20 20 LYS H H 20 8.645 8.645 8.235 0.410 18478 7707 1 18 . 1 1 21 21 GLY C C 21 176.205 176.205 172.086 4.119 18478 7708 1 18 . 1 1 21 21 GLY CA C 21 45.142 45.142 42.427 2.715 18478 7709 1 18 . 1 1 22 22 TYR HA H 22 4.573 4.573 4.651 -0.078 18478 7710 1 18 . 1 1 22 22 TYR CA C 22 55.748 55.748 57.760 -2.012 18478 7711 1 18 . 1 1 22 22 TYR CB C 22 41.331 41.331 38.377 2.954 18478 7712 1 18 . 1 1 23 23 PRO HA H 23 4.759 4.759 4.924 -0.165 18478 7713 1 18 . 1 1 23 23 PRO C C 23 174.587 174.587 175.136 -0.549 18478 7714 1 18 . 1 1 23 23 PRO CA C 23 62.072 62.072 61.556 0.516 18478 7715 1 18 . 1 1 23 23 PRO CB C 23 31.077 31.077 34.910 -3.833 18478 7716 1 18 . 1 1 24 24 HIS N N 24 119.190 119.190 117.692 1.498 18478 7717 1 18 . 1 1 24 24 HIS HA H 24 3.983 3.983 4.961 -0.978 18478 7718 1 18 . 1 1 24 24 HIS C C 24 175.555 175.555 173.490 2.065 18478 7719 1 18 . 1 1 24 24 HIS CA C 24 60.973 60.973 54.259 6.714 18478 7720 1 18 . 1 1 24 24 HIS CB C 24 30.689 30.689 33.476 -2.787 18478 7721 1 18 . 1 1 24 24 HIS H H 24 8.158 8.158 8.645 -0.487 18478 7722 1 18 . 1 1 25 25 TRP N N 25 127.435 127.435 127.798 -0.363 18478 7723 1 18 . 1 1 25 25 TRP HA H 25 3.760 3.760 4.647 -0.887 18478 7724 1 18 . 1 1 25 25 TRP CA C 25 55.890 55.890 59.423 -3.533 18478 7725 1 18 . 1 1 25 25 TRP CB C 25 32.879 32.879 29.910 2.969 18478 7726 1 18 . 1 1 25 25 TRP H H 25 9.211 9.211 8.920 0.291 18478 7727 1 18 . 1 1 26 26 PRO HA H 26 4.217 4.217 4.666 -0.449 18478 7728 1 18 . 1 1 26 26 PRO C C 26 176.279 176.279 176.403 -0.124 18478 7729 1 18 . 1 1 26 26 PRO CA C 26 63.140 63.140 62.007 1.133 18478 7730 1 18 . 1 1 26 26 PRO CB C 26 32.171 32.171 34.514 -2.343 18478 7731 1 18 . 1 1 27 27 ALA N N 27 130.162 130.162 123.473 6.689 18478 7732 1 18 . 1 1 27 27 ALA HA H 27 4.981 4.981 4.349 0.632 18478 7733 1 18 . 1 1 27 27 ALA C C 27 177.227 177.227 177.548 -0.321 18478 7734 1 18 . 1 1 27 27 ALA CA C 27 52.574 52.574 51.722 0.852 18478 7735 1 18 . 1 1 27 27 ALA CB C 27 23.239 23.239 19.833 3.406 18478 7736 1 18 . 1 1 27 27 ALA H H 27 9.394 9.394 8.193 1.201 18478 7737 1 18 . 1 1 28 28 ARG N N 28 117.381 117.381 117.214 0.167 18478 7738 1 18 . 1 1 28 28 ARG HA H 28 5.421 5.421 4.740 0.681 18478 7739 1 18 . 1 1 28 28 ARG C C 28 176.465 176.465 174.603 1.862 18478 7740 1 18 . 1 1 28 28 ARG CA C 28 53.662 53.662 53.534 0.128 18478 7741 1 18 . 1 1 28 28 ARG CB C 28 35.058 35.058 30.451 4.607 18478 7742 1 18 . 1 1 28 28 ARG H H 28 8.806 8.806 8.463 0.343 18478 7743 1 18 . 1 1 29 29 VAL HA H 29 4.109 4.109 4.297 -0.188 18478 7744 1 18 . 1 1 29 29 VAL C C 29 175.996 175.996 174.199 1.797 18478 7745 1 18 . 1 1 29 29 VAL CA C 29 62.810 62.810 61.779 1.031 18478 7746 1 18 . 1 1 29 29 VAL CB C 29 31.108 31.108 32.620 -1.512 18478 7747 1 18 . 1 1 30 30 ASP N N 30 133.830 133.830 119.691 14.139 18478 7748 1 18 . 1 1 30 30 ASP HA H 30 5.198 5.198 4.664 0.534 18478 7749 1 18 . 1 1 30 30 ASP C C 30 176.207 176.207 176.419 -0.212 18478 7750 1 18 . 1 1 30 30 ASP CA C 30 53.007 53.007 53.822 -0.815 18478 7751 1 18 . 1 1 30 30 ASP CB C 30 44.130 44.130 41.107 3.023 18478 7752 1 18 . 1 1 30 30 ASP H H 30 8.892 8.892 8.382 0.510 18478 7753 1 18 . 1 1 31 31 GLU N N 31 115.905 115.905 123.398 -7.493 18478 7754 1 18 . 1 1 31 31 GLU HA H 31 4.409 4.409 4.003 0.406 18478 7755 1 18 . 1 1 31 31 GLU C C 31 175.192 175.192 176.141 -0.949 18478 7756 1 18 . 1 1 31 31 GLU CA C 31 55.389 55.389 56.158 -0.769 18478 7757 1 18 . 1 1 31 31 GLU H H 31 7.966 7.966 8.955 -0.989 18478 7758 1 18 . 1 1 32 32 VAL N N 32 122.794 122.794 117.154 5.640 18478 7759 1 18 . 1 1 32 32 VAL HA H 32 4.303 4.303 3.796 0.507 18478 7760 1 18 . 1 1 32 32 VAL CA C 32 60.408 60.408 62.734 -2.326 18478 7761 1 18 . 1 1 32 32 VAL CB C 32 32.333 32.333 30.863 1.470 18478 7762 1 18 . 1 1 32 32 VAL H H 32 8.702 8.702 8.265 0.437 18478 7763 1 18 . 1 1 33 33 PRO HA H 33 4.572 4.572 4.169 0.403 18478 7764 1 18 . 1 1 33 33 PRO C C 33 175.366 175.366 177.201 -1.835 18478 7765 1 18 . 1 1 33 33 PRO CA C 33 63.702 63.702 64.877 -1.175 18478 7766 1 18 . 1 1 33 33 PRO CB C 33 32.736 32.736 31.830 0.906 18478 7767 1 18 . 1 1 34 34 ASP N N 34 119.187 119.187 116.222 2.965 18478 7768 1 18 . 1 1 34 34 ASP HA H 34 4.679 4.679 4.928 -0.249 18478 7769 1 18 . 1 1 34 34 ASP C C 34 175.713 175.713 173.594 2.119 18478 7770 1 18 . 1 1 34 34 ASP CA C 34 53.013 53.013 52.381 0.632 18478 7771 1 18 . 1 1 34 34 ASP CB C 34 40.850 40.850 39.968 0.882 18478 7772 1 18 . 1 1 34 34 ASP H H 34 8.686 8.686 7.818 0.868 18478 7773 1 18 . 1 1 35 35 GLY C C 35 177.458 177.458 172.927 4.531 18478 7774 1 18 . 1 1 35 35 GLY CA C 35 45.507 45.507 43.902 1.605 18478 7775 1 18 . 1 1 36 36 ALA HA H 36 4.404 4.404 4.316 0.088 18478 7776 1 18 . 1 1 36 36 ALA CA C 36 52.010 52.010 51.755 0.255 18478 7777 1 18 . 1 1 36 36 ALA CB C 36 19.909 19.909 19.765 0.144 18478 7778 1 18 . 1 1 37 37 VAL N N 37 119.594 119.594 123.222 -3.628 18478 7779 1 18 . 1 1 37 37 VAL HA H 37 3.932 3.932 4.179 -0.247 18478 7780 1 18 . 1 1 37 37 VAL C C 37 175.966 175.966 175.581 0.385 18478 7781 1 18 . 1 1 37 37 VAL CA C 37 62.810 62.810 63.874 -1.064 18478 7782 1 18 . 1 1 37 37 VAL CB C 37 32.267 32.267 32.823 -0.556 18478 7783 1 18 . 1 1 37 37 VAL H H 37 8.037 8.037 8.418 -0.381 18478 7784 1 18 . 1 1 38 38 LYS N N 38 125.676 125.676 120.949 4.727 18478 7785 1 18 . 1 1 38 38 LYS C C 38 173.865 173.865 174.487 -0.622 18478 7786 1 18 . 1 1 38 38 LYS CA C 38 54.278 54.278 56.865 -2.587 18478 7787 1 18 . 1 1 38 38 LYS CB C 38 31.740 31.740 34.364 -2.624 18478 7788 1 18 . 1 1 38 38 LYS H H 38 8.292 8.292 8.378 -0.086 18478 7789 1 18 . 1 1 40 40 PRO HA H 40 4.387 4.387 5.267 -0.880 18478 7790 1 18 . 1 1 40 40 PRO C C 40 175.535 175.535 175.345 0.190 18478 7791 1 18 . 1 1 40 40 PRO CA C 40 62.330 62.330 59.596 2.734 18478 7792 1 18 . 1 1 40 40 PRO CB C 40 32.086 32.086 31.721 0.365 18478 7793 1 18 . 1 1 41 41 THR HA H 41 4.027 4.027 4.518 -0.491 18478 7794 1 18 . 1 1 41 41 THR C C 41 176.795 176.795 173.013 3.782 18478 7795 1 18 . 1 1 41 41 THR CA C 41 63.693 63.693 62.183 1.510 18478 7796 1 18 . 1 1 41 41 THR CB C 41 69.370 69.370 68.838 0.532 18478 7797 1 18 . 1 1 42 42 ASN N N 42 118.513 118.513 121.822 -3.309 18478 7798 1 18 . 1 1 42 42 ASN HA H 42 4.530 4.530 4.951 -0.421 18478 7799 1 18 . 1 1 42 42 ASN C C 42 177.230 177.230 174.686 2.544 18478 7800 1 18 . 1 1 42 42 ASN CA C 42 56.373 56.373 50.485 5.888 18478 7801 1 18 . 1 1 42 42 ASN CB C 42 37.618 37.618 37.882 -0.264 18478 7802 1 18 . 1 1 42 42 ASN H H 42 8.752 8.752 8.794 -0.042 18478 7803 1 18 . 1 1 43 43 LYS N N 43 115.898 115.898 128.986 -13.088 18478 7804 1 18 . 1 1 43 43 LYS HA H 43 4.710 4.710 4.703 0.007 18478 7805 1 18 . 1 1 43 43 LYS C C 43 177.032 177.032 176.408 0.624 18478 7806 1 18 . 1 1 43 43 LYS CA C 43 54.957 54.957 55.065 -0.108 18478 7807 1 18 . 1 1 43 43 LYS CB C 43 36.600 36.600 32.183 4.417 18478 7808 1 18 . 1 1 43 43 LYS H H 43 7.723 7.723 9.125 -1.402 18478 7809 1 18 . 1 1 44 44 LEU N N 44 121.006 121.006 128.366 -7.360 18478 7810 1 18 . 1 1 44 44 LEU HA H 44 5.000 5.000 4.427 0.573 18478 7811 1 18 . 1 1 44 44 LEU CA C 44 51.842 51.842 54.862 -3.020 18478 7812 1 18 . 1 1 44 44 LEU CB C 44 44.418 44.418 40.755 3.663 18478 7813 1 18 . 1 1 44 44 LEU H H 44 9.063 9.063 8.767 0.296 18478 7814 1 18 . 1 1 45 45 PRO HA H 45 4.392 4.392 4.493 -0.101 18478 7815 1 18 . 1 1 45 45 PRO C C 45 177.051 177.051 177.370 -0.319 18478 7816 1 18 . 1 1 45 45 PRO CA C 45 62.000 62.000 63.929 -1.929 18478 7817 1 18 . 1 1 45 45 PRO CB C 45 30.737 30.737 32.598 -1.861 18478 7818 1 18 . 1 1 46 46 ILE N N 46 125.996 125.996 124.177 1.819 18478 7819 1 18 . 1 1 46 46 ILE HA H 46 4.564 4.564 3.584 0.980 18478 7820 1 18 . 1 1 46 46 ILE C C 46 176.985 176.985 175.984 1.001 18478 7821 1 18 . 1 1 46 46 ILE CA C 46 57.051 57.051 62.393 -5.342 18478 7822 1 18 . 1 1 46 46 ILE H H 46 8.908 8.908 8.862 0.046 18478 7823 1 18 . 1 1 47 47 PHE N N 47 128.276 128.276 116.717 11.559 18478 7824 1 18 . 1 1 47 47 PHE HA H 47 4.827 4.827 4.449 0.378 18478 7825 1 18 . 1 1 47 47 PHE C C 47 177.835 177.835 176.248 1.587 18478 7826 1 18 . 1 1 47 47 PHE CA C 47 56.099 56.099 57.455 -1.356 18478 7827 1 18 . 1 1 47 47 PHE CB C 47 41.217 41.217 40.857 0.360 18478 7828 1 18 . 1 1 47 47 PHE H H 47 8.739 8.739 7.710 1.029 18478 7829 1 18 . 1 1 48 48 PHE N N 48 125.953 125.953 119.824 6.129 18478 7830 1 18 . 1 1 48 48 PHE HA H 48 4.251 4.251 4.420 -0.169 18478 7831 1 18 . 1 1 48 48 PHE C C 48 175.869 175.869 174.563 1.306 18478 7832 1 18 . 1 1 48 48 PHE CA C 48 56.744 56.744 60.107 -3.363 18478 7833 1 18 . 1 1 48 48 PHE CB C 48 38.835 38.835 37.867 0.968 18478 7834 1 18 . 1 1 48 48 PHE H H 48 8.545 8.545 8.199 0.346 18478 7835 1 18 . 1 1 49 49 PHE N N 49 122.197 122.197 118.354 3.843 18478 7836 1 18 . 1 1 49 49 PHE HA H 49 4.400 4.400 4.665 -0.265 18478 7837 1 18 . 1 1 49 49 PHE C C 49 174.016 174.016 174.625 -0.609 18478 7838 1 18 . 1 1 49 49 PHE CA C 49 59.916 59.916 56.493 3.423 18478 7839 1 18 . 1 1 49 49 PHE CB C 49 39.799 39.799 40.988 -1.189 18478 7840 1 18 . 1 1 49 49 PHE H H 49 8.619 8.619 7.672 0.947 18478 7841 1 18 . 1 1 50 50 GLY N N 50 114.083 114.083 108.482 5.601 18478 7842 1 18 . 1 1 50 50 GLY C C 50 175.636 175.636 173.210 2.426 18478 7843 1 18 . 1 1 50 50 GLY CA C 50 46.718 46.718 43.939 2.779 18478 7844 1 18 . 1 1 50 50 GLY H H 50 10.329 10.329 8.145 2.184 18478 7845 1 18 . 1 1 51 51 THR N N 51 111.210 111.210 121.037 -9.827 18478 7846 1 18 . 1 1 51 51 THR HA H 51 3.980 3.980 4.598 -0.618 18478 7847 1 18 . 1 1 51 51 THR C C 51 175.588 175.588 171.853 3.735 18478 7848 1 18 . 1 1 51 51 THR CA C 51 62.223 62.223 60.823 1.400 18478 7849 1 18 . 1 1 51 51 THR CB C 51 68.346 68.346 72.432 -4.086 18478 7850 1 18 . 1 1 51 51 THR H H 51 7.882 7.882 8.781 -0.899 18478 7851 1 18 . 1 1 52 52 HIS N N 52 115.544 115.544 119.839 -4.295 18478 7852 1 18 . 1 1 52 52 HIS HA H 52 3.712 3.712 5.465 -1.753 18478 7853 1 18 . 1 1 52 52 HIS C C 52 177.717 177.717 175.408 2.309 18478 7854 1 18 . 1 1 52 52 HIS CA C 52 54.860 54.860 54.354 0.506 18478 7855 1 18 . 1 1 52 52 HIS CB C 52 26.388 26.388 30.503 -4.115 18478 7856 1 18 . 1 1 52 52 HIS H H 52 7.791 7.791 8.470 -0.679 18478 7857 1 18 . 1 1 53 53 GLU N N 53 117.517 117.517 123.058 -5.541 18478 7858 1 18 . 1 1 53 53 GLU HA H 53 4.298 4.298 4.717 -0.419 18478 7859 1 18 . 1 1 53 53 GLU C C 53 176.958 176.958 176.486 0.472 18478 7860 1 18 . 1 1 53 53 GLU CA C 53 55.403 55.403 55.431 -0.028 18478 7861 1 18 . 1 1 53 53 GLU CB C 53 31.588 31.588 33.297 -1.710 18478 7862 1 18 . 1 1 53 53 GLU H H 53 6.795 6.795 8.698 -1.903 18478 7863 1 18 . 1 1 54 54 THR N N 54 111.182 111.182 117.154 -5.972 18478 7864 1 18 . 1 1 54 54 THR HA H 54 5.648 5.648 4.399 1.249 18478 7865 1 18 . 1 1 54 54 THR C C 54 177.234 177.234 174.262 2.972 18478 7866 1 18 . 1 1 54 54 THR CA C 54 59.894 59.894 61.563 -1.669 18478 7867 1 18 . 1 1 54 54 THR H H 54 8.139 8.139 8.805 -0.666 18478 7868 1 18 . 1 1 55 55 ALA HA H 55 4.403 4.403 4.250 0.153 18478 7869 1 18 . 1 1 55 55 ALA C C 55 176.601 176.601 178.065 -1.464 18478 7870 1 18 . 1 1 55 55 ALA CA C 55 51.079 51.079 53.177 -2.098 18478 7871 1 18 . 1 1 55 55 ALA CB C 55 23.285 23.285 19.049 4.236 18478 7872 1 18 . 1 1 56 56 PHE N N 56 118.058 118.058 113.888 4.170 18478 7873 1 18 . 1 1 56 56 PHE HA H 56 5.678 5.678 4.580 1.098 18478 7874 1 18 . 1 1 56 56 PHE C C 56 175.962 175.962 174.981 0.981 18478 7875 1 18 . 1 1 56 56 PHE CA C 56 56.008 56.008 59.054 -3.046 18478 7876 1 18 . 1 1 56 56 PHE CB C 56 39.995 39.995 37.758 2.236 18478 7877 1 18 . 1 1 56 56 PHE H H 56 8.523 8.523 8.317 0.206 18478 7878 1 18 . 1 1 57 57 LEU N N 57 123.344 123.344 120.853 2.491 18478 7879 1 18 . 1 1 57 57 LEU HA H 57 4.929 4.929 4.727 0.202 18478 7880 1 18 . 1 1 57 57 LEU C C 57 175.584 175.584 174.803 0.781 18478 7881 1 18 . 1 1 57 57 LEU CA C 57 53.463 53.463 55.256 -1.793 18478 7882 1 18 . 1 1 57 57 LEU CB C 57 46.545 46.545 43.960 2.585 18478 7883 1 18 . 1 1 57 57 LEU H H 57 8.579 8.579 7.606 0.973 18478 7884 1 18 . 1 1 58 58 GLY N N 58 108.499 108.499 107.267 1.232 18478 7885 1 18 . 1 1 58 58 GLY CA C 58 43.755 43.755 44.217 -0.462 18478 7886 1 18 . 1 1 58 58 GLY H H 58 9.318 9.318 7.324 1.994 18478 7887 1 18 . 1 1 59 59 PRO HA H 59 4.048 4.048 4.964 -0.916 18478 7888 1 18 . 1 1 59 59 PRO C C 59 173.763 173.763 174.706 -0.943 18478 7889 1 18 . 1 1 59 59 PRO CA C 59 64.770 64.770 60.500 4.270 18478 7890 1 18 . 1 1 59 59 PRO CB C 59 31.889 31.889 35.681 -3.792 18478 7891 1 18 . 1 1 60 60 LYS HA H 60 4.191 4.191 4.609 -0.418 18478 7892 1 18 . 1 1 60 60 LYS C C 60 174.842 174.842 176.638 -1.796 18478 7893 1 18 . 1 1 60 60 LYS CA C 60 57.875 57.875 56.083 1.792 18478 7894 1 18 . 1 1 60 60 LYS CB C 60 31.576 31.576 32.808 -1.232 18478 7895 1 18 . 1 1 61 61 ASP N N 61 117.768 117.768 123.461 -5.693 18478 7896 1 18 . 1 1 61 61 ASP HA H 61 4.973 4.973 4.356 0.617 18478 7897 1 18 . 1 1 61 61 ASP C C 61 178.178 178.178 177.054 1.124 18478 7898 1 18 . 1 1 61 61 ASP CA C 61 54.687 54.687 55.791 -1.104 18478 7899 1 18 . 1 1 61 61 ASP CB C 61 43.555 43.555 39.344 4.211 18478 7900 1 18 . 1 1 61 61 ASP H H 61 7.722 7.722 8.872 -1.150 18478 7901 1 18 . 1 1 62 62 ILE N N 62 114.244 114.244 120.781 -6.537 18478 7902 1 18 . 1 1 62 62 ILE HA H 62 4.891 4.891 3.313 1.578 18478 7903 1 18 . 1 1 62 62 ILE C C 62 178.027 178.027 177.491 0.536 18478 7904 1 18 . 1 1 62 62 ILE CA C 62 59.994 59.994 63.578 -3.584 18478 7905 1 18 . 1 1 62 62 ILE CB C 62 40.652 40.652 37.142 3.510 18478 7906 1 18 . 1 1 62 62 ILE H H 62 6.784 6.784 7.499 -0.715 18478 7907 1 18 . 1 1 63 63 PHE N N 63 119.819 119.819 121.824 -2.005 18478 7908 1 18 . 1 1 63 63 PHE HA H 63 5.214 5.214 4.421 0.793 18478 7909 1 18 . 1 1 63 63 PHE CA C 63 54.735 54.735 60.022 -5.287 18478 7910 1 18 . 1 1 63 63 PHE CB C 63 42.122 42.122 38.947 3.175 18478 7911 1 18 . 1 1 63 63 PHE H H 63 8.734 8.734 7.663 1.071 18478 7912 1 18 . 1 1 64 64 PRO HA H 64 4.771 4.771 4.285 0.486 18478 7913 1 18 . 1 1 64 64 PRO C C 64 174.036 174.036 178.594 -4.558 18478 7914 1 18 . 1 1 64 64 PRO CA C 64 64.474 64.474 64.913 -0.439 18478 7915 1 18 . 1 1 64 64 PRO CB C 64 32.662 32.662 32.624 0.038 18478 7916 1 18 . 1 1 65 65 TYR N N 65 124.335 124.335 121.429 2.906 18478 7917 1 18 . 1 1 65 65 TYR HA H 65 4.530 4.530 4.281 0.249 18478 7918 1 18 . 1 1 65 65 TYR C C 65 173.944 173.944 177.494 -3.550 18478 7919 1 18 . 1 1 65 65 TYR CA C 65 61.205 61.205 60.756 0.449 18478 7920 1 18 . 1 1 65 65 TYR CB C 65 38.844 38.844 38.041 0.803 18478 7921 1 18 . 1 1 65 65 TYR H H 65 8.359 8.359 7.841 0.518 18478 7922 1 18 . 1 1 66 66 SER N N 66 114.836 114.836 112.286 2.550 18478 7923 1 18 . 1 1 66 66 SER HA H 66 3.505 3.505 4.346 -0.841 18478 7924 1 18 . 1 1 66 66 SER C C 66 173.697 173.697 175.408 -1.711 18478 7925 1 18 . 1 1 66 66 SER CA C 66 63.078 63.078 59.537 3.541 18478 7926 1 18 . 1 1 66 66 SER CB C 66 62.223 62.223 63.118 -0.895 18478 7927 1 18 . 1 1 66 66 SER H H 66 8.974 8.974 7.707 1.267 18478 7928 1 18 . 1 1 67 67 GLU N N 67 118.013 118.013 118.600 -0.587 18478 7929 1 18 . 1 1 67 67 GLU HA H 67 4.210 4.210 4.178 0.032 18478 7930 1 18 . 1 1 67 67 GLU C C 67 174.961 174.961 177.460 -2.499 18478 7931 1 18 . 1 1 67 67 GLU CA C 67 58.330 58.330 57.699 0.631 18478 7932 1 18 . 1 1 67 67 GLU CB C 67 30.205 30.205 30.898 -0.693 18478 7933 1 18 . 1 1 67 67 GLU H H 67 8.817 8.817 7.898 0.919 18478 7934 1 18 . 1 1 68 68 ASN N N 68 113.942 113.942 111.142 2.800 18478 7935 1 18 . 1 1 68 68 ASN HA H 68 5.015 5.015 4.962 0.053 18478 7936 1 18 . 1 1 68 68 ASN C C 68 176.626 176.626 175.894 0.732 18478 7937 1 18 . 1 1 68 68 ASN CA C 68 53.768 53.768 51.432 2.336 18478 7938 1 18 . 1 1 68 68 ASN CB C 68 41.948 41.948 39.468 2.480 18478 7939 1 18 . 1 1 68 68 ASN H H 68 7.448 7.448 7.722 -0.274 18478 7940 1 18 . 1 1 69 69 LYS N N 69 124.584 124.584 120.357 4.227 18478 7941 1 18 . 1 1 69 69 LYS HA H 69 3.794 3.794 3.963 -0.169 18478 7942 1 18 . 1 1 69 69 LYS C C 69 173.330 173.330 175.132 -1.802 18478 7943 1 18 . 1 1 69 69 LYS CA C 69 61.225 61.225 57.359 3.866 18478 7944 1 18 . 1 1 69 69 LYS H H 69 7.592 7.592 8.627 -1.035 18478 7945 1 18 . 1 1 70 70 GLU N N 70 118.408 118.408 118.324 0.084 18478 7946 1 18 . 1 1 70 70 GLU HA H 70 4.005 4.005 4.864 -0.859 18478 7947 1 18 . 1 1 70 70 GLU C C 70 174.588 174.588 173.885 0.703 18478 7948 1 18 . 1 1 70 70 GLU CA C 70 58.695 58.695 52.672 6.024 18478 7949 1 18 . 1 1 70 70 GLU CB C 70 28.928 28.928 29.701 -0.773 18478 7950 1 18 . 1 1 70 70 GLU H H 70 8.478 8.478 7.863 0.615 18478 7951 1 18 . 1 1 71 71 LYS HA H 71 3.847 3.847 4.264 -0.417 18478 7952 1 18 . 1 1 71 71 LYS C C 71 173.420 173.420 175.307 -1.887 18478 7953 1 18 . 1 1 71 71 LYS CA C 71 58.718 58.718 55.227 3.491 18478 7954 1 18 . 1 1 71 71 LYS CB C 71 32.964 32.964 33.818 -0.854 18478 7955 1 18 . 1 1 72 72 TYR N N 72 112.358 112.358 121.917 -9.559 18478 7956 1 18 . 1 1 72 72 TYR HA H 72 4.790 4.790 4.275 0.515 18478 7957 1 18 . 1 1 72 72 TYR C C 72 174.442 174.442 175.949 -1.507 18478 7958 1 18 . 1 1 72 72 TYR CA C 72 55.287 55.287 59.408 -4.121 18478 7959 1 18 . 1 1 72 72 TYR CB C 72 37.244 37.244 38.759 -1.515 18478 7960 1 18 . 1 1 72 72 TYR H H 72 7.341 7.341 8.262 -0.921 18478 7961 1 18 . 1 1 73 73 GLY N N 73 110.612 110.612 107.289 3.323 18478 7962 1 18 . 1 1 73 73 GLY C C 73 177.982 177.982 173.585 4.397 18478 7963 1 18 . 1 1 73 73 GLY CA C 73 46.623 46.623 44.183 2.440 18478 7964 1 18 . 1 1 73 73 GLY H H 73 8.076 8.076 8.075 0.001 18478 7965 1 18 . 1 1 74 74 LYS N N 74 121.009 121.009 120.574 0.435 18478 7966 1 18 . 1 1 74 74 LYS CA C 74 53.465 53.465 53.931 -0.466 18478 7967 1 18 . 1 1 74 74 LYS CB C 74 32.440 32.440 32.364 0.076 18478 7968 1 18 . 1 1 74 74 LYS H H 74 7.411 7.411 7.805 -0.394 18478 7969 1 18 . 1 1 75 75 PRO HA H 75 4.452 4.452 4.253 0.199 18478 7970 1 18 . 1 1 75 75 PRO C C 75 174.959 174.959 178.647 -3.688 18478 7971 1 18 . 1 1 75 75 PRO CA C 75 62.861 62.861 64.526 -1.665 18478 7972 1 18 . 1 1 75 75 PRO CB C 75 32.407 32.407 31.915 0.492 18478 7973 1 18 . 1 1 76 76 ASN N N 76 121.045 121.045 120.965 0.080 18478 7974 1 18 . 1 1 76 76 ASN HA H 76 4.445 4.445 4.447 -0.002 18478 7975 1 18 . 1 1 76 76 ASN C C 76 174.145 174.145 174.622 -0.477 18478 7976 1 18 . 1 1 76 76 ASN CA C 76 55.701 55.701 53.200 2.501 18478 7977 1 18 . 1 1 76 76 ASN H H 76 8.474 8.474 8.756 -0.282 18478 7978 1 18 . 1 1 77 77 LYS N N 77 111.466 111.466 119.929 -8.463 18478 7979 1 18 . 1 1 77 77 LYS HA H 77 4.369 4.369 4.351 0.018 18478 7980 1 18 . 1 1 77 77 LYS C C 77 173.881 173.881 176.378 -2.497 18478 7981 1 18 . 1 1 77 77 LYS CA C 77 55.995 55.995 55.476 0.519 18478 7982 1 18 . 1 1 77 77 LYS CB C 77 32.538 32.538 32.459 0.079 18478 7983 1 18 . 1 1 77 77 LYS H H 77 8.543 8.543 7.873 0.670 18478 7984 1 18 . 1 1 78 78 ARG N N 78 122.233 122.233 119.974 2.259 18478 7985 1 18 . 1 1 78 78 ARG HA H 78 4.286 4.286 4.055 0.231 18478 7986 1 18 . 1 1 78 78 ARG C C 78 173.652 173.652 174.519 -0.867 18478 7987 1 18 . 1 1 78 78 ARG CA C 78 55.780 55.780 57.232 -1.452 18478 7988 1 18 . 1 1 78 78 ARG CB C 78 29.554 29.554 29.591 -0.037 18478 7989 1 18 . 1 1 78 78 ARG H H 78 8.864 8.864 8.944 -0.080 18478 7990 1 18 . 1 1 79 79 LYS N N 79 128.197 128.197 118.710 9.487 18478 7991 1 18 . 1 1 79 79 LYS HA H 79 4.221 4.221 4.521 -0.300 18478 7992 1 18 . 1 1 79 79 LYS C C 79 174.336 174.336 175.850 -1.514 18478 7993 1 18 . 1 1 79 79 LYS CA C 79 58.986 58.986 55.760 3.227 18478 7994 1 18 . 1 1 79 79 LYS CB C 79 32.072 32.072 33.212 -1.140 18478 7995 1 18 . 1 1 79 79 LYS H H 79 8.927 8.927 8.405 0.522 18478 7996 1 18 . 1 1 80 80 GLY N N 80 114.730 114.730 108.543 6.187 18478 7997 1 18 . 1 1 80 80 GLY C C 80 176.536 176.536 174.999 1.537 18478 7998 1 18 . 1 1 80 80 GLY CA C 80 45.992 45.992 45.958 0.034 18478 7999 1 18 . 1 1 80 80 GLY H H 80 8.943 8.943 8.415 0.528 18478 8000 1 18 . 1 1 81 81 PHE N N 81 123.770 123.770 120.297 3.473 18478 8001 1 18 . 1 1 81 81 PHE HA H 81 3.336 3.336 4.036 -0.700 18478 8002 1 18 . 1 1 81 81 PHE C C 81 174.037 174.037 176.209 -2.172 18478 8003 1 18 . 1 1 81 81 PHE CA C 81 63.094 63.094 60.475 2.619 18478 8004 1 18 . 1 1 81 81 PHE CB C 81 39.823 39.823 38.813 1.010 18478 8005 1 18 . 1 1 81 81 PHE H H 81 8.281 8.281 8.252 0.029 18478 8006 1 18 . 1 1 82 82 ASN N N 82 119.812 119.812 116.389 3.423 18478 8007 1 18 . 1 1 82 82 ASN HA H 82 4.458 4.458 4.259 0.199 18478 8008 1 18 . 1 1 82 82 ASN C C 82 171.290 171.290 176.739 -5.449 18478 8009 1 18 . 1 1 82 82 ASN CA C 82 56.060 56.060 56.004 0.056 18478 8010 1 18 . 1 1 82 82 ASN CB C 82 36.390 36.390 38.281 -1.891 18478 8011 1 18 . 1 1 82 82 ASN H H 82 9.145 9.145 8.546 0.599 18478 8012 1 18 . 1 1 83 83 GLU N N 83 124.411 124.411 118.655 5.756 18478 8013 1 18 . 1 1 83 83 GLU HA H 83 4.186 4.186 3.961 0.225 18478 8014 1 18 . 1 1 83 83 GLU C C 83 172.222 172.222 178.630 -6.408 18478 8015 1 18 . 1 1 83 83 GLU CA C 83 60.922 60.922 59.009 1.913 18478 8016 1 18 . 1 1 83 83 GLU CB C 83 28.132 28.132 29.878 -1.746 18478 8017 1 18 . 1 1 83 83 GLU H H 83 9.560 9.560 7.628 1.932 18478 8018 1 18 . 1 1 84 84 GLY N N 84 111.388 111.388 107.292 4.096 18478 8019 1 18 . 1 1 84 84 GLY C C 84 176.445 176.445 174.416 2.029 18478 8020 1 18 . 1 1 84 84 GLY CA C 84 46.727 46.727 46.528 0.199 18478 8021 1 18 . 1 1 84 84 GLY H H 84 8.364 8.364 7.302 1.062 18478 8022 1 18 . 1 1 85 85 LEU N N 85 121.153 121.153 121.032 0.121 18478 8023 1 18 . 1 1 85 85 LEU HA H 85 4.236 4.236 4.251 -0.015 18478 8024 1 18 . 1 1 85 85 LEU C C 85 172.285 172.285 177.955 -5.670 18478 8025 1 18 . 1 1 85 85 LEU CA C 85 56.795 56.795 56.942 -0.147 18478 8026 1 18 . 1 1 85 85 LEU CB C 85 41.113 41.113 42.486 -1.373 18478 8027 1 18 . 1 1 85 85 LEU H H 85 8.294 8.294 7.799 0.495 18478 8028 1 18 . 1 1 86 86 TRP N N 86 118.898 118.898 119.131 -0.233 18478 8029 1 18 . 1 1 86 86 TRP HA H 86 4.161 4.161 4.312 -0.151 18478 8030 1 18 . 1 1 86 86 TRP C C 86 171.741 171.741 176.222 -4.481 18478 8031 1 18 . 1 1 86 86 TRP CA C 86 62.153 62.153 58.412 3.741 18478 8032 1 18 . 1 1 86 86 TRP CB C 86 28.424 28.424 29.790 -1.366 18478 8033 1 18 . 1 1 86 86 TRP H H 86 7.783 7.783 7.357 0.426 18478 8034 1 18 . 1 1 87 87 GLU N N 87 120.718 120.718 119.122 1.596 18478 8035 1 18 . 1 1 87 87 GLU HA H 87 3.416 3.416 4.681 -1.265 18478 8036 1 18 . 1 1 87 87 GLU C C 87 172.957 172.957 174.974 -2.017 18478 8037 1 18 . 1 1 87 87 GLU CA C 87 60.122 60.122 53.130 6.992 18478 8038 1 18 . 1 1 87 87 GLU CB C 87 31.021 31.021 30.493 0.528 18478 8039 1 18 . 1 1 87 87 GLU H H 87 8.779 8.779 7.495 1.284 18478 8040 1 18 . 1 1 88 88 ILE HA H 88 2.478 2.478 4.268 -1.790 18478 8041 1 18 . 1 1 88 88 ILE C C 88 177.873 177.873 177.157 0.716 18478 8042 1 18 . 1 1 88 88 ILE CA C 88 65.248 65.248 62.337 2.911 18478 8043 1 18 . 1 1 88 88 ILE CB C 88 37.327 37.327 38.426 -1.099 18478 8044 1 18 . 1 1 89 89 ASP N N 89 114.411 114.411 118.599 -4.188 18478 8045 1 18 . 1 1 89 89 ASP HA H 89 4.589 4.589 4.433 0.156 18478 8046 1 18 . 1 1 89 89 ASP C C 89 174.207 174.207 177.811 -3.604 18478 8047 1 18 . 1 1 89 89 ASP CA C 89 54.740 54.740 56.596 -1.856 18478 8048 1 18 . 1 1 89 89 ASP CB C 89 42.473 42.473 39.851 2.622 18478 8049 1 18 . 1 1 89 89 ASP H H 89 5.911 5.911 8.278 -2.367 18478 8050 1 18 . 1 1 90 90 ASN N N 90 114.358 114.358 115.266 -0.908 18478 8051 1 18 . 1 1 90 90 ASN HA H 90 4.420 4.420 4.332 0.088 18478 8052 1 18 . 1 1 90 90 ASN C C 90 176.991 176.991 177.520 -0.529 18478 8053 1 18 . 1 1 90 90 ASN CA C 90 54.855 54.855 56.480 -1.625 18478 8054 1 18 . 1 1 90 90 ASN CB C 90 40.582 40.582 38.056 2.526 18478 8055 1 18 . 1 1 90 90 ASN H H 90 7.480 7.480 7.650 -0.170 18478 8056 1 18 . 1 1 91 91 ASN N N 91 119.185 119.185 116.335 2.850 18478 8057 1 18 . 1 1 91 91 ASN HA H 91 5.006 5.006 5.165 -0.159 18478 8058 1 18 . 1 1 91 91 ASN CA C 91 51.624 51.624 55.008 -3.384 18478 8059 1 18 . 1 1 91 91 ASN CB C 91 38.752 38.752 38.052 0.700 18478 8060 1 18 . 1 1 91 91 ASN H H 91 9.238 9.238 7.803 1.435 18478 8061 1 18 . 1 1 92 92 PRO HA H 92 4.296 4.296 4.154 0.142 18478 8062 1 18 . 1 1 92 92 PRO C C 92 173.690 173.690 178.068 -4.378 18478 8063 1 18 . 1 1 92 92 PRO CA C 92 64.714 64.714 64.324 0.390 18478 8064 1 18 . 1 1 92 92 PRO CB C 92 31.781 31.781 31.934 -0.153 18478 8065 1 19 . 1 1 3 3 GLY C C 3 177.088 177.088 172.158 4.930 18478 8066 1 19 . 1 1 3 3 GLY CA C 3 45.330 45.330 43.680 1.650 18478 8067 1 19 . 1 1 4 4 SER N N 4 115.847 115.847 115.068 0.779 18478 8068 1 19 . 1 1 4 4 SER HA H 4 4.480 4.480 4.769 -0.289 18478 8069 1 19 . 1 1 4 4 SER C C 4 177.991 177.991 171.945 6.046 18478 8070 1 19 . 1 1 4 4 SER CA C 4 58.742 58.742 58.526 0.216 18478 8071 1 19 . 1 1 4 4 SER CB C 4 63.820 63.820 65.226 -1.406 18478 8072 1 19 . 1 1 4 4 SER H H 4 8.207 8.207 7.612 0.595 18478 8073 1 19 . 1 1 5 5 MET N N 5 125.867 125.867 122.466 3.401 18478 8074 1 19 . 1 1 5 5 MET HA H 5 4.580 4.580 4.711 -0.131 18478 8075 1 19 . 1 1 5 5 MET C C 5 174.825 174.825 175.150 -0.325 18478 8076 1 19 . 1 1 5 5 MET CA C 5 54.733 54.733 53.646 1.087 18478 8077 1 19 . 1 1 5 5 MET CB C 5 33.527 33.527 35.928 -2.401 18478 8078 1 19 . 1 1 5 5 MET H H 5 8.148 8.148 8.712 -0.564 18478 8079 1 19 . 1 1 6 6 THR N N 6 115.828 115.828 114.857 0.971 18478 8080 1 19 . 1 1 6 6 THR HA H 6 3.903 3.903 4.650 -0.747 18478 8081 1 19 . 1 1 6 6 THR C C 6 176.930 176.930 172.634 4.296 18478 8082 1 19 . 1 1 6 6 THR CA C 6 63.034 63.034 59.778 3.256 18478 8083 1 19 . 1 1 6 6 THR CB C 6 69.308 69.308 68.118 1.190 18478 8084 1 19 . 1 1 6 6 THR H H 6 8.408 8.408 8.358 0.050 18478 8085 1 19 . 1 1 7 7 ARG HA H 7 4.276 4.276 4.289 -0.013 18478 8086 1 19 . 1 1 7 7 ARG C C 7 176.546 176.546 176.743 -0.197 18478 8087 1 19 . 1 1 7 7 ARG CA C 7 55.813 55.813 56.119 -0.306 18478 8088 1 19 . 1 1 7 7 ARG CB C 7 30.556 30.556 30.628 -0.072 18478 8089 1 19 . 1 1 8 8 ASP N N 8 121.762 121.762 123.387 -1.625 18478 8090 1 19 . 1 1 8 8 ASP HA H 8 4.537 4.537 4.242 0.295 18478 8091 1 19 . 1 1 8 8 ASP C C 8 177.750 177.750 174.294 3.456 18478 8092 1 19 . 1 1 8 8 ASP CA C 8 54.117 54.117 54.398 -0.281 18478 8093 1 19 . 1 1 8 8 ASP H H 8 8.066 8.066 8.581 -0.515 18478 8094 1 19 . 1 1 9 9 PHE N N 9 119.991 119.991 119.443 0.548 18478 8095 1 19 . 1 1 9 9 PHE HA H 9 4.734 4.734 5.166 -0.432 18478 8096 1 19 . 1 1 9 9 PHE C C 9 176.838 176.838 174.709 2.129 18478 8097 1 19 . 1 1 9 9 PHE CA C 9 58.303 58.303 56.765 1.538 18478 8098 1 19 . 1 1 9 9 PHE CB C 9 41.594 41.594 41.740 -0.146 18478 8099 1 19 . 1 1 9 9 PHE H H 9 8.103 8.103 7.665 0.438 18478 8100 1 19 . 1 1 10 10 LYS N N 10 122.957 122.957 125.294 -2.337 18478 8101 1 19 . 1 1 10 10 LYS CA C 10 53.167 53.167 56.041 -2.874 18478 8102 1 19 . 1 1 10 10 LYS CB C 10 33.495 33.495 31.806 1.689 18478 8103 1 19 . 1 1 10 10 LYS H H 10 9.087 9.087 8.924 0.163 18478 8104 1 19 . 1 1 11 11 PRO HA H 11 3.903 3.903 5.001 -1.098 18478 8105 1 19 . 1 1 11 11 PRO C C 11 173.988 173.988 174.820 -0.832 18478 8106 1 19 . 1 1 11 11 PRO CA C 11 63.874 63.874 60.924 2.950 18478 8107 1 19 . 1 1 11 11 PRO CB C 11 31.623 31.623 35.280 -3.657 18478 8108 1 19 . 1 1 12 12 GLY N N 12 115.413 115.413 111.049 4.364 18478 8109 1 19 . 1 1 12 12 GLY C C 12 176.966 176.966 172.529 4.437 18478 8110 1 19 . 1 1 12 12 GLY CA C 12 44.651 44.651 42.148 2.503 18478 8111 1 19 . 1 1 12 12 GLY H H 12 9.667 9.667 9.018 0.649 18478 8112 1 19 . 1 1 13 13 ASP N N 13 122.208 122.208 128.008 -5.800 18478 8113 1 19 . 1 1 13 13 ASP HA H 13 4.601 4.601 4.799 -0.198 18478 8114 1 19 . 1 1 13 13 ASP C C 13 176.244 176.244 174.615 1.629 18478 8115 1 19 . 1 1 13 13 ASP CA C 13 55.870 55.870 51.917 3.953 18478 8116 1 19 . 1 1 13 13 ASP CB C 13 40.794 40.794 43.166 -2.372 18478 8117 1 19 . 1 1 13 13 ASP H H 13 8.303 8.303 8.452 -0.149 18478 8118 1 19 . 1 1 14 14 LEU N N 14 121.306 121.306 126.040 -4.734 18478 8119 1 19 . 1 1 14 14 LEU HA H 14 4.982 4.982 4.684 0.298 18478 8120 1 19 . 1 1 14 14 LEU C C 14 173.461 173.461 175.877 -2.416 18478 8121 1 19 . 1 1 14 14 LEU CA C 14 54.516 54.516 53.554 0.961 18478 8122 1 19 . 1 1 14 14 LEU CB C 14 40.999 40.999 42.337 -1.338 18478 8123 1 19 . 1 1 14 14 LEU H H 14 8.618 8.618 7.865 0.753 18478 8124 1 19 . 1 1 15 15 ILE N N 15 118.806 118.806 125.795 -6.989 18478 8125 1 19 . 1 1 15 15 ILE HA H 15 5.356 5.356 4.331 1.025 18478 8126 1 19 . 1 1 15 15 ILE C C 15 175.982 175.982 175.564 0.418 18478 8127 1 19 . 1 1 15 15 ILE CA C 15 60.481 60.481 59.309 1.172 18478 8128 1 19 . 1 1 15 15 ILE CB C 15 44.142 44.142 39.258 4.884 18478 8129 1 19 . 1 1 15 15 ILE H H 15 8.864 8.864 8.750 0.114 18478 8130 1 19 . 1 1 16 16 PHE N N 16 112.472 112.472 125.117 -12.645 18478 8131 1 19 . 1 1 16 16 PHE HA H 16 5.306 5.306 4.167 1.139 18478 8132 1 19 . 1 1 16 16 PHE C C 16 176.239 176.239 175.893 0.346 18478 8133 1 19 . 1 1 16 16 PHE CA C 16 58.603 58.603 59.380 -0.777 18478 8134 1 19 . 1 1 16 16 PHE CB C 16 43.305 43.305 38.110 5.195 18478 8135 1 19 . 1 1 16 16 PHE H H 16 9.411 9.411 8.936 0.475 18478 8136 1 19 . 1 1 17 17 ALA N N 17 123.889 123.889 124.452 -0.563 18478 8137 1 19 . 1 1 17 17 ALA HA H 17 5.348 5.348 3.664 1.684 18478 8138 1 19 . 1 1 17 17 ALA C C 17 174.426 174.426 176.093 -1.667 18478 8139 1 19 . 1 1 17 17 ALA CA C 17 50.062 50.062 51.554 -1.492 18478 8140 1 19 . 1 1 17 17 ALA H H 17 9.658 9.658 8.446 1.212 18478 8141 1 19 . 1 1 18 18 LYS N N 18 127.760 127.760 121.895 5.865 18478 8142 1 19 . 1 1 18 18 LYS HA H 18 4.697 4.697 4.705 -0.008 18478 8143 1 19 . 1 1 18 18 LYS C C 18 178.554 178.554 174.698 3.856 18478 8144 1 19 . 1 1 18 18 LYS CA C 18 53.893 53.893 52.471 1.422 18478 8145 1 19 . 1 1 18 18 LYS CB C 18 35.291 35.291 32.504 2.787 18478 8146 1 19 . 1 1 18 18 LYS H H 18 9.421 9.421 7.703 1.718 18478 8147 1 19 . 1 1 19 19 MET HA H 19 4.656 4.656 4.569 0.087 18478 8148 1 19 . 1 1 19 19 MET C C 19 175.741 175.741 174.753 0.988 18478 8149 1 19 . 1 1 19 19 MET CA C 19 53.916 53.916 54.846 -0.930 18478 8150 1 19 . 1 1 19 19 MET CB C 19 35.799 35.799 33.420 2.379 18478 8151 1 19 . 1 1 20 20 LYS N N 20 124.062 124.062 117.798 6.264 18478 8152 1 19 . 1 1 20 20 LYS CA C 20 58.585 58.585 56.407 2.178 18478 8153 1 19 . 1 1 20 20 LYS CB C 20 31.978 31.978 32.909 -0.931 18478 8154 1 19 . 1 1 20 20 LYS H H 20 8.645 8.645 8.185 0.460 18478 8155 1 19 . 1 1 21 21 GLY C C 21 176.205 176.205 172.474 3.731 18478 8156 1 19 . 1 1 21 21 GLY CA C 21 45.142 45.142 41.873 3.269 18478 8157 1 19 . 1 1 22 22 TYR HA H 22 4.573 4.573 4.694 -0.121 18478 8158 1 19 . 1 1 22 22 TYR CA C 22 55.748 55.748 57.870 -2.122 18478 8159 1 19 . 1 1 22 22 TYR CB C 22 41.331 41.331 38.104 3.227 18478 8160 1 19 . 1 1 23 23 PRO HA H 23 4.759 4.759 4.826 -0.067 18478 8161 1 19 . 1 1 23 23 PRO C C 23 174.587 174.587 175.381 -0.794 18478 8162 1 19 . 1 1 23 23 PRO CA C 23 62.072 62.072 61.151 0.921 18478 8163 1 19 . 1 1 23 23 PRO CB C 23 31.077 31.077 35.114 -4.037 18478 8164 1 19 . 1 1 24 24 HIS N N 24 119.190 119.190 117.850 1.340 18478 8165 1 19 . 1 1 24 24 HIS HA H 24 3.983 3.983 5.226 -1.243 18478 8166 1 19 . 1 1 24 24 HIS C C 24 175.555 175.555 173.672 1.883 18478 8167 1 19 . 1 1 24 24 HIS CA C 24 60.973 60.973 54.052 6.921 18478 8168 1 19 . 1 1 24 24 HIS CB C 24 30.689 30.689 33.502 -2.813 18478 8169 1 19 . 1 1 24 24 HIS H H 24 8.158 8.158 8.633 -0.475 18478 8170 1 19 . 1 1 25 25 TRP N N 25 127.435 127.435 127.748 -0.313 18478 8171 1 19 . 1 1 25 25 TRP HA H 25 3.760 3.760 4.842 -1.082 18478 8172 1 19 . 1 1 25 25 TRP CA C 25 55.890 55.890 58.830 -2.940 18478 8173 1 19 . 1 1 25 25 TRP CB C 25 32.879 32.879 30.169 2.710 18478 8174 1 19 . 1 1 25 25 TRP H H 25 9.211 9.211 8.897 0.314 18478 8175 1 19 . 1 1 26 26 PRO HA H 26 4.217 4.217 4.602 -0.385 18478 8176 1 19 . 1 1 26 26 PRO C C 26 176.279 176.279 175.704 0.575 18478 8177 1 19 . 1 1 26 26 PRO CA C 26 63.140 63.140 60.985 2.155 18478 8178 1 19 . 1 1 26 26 PRO CB C 26 32.171 32.171 35.138 -2.967 18478 8179 1 19 . 1 1 27 27 ALA N N 27 130.162 130.162 122.236 7.926 18478 8180 1 19 . 1 1 27 27 ALA HA H 27 4.981 4.981 4.417 0.564 18478 8181 1 19 . 1 1 27 27 ALA C C 27 177.227 177.227 177.096 0.131 18478 8182 1 19 . 1 1 27 27 ALA CA C 27 52.574 52.574 50.441 2.132 18478 8183 1 19 . 1 1 27 27 ALA CB C 27 23.239 23.239 19.877 3.362 18478 8184 1 19 . 1 1 27 27 ALA H H 27 9.394 9.394 8.128 1.266 18478 8185 1 19 . 1 1 28 28 ARG N N 28 117.381 117.381 121.825 -4.444 18478 8186 1 19 . 1 1 28 28 ARG HA H 28 5.421 5.421 4.354 1.067 18478 8187 1 19 . 1 1 28 28 ARG C C 28 176.465 176.465 175.561 0.904 18478 8188 1 19 . 1 1 28 28 ARG CA C 28 53.662 53.662 55.305 -1.643 18478 8189 1 19 . 1 1 28 28 ARG CB C 28 35.058 35.058 29.905 5.152 18478 8190 1 19 . 1 1 28 28 ARG H H 28 8.806 8.806 8.426 0.380 18478 8191 1 19 . 1 1 29 29 VAL HA H 29 4.109 4.109 4.201 -0.092 18478 8192 1 19 . 1 1 29 29 VAL C C 29 175.996 175.996 174.886 1.110 18478 8193 1 19 . 1 1 29 29 VAL CA C 29 62.810 62.810 61.522 1.288 18478 8194 1 19 . 1 1 29 29 VAL CB C 29 31.108 31.108 32.756 -1.648 18478 8195 1 19 . 1 1 30 30 ASP N N 30 133.830 133.830 118.624 15.206 18478 8196 1 19 . 1 1 30 30 ASP HA H 30 5.198 5.198 4.589 0.609 18478 8197 1 19 . 1 1 30 30 ASP C C 30 176.207 176.207 177.555 -1.348 18478 8198 1 19 . 1 1 30 30 ASP CA C 30 53.007 53.007 54.555 -1.548 18478 8199 1 19 . 1 1 30 30 ASP CB C 30 44.130 44.130 42.018 2.112 18478 8200 1 19 . 1 1 30 30 ASP H H 30 8.892 8.892 8.473 0.419 18478 8201 1 19 . 1 1 31 31 GLU N N 31 115.905 115.905 122.508 -6.603 18478 8202 1 19 . 1 1 31 31 GLU HA H 31 4.409 4.409 3.988 0.421 18478 8203 1 19 . 1 1 31 31 GLU C C 31 175.192 175.192 175.944 -0.752 18478 8204 1 19 . 1 1 31 31 GLU CA C 31 55.389 55.389 56.942 -1.553 18478 8205 1 19 . 1 1 31 31 GLU H H 31 7.966 7.966 8.809 -0.843 18478 8206 1 19 . 1 1 32 32 VAL N N 32 122.794 122.794 116.548 6.246 18478 8207 1 19 . 1 1 32 32 VAL HA H 32 4.303 4.303 3.677 0.626 18478 8208 1 19 . 1 1 32 32 VAL CA C 32 60.408 60.408 62.801 -2.393 18478 8209 1 19 . 1 1 32 32 VAL CB C 32 32.333 32.333 30.425 1.908 18478 8210 1 19 . 1 1 32 32 VAL H H 32 8.702 8.702 7.844 0.858 18478 8211 1 19 . 1 1 33 33 PRO HA H 33 4.572 4.572 4.161 0.411 18478 8212 1 19 . 1 1 33 33 PRO C C 33 175.366 175.366 177.618 -2.252 18478 8213 1 19 . 1 1 33 33 PRO CA C 33 63.702 63.702 65.528 -1.826 18478 8214 1 19 . 1 1 33 33 PRO CB C 33 32.736 32.736 32.106 0.630 18478 8215 1 19 . 1 1 34 34 ASP N N 34 119.187 119.187 117.098 2.089 18478 8216 1 19 . 1 1 34 34 ASP HA H 34 4.679 4.679 4.835 -0.156 18478 8217 1 19 . 1 1 34 34 ASP C C 34 175.713 175.713 173.801 1.912 18478 8218 1 19 . 1 1 34 34 ASP CA C 34 53.013 53.013 52.154 0.859 18478 8219 1 19 . 1 1 34 34 ASP CB C 34 40.850 40.850 41.145 -0.295 18478 8220 1 19 . 1 1 34 34 ASP H H 34 8.686 8.686 7.837 0.849 18478 8221 1 19 . 1 1 35 35 GLY C C 35 177.458 177.458 172.617 4.841 18478 8222 1 19 . 1 1 35 35 GLY CA C 35 45.507 45.507 43.785 1.722 18478 8223 1 19 . 1 1 36 36 ALA HA H 36 4.404 4.404 4.337 0.067 18478 8224 1 19 . 1 1 36 36 ALA CA C 36 52.010 52.010 51.944 0.066 18478 8225 1 19 . 1 1 36 36 ALA CB C 36 19.909 19.909 19.564 0.345 18478 8226 1 19 . 1 1 37 37 VAL N N 37 119.594 119.594 123.488 -3.894 18478 8227 1 19 . 1 1 37 37 VAL HA H 37 3.932 3.932 4.144 -0.212 18478 8228 1 19 . 1 1 37 37 VAL C C 37 175.966 175.966 176.338 -0.372 18478 8229 1 19 . 1 1 37 37 VAL CA C 37 62.810 62.810 63.889 -1.079 18478 8230 1 19 . 1 1 37 37 VAL CB C 37 32.267 32.267 32.606 -0.339 18478 8231 1 19 . 1 1 37 37 VAL H H 37 8.037 8.037 8.393 -0.356 18478 8232 1 19 . 1 1 38 38 LYS N N 38 125.676 125.676 121.344 4.332 18478 8233 1 19 . 1 1 38 38 LYS C C 38 173.865 173.865 174.684 -0.819 18478 8234 1 19 . 1 1 38 38 LYS CA C 38 54.278 54.278 56.387 -2.109 18478 8235 1 19 . 1 1 38 38 LYS CB C 38 31.740 31.740 33.188 -1.448 18478 8236 1 19 . 1 1 38 38 LYS H H 38 8.292 8.292 8.392 -0.100 18478 8237 1 19 . 1 1 40 40 PRO HA H 40 4.387 4.387 5.270 -0.883 18478 8238 1 19 . 1 1 40 40 PRO C C 40 175.535 175.535 175.442 0.093 18478 8239 1 19 . 1 1 40 40 PRO CA C 40 62.330 62.330 59.489 2.841 18478 8240 1 19 . 1 1 40 40 PRO CB C 40 32.086 32.086 32.026 0.060 18478 8241 1 19 . 1 1 41 41 THR HA H 41 4.027 4.027 4.633 -0.606 18478 8242 1 19 . 1 1 41 41 THR C C 41 176.795 176.795 173.093 3.702 18478 8243 1 19 . 1 1 41 41 THR CA C 41 63.693 63.693 62.285 1.408 18478 8244 1 19 . 1 1 41 41 THR CB C 41 69.370 69.370 69.013 0.357 18478 8245 1 19 . 1 1 42 42 ASN N N 42 118.513 118.513 121.687 -3.174 18478 8246 1 19 . 1 1 42 42 ASN HA H 42 4.530 4.530 4.997 -0.467 18478 8247 1 19 . 1 1 42 42 ASN C C 42 177.230 177.230 174.646 2.584 18478 8248 1 19 . 1 1 42 42 ASN CA C 42 56.373 56.373 50.501 5.872 18478 8249 1 19 . 1 1 42 42 ASN CB C 42 37.618 37.618 38.208 -0.590 18478 8250 1 19 . 1 1 42 42 ASN H H 42 8.752 8.752 8.835 -0.083 18478 8251 1 19 . 1 1 43 43 LYS N N 43 115.898 115.898 128.652 -12.754 18478 8252 1 19 . 1 1 43 43 LYS HA H 43 4.710 4.710 4.670 0.040 18478 8253 1 19 . 1 1 43 43 LYS C C 43 177.032 177.032 176.043 0.989 18478 8254 1 19 . 1 1 43 43 LYS CA C 43 54.957 54.957 55.431 -0.474 18478 8255 1 19 . 1 1 43 43 LYS CB C 43 36.600 36.600 32.924 3.676 18478 8256 1 19 . 1 1 43 43 LYS H H 43 7.723 7.723 9.237 -1.514 18478 8257 1 19 . 1 1 44 44 LEU N N 44 121.006 121.006 128.142 -7.136 18478 8258 1 19 . 1 1 44 44 LEU HA H 44 5.000 5.000 4.409 0.591 18478 8259 1 19 . 1 1 44 44 LEU CA C 44 51.842 51.842 54.888 -3.046 18478 8260 1 19 . 1 1 44 44 LEU CB C 44 44.418 44.418 41.771 2.647 18478 8261 1 19 . 1 1 44 44 LEU H H 44 9.063 9.063 8.959 0.104 18478 8262 1 19 . 1 1 45 45 PRO HA H 45 4.392 4.392 4.408 -0.016 18478 8263 1 19 . 1 1 45 45 PRO C C 45 177.051 177.051 179.283 -2.232 18478 8264 1 19 . 1 1 45 45 PRO CA C 45 62.000 62.000 65.350 -3.350 18478 8265 1 19 . 1 1 45 45 PRO CB C 45 30.737 30.737 32.557 -1.820 18478 8266 1 19 . 1 1 46 46 ILE N N 46 125.996 125.996 124.560 1.436 18478 8267 1 19 . 1 1 46 46 ILE HA H 46 4.564 4.564 3.976 0.588 18478 8268 1 19 . 1 1 46 46 ILE C C 46 176.985 176.985 176.408 0.577 18478 8269 1 19 . 1 1 46 46 ILE CA C 46 57.051 57.051 62.891 -5.840 18478 8270 1 19 . 1 1 46 46 ILE H H 46 8.908 8.908 9.113 -0.205 18478 8271 1 19 . 1 1 47 47 PHE N N 47 128.276 128.276 119.726 8.550 18478 8272 1 19 . 1 1 47 47 PHE HA H 47 4.827 4.827 4.174 0.653 18478 8273 1 19 . 1 1 47 47 PHE C C 47 177.835 177.835 176.177 1.658 18478 8274 1 19 . 1 1 47 47 PHE CA C 47 56.099 56.099 58.214 -2.115 18478 8275 1 19 . 1 1 47 47 PHE CB C 47 41.217 41.217 40.132 1.085 18478 8276 1 19 . 1 1 47 47 PHE H H 47 8.739 8.739 7.616 1.123 18478 8277 1 19 . 1 1 48 48 PHE N N 48 125.953 125.953 117.992 7.961 18478 8278 1 19 . 1 1 48 48 PHE HA H 48 4.251 4.251 4.224 0.027 18478 8279 1 19 . 1 1 48 48 PHE C C 48 175.869 175.869 174.377 1.492 18478 8280 1 19 . 1 1 48 48 PHE CA C 48 56.744 56.744 59.571 -2.827 18478 8281 1 19 . 1 1 48 48 PHE CB C 48 38.835 38.835 36.072 2.763 18478 8282 1 19 . 1 1 48 48 PHE H H 48 8.545 8.545 7.941 0.605 18478 8283 1 19 . 1 1 49 49 PHE N N 49 122.197 122.197 117.787 4.410 18478 8284 1 19 . 1 1 49 49 PHE HA H 49 4.400 4.400 4.452 -0.052 18478 8285 1 19 . 1 1 49 49 PHE C C 49 174.016 174.016 174.715 -0.699 18478 8286 1 19 . 1 1 49 49 PHE CA C 49 59.916 59.916 57.370 2.546 18478 8287 1 19 . 1 1 49 49 PHE CB C 49 39.799 39.799 40.980 -1.181 18478 8288 1 19 . 1 1 49 49 PHE H H 49 8.619 8.619 7.474 1.145 18478 8289 1 19 . 1 1 50 50 GLY N N 50 114.083 114.083 108.342 5.741 18478 8290 1 19 . 1 1 50 50 GLY C C 50 175.636 175.636 173.202 2.434 18478 8291 1 19 . 1 1 50 50 GLY CA C 50 46.718 46.718 43.902 2.816 18478 8292 1 19 . 1 1 50 50 GLY H H 50 10.329 10.329 8.170 2.159 18478 8293 1 19 . 1 1 51 51 THR N N 51 111.210 111.210 121.259 -10.049 18478 8294 1 19 . 1 1 51 51 THR HA H 51 3.980 3.980 4.601 -0.621 18478 8295 1 19 . 1 1 51 51 THR C C 51 175.588 175.588 171.855 3.733 18478 8296 1 19 . 1 1 51 51 THR CA C 51 62.223 62.223 60.850 1.373 18478 8297 1 19 . 1 1 51 51 THR CB C 51 68.346 68.346 72.417 -4.071 18478 8298 1 19 . 1 1 51 51 THR H H 51 7.882 7.882 8.797 -0.915 18478 8299 1 19 . 1 1 52 52 HIS N N 52 115.544 115.544 119.844 -4.300 18478 8300 1 19 . 1 1 52 52 HIS HA H 52 3.712 3.712 5.467 -1.755 18478 8301 1 19 . 1 1 52 52 HIS C C 52 177.717 177.717 175.362 2.355 18478 8302 1 19 . 1 1 52 52 HIS CA C 52 54.860 54.860 54.296 0.564 18478 8303 1 19 . 1 1 52 52 HIS CB C 52 26.388 26.388 30.372 -3.984 18478 8304 1 19 . 1 1 52 52 HIS H H 52 7.791 7.791 8.467 -0.676 18478 8305 1 19 . 1 1 53 53 GLU N N 53 117.517 117.517 123.197 -5.680 18478 8306 1 19 . 1 1 53 53 GLU HA H 53 4.298 4.298 4.731 -0.433 18478 8307 1 19 . 1 1 53 53 GLU C C 53 176.958 176.958 176.456 0.502 18478 8308 1 19 . 1 1 53 53 GLU CA C 53 55.403 55.403 55.300 0.103 18478 8309 1 19 . 1 1 53 53 GLU CB C 53 31.588 31.588 33.248 -1.660 18478 8310 1 19 . 1 1 53 53 GLU H H 53 6.795 6.795 8.524 -1.729 18478 8311 1 19 . 1 1 54 54 THR N N 54 111.182 111.182 117.061 -5.879 18478 8312 1 19 . 1 1 54 54 THR HA H 54 5.648 5.648 4.308 1.340 18478 8313 1 19 . 1 1 54 54 THR C C 54 177.234 177.234 174.345 2.889 18478 8314 1 19 . 1 1 54 54 THR CA C 54 59.894 59.894 61.467 -1.573 18478 8315 1 19 . 1 1 54 54 THR H H 54 8.139 8.139 8.759 -0.620 18478 8316 1 19 . 1 1 55 55 ALA HA H 55 4.403 4.403 4.092 0.311 18478 8317 1 19 . 1 1 55 55 ALA C C 55 176.601 176.601 178.053 -1.452 18478 8318 1 19 . 1 1 55 55 ALA CA C 55 51.079 51.079 53.009 -1.930 18478 8319 1 19 . 1 1 55 55 ALA CB C 55 23.285 23.285 18.994 4.291 18478 8320 1 19 . 1 1 56 56 PHE N N 56 118.058 118.058 113.691 4.367 18478 8321 1 19 . 1 1 56 56 PHE HA H 56 5.678 5.678 4.540 1.138 18478 8322 1 19 . 1 1 56 56 PHE C C 56 175.962 175.962 175.181 0.781 18478 8323 1 19 . 1 1 56 56 PHE CA C 56 56.008 56.008 59.298 -3.290 18478 8324 1 19 . 1 1 56 56 PHE CB C 56 39.995 39.995 37.783 2.212 18478 8325 1 19 . 1 1 56 56 PHE H H 56 8.523 8.523 8.220 0.303 18478 8326 1 19 . 1 1 57 57 LEU N N 57 123.344 123.344 120.324 3.020 18478 8327 1 19 . 1 1 57 57 LEU HA H 57 4.929 4.929 4.719 0.210 18478 8328 1 19 . 1 1 57 57 LEU C C 57 175.584 175.584 175.022 0.562 18478 8329 1 19 . 1 1 57 57 LEU CA C 57 53.463 53.463 55.192 -1.729 18478 8330 1 19 . 1 1 57 57 LEU CB C 57 46.545 46.545 44.179 2.366 18478 8331 1 19 . 1 1 57 57 LEU H H 57 8.579 8.579 7.689 0.890 18478 8332 1 19 . 1 1 58 58 GLY N N 58 108.499 108.499 107.643 0.856 18478 8333 1 19 . 1 1 58 58 GLY CA C 58 43.755 43.755 44.526 -0.771 18478 8334 1 19 . 1 1 58 58 GLY H H 58 9.318 9.318 7.340 1.978 18478 8335 1 19 . 1 1 59 59 PRO HA H 59 4.048 4.048 4.908 -0.860 18478 8336 1 19 . 1 1 59 59 PRO C C 59 173.763 173.763 174.663 -0.900 18478 8337 1 19 . 1 1 59 59 PRO CA C 59 64.770 64.770 60.441 4.330 18478 8338 1 19 . 1 1 59 59 PRO CB C 59 31.889 31.889 35.645 -3.756 18478 8339 1 19 . 1 1 60 60 LYS HA H 60 4.191 4.191 4.560 -0.369 18478 8340 1 19 . 1 1 60 60 LYS C C 60 174.842 174.842 176.525 -1.683 18478 8341 1 19 . 1 1 60 60 LYS CA C 60 57.875 57.875 56.057 1.818 18478 8342 1 19 . 1 1 60 60 LYS CB C 60 31.576 31.576 32.760 -1.184 18478 8343 1 19 . 1 1 61 61 ASP N N 61 117.768 117.768 123.092 -5.324 18478 8344 1 19 . 1 1 61 61 ASP HA H 61 4.973 4.973 4.304 0.669 18478 8345 1 19 . 1 1 61 61 ASP C C 61 178.178 178.178 176.928 1.250 18478 8346 1 19 . 1 1 61 61 ASP CA C 61 54.687 54.687 56.385 -1.698 18478 8347 1 19 . 1 1 61 61 ASP CB C 61 43.555 43.555 39.344 4.211 18478 8348 1 19 . 1 1 61 61 ASP H H 61 7.722 7.722 8.851 -1.129 18478 8349 1 19 . 1 1 62 62 ILE N N 62 114.244 114.244 120.592 -6.348 18478 8350 1 19 . 1 1 62 62 ILE HA H 62 4.891 4.891 3.378 1.513 18478 8351 1 19 . 1 1 62 62 ILE C C 62 178.027 178.027 177.594 0.433 18478 8352 1 19 . 1 1 62 62 ILE CA C 62 59.994 59.994 63.878 -3.884 18478 8353 1 19 . 1 1 62 62 ILE CB C 62 40.652 40.652 36.905 3.747 18478 8354 1 19 . 1 1 62 62 ILE H H 62 6.784 6.784 7.763 -0.979 18478 8355 1 19 . 1 1 63 63 PHE N N 63 119.819 119.819 119.597 0.222 18478 8356 1 19 . 1 1 63 63 PHE HA H 63 5.214 5.214 4.202 1.012 18478 8357 1 19 . 1 1 63 63 PHE CA C 63 54.735 54.735 60.344 -5.609 18478 8358 1 19 . 1 1 63 63 PHE CB C 63 42.122 42.122 38.687 3.435 18478 8359 1 19 . 1 1 63 63 PHE H H 63 8.734 8.734 7.654 1.080 18478 8360 1 19 . 1 1 64 64 PRO HA H 64 4.771 4.771 4.282 0.489 18478 8361 1 19 . 1 1 64 64 PRO C C 64 174.036 174.036 178.494 -4.458 18478 8362 1 19 . 1 1 64 64 PRO CA C 64 64.474 64.474 63.849 0.625 18478 8363 1 19 . 1 1 64 64 PRO CB C 64 32.662 32.662 32.739 -0.077 18478 8364 1 19 . 1 1 65 65 TYR N N 65 124.335 124.335 121.716 2.619 18478 8365 1 19 . 1 1 65 65 TYR HA H 65 4.530 4.530 4.343 0.187 18478 8366 1 19 . 1 1 65 65 TYR C C 65 173.944 173.944 177.374 -3.430 18478 8367 1 19 . 1 1 65 65 TYR CA C 65 61.205 61.205 60.746 0.459 18478 8368 1 19 . 1 1 65 65 TYR CB C 65 38.844 38.844 37.827 1.017 18478 8369 1 19 . 1 1 65 65 TYR H H 65 8.359 8.359 7.800 0.559 18478 8370 1 19 . 1 1 66 66 SER N N 66 114.836 114.836 112.301 2.535 18478 8371 1 19 . 1 1 66 66 SER HA H 66 3.505 3.505 4.354 -0.849 18478 8372 1 19 . 1 1 66 66 SER C C 66 173.697 173.697 175.426 -1.729 18478 8373 1 19 . 1 1 66 66 SER CA C 66 63.078 63.078 59.618 3.460 18478 8374 1 19 . 1 1 66 66 SER CB C 66 62.223 62.223 63.065 -0.842 18478 8375 1 19 . 1 1 66 66 SER H H 66 8.974 8.974 7.682 1.292 18478 8376 1 19 . 1 1 67 67 GLU N N 67 118.013 118.013 118.656 -0.643 18478 8377 1 19 . 1 1 67 67 GLU HA H 67 4.210 4.210 4.169 0.041 18478 8378 1 19 . 1 1 67 67 GLU C C 67 174.961 174.961 177.499 -2.538 18478 8379 1 19 . 1 1 67 67 GLU CA C 67 58.330 58.330 57.775 0.555 18478 8380 1 19 . 1 1 67 67 GLU CB C 67 30.205 30.205 30.884 -0.679 18478 8381 1 19 . 1 1 67 67 GLU H H 67 8.817 8.817 7.884 0.933 18478 8382 1 19 . 1 1 68 68 ASN N N 68 113.942 113.942 112.199 1.743 18478 8383 1 19 . 1 1 68 68 ASN HA H 68 5.015 5.015 5.011 0.004 18478 8384 1 19 . 1 1 68 68 ASN C C 68 176.626 176.626 176.535 0.091 18478 8385 1 19 . 1 1 68 68 ASN CA C 68 53.768 53.768 51.845 1.923 18478 8386 1 19 . 1 1 68 68 ASN CB C 68 41.948 41.948 39.577 2.372 18478 8387 1 19 . 1 1 68 68 ASN H H 68 7.448 7.448 7.730 -0.282 18478 8388 1 19 . 1 1 69 69 LYS N N 69 124.584 124.584 121.157 3.427 18478 8389 1 19 . 1 1 69 69 LYS HA H 69 3.794 3.794 3.903 -0.109 18478 8390 1 19 . 1 1 69 69 LYS C C 69 173.330 173.330 174.804 -1.474 18478 8391 1 19 . 1 1 69 69 LYS CA C 69 61.225 61.225 57.407 3.818 18478 8392 1 19 . 1 1 69 69 LYS H H 69 7.592 7.592 8.689 -1.097 18478 8393 1 19 . 1 1 70 70 GLU N N 70 118.408 118.408 117.897 0.511 18478 8394 1 19 . 1 1 70 70 GLU HA H 70 4.005 4.005 4.844 -0.839 18478 8395 1 19 . 1 1 70 70 GLU C C 70 174.588 174.588 173.731 0.857 18478 8396 1 19 . 1 1 70 70 GLU CA C 70 58.695 58.695 52.982 5.713 18478 8397 1 19 . 1 1 70 70 GLU CB C 70 28.928 28.928 30.950 -2.022 18478 8398 1 19 . 1 1 70 70 GLU H H 70 8.478 8.478 7.883 0.595 18478 8399 1 19 . 1 1 71 71 LYS HA H 71 3.847 3.847 4.418 -0.571 18478 8400 1 19 . 1 1 71 71 LYS C C 71 173.420 173.420 175.350 -1.930 18478 8401 1 19 . 1 1 71 71 LYS CA C 71 58.718 58.718 55.457 3.261 18478 8402 1 19 . 1 1 71 71 LYS CB C 71 32.964 32.964 33.978 -1.014 18478 8403 1 19 . 1 1 72 72 TYR N N 72 112.358 112.358 123.630 -11.272 18478 8404 1 19 . 1 1 72 72 TYR HA H 72 4.790 4.790 4.337 0.453 18478 8405 1 19 . 1 1 72 72 TYR C C 72 174.442 174.442 176.118 -1.676 18478 8406 1 19 . 1 1 72 72 TYR CA C 72 55.287 55.287 59.227 -3.940 18478 8407 1 19 . 1 1 72 72 TYR CB C 72 37.244 37.244 38.359 -1.115 18478 8408 1 19 . 1 1 72 72 TYR H H 72 7.341 7.341 8.256 -0.915 18478 8409 1 19 . 1 1 73 73 GLY N N 73 110.612 110.612 107.867 2.745 18478 8410 1 19 . 1 1 73 73 GLY C C 73 177.982 177.982 173.342 4.640 18478 8411 1 19 . 1 1 73 73 GLY CA C 73 46.623 46.623 44.547 2.076 18478 8412 1 19 . 1 1 73 73 GLY H H 73 8.076 8.076 8.089 -0.013 18478 8413 1 19 . 1 1 74 74 LYS N N 74 121.009 121.009 120.913 0.096 18478 8414 1 19 . 1 1 74 74 LYS CA C 74 53.465 53.465 54.040 -0.575 18478 8415 1 19 . 1 1 74 74 LYS CB C 74 32.440 32.440 33.603 -1.163 18478 8416 1 19 . 1 1 74 74 LYS H H 74 7.411 7.411 7.877 -0.466 18478 8417 1 19 . 1 1 75 75 PRO HA H 75 4.452 4.452 4.395 0.057 18478 8418 1 19 . 1 1 75 75 PRO C C 75 174.959 174.959 177.838 -2.879 18478 8419 1 19 . 1 1 75 75 PRO CA C 75 62.861 62.861 64.089 -1.228 18478 8420 1 19 . 1 1 75 75 PRO CB C 75 32.407 32.407 31.491 0.916 18478 8421 1 19 . 1 1 76 76 ASN N N 76 121.045 121.045 119.040 2.005 18478 8422 1 19 . 1 1 76 76 ASN HA H 76 4.445 4.445 4.415 0.030 18478 8423 1 19 . 1 1 76 76 ASN C C 76 174.145 174.145 174.616 -0.471 18478 8424 1 19 . 1 1 76 76 ASN CA C 76 55.701 55.701 52.936 2.765 18478 8425 1 19 . 1 1 76 76 ASN H H 76 8.474 8.474 8.915 -0.441 18478 8426 1 19 . 1 1 77 77 LYS N N 77 111.466 111.466 120.118 -8.652 18478 8427 1 19 . 1 1 77 77 LYS HA H 77 4.369 4.369 4.248 0.121 18478 8428 1 19 . 1 1 77 77 LYS C C 77 173.881 173.881 176.168 -2.287 18478 8429 1 19 . 1 1 77 77 LYS CA C 77 55.995 55.995 56.285 -0.290 18478 8430 1 19 . 1 1 77 77 LYS CB C 77 32.538 32.538 32.380 0.158 18478 8431 1 19 . 1 1 77 77 LYS H H 77 8.543 8.543 7.815 0.728 18478 8432 1 19 . 1 1 78 78 ARG N N 78 122.233 122.233 120.253 1.980 18478 8433 1 19 . 1 1 78 78 ARG HA H 78 4.286 4.286 4.077 0.209 18478 8434 1 19 . 1 1 78 78 ARG C C 78 173.652 173.652 174.928 -1.276 18478 8435 1 19 . 1 1 78 78 ARG CA C 78 55.780 55.780 57.776 -1.996 18478 8436 1 19 . 1 1 78 78 ARG CB C 78 29.554 29.554 29.555 -0.001 18478 8437 1 19 . 1 1 78 78 ARG H H 78 8.864 8.864 8.658 0.206 18478 8438 1 19 . 1 1 79 79 LYS N N 79 128.197 128.197 119.484 8.713 18478 8439 1 19 . 1 1 79 79 LYS HA H 79 4.221 4.221 4.490 -0.269 18478 8440 1 19 . 1 1 79 79 LYS C C 79 174.336 174.336 175.396 -1.060 18478 8441 1 19 . 1 1 79 79 LYS CA C 79 58.986 58.986 56.029 2.957 18478 8442 1 19 . 1 1 79 79 LYS CB C 79 32.072 32.072 33.205 -1.133 18478 8443 1 19 . 1 1 79 79 LYS H H 79 8.927 8.927 7.692 1.235 18478 8444 1 19 . 1 1 80 80 GLY N N 80 114.730 114.730 109.402 5.328 18478 8445 1 19 . 1 1 80 80 GLY C C 80 176.536 176.536 174.485 2.051 18478 8446 1 19 . 1 1 80 80 GLY CA C 80 45.992 45.992 45.299 0.693 18478 8447 1 19 . 1 1 80 80 GLY H H 80 8.943 8.943 8.565 0.378 18478 8448 1 19 . 1 1 81 81 PHE N N 81 123.770 123.770 118.776 4.994 18478 8449 1 19 . 1 1 81 81 PHE HA H 81 3.336 3.336 4.373 -1.037 18478 8450 1 19 . 1 1 81 81 PHE C C 81 174.037 174.037 176.342 -2.305 18478 8451 1 19 . 1 1 81 81 PHE CA C 81 63.094 63.094 59.530 3.564 18478 8452 1 19 . 1 1 81 81 PHE CB C 81 39.823 39.823 38.810 1.013 18478 8453 1 19 . 1 1 81 81 PHE H H 81 8.281 8.281 7.883 0.398 18478 8454 1 19 . 1 1 82 82 ASN N N 82 119.812 119.812 117.476 2.336 18478 8455 1 19 . 1 1 82 82 ASN HA H 82 4.458 4.458 4.257 0.201 18478 8456 1 19 . 1 1 82 82 ASN C C 82 171.290 171.290 176.282 -4.992 18478 8457 1 19 . 1 1 82 82 ASN CA C 82 56.060 56.060 56.676 -0.616 18478 8458 1 19 . 1 1 82 82 ASN CB C 82 36.390 36.390 38.389 -1.998 18478 8459 1 19 . 1 1 82 82 ASN H H 82 9.145 9.145 8.399 0.746 18478 8460 1 19 . 1 1 83 83 GLU N N 83 124.411 124.411 117.975 6.436 18478 8461 1 19 . 1 1 83 83 GLU HA H 83 4.186 4.186 4.042 0.144 18478 8462 1 19 . 1 1 83 83 GLU C C 83 172.222 172.222 178.650 -6.428 18478 8463 1 19 . 1 1 83 83 GLU CA C 83 60.922 60.922 59.255 1.667 18478 8464 1 19 . 1 1 83 83 GLU CB C 83 28.132 28.132 29.453 -1.321 18478 8465 1 19 . 1 1 83 83 GLU H H 83 9.560 9.560 7.937 1.623 18478 8466 1 19 . 1 1 84 84 GLY N N 84 111.388 111.388 106.994 4.394 18478 8467 1 19 . 1 1 84 84 GLY C C 84 176.445 176.445 174.795 1.650 18478 8468 1 19 . 1 1 84 84 GLY CA C 84 46.727 46.727 46.689 0.038 18478 8469 1 19 . 1 1 84 84 GLY H H 84 8.364 8.364 7.394 0.970 18478 8470 1 19 . 1 1 85 85 LEU N N 85 121.153 121.153 121.247 -0.094 18478 8471 1 19 . 1 1 85 85 LEU HA H 85 4.236 4.236 4.279 -0.043 18478 8472 1 19 . 1 1 85 85 LEU C C 85 172.285 172.285 177.966 -5.681 18478 8473 1 19 . 1 1 85 85 LEU CA C 85 56.795 56.795 56.868 -0.073 18478 8474 1 19 . 1 1 85 85 LEU CB C 85 41.113 41.113 42.786 -1.673 18478 8475 1 19 . 1 1 85 85 LEU H H 85 8.294 8.294 7.725 0.569 18478 8476 1 19 . 1 1 86 86 TRP N N 86 118.898 118.898 118.798 0.100 18478 8477 1 19 . 1 1 86 86 TRP HA H 86 4.161 4.161 4.281 -0.120 18478 8478 1 19 . 1 1 86 86 TRP C C 86 171.741 171.741 176.239 -4.498 18478 8479 1 19 . 1 1 86 86 TRP CA C 86 62.153 62.153 58.481 3.672 18478 8480 1 19 . 1 1 86 86 TRP CB C 86 28.424 28.424 29.623 -1.199 18478 8481 1 19 . 1 1 86 86 TRP H H 86 7.783 7.783 7.666 0.117 18478 8482 1 19 . 1 1 87 87 GLU N N 87 120.718 120.718 119.285 1.433 18478 8483 1 19 . 1 1 87 87 GLU HA H 87 3.416 3.416 4.680 -1.264 18478 8484 1 19 . 1 1 87 87 GLU C C 87 172.957 172.957 175.052 -2.095 18478 8485 1 19 . 1 1 87 87 GLU CA C 87 60.122 60.122 53.337 6.785 18478 8486 1 19 . 1 1 87 87 GLU CB C 87 31.021 31.021 30.518 0.503 18478 8487 1 19 . 1 1 87 87 GLU H H 87 8.779 8.779 7.560 1.219 18478 8488 1 19 . 1 1 88 88 ILE HA H 88 2.478 2.478 4.308 -1.830 18478 8489 1 19 . 1 1 88 88 ILE C C 88 177.873 177.873 177.445 0.428 18478 8490 1 19 . 1 1 88 88 ILE CA C 88 65.248 65.248 62.518 2.730 18478 8491 1 19 . 1 1 88 88 ILE CB C 88 37.327 37.327 38.558 -1.231 18478 8492 1 19 . 1 1 89 89 ASP N N 89 114.411 114.411 118.571 -4.160 18478 8493 1 19 . 1 1 89 89 ASP HA H 89 4.589 4.589 4.278 0.311 18478 8494 1 19 . 1 1 89 89 ASP C C 89 174.207 174.207 178.103 -3.896 18478 8495 1 19 . 1 1 89 89 ASP CA C 89 54.740 54.740 56.727 -1.986 18478 8496 1 19 . 1 1 89 89 ASP CB C 89 42.473 42.473 40.125 2.348 18478 8497 1 19 . 1 1 89 89 ASP H H 89 5.911 5.911 8.117 -2.206 18478 8498 1 19 . 1 1 90 90 ASN N N 90 114.358 114.358 115.725 -1.367 18478 8499 1 19 . 1 1 90 90 ASN HA H 90 4.420 4.420 4.404 0.016 18478 8500 1 19 . 1 1 90 90 ASN C C 90 176.991 176.991 177.741 -0.750 18478 8501 1 19 . 1 1 90 90 ASN CA C 90 54.855 54.855 56.632 -1.777 18478 8502 1 19 . 1 1 90 90 ASN CB C 90 40.582 40.582 38.089 2.493 18478 8503 1 19 . 1 1 90 90 ASN H H 90 7.480 7.480 7.815 -0.335 18478 8504 1 19 . 1 1 91 91 ASN N N 91 119.185 119.185 116.216 2.969 18478 8505 1 19 . 1 1 91 91 ASN HA H 91 5.006 5.006 5.149 -0.143 18478 8506 1 19 . 1 1 91 91 ASN CA C 91 51.624 51.624 55.067 -3.443 18478 8507 1 19 . 1 1 91 91 ASN CB C 91 38.752 38.752 38.238 0.514 18478 8508 1 19 . 1 1 91 91 ASN H H 91 9.238 9.238 7.894 1.344 18478 8509 1 19 . 1 1 92 92 PRO HA H 92 4.296 4.296 4.240 0.056 18478 8510 1 19 . 1 1 92 92 PRO C C 92 173.690 173.690 178.831 -5.141 18478 8511 1 19 . 1 1 92 92 PRO CA C 92 64.714 64.714 65.245 -0.531 18478 8512 1 19 . 1 1 92 92 PRO CB C 92 31.781 31.781 31.907 -0.126 18478 8513 1 20 . 1 1 3 3 GLY C C 3 177.088 177.088 174.207 2.881 18478 8514 1 20 . 1 1 3 3 GLY CA C 3 45.330 45.330 46.869 -1.539 18478 8515 1 20 . 1 1 4 4 SER N N 4 115.847 115.847 112.208 3.639 18478 8516 1 20 . 1 1 4 4 SER HA H 4 4.480 4.480 4.656 -0.176 18478 8517 1 20 . 1 1 4 4 SER C C 4 177.991 177.991 172.526 5.465 18478 8518 1 20 . 1 1 4 4 SER CA C 4 58.742 58.742 56.893 1.849 18478 8519 1 20 . 1 1 4 4 SER CB C 4 63.820 63.820 65.462 -1.642 18478 8520 1 20 . 1 1 4 4 SER H H 4 8.207 8.207 7.497 0.710 18478 8521 1 20 . 1 1 5 5 MET N N 5 125.867 125.867 120.468 5.399 18478 8522 1 20 . 1 1 5 5 MET HA H 5 4.580 4.580 4.534 0.046 18478 8523 1 20 . 1 1 5 5 MET C C 5 174.825 174.825 175.943 -1.118 18478 8524 1 20 . 1 1 5 5 MET CA C 5 54.733 54.733 54.497 0.236 18478 8525 1 20 . 1 1 5 5 MET CB C 5 33.527 33.527 35.055 -1.528 18478 8526 1 20 . 1 1 5 5 MET H H 5 8.148 8.148 8.498 -0.350 18478 8527 1 20 . 1 1 6 6 THR N N 6 115.828 115.828 114.554 1.274 18478 8528 1 20 . 1 1 6 6 THR HA H 6 3.903 3.903 4.524 -0.621 18478 8529 1 20 . 1 1 6 6 THR C C 6 176.930 176.930 172.872 4.058 18478 8530 1 20 . 1 1 6 6 THR CA C 6 63.034 63.034 60.622 2.412 18478 8531 1 20 . 1 1 6 6 THR CB C 6 69.308 69.308 68.429 0.879 18478 8532 1 20 . 1 1 6 6 THR H H 6 8.408 8.408 8.386 0.022 18478 8533 1 20 . 1 1 7 7 ARG HA H 7 4.276 4.276 4.200 0.076 18478 8534 1 20 . 1 1 7 7 ARG C C 7 176.546 176.546 176.404 0.142 18478 8535 1 20 . 1 1 7 7 ARG CA C 7 55.813 55.813 56.377 -0.564 18478 8536 1 20 . 1 1 7 7 ARG CB C 7 30.556 30.556 30.747 -0.192 18478 8537 1 20 . 1 1 8 8 ASP N N 8 121.762 121.762 123.225 -1.463 18478 8538 1 20 . 1 1 8 8 ASP HA H 8 4.537 4.537 4.158 0.379 18478 8539 1 20 . 1 1 8 8 ASP C C 8 177.750 177.750 175.519 2.231 18478 8540 1 20 . 1 1 8 8 ASP CA C 8 54.117 54.117 54.637 -0.520 18478 8541 1 20 . 1 1 8 8 ASP H H 8 8.066 8.066 8.387 -0.321 18478 8542 1 20 . 1 1 9 9 PHE N N 9 119.991 119.991 120.228 -0.237 18478 8543 1 20 . 1 1 9 9 PHE HA H 9 4.734 4.734 4.799 -0.065 18478 8544 1 20 . 1 1 9 9 PHE C C 9 176.838 176.838 175.071 1.767 18478 8545 1 20 . 1 1 9 9 PHE CA C 9 58.303 58.303 58.016 0.288 18478 8546 1 20 . 1 1 9 9 PHE CB C 9 41.594 41.594 40.401 1.193 18478 8547 1 20 . 1 1 9 9 PHE H H 9 8.103 8.103 7.584 0.519 18478 8548 1 20 . 1 1 10 10 LYS N N 10 122.957 122.957 124.242 -1.285 18478 8549 1 20 . 1 1 10 10 LYS CA C 10 53.167 53.167 55.658 -2.491 18478 8550 1 20 . 1 1 10 10 LYS CB C 10 33.495 33.495 31.908 1.587 18478 8551 1 20 . 1 1 10 10 LYS H H 10 9.087 9.087 8.721 0.366 18478 8552 1 20 . 1 1 11 11 PRO HA H 11 3.903 3.903 5.021 -1.118 18478 8553 1 20 . 1 1 11 11 PRO C C 11 173.988 173.988 174.714 -0.726 18478 8554 1 20 . 1 1 11 11 PRO CA C 11 63.874 63.874 61.304 2.570 18478 8555 1 20 . 1 1 11 11 PRO CB C 11 31.623 31.623 35.073 -3.450 18478 8556 1 20 . 1 1 12 12 GLY N N 12 115.413 115.413 111.064 4.349 18478 8557 1 20 . 1 1 12 12 GLY C C 12 176.966 176.966 172.513 4.453 18478 8558 1 20 . 1 1 12 12 GLY CA C 12 44.651 44.651 42.218 2.433 18478 8559 1 20 . 1 1 12 12 GLY H H 12 9.667 9.667 8.828 0.839 18478 8560 1 20 . 1 1 13 13 ASP N N 13 122.208 122.208 128.685 -6.477 18478 8561 1 20 . 1 1 13 13 ASP HA H 13 4.601 4.601 4.924 -0.323 18478 8562 1 20 . 1 1 13 13 ASP C C 13 176.244 176.244 174.422 1.822 18478 8563 1 20 . 1 1 13 13 ASP CA C 13 55.870 55.870 52.098 3.772 18478 8564 1 20 . 1 1 13 13 ASP CB C 13 40.794 40.794 42.623 -1.829 18478 8565 1 20 . 1 1 13 13 ASP H H 13 8.303 8.303 8.457 -0.154 18478 8566 1 20 . 1 1 14 14 LEU N N 14 121.306 121.306 126.619 -5.313 18478 8567 1 20 . 1 1 14 14 LEU HA H 14 4.982 4.982 4.612 0.370 18478 8568 1 20 . 1 1 14 14 LEU C C 14 173.461 173.461 176.236 -2.775 18478 8569 1 20 . 1 1 14 14 LEU CA C 14 54.516 54.516 53.579 0.937 18478 8570 1 20 . 1 1 14 14 LEU CB C 14 40.999 40.999 42.037 -1.038 18478 8571 1 20 . 1 1 14 14 LEU H H 14 8.618 8.618 7.722 0.896 18478 8572 1 20 . 1 1 15 15 ILE N N 15 118.806 118.806 126.029 -7.223 18478 8573 1 20 . 1 1 15 15 ILE HA H 15 5.356 5.356 4.285 1.071 18478 8574 1 20 . 1 1 15 15 ILE C C 15 175.982 175.982 176.026 -0.044 18478 8575 1 20 . 1 1 15 15 ILE CA C 15 60.481 60.481 60.093 0.388 18478 8576 1 20 . 1 1 15 15 ILE CB C 15 44.142 44.142 39.419 4.723 18478 8577 1 20 . 1 1 15 15 ILE H H 15 8.864 8.864 8.602 0.262 18478 8578 1 20 . 1 1 16 16 PHE N N 16 112.472 112.472 124.989 -12.517 18478 8579 1 20 . 1 1 16 16 PHE HA H 16 5.306 5.306 4.252 1.054 18478 8580 1 20 . 1 1 16 16 PHE C C 16 176.239 176.239 176.424 -0.185 18478 8581 1 20 . 1 1 16 16 PHE CA C 16 58.603 58.603 59.502 -0.899 18478 8582 1 20 . 1 1 16 16 PHE CB C 16 43.305 43.305 38.565 4.740 18478 8583 1 20 . 1 1 16 16 PHE H H 16 9.411 9.411 8.723 0.688 18478 8584 1 20 . 1 1 17 17 ALA N N 17 123.889 123.889 126.907 -3.018 18478 8585 1 20 . 1 1 17 17 ALA HA H 17 5.348 5.348 3.652 1.696 18478 8586 1 20 . 1 1 17 17 ALA C C 17 174.426 174.426 176.460 -2.034 18478 8587 1 20 . 1 1 17 17 ALA CA C 17 50.062 50.062 51.637 -1.575 18478 8588 1 20 . 1 1 17 17 ALA H H 17 9.658 9.658 8.479 1.179 18478 8589 1 20 . 1 1 18 18 LYS N N 18 127.760 127.760 121.623 6.137 18478 8590 1 20 . 1 1 18 18 LYS HA H 18 4.697 4.697 4.739 -0.042 18478 8591 1 20 . 1 1 18 18 LYS C C 18 178.554 178.554 174.798 3.756 18478 8592 1 20 . 1 1 18 18 LYS CA C 18 53.893 53.893 52.280 1.613 18478 8593 1 20 . 1 1 18 18 LYS CB C 18 35.291 35.291 32.337 2.954 18478 8594 1 20 . 1 1 18 18 LYS H H 18 9.421 9.421 7.626 1.795 18478 8595 1 20 . 1 1 19 19 MET HA H 19 4.656 4.656 4.602 0.054 18478 8596 1 20 . 1 1 19 19 MET C C 19 175.741 175.741 174.685 1.056 18478 8597 1 20 . 1 1 19 19 MET CA C 19 53.916 53.916 54.727 -0.811 18478 8598 1 20 . 1 1 19 19 MET CB C 19 35.799 35.799 33.521 2.278 18478 8599 1 20 . 1 1 20 20 LYS N N 20 124.062 124.062 117.007 7.055 18478 8600 1 20 . 1 1 20 20 LYS CA C 20 58.585 58.585 56.162 2.423 18478 8601 1 20 . 1 1 20 20 LYS CB C 20 31.978 31.978 32.746 -0.768 18478 8602 1 20 . 1 1 20 20 LYS H H 20 8.645 8.645 8.144 0.501 18478 8603 1 20 . 1 1 21 21 GLY C C 21 176.205 176.205 172.338 3.867 18478 8604 1 20 . 1 1 21 21 GLY CA C 21 45.142 45.142 42.004 3.138 18478 8605 1 20 . 1 1 22 22 TYR HA H 22 4.573 4.573 4.785 -0.212 18478 8606 1 20 . 1 1 22 22 TYR CA C 22 55.748 55.748 57.756 -2.008 18478 8607 1 20 . 1 1 22 22 TYR CB C 22 41.331 41.331 38.412 2.919 18478 8608 1 20 . 1 1 23 23 PRO HA H 23 4.759 4.759 5.103 -0.344 18478 8609 1 20 . 1 1 23 23 PRO C C 23 174.587 174.587 175.065 -0.478 18478 8610 1 20 . 1 1 23 23 PRO CA C 23 62.072 62.072 61.741 0.331 18478 8611 1 20 . 1 1 23 23 PRO CB C 23 31.077 31.077 34.824 -3.747 18478 8612 1 20 . 1 1 24 24 HIS N N 24 119.190 119.190 115.259 3.931 18478 8613 1 20 . 1 1 24 24 HIS HA H 24 3.983 3.983 5.520 -1.537 18478 8614 1 20 . 1 1 24 24 HIS C C 24 175.555 175.555 173.850 1.705 18478 8615 1 20 . 1 1 24 24 HIS CA C 24 60.973 60.973 54.391 6.582 18478 8616 1 20 . 1 1 24 24 HIS CB C 24 30.689 30.689 32.769 -2.080 18478 8617 1 20 . 1 1 24 24 HIS H H 24 8.158 8.158 8.446 -0.288 18478 8618 1 20 . 1 1 25 25 TRP N N 25 127.435 127.435 121.899 5.536 18478 8619 1 20 . 1 1 25 25 TRP HA H 25 3.760 3.760 5.309 -1.549 18478 8620 1 20 . 1 1 25 25 TRP CA C 25 55.890 55.890 57.377 -1.487 18478 8621 1 20 . 1 1 25 25 TRP CB C 25 32.879 32.879 30.748 2.131 18478 8622 1 20 . 1 1 25 25 TRP H H 25 9.211 9.211 8.775 0.436 18478 8623 1 20 . 1 1 26 26 PRO HA H 26 4.217 4.217 4.493 -0.276 18478 8624 1 20 . 1 1 26 26 PRO C C 26 176.279 176.279 176.149 0.130 18478 8625 1 20 . 1 1 26 26 PRO CA C 26 63.140 63.140 62.077 1.063 18478 8626 1 20 . 1 1 26 26 PRO CB C 26 32.171 32.171 34.184 -2.013 18478 8627 1 20 . 1 1 27 27 ALA N N 27 130.162 130.162 126.851 3.311 18478 8628 1 20 . 1 1 27 27 ALA HA H 27 4.981 4.981 4.358 0.623 18478 8629 1 20 . 1 1 27 27 ALA C C 27 177.227 177.227 177.258 -0.031 18478 8630 1 20 . 1 1 27 27 ALA CA C 27 52.574 52.574 51.447 1.127 18478 8631 1 20 . 1 1 27 27 ALA CB C 27 23.239 23.239 19.635 3.604 18478 8632 1 20 . 1 1 27 27 ALA H H 27 9.394 9.394 8.294 1.100 18478 8633 1 20 . 1 1 28 28 ARG N N 28 117.381 117.381 123.926 -6.545 18478 8634 1 20 . 1 1 28 28 ARG HA H 28 5.421 5.421 4.279 1.142 18478 8635 1 20 . 1 1 28 28 ARG C C 28 176.465 176.465 175.705 0.760 18478 8636 1 20 . 1 1 28 28 ARG CA C 28 53.662 53.662 55.215 -1.553 18478 8637 1 20 . 1 1 28 28 ARG CB C 28 35.058 35.058 29.232 5.827 18478 8638 1 20 . 1 1 28 28 ARG H H 28 8.806 8.806 8.493 0.313 18478 8639 1 20 . 1 1 29 29 VAL HA H 29 4.109 4.109 4.242 -0.133 18478 8640 1 20 . 1 1 29 29 VAL C C 29 175.996 175.996 174.857 1.139 18478 8641 1 20 . 1 1 29 29 VAL CA C 29 62.810 62.810 61.501 1.309 18478 8642 1 20 . 1 1 29 29 VAL CB C 29 31.108 31.108 32.678 -1.570 18478 8643 1 20 . 1 1 30 30 ASP N N 30 133.830 133.830 118.317 15.513 18478 8644 1 20 . 1 1 30 30 ASP HA H 30 5.198 5.198 4.590 0.608 18478 8645 1 20 . 1 1 30 30 ASP C C 30 176.207 176.207 177.527 -1.320 18478 8646 1 20 . 1 1 30 30 ASP CA C 30 53.007 53.007 54.547 -1.540 18478 8647 1 20 . 1 1 30 30 ASP CB C 30 44.130 44.130 41.978 2.152 18478 8648 1 20 . 1 1 30 30 ASP H H 30 8.892 8.892 8.449 0.443 18478 8649 1 20 . 1 1 31 31 GLU N N 31 115.905 115.905 122.642 -6.737 18478 8650 1 20 . 1 1 31 31 GLU HA H 31 4.409 4.409 3.990 0.419 18478 8651 1 20 . 1 1 31 31 GLU C C 31 175.192 175.192 175.873 -0.681 18478 8652 1 20 . 1 1 31 31 GLU CA C 31 55.389 55.389 56.856 -1.467 18478 8653 1 20 . 1 1 31 31 GLU H H 31 7.966 7.966 8.795 -0.829 18478 8654 1 20 . 1 1 32 32 VAL N N 32 122.794 122.794 117.491 5.303 18478 8655 1 20 . 1 1 32 32 VAL HA H 32 4.303 4.303 3.728 0.575 18478 8656 1 20 . 1 1 32 32 VAL CA C 32 60.408 60.408 62.731 -2.323 18478 8657 1 20 . 1 1 32 32 VAL CB C 32 32.333 32.333 30.349 1.984 18478 8658 1 20 . 1 1 32 32 VAL H H 32 8.702 8.702 7.819 0.882 18478 8659 1 20 . 1 1 33 33 PRO HA H 33 4.572 4.572 4.207 0.365 18478 8660 1 20 . 1 1 33 33 PRO C C 33 175.366 175.366 177.209 -1.843 18478 8661 1 20 . 1 1 33 33 PRO CA C 33 63.702 63.702 65.102 -1.400 18478 8662 1 20 . 1 1 33 33 PRO CB C 33 32.736 32.736 31.934 0.802 18478 8663 1 20 . 1 1 34 34 ASP N N 34 119.187 119.187 118.084 1.103 18478 8664 1 20 . 1 1 34 34 ASP HA H 34 4.679 4.679 4.880 -0.201 18478 8665 1 20 . 1 1 34 34 ASP C C 34 175.713 175.713 173.951 1.762 18478 8666 1 20 . 1 1 34 34 ASP CA C 34 53.013 53.013 52.382 0.631 18478 8667 1 20 . 1 1 34 34 ASP CB C 34 40.850 40.850 41.235 -0.385 18478 8668 1 20 . 1 1 34 34 ASP H H 34 8.686 8.686 7.933 0.753 18478 8669 1 20 . 1 1 35 35 GLY C C 35 177.458 177.458 173.003 4.455 18478 8670 1 20 . 1 1 35 35 GLY CA C 35 45.507 45.507 43.760 1.747 18478 8671 1 20 . 1 1 36 36 ALA HA H 36 4.404 4.404 4.316 0.088 18478 8672 1 20 . 1 1 36 36 ALA CA C 36 52.010 52.010 51.797 0.213 18478 8673 1 20 . 1 1 36 36 ALA CB C 36 19.909 19.909 19.690 0.219 18478 8674 1 20 . 1 1 37 37 VAL N N 37 119.594 119.594 121.515 -1.921 18478 8675 1 20 . 1 1 37 37 VAL HA H 37 3.932 3.932 4.284 -0.352 18478 8676 1 20 . 1 1 37 37 VAL C C 37 175.966 175.966 175.570 0.396 18478 8677 1 20 . 1 1 37 37 VAL CA C 37 62.810 62.810 63.312 -0.502 18478 8678 1 20 . 1 1 37 37 VAL CB C 37 32.267 32.267 33.261 -0.994 18478 8679 1 20 . 1 1 37 37 VAL H H 37 8.037 8.037 8.361 -0.324 18478 8680 1 20 . 1 1 38 38 LYS N N 38 125.676 125.676 121.390 4.286 18478 8681 1 20 . 1 1 38 38 LYS C C 38 173.865 173.865 174.579 -0.714 18478 8682 1 20 . 1 1 38 38 LYS CA C 38 54.278 54.278 56.658 -2.381 18478 8683 1 20 . 1 1 38 38 LYS CB C 38 31.740 31.740 34.121 -2.381 18478 8684 1 20 . 1 1 38 38 LYS H H 38 8.292 8.292 8.424 -0.132 18478 8685 1 20 . 1 1 40 40 PRO HA H 40 4.387 4.387 5.187 -0.800 18478 8686 1 20 . 1 1 40 40 PRO C C 40 175.535 175.535 175.277 0.258 18478 8687 1 20 . 1 1 40 40 PRO CA C 40 62.330 62.330 59.642 2.688 18478 8688 1 20 . 1 1 40 40 PRO CB C 40 32.086 32.086 31.701 0.385 18478 8689 1 20 . 1 1 41 41 THR HA H 41 4.027 4.027 4.555 -0.528 18478 8690 1 20 . 1 1 41 41 THR C C 41 176.795 176.795 173.088 3.707 18478 8691 1 20 . 1 1 41 41 THR CA C 41 63.693 63.693 62.288 1.405 18478 8692 1 20 . 1 1 41 41 THR CB C 41 69.370 69.370 68.892 0.478 18478 8693 1 20 . 1 1 42 42 ASN N N 42 118.513 118.513 122.246 -3.733 18478 8694 1 20 . 1 1 42 42 ASN HA H 42 4.530 4.530 5.228 -0.698 18478 8695 1 20 . 1 1 42 42 ASN C C 42 177.230 177.230 174.836 2.394 18478 8696 1 20 . 1 1 42 42 ASN CA C 42 56.373 56.373 50.359 6.014 18478 8697 1 20 . 1 1 42 42 ASN CB C 42 37.618 37.618 38.157 -0.539 18478 8698 1 20 . 1 1 42 42 ASN H H 42 8.752 8.752 8.797 -0.045 18478 8699 1 20 . 1 1 43 43 LYS N N 43 115.898 115.898 128.935 -13.037 18478 8700 1 20 . 1 1 43 43 LYS HA H 43 4.710 4.710 4.698 0.012 18478 8701 1 20 . 1 1 43 43 LYS C C 43 177.032 177.032 175.914 1.118 18478 8702 1 20 . 1 1 43 43 LYS CA C 43 54.957 54.957 55.088 -0.131 18478 8703 1 20 . 1 1 43 43 LYS CB C 43 36.600 36.600 33.016 3.584 18478 8704 1 20 . 1 1 43 43 LYS H H 43 7.723 7.723 8.650 -0.927 18478 8705 1 20 . 1 1 44 44 LEU N N 44 121.006 121.006 129.401 -8.395 18478 8706 1 20 . 1 1 44 44 LEU HA H 44 5.000 5.000 4.353 0.647 18478 8707 1 20 . 1 1 44 44 LEU CA C 44 51.842 51.842 54.607 -2.765 18478 8708 1 20 . 1 1 44 44 LEU CB C 44 44.418 44.418 40.587 3.831 18478 8709 1 20 . 1 1 44 44 LEU H H 44 9.063 9.063 8.430 0.633 18478 8710 1 20 . 1 1 45 45 PRO HA H 45 4.392 4.392 4.503 -0.111 18478 8711 1 20 . 1 1 45 45 PRO C C 45 177.051 177.051 177.615 -0.564 18478 8712 1 20 . 1 1 45 45 PRO CA C 45 62.000 62.000 63.769 -1.769 18478 8713 1 20 . 1 1 45 45 PRO CB C 45 30.737 30.737 32.412 -1.675 18478 8714 1 20 . 1 1 46 46 ILE N N 46 125.996 125.996 125.055 0.941 18478 8715 1 20 . 1 1 46 46 ILE HA H 46 4.564 4.564 3.719 0.845 18478 8716 1 20 . 1 1 46 46 ILE C C 46 176.985 176.985 176.199 0.786 18478 8717 1 20 . 1 1 46 46 ILE CA C 46 57.051 57.051 62.398 -5.347 18478 8718 1 20 . 1 1 46 46 ILE H H 46 8.908 8.908 8.942 -0.034 18478 8719 1 20 . 1 1 47 47 PHE N N 47 128.276 128.276 117.780 10.496 18478 8720 1 20 . 1 1 47 47 PHE HA H 47 4.827 4.827 4.418 0.409 18478 8721 1 20 . 1 1 47 47 PHE C C 47 177.835 177.835 176.260 1.575 18478 8722 1 20 . 1 1 47 47 PHE CA C 47 56.099 56.099 57.368 -1.269 18478 8723 1 20 . 1 1 47 47 PHE CB C 47 41.217 41.217 41.026 0.191 18478 8724 1 20 . 1 1 47 47 PHE H H 47 8.739 8.739 7.747 0.992 18478 8725 1 20 . 1 1 48 48 PHE N N 48 125.953 125.953 118.803 7.150 18478 8726 1 20 . 1 1 48 48 PHE HA H 48 4.251 4.251 4.434 -0.183 18478 8727 1 20 . 1 1 48 48 PHE C C 48 175.869 175.869 174.406 1.463 18478 8728 1 20 . 1 1 48 48 PHE CA C 48 56.744 56.744 59.923 -3.179 18478 8729 1 20 . 1 1 48 48 PHE CB C 48 38.835 38.835 37.336 1.500 18478 8730 1 20 . 1 1 48 48 PHE H H 48 8.545 8.545 8.123 0.422 18478 8731 1 20 . 1 1 49 49 PHE N N 49 122.197 122.197 117.882 4.315 18478 8732 1 20 . 1 1 49 49 PHE HA H 49 4.400 4.400 4.615 -0.215 18478 8733 1 20 . 1 1 49 49 PHE C C 49 174.016 174.016 173.809 0.207 18478 8734 1 20 . 1 1 49 49 PHE CA C 49 59.916 59.916 55.312 4.604 18478 8735 1 20 . 1 1 49 49 PHE CB C 49 39.799 39.799 42.481 -2.682 18478 8736 1 20 . 1 1 49 49 PHE H H 49 8.619 8.619 7.233 1.386 18478 8737 1 20 . 1 1 50 50 GLY N N 50 114.083 114.083 107.304 6.779 18478 8738 1 20 . 1 1 50 50 GLY C C 50 175.636 175.636 173.107 2.529 18478 8739 1 20 . 1 1 50 50 GLY CA C 50 46.718 46.718 43.775 2.943 18478 8740 1 20 . 1 1 50 50 GLY H H 50 10.329 10.329 8.000 2.329 18478 8741 1 20 . 1 1 51 51 THR N N 51 111.210 111.210 117.577 -6.367 18478 8742 1 20 . 1 1 51 51 THR HA H 51 3.980 3.980 4.580 -0.600 18478 8743 1 20 . 1 1 51 51 THR C C 51 175.588 175.588 172.001 3.587 18478 8744 1 20 . 1 1 51 51 THR CA C 51 62.223 62.223 61.227 0.996 18478 8745 1 20 . 1 1 51 51 THR CB C 51 68.346 68.346 72.201 -3.855 18478 8746 1 20 . 1 1 51 51 THR H H 51 7.882 7.882 8.618 -0.736 18478 8747 1 20 . 1 1 52 52 HIS N N 52 115.544 115.544 120.136 -4.592 18478 8748 1 20 . 1 1 52 52 HIS HA H 52 3.712 3.712 5.498 -1.786 18478 8749 1 20 . 1 1 52 52 HIS C C 52 177.717 177.717 174.744 2.973 18478 8750 1 20 . 1 1 52 52 HIS CA C 52 54.860 54.860 54.140 0.720 18478 8751 1 20 . 1 1 52 52 HIS CB C 52 26.388 26.388 30.613 -4.226 18478 8752 1 20 . 1 1 52 52 HIS H H 52 7.791 7.791 8.645 -0.854 18478 8753 1 20 . 1 1 53 53 GLU N N 53 117.517 117.517 121.548 -4.031 18478 8754 1 20 . 1 1 53 53 GLU HA H 53 4.298 4.298 4.837 -0.539 18478 8755 1 20 . 1 1 53 53 GLU C C 53 176.958 176.958 176.762 0.196 18478 8756 1 20 . 1 1 53 53 GLU CA C 53 55.403 55.403 54.989 0.414 18478 8757 1 20 . 1 1 53 53 GLU CB C 53 31.588 31.588 33.276 -1.688 18478 8758 1 20 . 1 1 53 53 GLU H H 53 6.795 6.795 8.372 -1.577 18478 8759 1 20 . 1 1 54 54 THR N N 54 111.182 111.182 116.784 -5.602 18478 8760 1 20 . 1 1 54 54 THR HA H 54 5.648 5.648 4.391 1.257 18478 8761 1 20 . 1 1 54 54 THR C C 54 177.234 177.234 174.371 2.863 18478 8762 1 20 . 1 1 54 54 THR CA C 54 59.894 59.894 61.297 -1.403 18478 8763 1 20 . 1 1 54 54 THR H H 54 8.139 8.139 8.690 -0.551 18478 8764 1 20 . 1 1 55 55 ALA HA H 55 4.403 4.403 4.241 0.162 18478 8765 1 20 . 1 1 55 55 ALA C C 55 176.601 176.601 178.143 -1.542 18478 8766 1 20 . 1 1 55 55 ALA CA C 55 51.079 51.079 53.155 -2.076 18478 8767 1 20 . 1 1 55 55 ALA CB C 55 23.285 23.285 19.159 4.126 18478 8768 1 20 . 1 1 56 56 PHE N N 56 118.058 118.058 116.037 2.021 18478 8769 1 20 . 1 1 56 56 PHE HA H 56 5.678 5.678 4.625 1.053 18478 8770 1 20 . 1 1 56 56 PHE C C 56 175.962 175.962 175.238 0.724 18478 8771 1 20 . 1 1 56 56 PHE CA C 56 56.008 56.008 59.035 -3.027 18478 8772 1 20 . 1 1 56 56 PHE CB C 56 39.995 39.995 38.006 1.989 18478 8773 1 20 . 1 1 56 56 PHE H H 56 8.523 8.523 8.275 0.248 18478 8774 1 20 . 1 1 57 57 LEU N N 57 123.344 123.344 120.290 3.054 18478 8775 1 20 . 1 1 57 57 LEU HA H 57 4.929 4.929 4.662 0.267 18478 8776 1 20 . 1 1 57 57 LEU C C 57 175.584 175.584 174.739 0.845 18478 8777 1 20 . 1 1 57 57 LEU CA C 57 53.463 53.463 55.024 -1.561 18478 8778 1 20 . 1 1 57 57 LEU CB C 57 46.545 46.545 43.453 3.092 18478 8779 1 20 . 1 1 57 57 LEU H H 57 8.579 8.579 7.657 0.922 18478 8780 1 20 . 1 1 58 58 GLY N N 58 108.499 108.499 107.006 1.493 18478 8781 1 20 . 1 1 58 58 GLY CA C 58 43.755 43.755 44.167 -0.412 18478 8782 1 20 . 1 1 58 58 GLY H H 58 9.318 9.318 7.274 2.044 18478 8783 1 20 . 1 1 59 59 PRO HA H 59 4.048 4.048 4.969 -0.921 18478 8784 1 20 . 1 1 59 59 PRO C C 59 173.763 173.763 174.741 -0.978 18478 8785 1 20 . 1 1 59 59 PRO CA C 59 64.770 64.770 60.433 4.337 18478 8786 1 20 . 1 1 59 59 PRO CB C 59 31.889 31.889 35.704 -3.815 18478 8787 1 20 . 1 1 60 60 LYS HA H 60 4.191 4.191 4.567 -0.376 18478 8788 1 20 . 1 1 60 60 LYS C C 60 174.842 174.842 176.271 -1.429 18478 8789 1 20 . 1 1 60 60 LYS CA C 60 57.875 57.875 56.488 1.387 18478 8790 1 20 . 1 1 60 60 LYS CB C 60 31.576 31.576 32.441 -0.866 18478 8791 1 20 . 1 1 61 61 ASP N N 61 117.768 117.768 122.890 -5.122 18478 8792 1 20 . 1 1 61 61 ASP HA H 61 4.973 4.973 4.331 0.642 18478 8793 1 20 . 1 1 61 61 ASP C C 61 178.178 178.178 176.931 1.247 18478 8794 1 20 . 1 1 61 61 ASP CA C 61 54.687 54.687 56.276 -1.589 18478 8795 1 20 . 1 1 61 61 ASP CB C 61 43.555 43.555 39.565 3.990 18478 8796 1 20 . 1 1 61 61 ASP H H 61 7.722 7.722 8.833 -1.111 18478 8797 1 20 . 1 1 62 62 ILE N N 62 114.244 114.244 121.760 -7.516 18478 8798 1 20 . 1 1 62 62 ILE HA H 62 4.891 4.891 3.407 1.484 18478 8799 1 20 . 1 1 62 62 ILE C C 62 178.027 178.027 177.236 0.791 18478 8800 1 20 . 1 1 62 62 ILE CA C 62 59.994 59.994 64.256 -4.262 18478 8801 1 20 . 1 1 62 62 ILE CB C 62 40.652 40.652 36.951 3.701 18478 8802 1 20 . 1 1 62 62 ILE H H 62 6.784 6.784 7.711 -0.927 18478 8803 1 20 . 1 1 63 63 PHE N N 63 119.819 119.819 120.369 -0.550 18478 8804 1 20 . 1 1 63 63 PHE HA H 63 5.214 5.214 4.216 0.998 18478 8805 1 20 . 1 1 63 63 PHE CA C 63 54.735 54.735 60.244 -5.509 18478 8806 1 20 . 1 1 63 63 PHE CB C 63 42.122 42.122 38.922 3.200 18478 8807 1 20 . 1 1 63 63 PHE H H 63 8.734 8.734 7.639 1.095 18478 8808 1 20 . 1 1 64 64 PRO HA H 64 4.771 4.771 4.389 0.382 18478 8809 1 20 . 1 1 64 64 PRO C C 64 174.036 174.036 178.305 -4.269 18478 8810 1 20 . 1 1 64 64 PRO CA C 64 64.474 64.474 64.416 0.058 18478 8811 1 20 . 1 1 64 64 PRO CB C 64 32.662 32.662 33.452 -0.790 18478 8812 1 20 . 1 1 65 65 TYR N N 65 124.335 124.335 121.666 2.669 18478 8813 1 20 . 1 1 65 65 TYR HA H 65 4.530 4.530 4.344 0.186 18478 8814 1 20 . 1 1 65 65 TYR C C 65 173.944 173.944 177.325 -3.381 18478 8815 1 20 . 1 1 65 65 TYR CA C 65 61.205 61.205 61.142 0.063 18478 8816 1 20 . 1 1 65 65 TYR CB C 65 38.844 38.844 38.167 0.677 18478 8817 1 20 . 1 1 65 65 TYR H H 65 8.359 8.359 7.942 0.417 18478 8818 1 20 . 1 1 66 66 SER N N 66 114.836 114.836 112.441 2.395 18478 8819 1 20 . 1 1 66 66 SER HA H 66 3.505 3.505 4.407 -0.902 18478 8820 1 20 . 1 1 66 66 SER C C 66 173.697 173.697 175.547 -1.850 18478 8821 1 20 . 1 1 66 66 SER CA C 66 63.078 63.078 59.831 3.247 18478 8822 1 20 . 1 1 66 66 SER CB C 66 62.223 62.223 62.598 -0.375 18478 8823 1 20 . 1 1 66 66 SER H H 66 8.974 8.974 7.715 1.259 18478 8824 1 20 . 1 1 67 67 GLU N N 67 118.013 118.013 118.488 -0.475 18478 8825 1 20 . 1 1 67 67 GLU HA H 67 4.210 4.210 4.184 0.026 18478 8826 1 20 . 1 1 67 67 GLU C C 67 174.961 174.961 177.558 -2.597 18478 8827 1 20 . 1 1 67 67 GLU CA C 67 58.330 58.330 57.887 0.443 18478 8828 1 20 . 1 1 67 67 GLU CB C 67 30.205 30.205 30.894 -0.689 18478 8829 1 20 . 1 1 67 67 GLU H H 67 8.817 8.817 7.882 0.935 18478 8830 1 20 . 1 1 68 68 ASN N N 68 113.942 113.942 110.819 3.123 18478 8831 1 20 . 1 1 68 68 ASN HA H 68 5.015 5.015 5.094 -0.079 18478 8832 1 20 . 1 1 68 68 ASN C C 68 176.626 176.626 176.294 0.332 18478 8833 1 20 . 1 1 68 68 ASN CA C 68 53.768 53.768 51.919 1.849 18478 8834 1 20 . 1 1 68 68 ASN CB C 68 41.948 41.948 39.168 2.780 18478 8835 1 20 . 1 1 68 68 ASN H H 68 7.448 7.448 7.872 -0.424 18478 8836 1 20 . 1 1 69 69 LYS N N 69 124.584 124.584 121.344 3.240 18478 8837 1 20 . 1 1 69 69 LYS HA H 69 3.794 3.794 3.929 -0.135 18478 8838 1 20 . 1 1 69 69 LYS C C 69 173.330 173.330 174.862 -1.532 18478 8839 1 20 . 1 1 69 69 LYS CA C 69 61.225 61.225 57.527 3.698 18478 8840 1 20 . 1 1 69 69 LYS H H 69 7.592 7.592 8.725 -1.133 18478 8841 1 20 . 1 1 70 70 GLU N N 70 118.408 118.408 117.381 1.027 18478 8842 1 20 . 1 1 70 70 GLU HA H 70 4.005 4.005 4.936 -0.931 18478 8843 1 20 . 1 1 70 70 GLU C C 70 174.588 174.588 173.800 0.788 18478 8844 1 20 . 1 1 70 70 GLU CA C 70 58.695 58.695 52.961 5.734 18478 8845 1 20 . 1 1 70 70 GLU CB C 70 28.928 28.928 30.784 -1.855 18478 8846 1 20 . 1 1 70 70 GLU H H 70 8.478 8.478 7.908 0.570 18478 8847 1 20 . 1 1 71 71 LYS HA H 71 3.847 3.847 4.405 -0.558 18478 8848 1 20 . 1 1 71 71 LYS C C 71 173.420 173.420 175.624 -2.204 18478 8849 1 20 . 1 1 71 71 LYS CA C 71 58.718 58.718 55.816 2.902 18478 8850 1 20 . 1 1 71 71 LYS CB C 71 32.964 32.964 33.804 -0.840 18478 8851 1 20 . 1 1 72 72 TYR N N 72 112.358 112.358 122.221 -9.863 18478 8852 1 20 . 1 1 72 72 TYR HA H 72 4.790 4.790 4.264 0.526 18478 8853 1 20 . 1 1 72 72 TYR C C 72 174.442 174.442 175.850 -1.408 18478 8854 1 20 . 1 1 72 72 TYR CA C 72 55.287 55.287 58.900 -3.613 18478 8855 1 20 . 1 1 72 72 TYR CB C 72 37.244 37.244 38.765 -1.521 18478 8856 1 20 . 1 1 72 72 TYR H H 72 7.341 7.341 8.683 -1.342 18478 8857 1 20 . 1 1 73 73 GLY N N 73 110.612 110.612 108.122 2.490 18478 8858 1 20 . 1 1 73 73 GLY C C 73 177.982 177.982 173.573 4.409 18478 8859 1 20 . 1 1 73 73 GLY CA C 73 46.623 46.623 44.532 2.091 18478 8860 1 20 . 1 1 73 73 GLY H H 73 8.076 8.076 8.289 -0.213 18478 8861 1 20 . 1 1 74 74 LYS N N 74 121.009 121.009 120.688 0.321 18478 8862 1 20 . 1 1 74 74 LYS CA C 74 53.465 53.465 54.059 -0.593 18478 8863 1 20 . 1 1 74 74 LYS CB C 74 32.440 32.440 32.901 -0.461 18478 8864 1 20 . 1 1 74 74 LYS H H 74 7.411 7.411 7.945 -0.534 18478 8865 1 20 . 1 1 75 75 PRO HA H 75 4.452 4.452 4.266 0.186 18478 8866 1 20 . 1 1 75 75 PRO C C 75 174.959 174.959 177.915 -2.956 18478 8867 1 20 . 1 1 75 75 PRO CA C 75 62.861 62.861 64.740 -1.879 18478 8868 1 20 . 1 1 75 75 PRO CB C 75 32.407 32.407 31.666 0.741 18478 8869 1 20 . 1 1 76 76 ASN N N 76 121.045 121.045 119.094 1.951 18478 8870 1 20 . 1 1 76 76 ASN HA H 76 4.445 4.445 4.465 -0.020 18478 8871 1 20 . 1 1 76 76 ASN C C 76 174.145 174.145 175.279 -1.134 18478 8872 1 20 . 1 1 76 76 ASN CA C 76 55.701 55.701 52.483 3.218 18478 8873 1 20 . 1 1 76 76 ASN H H 76 8.474 8.474 8.882 -0.408 18478 8874 1 20 . 1 1 77 77 LYS N N 77 111.466 111.466 120.205 -8.739 18478 8875 1 20 . 1 1 77 77 LYS HA H 77 4.369 4.369 4.245 0.124 18478 8876 1 20 . 1 1 77 77 LYS C C 77 173.881 173.881 176.546 -2.665 18478 8877 1 20 . 1 1 77 77 LYS CA C 77 55.995 55.995 56.163 -0.168 18478 8878 1 20 . 1 1 77 77 LYS CB C 77 32.538 32.538 32.370 0.168 18478 8879 1 20 . 1 1 77 77 LYS H H 77 8.543 8.543 7.949 0.594 18478 8880 1 20 . 1 1 78 78 ARG N N 78 122.233 122.233 119.344 2.889 18478 8881 1 20 . 1 1 78 78 ARG HA H 78 4.286 4.286 3.987 0.299 18478 8882 1 20 . 1 1 78 78 ARG C C 78 173.652 173.652 174.505 -0.853 18478 8883 1 20 . 1 1 78 78 ARG CA C 78 55.780 55.780 57.278 -1.498 18478 8884 1 20 . 1 1 78 78 ARG CB C 78 29.554 29.554 29.406 0.148 18478 8885 1 20 . 1 1 78 78 ARG H H 78 8.864 8.864 8.865 -0.001 18478 8886 1 20 . 1 1 79 79 LYS N N 79 128.197 128.197 118.598 9.599 18478 8887 1 20 . 1 1 79 79 LYS HA H 79 4.221 4.221 4.597 -0.376 18478 8888 1 20 . 1 1 79 79 LYS C C 79 174.336 174.336 175.632 -1.296 18478 8889 1 20 . 1 1 79 79 LYS CA C 79 58.986 58.986 55.960 3.026 18478 8890 1 20 . 1 1 79 79 LYS CB C 79 32.072 32.072 33.167 -1.095 18478 8891 1 20 . 1 1 79 79 LYS H H 79 8.927 8.927 8.275 0.652 18478 8892 1 20 . 1 1 80 80 GLY N N 80 114.730 114.730 108.662 6.068 18478 8893 1 20 . 1 1 80 80 GLY C C 80 176.536 176.536 175.508 1.028 18478 8894 1 20 . 1 1 80 80 GLY CA C 80 45.992 45.992 45.681 0.311 18478 8895 1 20 . 1 1 80 80 GLY H H 80 8.943 8.943 8.650 0.293 18478 8896 1 20 . 1 1 81 81 PHE N N 81 123.770 123.770 120.488 3.282 18478 8897 1 20 . 1 1 81 81 PHE HA H 81 3.336 3.336 4.136 -0.800 18478 8898 1 20 . 1 1 81 81 PHE C C 81 174.037 174.037 176.412 -2.375 18478 8899 1 20 . 1 1 81 81 PHE CA C 81 63.094 63.094 60.854 2.240 18478 8900 1 20 . 1 1 81 81 PHE CB C 81 39.823 39.823 38.553 1.270 18478 8901 1 20 . 1 1 81 81 PHE H H 81 8.281 8.281 8.408 -0.127 18478 8902 1 20 . 1 1 82 82 ASN N N 82 119.812 119.812 116.536 3.276 18478 8903 1 20 . 1 1 82 82 ASN HA H 82 4.458 4.458 4.303 0.155 18478 8904 1 20 . 1 1 82 82 ASN C C 82 171.290 171.290 176.392 -5.102 18478 8905 1 20 . 1 1 82 82 ASN CA C 82 56.060 56.060 56.075 -0.015 18478 8906 1 20 . 1 1 82 82 ASN CB C 82 36.390 36.390 38.393 -2.003 18478 8907 1 20 . 1 1 82 82 ASN H H 82 9.145 9.145 8.479 0.666 18478 8908 1 20 . 1 1 83 83 GLU N N 83 124.411 124.411 118.975 5.436 18478 8909 1 20 . 1 1 83 83 GLU HA H 83 4.186 4.186 4.040 0.146 18478 8910 1 20 . 1 1 83 83 GLU C C 83 172.222 172.222 178.765 -6.543 18478 8911 1 20 . 1 1 83 83 GLU CA C 83 60.922 60.922 59.240 1.682 18478 8912 1 20 . 1 1 83 83 GLU CB C 83 28.132 28.132 30.002 -1.870 18478 8913 1 20 . 1 1 83 83 GLU H H 83 9.560 9.560 8.179 1.381 18478 8914 1 20 . 1 1 84 84 GLY N N 84 111.388 111.388 106.590 4.798 18478 8915 1 20 . 1 1 84 84 GLY C C 84 176.445 176.445 174.881 1.564 18478 8916 1 20 . 1 1 84 84 GLY CA C 84 46.727 46.727 46.598 0.129 18478 8917 1 20 . 1 1 84 84 GLY H H 84 8.364 8.364 7.284 1.080 18478 8918 1 20 . 1 1 85 85 LEU N N 85 121.153 121.153 120.608 0.545 18478 8919 1 20 . 1 1 85 85 LEU HA H 85 4.236 4.236 4.277 -0.041 18478 8920 1 20 . 1 1 85 85 LEU C C 85 172.285 172.285 177.606 -5.321 18478 8921 1 20 . 1 1 85 85 LEU CA C 85 56.795 56.795 56.881 -0.086 18478 8922 1 20 . 1 1 85 85 LEU CB C 85 41.113 41.113 43.054 -1.941 18478 8923 1 20 . 1 1 85 85 LEU H H 85 8.294 8.294 7.707 0.587 18478 8924 1 20 . 1 1 86 86 TRP N N 86 118.898 118.898 118.334 0.564 18478 8925 1 20 . 1 1 86 86 TRP HA H 86 4.161 4.161 4.306 -0.145 18478 8926 1 20 . 1 1 86 86 TRP C C 86 171.741 171.741 176.392 -4.651 18478 8927 1 20 . 1 1 86 86 TRP CA C 86 62.153 62.153 58.535 3.618 18478 8928 1 20 . 1 1 86 86 TRP CB C 86 28.424 28.424 29.640 -1.216 18478 8929 1 20 . 1 1 86 86 TRP H H 86 7.783 7.783 7.360 0.423 18478 8930 1 20 . 1 1 87 87 GLU N N 87 120.718 120.718 119.259 1.459 18478 8931 1 20 . 1 1 87 87 GLU HA H 87 3.416 3.416 4.696 -1.280 18478 8932 1 20 . 1 1 87 87 GLU C C 87 172.957 172.957 174.961 -2.004 18478 8933 1 20 . 1 1 87 87 GLU CA C 87 60.122 60.122 53.200 6.923 18478 8934 1 20 . 1 1 87 87 GLU CB C 87 31.021 31.021 30.296 0.725 18478 8935 1 20 . 1 1 87 87 GLU H H 87 8.779 8.779 7.526 1.253 18478 8936 1 20 . 1 1 88 88 ILE HA H 88 2.478 2.478 4.225 -1.747 18478 8937 1 20 . 1 1 88 88 ILE C C 88 177.873 177.873 177.328 0.545 18478 8938 1 20 . 1 1 88 88 ILE CA C 88 65.248 65.248 62.287 2.961 18478 8939 1 20 . 1 1 88 88 ILE CB C 88 37.327 37.327 38.451 -1.124 18478 8940 1 20 . 1 1 89 89 ASP N N 89 114.411 114.411 119.308 -4.897 18478 8941 1 20 . 1 1 89 89 ASP HA H 89 4.589 4.589 4.484 0.105 18478 8942 1 20 . 1 1 89 89 ASP C C 89 174.207 174.207 178.077 -3.870 18478 8943 1 20 . 1 1 89 89 ASP CA C 89 54.740 54.740 56.703 -1.963 18478 8944 1 20 . 1 1 89 89 ASP CB C 89 42.473 42.473 40.446 2.027 18478 8945 1 20 . 1 1 89 89 ASP H H 89 5.911 5.911 7.815 -1.904 18478 8946 1 20 . 1 1 90 90 ASN N N 90 114.358 114.358 114.443 -0.085 18478 8947 1 20 . 1 1 90 90 ASN HA H 90 4.420 4.420 4.349 0.071 18478 8948 1 20 . 1 1 90 90 ASN C C 90 176.991 176.991 177.216 -0.225 18478 8949 1 20 . 1 1 90 90 ASN CA C 90 54.855 54.855 57.309 -2.454 18478 8950 1 20 . 1 1 90 90 ASN CB C 90 40.582 40.582 37.557 3.025 18478 8951 1 20 . 1 1 90 90 ASN H H 90 7.480 7.480 7.771 -0.291 18478 8952 1 20 . 1 1 91 91 ASN N N 91 119.185 119.185 114.846 4.339 18478 8953 1 20 . 1 1 91 91 ASN HA H 91 5.006 5.006 5.210 -0.204 18478 8954 1 20 . 1 1 91 91 ASN CA C 91 51.624 51.624 54.710 -3.086 18478 8955 1 20 . 1 1 91 91 ASN CB C 91 38.752 38.752 38.309 0.442 18478 8956 1 20 . 1 1 91 91 ASN H H 91 9.238 9.238 7.870 1.368 18478 8957 1 20 . 1 1 92 92 PRO HA H 92 4.296 4.296 4.257 0.039 18478 8958 1 20 . 1 1 92 92 PRO C C 92 173.690 173.690 177.779 -4.089 18478 8959 1 20 . 1 1 92 92 PRO CA C 92 64.714 64.714 65.138 -0.424 18478 8960 1 20 . 1 1 92 92 PRO CB C 92 31.781 31.781 32.507 -0.726 18478 stop_ loop_ _SPARTA_output.Data_ID _SPARTA_output.Entity_delta_chem_shifts_ID _SPARTA_output.Conformer_ID _SPARTA_output.Data_type _SPARTA_output.Data_atom _SPARTA_output.Data_num_shifts _SPARTA_output.Data_value _SPARTA_output.Data_low_range _SPARTA_output.Data_high_range _SPARTA_output.Entry_ID 1 1 1 "Average Difference" N 66 5.616 -0.447 5.641 18478 2 1 1 "Average Difference" HA 94 0.699 0.030 0.702 18478 3 1 1 "Average Difference" C 78 2.503 -0.025 2.519 18478 4 1 1 "Average Difference" CA 89 2.544 -0.464 2.516 18478 5 1 1 "Average Difference" CB 73 2.285 -0.271 2.284 18478 6 1 1 "Average Difference" HN 66 0.899 -0.300 0.854 18478 7 1 2 "Average Difference" N 66 5.695 -0.460 5.720 18478 8 1 2 "Average Difference" HA 94 0.703 0.035 0.706 18478 9 1 2 "Average Difference" C 78 2.549 -0.030 2.566 18478 10 1 2 "Average Difference" CA 89 2.556 -0.415 2.536 18478 11 1 2 "Average Difference" CB 73 2.306 -0.311 2.301 18478 12 1 2 "Average Difference" HN 66 0.910 -0.282 0.872 18478 13 1 3 "Average Difference" N 66 5.410 -0.373 5.438 18478 14 1 3 "Average Difference" HA 94 0.673 0.039 0.675 18478 15 1 3 "Average Difference" C 78 2.584 -0.042 2.601 18478 16 1 3 "Average Difference" CA 89 2.590 -0.371 2.578 18478 17 1 3 "Average Difference" CB 73 2.355 -0.300 2.352 18478 18 1 3 "Average Difference" HN 66 0.917 -0.273 0.882 18478 19 1 4 "Average Difference" N 66 5.682 -0.434 5.709 18478 20 1 4 "Average Difference" HA 94 0.697 0.031 0.700 18478 21 1 4 "Average Difference" C 78 2.574 -0.052 2.591 18478 22 1 4 "Average Difference" CA 89 2.504 -0.394 2.487 18478 23 1 4 "Average Difference" CB 73 2.285 -0.281 2.283 18478 24 1 4 "Average Difference" HN 66 0.919 -0.286 0.880 18478 25 1 5 "Average Difference" N 66 5.613 -0.496 5.634 18478 26 1 5 "Average Difference" HA 94 0.692 0.025 0.696 18478 27 1 5 "Average Difference" C 78 2.565 -0.051 2.581 18478 28 1 5 "Average Difference" CA 89 2.579 -0.352 2.570 18478 29 1 5 "Average Difference" CB 73 2.239 -0.277 2.237 18478 30 1 5 "Average Difference" HN 66 0.929 -0.318 0.880 18478 31 1 6 "Average Difference" N 66 5.560 -0.480 5.582 18478 32 1 6 "Average Difference" HA 94 0.679 0.036 0.682 18478 33 1 6 "Average Difference" C 78 2.563 -0.063 2.579 18478 34 1 6 "Average Difference" CA 89 2.537 -0.441 2.512 18478 35 1 6 "Average Difference" CB 73 2.243 -0.249 2.245 18478 36 1 6 "Average Difference" HN 66 0.898 -0.265 0.865 18478 37 1 7 "Average Difference" N 66 5.585 -0.278 5.621 18478 38 1 7 "Average Difference" HA 94 0.664 0.038 0.666 18478 39 1 7 "Average Difference" C 78 2.517 -0.018 2.534 18478 40 1 7 "Average Difference" CA 89 2.538 -0.405 2.520 18478 41 1 7 "Average Difference" CB 73 2.316 -0.264 2.317 18478 42 1 7 "Average Difference" HN 66 0.930 -0.262 0.899 18478 43 1 8 "Average Difference" N 66 5.602 -0.485 5.624 18478 44 1 8 "Average Difference" HA 94 0.676 0.036 0.678 18478 45 1 8 "Average Difference" C 78 2.552 -0.056 2.567 18478 46 1 8 "Average Difference" CA 89 2.545 -0.394 2.528 18478 47 1 8 "Average Difference" CB 73 2.261 -0.283 2.259 18478 48 1 8 "Average Difference" HN 66 0.912 -0.273 0.877 18478 49 1 9 "Average Difference" N 66 5.475 -0.416 5.501 18478 50 1 9 "Average Difference" HA 94 0.686 0.038 0.689 18478 51 1 9 "Average Difference" C 78 2.563 -0.030 2.580 18478 52 1 9 "Average Difference" CA 89 2.529 -0.393 2.512 18478 53 1 9 "Average Difference" CB 73 2.263 -0.308 2.257 18478 54 1 9 "Average Difference" HN 66 0.916 -0.294 0.874 18478 55 1 10 "Average Difference" N 66 5.252 -0.471 5.271 18478 56 1 10 "Average Difference" HA 94 0.677 0.052 0.679 18478 57 1 10 "Average Difference" C 78 2.592 -0.102 2.607 18478 58 1 10 "Average Difference" CA 89 2.555 -0.432 2.533 18478 59 1 10 "Average Difference" CB 73 2.369 -0.278 2.369 18478 60 1 10 "Average Difference" HN 66 0.928 -0.241 0.903 18478 61 1 11 "Average Difference" N 66 5.609 -0.508 5.628 18478 62 1 11 "Average Difference" HA 94 0.685 0.038 0.687 18478 63 1 11 "Average Difference" C 78 2.503 -0.045 2.519 18478 64 1 11 "Average Difference" CA 89 2.559 -0.418 2.539 18478 65 1 11 "Average Difference" CB 73 2.402 -0.308 2.398 18478 66 1 11 "Average Difference" HN 66 0.932 -0.304 0.887 18478 67 1 12 "Average Difference" N 66 5.478 -0.236 5.515 18478 68 1 12 "Average Difference" HA 94 0.688 0.039 0.691 18478 69 1 12 "Average Difference" C 78 2.594 -0.054 2.611 18478 70 1 12 "Average Difference" CA 89 2.547 -0.326 2.540 18478 71 1 12 "Average Difference" CB 73 2.254 -0.277 2.252 18478 72 1 12 "Average Difference" HN 66 0.918 -0.293 0.877 18478 73 1 13 "Average Difference" N 66 5.531 -0.354 5.562 18478 74 1 13 "Average Difference" HA 94 0.675 0.026 0.678 18478 75 1 13 "Average Difference" C 78 2.530 -0.036 2.546 18478 76 1 13 "Average Difference" CA 89 2.583 -0.338 2.575 18478 77 1 13 "Average Difference" CB 73 2.170 -0.296 2.165 18478 78 1 13 "Average Difference" HN 66 0.913 -0.260 0.881 18478 79 1 14 "Average Difference" N 66 5.464 -0.564 5.476 18478 80 1 14 "Average Difference" HA 94 0.702 0.036 0.705 18478 81 1 14 "Average Difference" C 78 2.580 -0.066 2.595 18478 82 1 14 "Average Difference" CA 89 2.551 -0.416 2.531 18478 83 1 14 "Average Difference" CB 73 2.262 -0.319 2.255 18478 84 1 14 "Average Difference" HN 66 0.919 -0.299 0.876 18478 85 1 15 "Average Difference" N 66 5.545 -0.387 5.574 18478 86 1 15 "Average Difference" HA 94 0.675 0.044 0.677 18478 87 1 15 "Average Difference" C 78 2.540 -0.080 2.556 18478 88 1 15 "Average Difference" CA 89 2.571 -0.477 2.541 18478 89 1 15 "Average Difference" CB 73 2.352 -0.185 2.361 18478 90 1 15 "Average Difference" HN 66 0.895 -0.267 0.861 18478 91 1 16 "Average Difference" N 66 5.501 -0.504 5.520 18478 92 1 16 "Average Difference" HA 94 0.701 0.014 0.705 18478 93 1 16 "Average Difference" C 78 2.553 -0.089 2.568 18478 94 1 16 "Average Difference" CA 89 2.582 -0.395 2.566 18478 95 1 16 "Average Difference" CB 73 2.217 -0.295 2.212 18478 96 1 16 "Average Difference" HN 66 0.917 -0.293 0.876 18478 97 1 17 "Average Difference" N 66 5.424 -0.338 5.455 18478 98 1 17 "Average Difference" HA 94 0.695 0.042 0.698 18478 99 1 17 "Average Difference" C 78 2.542 -0.064 2.557 18478 100 1 17 "Average Difference" CA 89 2.560 -0.430 2.538 18478 101 1 17 "Average Difference" CB 73 2.328 -0.310 2.323 18478 102 1 17 "Average Difference" HN 66 0.918 -0.297 0.876 18478 103 1 18 "Average Difference" N 66 5.587 -0.292 5.622 18478 104 1 18 "Average Difference" HA 94 0.662 0.032 0.664 18478 105 1 18 "Average Difference" C 78 2.563 -0.057 2.579 18478 106 1 18 "Average Difference" CA 89 2.559 -0.399 2.542 18478 107 1 18 "Average Difference" CB 73 2.280 -0.315 2.274 18478 108 1 18 "Average Difference" HN 66 0.906 -0.229 0.884 18478 109 1 19 "Average Difference" N 66 5.486 -0.204 5.524 18478 110 1 19 "Average Difference" HA 94 0.681 0.030 0.684 18478 111 1 19 "Average Difference" C 78 2.632 -0.047 2.649 18478 112 1 19 "Average Difference" CA 89 2.634 -0.384 2.621 18478 113 1 19 "Average Difference" CB 73 2.342 -0.275 2.342 18478 114 1 19 "Average Difference" HN 66 0.915 -0.249 0.888 18478 115 1 20 "Average Difference" N 66 5.565 -0.406 5.592 18478 116 1 20 "Average Difference" HA 94 0.693 0.051 0.694 18478 117 1 20 "Average Difference" C 78 2.502 -0.013 2.518 18478 118 1 20 "Average Difference" CA 89 2.538 -0.355 2.528 18478 119 1 20 "Average Difference" CB 73 2.329 -0.282 2.328 18478 120 1 20 "Average Difference" HN 66 0.896 -0.268 0.862 18478 stop_ save_ save_delta_chem_shifts_average _Entity_delta_chem_shifts.Sf_category delta_chem_shifts _Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_average _Entity_delta_chem_shifts.Model_type average _Entity_delta_chem_shifts.Entry_ID 18478 _Entity_delta_chem_shifts.ID 2 _Entity_delta_chem_shifts.Details ; This saveframe contains the averaged SPARTA chemical shift over all the models used. ; loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 . 1 1 3 3 GLY C C 3 177.088 177.088 172.726 4.362 18478 2 1 . 1 1 3 3 GLY CA C 3 45.330 45.330 44.676 0.654 18478 3 1 . 1 1 4 4 SER N N 4 115.847 115.847 113.118 2.729 18478 4 1 . 1 1 4 4 SER HA H 4 4.480 4.480 4.691 -0.211 18478 5 1 . 1 1 4 4 SER C C 4 177.991 177.991 172.269 5.722 18478 6 1 . 1 1 4 4 SER CA C 4 58.742 58.742 58.243 0.499 18478 7 1 . 1 1 4 4 SER CB C 4 63.820 63.820 65.122 -1.302 18478 8 1 . 1 1 4 4 SER H H 4 8.207 8.207 7.689 0.518 18478 9 1 . 1 1 5 5 MET N N 5 125.867 125.867 121.854 4.013 18478 10 1 . 1 1 5 5 MET HA H 5 4.580 4.580 4.636 -0.056 18478 11 1 . 1 1 5 5 MET C C 5 174.825 174.825 176.042 -1.216 18478 12 1 . 1 1 5 5 MET CA C 5 54.733 54.733 54.411 0.322 18478 13 1 . 1 1 5 5 MET CB C 5 33.527 33.527 35.474 -1.947 18478 14 1 . 1 1 5 5 MET H H 5 8.148 8.148 8.703 -0.555 18478 15 1 . 1 1 6 6 THR N N 6 115.828 115.828 115.502 0.326 18478 16 1 . 1 1 6 6 THR HA H 6 3.903 3.903 4.485 -0.582 18478 17 1 . 1 1 6 6 THR C C 6 176.930 176.930 172.948 3.982 18478 18 1 . 1 1 6 6 THR CA C 6 63.034 63.034 60.888 2.146 18478 19 1 . 1 1 6 6 THR CB C 6 69.308 69.308 68.600 0.708 18478 20 1 . 1 1 6 6 THR H H 6 8.408 8.408 8.449 -0.041 18478 21 1 . 1 1 7 7 ARG HA H 7 4.276 4.276 4.257 0.019 18478 22 1 . 1 1 7 7 ARG C C 7 176.546 176.546 176.326 0.220 18478 23 1 . 1 1 7 7 ARG CA C 7 55.813 55.813 56.358 -0.545 18478 24 1 . 1 1 7 7 ARG CB C 7 30.556 30.556 30.626 -0.070 18478 25 1 . 1 1 8 8 ASP N N 8 121.762 121.762 124.480 -2.718 18478 26 1 . 1 1 8 8 ASP HA H 8 4.537 4.537 4.184 0.353 18478 27 1 . 1 1 8 8 ASP C C 8 177.750 177.750 175.160 2.590 18478 28 1 . 1 1 8 8 ASP CA C 8 54.117 54.117 54.645 -0.528 18478 29 1 . 1 1 8 8 ASP H H 8 8.066 8.066 8.506 -0.440 18478 30 1 . 1 1 9 9 PHE N N 9 119.991 119.991 119.417 0.574 18478 31 1 . 1 1 9 9 PHE HA H 9 4.734 4.734 4.925 -0.191 18478 32 1 . 1 1 9 9 PHE C C 9 176.838 176.838 175.110 1.728 18478 33 1 . 1 1 9 9 PHE CA C 9 58.303 58.303 57.515 0.788 18478 34 1 . 1 1 9 9 PHE CB C 9 41.594 41.594 40.958 0.636 18478 35 1 . 1 1 9 9 PHE H H 9 8.103 8.103 7.610 0.493 18478 36 1 . 1 1 10 10 LYS N N 10 122.957 122.957 123.925 -0.967 18478 37 1 . 1 1 10 10 LYS CA C 10 53.167 53.167 55.837 -2.670 18478 38 1 . 1 1 10 10 LYS CB C 10 33.495 33.495 32.141 1.354 18478 39 1 . 1 1 10 10 LYS H H 10 9.087 9.087 8.731 0.356 18478 40 1 . 1 1 11 11 PRO HA H 11 3.903 3.903 4.998 -1.095 18478 41 1 . 1 1 11 11 PRO C C 11 173.988 173.988 174.760 -0.772 18478 42 1 . 1 1 11 11 PRO CA C 11 63.874 63.874 61.028 2.846 18478 43 1 . 1 1 11 11 PRO CB C 11 31.623 31.623 34.959 -3.336 18478 44 1 . 1 1 12 12 GLY N N 12 115.413 115.413 110.940 4.473 18478 45 1 . 1 1 12 12 GLY C C 12 176.966 176.966 172.540 4.426 18478 46 1 . 1 1 12 12 GLY CA C 12 44.651 44.651 42.192 2.459 18478 47 1 . 1 1 12 12 GLY H H 12 9.667 9.667 8.936 0.731 18478 48 1 . 1 1 13 13 ASP N N 13 122.208 122.208 128.444 -6.236 18478 49 1 . 1 1 13 13 ASP HA H 13 4.601 4.601 4.831 -0.230 18478 50 1 . 1 1 13 13 ASP C C 13 176.244 176.244 174.425 1.819 18478 51 1 . 1 1 13 13 ASP CA C 13 55.870 55.870 52.079 3.791 18478 52 1 . 1 1 13 13 ASP CB C 13 40.794 40.794 42.806 -2.012 18478 53 1 . 1 1 13 13 ASP H H 13 8.303 8.303 8.477 -0.174 18478 54 1 . 1 1 14 14 LEU N N 14 121.306 121.306 126.392 -5.086 18478 55 1 . 1 1 14 14 LEU HA H 14 4.982 4.982 4.610 0.372 18478 56 1 . 1 1 14 14 LEU C C 14 173.461 173.461 176.177 -2.716 18478 57 1 . 1 1 14 14 LEU CA C 14 54.516 54.516 53.671 0.845 18478 58 1 . 1 1 14 14 LEU CB C 14 40.999 40.999 42.007 -1.008 18478 59 1 . 1 1 14 14 LEU H H 14 8.618 8.618 7.794 0.824 18478 60 1 . 1 1 15 15 ILE N N 15 118.806 118.806 125.818 -7.012 18478 61 1 . 1 1 15 15 ILE HA H 15 5.356 5.356 4.279 1.077 18478 62 1 . 1 1 15 15 ILE C C 15 175.982 175.982 175.934 0.048 18478 63 1 . 1 1 15 15 ILE CA C 15 60.481 60.481 60.672 -0.191 18478 64 1 . 1 1 15 15 ILE CB C 15 44.142 44.142 39.759 4.383 18478 65 1 . 1 1 15 15 ILE H H 15 8.864 8.864 8.588 0.276 18478 66 1 . 1 1 16 16 PHE N N 16 112.472 112.472 124.311 -11.839 18478 67 1 . 1 1 16 16 PHE HA H 16 5.306 5.306 4.277 1.029 18478 68 1 . 1 1 16 16 PHE C C 16 176.239 176.239 176.204 0.035 18478 69 1 . 1 1 16 16 PHE CA C 16 58.603 58.603 59.292 -0.689 18478 70 1 . 1 1 16 16 PHE CB C 16 43.305 43.305 38.271 5.034 18478 71 1 . 1 1 16 16 PHE H H 16 9.411 9.411 8.725 0.686 18478 72 1 . 1 1 17 17 ALA N N 17 123.889 123.889 126.351 -2.462 18478 73 1 . 1 1 17 17 ALA HA H 17 5.348 5.348 3.678 1.670 18478 74 1 . 1 1 17 17 ALA C C 17 174.426 174.426 176.481 -2.055 18478 75 1 . 1 1 17 17 ALA CA C 17 50.062 50.062 51.659 -1.597 18478 76 1 . 1 1 17 17 ALA H H 17 9.658 9.658 8.520 1.138 18478 77 1 . 1 1 18 18 LYS N N 18 127.760 127.760 121.556 6.204 18478 78 1 . 1 1 18 18 LYS HA H 18 4.697 4.697 4.700 -0.003 18478 79 1 . 1 1 18 18 LYS C C 18 178.554 178.554 174.637 3.917 18478 80 1 . 1 1 18 18 LYS CA C 18 53.893 53.893 52.301 1.592 18478 81 1 . 1 1 18 18 LYS CB C 18 35.291 35.291 32.529 2.762 18478 82 1 . 1 1 18 18 LYS H H 18 9.421 9.421 7.525 1.895 18478 83 1 . 1 1 19 19 MET HA H 19 4.656 4.656 4.542 0.114 18478 84 1 . 1 1 19 19 MET C C 19 175.741 175.741 174.802 0.939 18478 85 1 . 1 1 19 19 MET CA C 19 53.916 53.916 54.766 -0.850 18478 86 1 . 1 1 19 19 MET CB C 19 35.799 35.799 33.538 2.261 18478 87 1 . 1 1 20 20 LYS N N 20 124.062 124.062 118.059 6.003 18478 88 1 . 1 1 20 20 LYS CA C 20 58.585 58.585 56.401 2.184 18478 89 1 . 1 1 20 20 LYS CB C 20 31.978 31.978 32.703 -0.725 18478 90 1 . 1 1 20 20 LYS H H 20 8.645 8.645 8.134 0.511 18478 91 1 . 1 1 21 21 GLY C C 21 176.205 176.205 172.228 3.977 18478 92 1 . 1 1 21 21 GLY CA C 21 45.142 45.142 42.052 3.090 18478 93 1 . 1 1 22 22 TYR HA H 22 4.573 4.573 4.748 -0.175 18478 94 1 . 1 1 22 22 TYR CA C 22 55.748 55.748 57.813 -2.066 18478 95 1 . 1 1 22 22 TYR CB C 22 41.331 41.331 38.135 3.196 18478 96 1 . 1 1 23 23 PRO HA H 23 4.759 4.759 4.976 -0.217 18478 97 1 . 1 1 23 23 PRO C C 23 174.587 174.587 175.175 -0.588 18478 98 1 . 1 1 23 23 PRO CA C 23 62.072 62.072 61.435 0.637 18478 99 1 . 1 1 23 23 PRO CB C 23 31.077 31.077 34.981 -3.905 18478 100 1 . 1 1 24 24 HIS N N 24 119.190 119.190 115.939 3.251 18478 101 1 . 1 1 24 24 HIS HA H 24 3.983 3.983 5.435 -1.452 18478 102 1 . 1 1 24 24 HIS C C 24 175.555 175.555 173.893 1.662 18478 103 1 . 1 1 24 24 HIS CA C 24 60.973 60.973 54.193 6.780 18478 104 1 . 1 1 24 24 HIS CB C 24 30.689 30.689 33.044 -2.355 18478 105 1 . 1 1 24 24 HIS H H 24 8.158 8.158 8.569 -0.411 18478 106 1 . 1 1 25 25 TRP N N 25 127.435 127.435 123.883 3.552 18478 107 1 . 1 1 25 25 TRP HA H 25 3.760 3.760 5.156 -1.396 18478 108 1 . 1 1 25 25 TRP CA C 25 55.890 55.890 57.686 -1.796 18478 109 1 . 1 1 25 25 TRP CB C 25 32.879 32.879 30.246 2.633 18478 110 1 . 1 1 25 25 TRP H H 25 9.211 9.211 8.736 0.475 18478 111 1 . 1 1 26 26 PRO HA H 26 4.217 4.217 4.604 -0.387 18478 112 1 . 1 1 26 26 PRO C C 26 176.279 176.279 176.035 0.244 18478 113 1 . 1 1 26 26 PRO CA C 26 63.140 63.140 61.705 1.435 18478 114 1 . 1 1 26 26 PRO CB C 26 32.171 32.171 34.495 -2.324 18478 115 1 . 1 1 27 27 ALA N N 27 130.162 130.162 123.962 6.200 18478 116 1 . 1 1 27 27 ALA HA H 27 4.981 4.981 4.336 0.645 18478 117 1 . 1 1 27 27 ALA C C 27 177.227 177.227 177.279 -0.052 18478 118 1 . 1 1 27 27 ALA CA C 27 52.574 52.574 51.276 1.298 18478 119 1 . 1 1 27 27 ALA CB C 27 23.239 23.239 20.112 3.127 18478 120 1 . 1 1 27 27 ALA H H 27 9.394 9.394 8.209 1.185 18478 121 1 . 1 1 28 28 ARG N N 28 117.381 117.381 119.327 -1.946 18478 122 1 . 1 1 28 28 ARG HA H 28 5.421 5.421 4.430 0.991 18478 123 1 . 1 1 28 28 ARG C C 28 176.465 176.465 175.415 1.050 18478 124 1 . 1 1 28 28 ARG CA C 28 53.662 53.662 54.768 -1.106 18478 125 1 . 1 1 28 28 ARG CB C 28 35.058 35.058 29.987 5.071 18478 126 1 . 1 1 28 28 ARG H H 28 8.806 8.806 8.446 0.360 18478 127 1 . 1 1 29 29 VAL HA H 29 4.109 4.109 4.255 -0.146 18478 128 1 . 1 1 29 29 VAL C C 29 175.996 175.996 174.688 1.308 18478 129 1 . 1 1 29 29 VAL CA C 29 62.810 62.810 61.666 1.143 18478 130 1 . 1 1 29 29 VAL CB C 29 31.108 31.108 32.632 -1.524 18478 131 1 . 1 1 30 30 ASP N N 30 133.830 133.830 118.575 15.255 18478 132 1 . 1 1 30 30 ASP HA H 30 5.198 5.198 4.621 0.577 18478 133 1 . 1 1 30 30 ASP C C 30 176.207 176.207 177.123 -0.916 18478 134 1 . 1 1 30 30 ASP CA C 30 53.007 53.007 54.159 -1.152 18478 135 1 . 1 1 30 30 ASP CB C 30 44.130 44.130 41.252 2.878 18478 136 1 . 1 1 30 30 ASP H H 30 8.892 8.892 8.428 0.464 18478 137 1 . 1 1 31 31 GLU N N 31 115.905 115.905 122.070 -6.165 18478 138 1 . 1 1 31 31 GLU HA H 31 4.409 4.409 3.974 0.435 18478 139 1 . 1 1 31 31 GLU C C 31 175.192 175.192 176.104 -0.912 18478 140 1 . 1 1 31 31 GLU CA C 31 55.389 55.389 56.516 -1.127 18478 141 1 . 1 1 31 31 GLU H H 31 7.966 7.966 8.899 -0.933 18478 142 1 . 1 1 32 32 VAL N N 32 122.794 122.794 117.278 5.516 18478 143 1 . 1 1 32 32 VAL HA H 32 4.303 4.303 3.766 0.537 18478 144 1 . 1 1 32 32 VAL CA C 32 60.408 60.408 62.781 -2.373 18478 145 1 . 1 1 32 32 VAL CB C 32 32.333 32.333 30.744 1.589 18478 146 1 . 1 1 32 32 VAL H H 32 8.702 8.702 8.009 0.693 18478 147 1 . 1 1 33 33 PRO HA H 33 4.572 4.572 4.197 0.375 18478 148 1 . 1 1 33 33 PRO C C 33 175.366 175.366 177.607 -2.241 18478 149 1 . 1 1 33 33 PRO CA C 33 63.702 63.702 65.176 -1.473 18478 150 1 . 1 1 33 33 PRO CB C 33 32.736 32.736 32.027 0.709 18478 151 1 . 1 1 34 34 ASP N N 34 119.187 119.187 117.817 1.370 18478 152 1 . 1 1 34 34 ASP HA H 34 4.679 4.679 4.891 -0.212 18478 153 1 . 1 1 34 34 ASP C C 34 175.713 175.713 173.823 1.890 18478 154 1 . 1 1 34 34 ASP CA C 34 53.013 53.013 52.360 0.653 18478 155 1 . 1 1 34 34 ASP CB C 34 40.850 40.850 40.890 -0.040 18478 156 1 . 1 1 34 34 ASP H H 34 8.686 8.686 7.931 0.755 18478 157 1 . 1 1 35 35 GLY C C 35 177.458 177.458 172.853 4.605 18478 158 1 . 1 1 35 35 GLY CA C 35 45.507 45.507 43.827 1.680 18478 159 1 . 1 1 36 36 ALA HA H 36 4.404 4.404 4.273 0.131 18478 160 1 . 1 1 36 36 ALA CA C 36 52.010 52.010 51.795 0.215 18478 161 1 . 1 1 36 36 ALA CB C 36 19.909 19.909 19.716 0.193 18478 162 1 . 1 1 37 37 VAL N N 37 119.594 119.594 122.441 -2.847 18478 163 1 . 1 1 37 37 VAL HA H 37 3.932 3.932 4.132 -0.200 18478 164 1 . 1 1 37 37 VAL C C 37 175.966 175.966 176.037 -0.071 18478 165 1 . 1 1 37 37 VAL CA C 37 62.810 62.810 63.817 -1.007 18478 166 1 . 1 1 37 37 VAL CB C 37 32.267 32.267 32.680 -0.413 18478 167 1 . 1 1 37 37 VAL H H 37 8.037 8.037 8.458 -0.421 18478 168 1 . 1 1 38 38 LYS N N 38 125.676 125.676 120.342 5.334 18478 169 1 . 1 1 38 38 LYS C C 38 173.865 173.865 174.788 -0.923 18478 170 1 . 1 1 38 38 LYS CA C 38 54.278 54.278 56.641 -2.363 18478 171 1 . 1 1 38 38 LYS CB C 38 31.740 31.740 33.746 -2.006 18478 172 1 . 1 1 38 38 LYS H H 38 8.292 8.292 8.397 -0.105 18478 173 1 . 1 1 40 40 PRO HA H 40 4.387 4.387 5.270 -0.883 18478 174 1 . 1 1 40 40 PRO C C 40 175.535 175.535 175.293 0.243 18478 175 1 . 1 1 40 40 PRO CA C 40 62.330 62.330 59.477 2.853 18478 176 1 . 1 1 40 40 PRO CB C 40 32.086 32.086 31.955 0.131 18478 177 1 . 1 1 41 41 THR HA H 41 4.027 4.027 4.523 -0.496 18478 178 1 . 1 1 41 41 THR C C 41 176.795 176.795 173.124 3.671 18478 179 1 . 1 1 41 41 THR CA C 41 63.693 63.693 62.239 1.454 18478 180 1 . 1 1 41 41 THR CB C 41 69.370 69.370 68.960 0.410 18478 181 1 . 1 1 42 42 ASN N N 42 118.513 118.513 121.941 -3.428 18478 182 1 . 1 1 42 42 ASN HA H 42 4.530 4.530 5.178 -0.648 18478 183 1 . 1 1 42 42 ASN C C 42 177.230 177.230 174.830 2.400 18478 184 1 . 1 1 42 42 ASN CA C 42 56.373 56.373 50.380 5.993 18478 185 1 . 1 1 42 42 ASN CB C 42 37.618 37.618 37.960 -0.342 18478 186 1 . 1 1 42 42 ASN H H 42 8.752 8.752 8.715 0.037 18478 187 1 . 1 1 43 43 LYS N N 43 115.898 115.898 128.825 -12.927 18478 188 1 . 1 1 43 43 LYS HA H 43 4.710 4.710 4.683 0.027 18478 189 1 . 1 1 43 43 LYS C C 43 177.032 177.032 175.963 1.069 18478 190 1 . 1 1 43 43 LYS CA C 43 54.957 54.957 55.045 -0.088 18478 191 1 . 1 1 43 43 LYS CB C 43 36.600 36.600 32.922 3.678 18478 192 1 . 1 1 43 43 LYS H H 43 7.723 7.723 8.823 -1.100 18478 193 1 . 1 1 44 44 LEU N N 44 121.006 121.006 128.968 -7.962 18478 194 1 . 1 1 44 44 LEU HA H 44 5.000 5.000 4.336 0.664 18478 195 1 . 1 1 44 44 LEU CA C 44 51.842 51.842 54.949 -3.107 18478 196 1 . 1 1 44 44 LEU CB C 44 44.418 44.418 41.341 3.077 18478 197 1 . 1 1 44 44 LEU H H 44 9.063 9.063 8.620 0.443 18478 198 1 . 1 1 45 45 PRO HA H 45 4.392 4.392 4.484 -0.091 18478 199 1 . 1 1 45 45 PRO C C 45 177.051 177.051 178.214 -1.163 18478 200 1 . 1 1 45 45 PRO CA C 45 62.000 62.000 64.547 -2.547 18478 201 1 . 1 1 45 45 PRO CB C 45 30.737 30.737 32.531 -1.794 18478 202 1 . 1 1 46 46 ILE N N 46 125.996 125.996 124.855 1.141 18478 203 1 . 1 1 46 46 ILE HA H 46 4.564 4.564 3.827 0.737 18478 204 1 . 1 1 46 46 ILE C C 46 176.985 176.985 176.146 0.839 18478 205 1 . 1 1 46 46 ILE CA C 46 57.051 57.051 62.613 -5.562 18478 206 1 . 1 1 46 46 ILE H H 46 8.908 8.908 8.790 0.118 18478 207 1 . 1 1 47 47 PHE N N 47 128.276 128.276 118.403 9.873 18478 208 1 . 1 1 47 47 PHE HA H 47 4.827 4.827 4.279 0.548 18478 209 1 . 1 1 47 47 PHE C C 47 177.835 177.835 176.132 1.703 18478 210 1 . 1 1 47 47 PHE CA C 47 56.099 56.099 57.885 -1.786 18478 211 1 . 1 1 47 47 PHE CB C 47 41.217 41.217 40.227 0.990 18478 212 1 . 1 1 47 47 PHE H H 47 8.739 8.739 7.562 1.177 18478 213 1 . 1 1 48 48 PHE N N 48 125.953 125.953 118.205 7.748 18478 214 1 . 1 1 48 48 PHE HA H 48 4.251 4.251 4.172 0.079 18478 215 1 . 1 1 48 48 PHE C C 48 175.869 175.869 174.319 1.550 18478 216 1 . 1 1 48 48 PHE CA C 48 56.744 56.744 59.593 -2.849 18478 217 1 . 1 1 48 48 PHE CB C 48 38.835 38.835 36.824 2.011 18478 218 1 . 1 1 48 48 PHE H H 48 8.545 8.545 7.922 0.623 18478 219 1 . 1 1 49 49 PHE N N 49 122.197 122.197 117.840 4.357 18478 220 1 . 1 1 49 49 PHE HA H 49 4.400 4.400 4.533 -0.133 18478 221 1 . 1 1 49 49 PHE C C 49 174.016 174.016 174.506 -0.490 18478 222 1 . 1 1 49 49 PHE CA C 49 59.916 59.916 56.448 3.468 18478 223 1 . 1 1 49 49 PHE CB C 49 39.799 39.799 41.010 -1.210 18478 224 1 . 1 1 49 49 PHE H H 49 8.619 8.619 7.459 1.160 18478 225 1 . 1 1 50 50 GLY N N 50 114.083 114.083 107.783 6.300 18478 226 1 . 1 1 50 50 GLY C C 50 175.636 175.636 173.258 2.378 18478 227 1 . 1 1 50 50 GLY CA C 50 46.718 46.718 43.877 2.841 18478 228 1 . 1 1 50 50 GLY H H 50 10.329 10.329 8.082 2.247 18478 229 1 . 1 1 51 51 THR N N 51 111.210 111.210 119.218 -8.008 18478 230 1 . 1 1 51 51 THR HA H 51 3.980 3.980 4.582 -0.602 18478 231 1 . 1 1 51 51 THR C C 51 175.588 175.588 171.990 3.598 18478 232 1 . 1 1 51 51 THR CA C 51 62.223 62.223 61.173 1.050 18478 233 1 . 1 1 51 51 THR CB C 51 68.346 68.346 72.237 -3.891 18478 234 1 . 1 1 51 51 THR H H 51 7.882 7.882 8.502 -0.620 18478 235 1 . 1 1 52 52 HIS N N 52 115.544 115.544 120.256 -4.712 18478 236 1 . 1 1 52 52 HIS HA H 52 3.712 3.712 5.417 -1.705 18478 237 1 . 1 1 52 52 HIS C C 52 177.717 177.717 175.177 2.540 18478 238 1 . 1 1 52 52 HIS CA C 52 54.860 54.860 54.516 0.344 18478 239 1 . 1 1 52 52 HIS CB C 52 26.388 26.388 30.327 -3.939 18478 240 1 . 1 1 52 52 HIS H H 52 7.791 7.791 8.553 -0.762 18478 241 1 . 1 1 53 53 GLU N N 53 117.517 117.517 123.001 -5.484 18478 242 1 . 1 1 53 53 GLU HA H 53 4.298 4.298 4.769 -0.471 18478 243 1 . 1 1 53 53 GLU C C 53 176.958 176.958 176.579 0.379 18478 244 1 . 1 1 53 53 GLU CA C 53 55.403 55.403 55.273 0.130 18478 245 1 . 1 1 53 53 GLU CB C 53 31.588 31.588 33.289 -1.701 18478 246 1 . 1 1 53 53 GLU H H 53 6.795 6.795 8.484 -1.689 18478 247 1 . 1 1 54 54 THR N N 54 111.182 111.182 116.881 -5.699 18478 248 1 . 1 1 54 54 THR HA H 54 5.648 5.648 4.352 1.296 18478 249 1 . 1 1 54 54 THR C C 54 177.234 177.234 174.288 2.946 18478 250 1 . 1 1 54 54 THR CA C 54 59.894 59.894 61.377 -1.482 18478 251 1 . 1 1 54 54 THR H H 54 8.139 8.139 8.765 -0.626 18478 252 1 . 1 1 55 55 ALA HA H 55 4.403 4.403 4.178 0.225 18478 253 1 . 1 1 55 55 ALA C C 55 176.601 176.601 177.978 -1.377 18478 254 1 . 1 1 55 55 ALA CA C 55 51.079 51.079 53.121 -2.042 18478 255 1 . 1 1 55 55 ALA CB C 55 23.285 23.285 19.076 4.210 18478 256 1 . 1 1 56 56 PHE N N 56 118.058 118.058 113.783 4.275 18478 257 1 . 1 1 56 56 PHE HA H 56 5.678 5.678 4.582 1.096 18478 258 1 . 1 1 56 56 PHE C C 56 175.962 175.962 175.083 0.879 18478 259 1 . 1 1 56 56 PHE CA C 56 56.008 56.008 58.959 -2.951 18478 260 1 . 1 1 56 56 PHE CB C 56 39.995 39.995 37.727 2.268 18478 261 1 . 1 1 56 56 PHE H H 56 8.523 8.523 8.257 0.266 18478 262 1 . 1 1 57 57 LEU N N 57 123.344 123.344 120.500 2.844 18478 263 1 . 1 1 57 57 LEU HA H 57 4.929 4.929 4.688 0.241 18478 264 1 . 1 1 57 57 LEU C C 57 175.584 175.584 174.891 0.693 18478 265 1 . 1 1 57 57 LEU CA C 57 53.463 53.463 55.036 -1.573 18478 266 1 . 1 1 57 57 LEU CB C 57 46.545 46.545 43.882 2.663 18478 267 1 . 1 1 57 57 LEU H H 57 8.579 8.579 7.640 0.939 18478 268 1 . 1 1 58 58 GLY N N 58 108.499 108.499 107.199 1.300 18478 269 1 . 1 1 58 58 GLY CA C 58 43.755 43.755 44.448 -0.693 18478 270 1 . 1 1 58 58 GLY H H 58 9.318 9.318 7.281 2.036 18478 271 1 . 1 1 59 59 PRO HA H 59 4.048 4.048 4.935 -0.887 18478 272 1 . 1 1 59 59 PRO C C 59 173.763 173.763 174.699 -0.936 18478 273 1 . 1 1 59 59 PRO CA C 59 64.770 64.770 60.454 4.315 18478 274 1 . 1 1 59 59 PRO CB C 59 31.889 31.889 35.721 -3.832 18478 275 1 . 1 1 60 60 LYS HA H 60 4.191 4.191 4.572 -0.381 18478 276 1 . 1 1 60 60 LYS C C 60 174.842 174.842 176.570 -1.728 18478 277 1 . 1 1 60 60 LYS CA C 60 57.875 57.875 56.091 1.784 18478 278 1 . 1 1 60 60 LYS CB C 60 31.576 31.576 32.751 -1.175 18478 279 1 . 1 1 61 61 ASP N N 61 117.768 117.768 123.550 -5.782 18478 280 1 . 1 1 61 61 ASP HA H 61 4.973 4.973 4.321 0.653 18478 281 1 . 1 1 61 61 ASP C C 61 178.178 178.178 177.090 1.088 18478 282 1 . 1 1 61 61 ASP CA C 61 54.687 54.687 55.881 -1.194 18478 283 1 . 1 1 61 61 ASP CB C 61 43.555 43.555 39.544 4.011 18478 284 1 . 1 1 61 61 ASP H H 61 7.722 7.722 8.817 -1.095 18478 285 1 . 1 1 62 62 ILE N N 62 114.244 114.244 120.953 -6.709 18478 286 1 . 1 1 62 62 ILE HA H 62 4.891 4.891 3.392 1.499 18478 287 1 . 1 1 62 62 ILE C C 62 178.027 178.027 177.453 0.574 18478 288 1 . 1 1 62 62 ILE CA C 62 59.994 59.994 63.887 -3.893 18478 289 1 . 1 1 62 62 ILE CB C 62 40.652 40.652 37.001 3.651 18478 290 1 . 1 1 62 62 ILE H H 62 6.784 6.784 7.691 -0.907 18478 291 1 . 1 1 63 63 PHE N N 63 119.819 119.819 119.789 0.030 18478 292 1 . 1 1 63 63 PHE HA H 63 5.214 5.214 4.259 0.955 18478 293 1 . 1 1 63 63 PHE CA C 63 54.735 54.735 60.021 -5.286 18478 294 1 . 1 1 63 63 PHE CB C 63 42.122 42.122 38.811 3.311 18478 295 1 . 1 1 63 63 PHE H H 63 8.734 8.734 7.646 1.088 18478 296 1 . 1 1 64 64 PRO HA H 64 4.771 4.771 4.341 0.430 18478 297 1 . 1 1 64 64 PRO C C 64 174.036 174.036 178.477 -4.441 18478 298 1 . 1 1 64 64 PRO CA C 64 64.474 64.474 64.383 0.091 18478 299 1 . 1 1 64 64 PRO CB C 64 32.662 32.662 33.078 -0.416 18478 300 1 . 1 1 65 65 TYR N N 65 124.335 124.335 121.667 2.668 18478 301 1 . 1 1 65 65 TYR HA H 65 4.530 4.530 4.314 0.216 18478 302 1 . 1 1 65 65 TYR C C 65 173.944 173.944 177.415 -3.472 18478 303 1 . 1 1 65 65 TYR CA C 65 61.205 61.205 60.954 0.251 18478 304 1 . 1 1 65 65 TYR CB C 65 38.844 38.844 38.087 0.757 18478 305 1 . 1 1 65 65 TYR H H 65 8.359 8.359 7.893 0.466 18478 306 1 . 1 1 66 66 SER N N 66 114.836 114.836 112.235 2.601 18478 307 1 . 1 1 66 66 SER HA H 66 3.505 3.505 4.364 -0.859 18478 308 1 . 1 1 66 66 SER C C 66 173.697 173.697 175.451 -1.754 18478 309 1 . 1 1 66 66 SER CA C 66 63.078 63.078 59.666 3.412 18478 310 1 . 1 1 66 66 SER CB C 66 62.223 62.223 62.970 -0.747 18478 311 1 . 1 1 66 66 SER H H 66 8.974 8.974 7.694 1.280 18478 312 1 . 1 1 67 67 GLU N N 67 118.013 118.013 118.627 -0.614 18478 313 1 . 1 1 67 67 GLU HA H 67 4.210 4.210 4.165 0.045 18478 314 1 . 1 1 67 67 GLU C C 67 174.961 174.961 177.511 -2.550 18478 315 1 . 1 1 67 67 GLU CA C 67 58.330 58.330 57.875 0.455 18478 316 1 . 1 1 67 67 GLU CB C 67 30.205 30.205 30.940 -0.735 18478 317 1 . 1 1 67 67 GLU H H 67 8.817 8.817 7.880 0.937 18478 318 1 . 1 1 68 68 ASN N N 68 113.942 113.942 111.443 2.499 18478 319 1 . 1 1 68 68 ASN HA H 68 5.015 5.015 5.024 -0.009 18478 320 1 . 1 1 68 68 ASN C C 68 176.626 176.626 176.267 0.359 18478 321 1 . 1 1 68 68 ASN CA C 68 53.768 53.768 51.646 2.122 18478 322 1 . 1 1 68 68 ASN CB C 68 41.948 41.948 39.389 2.559 18478 323 1 . 1 1 68 68 ASN H H 68 7.448 7.448 7.747 -0.299 18478 324 1 . 1 1 69 69 LYS N N 69 124.584 124.584 121.145 3.439 18478 325 1 . 1 1 69 69 LYS HA H 69 3.794 3.794 3.951 -0.157 18478 326 1 . 1 1 69 69 LYS C C 69 173.330 173.330 175.186 -1.856 18478 327 1 . 1 1 69 69 LYS CA C 69 61.225 61.225 57.378 3.847 18478 328 1 . 1 1 69 69 LYS H H 69 7.592 7.592 8.586 -0.994 18478 329 1 . 1 1 70 70 GLU N N 70 118.408 118.408 117.834 0.574 18478 330 1 . 1 1 70 70 GLU HA H 70 4.005 4.005 4.814 -0.809 18478 331 1 . 1 1 70 70 GLU C C 70 174.588 174.588 173.583 1.005 18478 332 1 . 1 1 70 70 GLU CA C 70 58.695 58.695 52.984 5.711 18478 333 1 . 1 1 70 70 GLU CB C 70 28.928 28.928 30.948 -2.020 18478 334 1 . 1 1 70 70 GLU H H 70 8.478 8.478 8.087 0.391 18478 335 1 . 1 1 71 71 LYS HA H 71 3.847 3.847 4.389 -0.542 18478 336 1 . 1 1 71 71 LYS C C 71 173.420 173.420 175.433 -2.013 18478 337 1 . 1 1 71 71 LYS CA C 71 58.718 58.718 55.583 3.135 18478 338 1 . 1 1 71 71 LYS CB C 71 32.964 32.964 33.930 -0.966 18478 339 1 . 1 1 72 72 TYR N N 72 112.358 112.358 122.567 -10.209 18478 340 1 . 1 1 72 72 TYR HA H 72 4.790 4.790 4.300 0.490 18478 341 1 . 1 1 72 72 TYR C C 72 174.442 174.442 175.920 -1.478 18478 342 1 . 1 1 72 72 TYR CA C 72 55.287 55.287 59.278 -3.991 18478 343 1 . 1 1 72 72 TYR CB C 72 37.244 37.244 38.804 -1.560 18478 344 1 . 1 1 72 72 TYR H H 72 7.341 7.341 8.381 -1.040 18478 345 1 . 1 1 73 73 GLY N N 73 110.612 110.612 107.878 2.734 18478 346 1 . 1 1 73 73 GLY C C 73 177.982 177.982 173.438 4.544 18478 347 1 . 1 1 73 73 GLY CA C 73 46.623 46.623 44.413 2.210 18478 348 1 . 1 1 73 73 GLY H H 73 8.076 8.076 8.185 -0.109 18478 349 1 . 1 1 74 74 LYS N N 74 121.009 121.009 120.576 0.433 18478 350 1 . 1 1 74 74 LYS CA C 74 53.465 53.465 54.094 -0.629 18478 351 1 . 1 1 74 74 LYS CB C 74 32.440 32.440 33.017 -0.577 18478 352 1 . 1 1 74 74 LYS H H 74 7.411 7.411 7.895 -0.484 18478 353 1 . 1 1 75 75 PRO HA H 75 4.452 4.452 4.317 0.135 18478 354 1 . 1 1 75 75 PRO C C 75 174.959 174.959 178.052 -3.093 18478 355 1 . 1 1 75 75 PRO CA C 75 62.861 62.861 64.437 -1.576 18478 356 1 . 1 1 75 75 PRO CB C 75 32.407 32.407 31.769 0.638 18478 357 1 . 1 1 76 76 ASN N N 76 121.045 121.045 120.027 1.018 18478 358 1 . 1 1 76 76 ASN HA H 76 4.445 4.445 4.429 0.016 18478 359 1 . 1 1 76 76 ASN C C 76 174.145 174.145 174.760 -0.615 18478 360 1 . 1 1 76 76 ASN CA C 76 55.701 55.701 52.837 2.864 18478 361 1 . 1 1 76 76 ASN H H 76 8.474 8.474 8.885 -0.411 18478 362 1 . 1 1 77 77 LYS N N 77 111.466 111.466 120.631 -9.165 18478 363 1 . 1 1 77 77 LYS HA H 77 4.369 4.369 4.214 0.155 18478 364 1 . 1 1 77 77 LYS C C 77 173.881 173.881 176.429 -2.548 18478 365 1 . 1 1 77 77 LYS CA C 77 55.995 55.995 56.269 -0.274 18478 366 1 . 1 1 77 77 LYS CB C 77 32.538 32.538 32.397 0.141 18478 367 1 . 1 1 77 77 LYS H H 77 8.543 8.543 7.905 0.638 18478 368 1 . 1 1 78 78 ARG N N 78 122.233 122.233 120.205 2.028 18478 369 1 . 1 1 78 78 ARG HA H 78 4.286 4.286 4.011 0.275 18478 370 1 . 1 1 78 78 ARG C C 78 173.652 173.652 174.693 -1.041 18478 371 1 . 1 1 78 78 ARG CA C 78 55.780 55.780 57.353 -1.573 18478 372 1 . 1 1 78 78 ARG CB C 78 29.554 29.554 29.434 0.120 18478 373 1 . 1 1 78 78 ARG H H 78 8.864 8.864 8.768 0.096 18478 374 1 . 1 1 79 79 LYS N N 79 128.197 128.197 119.105 9.092 18478 375 1 . 1 1 79 79 LYS HA H 79 4.221 4.221 4.508 -0.287 18478 376 1 . 1 1 79 79 LYS C C 79 174.336 174.336 175.659 -1.323 18478 377 1 . 1 1 79 79 LYS CA C 79 58.986 58.986 55.724 3.262 18478 378 1 . 1 1 79 79 LYS CB C 79 32.072 32.072 33.032 -0.960 18478 379 1 . 1 1 79 79 LYS H H 79 8.927 8.927 8.059 0.868 18478 380 1 . 1 1 80 80 GLY N N 80 114.730 114.730 109.703 5.027 18478 381 1 . 1 1 80 80 GLY C C 80 176.536 176.536 174.894 1.642 18478 382 1 . 1 1 80 80 GLY CA C 80 45.992 45.992 45.681 0.311 18478 383 1 . 1 1 80 80 GLY H H 80 8.943 8.943 8.425 0.518 18478 384 1 . 1 1 81 81 PHE N N 81 123.770 123.770 119.211 4.559 18478 385 1 . 1 1 81 81 PHE HA H 81 3.336 3.336 4.323 -0.987 18478 386 1 . 1 1 81 81 PHE C C 81 174.037 174.037 176.281 -2.244 18478 387 1 . 1 1 81 81 PHE CA C 81 63.094 63.094 59.753 3.341 18478 388 1 . 1 1 81 81 PHE CB C 81 39.823 39.823 38.690 1.133 18478 389 1 . 1 1 81 81 PHE H H 81 8.281 8.281 8.082 0.199 18478 390 1 . 1 1 82 82 ASN N N 82 119.812 119.812 116.894 2.918 18478 391 1 . 1 1 82 82 ASN HA H 82 4.458 4.458 4.345 0.113 18478 392 1 . 1 1 82 82 ASN C C 82 171.290 171.290 176.524 -5.234 18478 393 1 . 1 1 82 82 ASN CA C 82 56.060 56.060 56.136 -0.076 18478 394 1 . 1 1 82 82 ASN CB C 82 36.390 36.390 38.456 -2.066 18478 395 1 . 1 1 82 82 ASN H H 82 9.145 9.145 8.455 0.690 18478 396 1 . 1 1 83 83 GLU N N 83 124.411 124.411 118.663 5.748 18478 397 1 . 1 1 83 83 GLU HA H 83 4.186 4.186 4.049 0.137 18478 398 1 . 1 1 83 83 GLU C C 83 172.222 172.222 178.711 -6.489 18478 399 1 . 1 1 83 83 GLU CA C 83 60.922 60.922 59.283 1.639 18478 400 1 . 1 1 83 83 GLU CB C 83 28.132 28.132 29.680 -1.548 18478 401 1 . 1 1 83 83 GLU H H 83 9.560 9.560 8.009 1.551 18478 402 1 . 1 1 84 84 GLY N N 84 111.388 111.388 106.660 4.728 18478 403 1 . 1 1 84 84 GLY C C 84 176.445 176.445 174.617 1.828 18478 404 1 . 1 1 84 84 GLY CA C 84 46.727 46.727 46.584 0.143 18478 405 1 . 1 1 84 84 GLY H H 84 8.364 8.364 7.324 1.040 18478 406 1 . 1 1 85 85 LEU N N 85 121.153 121.153 120.486 0.667 18478 407 1 . 1 1 85 85 LEU HA H 85 4.236 4.236 4.262 -0.026 18478 408 1 . 1 1 85 85 LEU C C 85 172.285 172.285 177.741 -5.456 18478 409 1 . 1 1 85 85 LEU CA C 85 56.795 56.795 56.784 0.011 18478 410 1 . 1 1 85 85 LEU CB C 85 41.113 41.113 42.940 -1.827 18478 411 1 . 1 1 85 85 LEU H H 85 8.294 8.294 7.537 0.757 18478 412 1 . 1 1 86 86 TRP N N 86 118.898 118.898 118.690 0.208 18478 413 1 . 1 1 86 86 TRP HA H 86 4.161 4.161 4.306 -0.145 18478 414 1 . 1 1 86 86 TRP C C 86 171.741 171.741 176.320 -4.579 18478 415 1 . 1 1 86 86 TRP CA C 86 62.153 62.153 58.481 3.672 18478 416 1 . 1 1 86 86 TRP CB C 86 28.424 28.424 29.662 -1.238 18478 417 1 . 1 1 86 86 TRP H H 86 7.783 7.783 7.488 0.295 18478 418 1 . 1 1 87 87 GLU N N 87 120.718 120.718 119.290 1.428 18478 419 1 . 1 1 87 87 GLU HA H 87 3.416 3.416 4.705 -1.289 18478 420 1 . 1 1 87 87 GLU C C 87 172.957 172.957 175.000 -2.043 18478 421 1 . 1 1 87 87 GLU CA C 87 60.122 60.122 53.242 6.880 18478 422 1 . 1 1 87 87 GLU CB C 87 31.021 31.021 30.477 0.544 18478 423 1 . 1 1 87 87 GLU H H 87 8.779 8.779 7.534 1.245 18478 424 1 . 1 1 88 88 ILE HA H 88 2.478 2.478 4.243 -1.765 18478 425 1 . 1 1 88 88 ILE C C 88 177.873 177.873 177.215 0.658 18478 426 1 . 1 1 88 88 ILE CA C 88 65.248 65.248 62.337 2.911 18478 427 1 . 1 1 88 88 ILE CB C 88 37.327 37.327 38.434 -1.107 18478 428 1 . 1 1 89 89 ASP N N 89 114.411 114.411 118.749 -4.338 18478 429 1 . 1 1 89 89 ASP HA H 89 4.589 4.589 4.488 0.101 18478 430 1 . 1 1 89 89 ASP C C 89 174.207 174.207 177.680 -3.473 18478 431 1 . 1 1 89 89 ASP CA C 89 54.740 54.740 56.426 -1.686 18478 432 1 . 1 1 89 89 ASP CB C 89 42.473 42.473 40.166 2.307 18478 433 1 . 1 1 89 89 ASP H H 89 5.911 5.911 8.013 -2.102 18478 434 1 . 1 1 90 90 ASN N N 90 114.358 114.358 113.758 0.600 18478 435 1 . 1 1 90 90 ASN HA H 90 4.420 4.420 4.415 0.005 18478 436 1 . 1 1 90 90 ASN C C 90 176.991 176.991 177.350 -0.359 18478 437 1 . 1 1 90 90 ASN CA C 90 54.855 54.855 56.434 -1.579 18478 438 1 . 1 1 90 90 ASN CB C 90 40.582 40.582 38.032 2.550 18478 439 1 . 1 1 90 90 ASN H H 90 7.480 7.480 7.752 -0.273 18478 440 1 . 1 1 91 91 ASN N N 91 119.185 119.185 115.670 3.515 18478 441 1 . 1 1 91 91 ASN HA H 91 5.006 5.006 5.006 -0.000 18478 442 1 . 1 1 91 91 ASN CA C 91 51.624 51.624 54.378 -2.754 18478 443 1 . 1 1 91 91 ASN CB C 91 38.752 38.752 38.633 0.119 18478 444 1 . 1 1 91 91 ASN H H 91 9.238 9.238 7.788 1.450 18478 445 1 . 1 1 92 92 PRO HA H 92 4.296 4.296 4.261 0.035 18478 446 1 . 1 1 92 92 PRO C C 92 173.690 173.690 176.609 -2.919 18478 447 1 . 1 1 92 92 PRO CA C 92 64.714 64.714 63.949 0.765 18478 448 1 . 1 1 92 92 PRO CB C 92 31.781 31.781 32.234 -0.453 18478 stop_ save_