data_18112 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 18112 _Entry.PDB_ID 2LMD 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 18112 _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 12 12 ALA N N 12 125.167 125.167 124.892 0.275 18112 2 1 1 . 1 1 12 12 ALA C C 12 177.566 177.566 176.780 0.786 18112 3 1 1 . 1 1 12 12 ALA CA C 12 52.067 52.067 51.163 0.904 18112 4 1 1 . 1 1 12 12 ALA CB C 12 18.456 18.456 18.357 0.099 18112 5 1 1 . 1 1 12 12 ALA H H 12 8.311 8.311 7.780 0.531 18112 6 1 1 . 1 1 13 13 MET N N 13 119.278 119.278 121.285 -2.007 18112 7 1 1 . 1 1 13 13 MET C C 13 176.325 176.325 175.450 0.875 18112 8 1 1 . 1 1 13 13 MET CA C 13 54.992 54.992 53.682 1.310 18112 9 1 1 . 1 1 13 13 MET CB C 13 32.308 32.308 29.556 2.752 18112 10 1 1 . 1 1 13 13 MET H H 13 8.269 8.269 8.193 0.076 18112 11 1 1 . 1 1 14 14 GLN N N 14 120.869 120.869 121.160 -0.291 18112 12 1 1 . 1 1 14 14 GLN HA H 14 4.399 4.399 4.660 -0.261 18112 13 1 1 . 1 1 14 14 GLN C C 14 175.644 175.644 174.344 1.300 18112 14 1 1 . 1 1 14 14 GLN CA C 14 55.139 55.139 54.529 0.610 18112 15 1 1 . 1 1 14 14 GLN CB C 14 29.051 29.051 31.173 -2.122 18112 16 1 1 . 1 1 14 14 GLN H H 14 8.501 8.501 7.813 0.688 18112 17 1 1 . 1 1 15 15 GLU N N 15 122.042 122.042 119.254 2.788 18112 18 1 1 . 1 1 15 15 GLU C C 15 176.242 176.242 175.392 0.850 18112 19 1 1 . 1 1 15 15 GLU CA C 15 56.064 56.064 55.550 0.514 18112 20 1 1 . 1 1 15 15 GLU CB C 15 29.302 29.302 31.905 -2.603 18112 21 1 1 . 1 1 15 15 GLU H H 15 8.547 8.547 8.374 0.173 18112 22 1 1 . 1 1 16 16 GLY N N 16 108.821 108.821 111.094 -2.273 18112 23 1 1 . 1 1 16 16 GLY C C 16 172.949 172.949 173.764 -0.815 18112 24 1 1 . 1 1 16 16 GLY CA C 16 44.227 44.227 45.266 -1.039 18112 25 1 1 . 1 1 16 16 GLY H H 16 8.100 8.100 8.303 -0.203 18112 26 1 1 . 1 1 17 17 LEU N N 17 120.315 120.315 122.786 -2.471 18112 27 1 1 . 1 1 17 17 LEU C C 17 177.334 177.334 176.584 0.750 18112 28 1 1 . 1 1 17 17 LEU CA C 17 53.544 53.544 54.786 -1.242 18112 29 1 1 . 1 1 17 17 LEU CB C 17 42.140 42.140 42.784 -0.644 18112 30 1 1 . 1 1 17 17 LEU H H 17 8.222 8.222 8.239 -0.017 18112 31 1 1 . 1 1 18 18 SER N N 18 126.547 126.547 117.724 8.823 18112 32 1 1 . 1 1 18 18 SER CA C 18 56.851 56.851 56.861 -0.010 18112 33 1 1 . 1 1 18 18 SER CB C 18 64.636 64.636 63.140 1.496 18112 34 1 1 . 1 1 18 18 SER H H 18 11.627 11.627 8.679 2.948 18112 35 1 1 . 1 1 19 19 PRO C C 19 175.118 175.118 178.070 -2.952 18112 36 1 1 . 1 1 20 20 ASN N N 20 121.372 121.372 117.188 4.184 18112 37 1 1 . 1 1 20 20 ASN H H 20 8.172 8.172 8.815 -0.643 18112 38 1 1 . 1 1 25 25 ALA CB C 25 18.020 18.020 18.576 -0.556 18112 39 1 1 . 1 1 26 26 LYS N N 26 118.490 118.490 119.445 -0.955 18112 40 1 1 . 1 1 26 26 LYS CA C 26 56.146 56.146 59.558 -3.412 18112 41 1 1 . 1 1 26 26 LYS H H 26 6.794 6.794 7.851 -1.057 18112 42 1 1 . 1 1 31 31 TYR HA H 31 4.398 4.398 4.001 0.397 18112 43 1 1 . 1 1 31 31 TYR C C 31 173.714 173.714 176.043 -2.329 18112 44 1 1 . 1 1 31 31 TYR CA C 31 59.757 59.757 57.642 2.115 18112 45 1 1 . 1 1 32 32 THR N N 32 111.928 111.928 111.969 -0.041 18112 46 1 1 . 1 1 32 32 THR HA H 32 4.209 4.209 4.403 -0.194 18112 47 1 1 . 1 1 32 32 THR C C 32 171.061 171.061 174.657 -3.596 18112 48 1 1 . 1 1 32 32 THR CA C 32 56.905 56.905 63.870 -6.965 18112 49 1 1 . 1 1 32 32 THR CB C 32 69.707 69.707 69.903 -0.196 18112 50 1 1 . 1 1 32 32 THR H H 32 8.237 8.237 7.577 0.660 18112 51 1 1 . 1 1 33 33 ARG N N 33 124.856 124.856 118.212 6.644 18112 52 1 1 . 1 1 33 33 ARG C C 33 176.451 176.451 174.964 1.487 18112 53 1 1 . 1 1 33 33 ARG CA C 33 55.627 55.627 54.990 0.637 18112 54 1 1 . 1 1 33 33 ARG CB C 33 29.861 29.861 31.991 -2.130 18112 55 1 1 . 1 1 33 33 ARG H H 33 9.159 9.159 7.465 1.694 18112 56 1 1 . 1 1 34 34 TYR N N 34 117.908 117.908 124.539 -6.631 18112 57 1 1 . 1 1 34 34 TYR CA C 34 55.320 55.320 62.495 -7.175 18112 58 1 1 . 1 1 34 34 TYR H H 34 8.995 8.995 9.100 -0.105 18112 59 1 1 . 1 1 35 35 PRO C C 35 177.280 177.280 176.393 0.887 18112 60 1 1 . 1 1 36 36 SER N N 36 116.410 116.410 116.840 -0.430 18112 61 1 1 . 1 1 36 36 SER C C 36 178.938 178.938 176.041 2.897 18112 62 1 1 . 1 1 36 36 SER CA C 36 64.815 64.815 61.173 3.642 18112 63 1 1 . 1 1 36 36 SER H H 36 8.106 8.106 8.238 -0.132 18112 64 1 1 . 1 1 37 37 SER N N 37 117.488 117.488 118.142 -0.654 18112 65 1 1 . 1 1 37 37 SER C C 37 177.698 177.698 176.542 1.156 18112 66 1 1 . 1 1 37 37 SER CA C 37 61.357 61.357 61.164 0.193 18112 67 1 1 . 1 1 37 37 SER CB C 37 68.118 68.118 62.333 5.785 18112 68 1 1 . 1 1 37 37 SER H H 37 8.169 8.169 8.518 -0.349 18112 69 1 1 . 1 1 38 38 ASN N N 38 115.638 115.638 121.053 -5.415 18112 70 1 1 . 1 1 38 38 ASN HA H 38 4.259 4.259 4.386 -0.127 18112 71 1 1 . 1 1 38 38 ASN C C 38 177.868 177.868 177.331 0.537 18112 72 1 1 . 1 1 38 38 ASN CA C 38 55.907 55.907 56.282 -0.375 18112 73 1 1 . 1 1 38 38 ASN CB C 38 37.230 37.230 38.278 -1.048 18112 74 1 1 . 1 1 38 38 ASN H H 38 8.284 8.284 7.715 0.569 18112 75 1 1 . 1 1 39 39 MET N N 39 121.352 121.352 119.859 1.493 18112 76 1 1 . 1 1 39 39 MET HA H 39 4.170 4.170 3.521 0.649 18112 77 1 1 . 1 1 39 39 MET C C 39 179.068 179.068 177.869 1.199 18112 78 1 1 . 1 1 39 39 MET CA C 39 58.751 58.751 57.958 0.793 18112 79 1 1 . 1 1 39 39 MET CB C 39 31.850 31.850 31.844 0.006 18112 80 1 1 . 1 1 39 39 MET H H 39 7.857 7.857 7.386 0.471 18112 81 1 1 . 1 1 40 40 LEU N N 40 118.936 118.936 120.041 -1.105 18112 82 1 1 . 1 1 40 40 LEU HA H 40 4.139 4.139 4.125 0.014 18112 83 1 1 . 1 1 40 40 LEU C C 40 178.700 178.700 178.389 0.311 18112 84 1 1 . 1 1 40 40 LEU CA C 40 58.455 58.455 58.303 0.152 18112 85 1 1 . 1 1 40 40 LEU CB C 40 40.304 40.304 41.837 -1.534 18112 86 1 1 . 1 1 40 40 LEU H H 40 8.167 8.167 8.266 -0.099 18112 87 1 1 . 1 1 41 41 LYS N N 41 116.791 116.791 117.686 -0.895 18112 88 1 1 . 1 1 41 41 LYS HA H 41 3.475 3.475 3.857 -0.382 18112 89 1 1 . 1 1 41 41 LYS C C 41 178.793 178.793 178.862 -0.069 18112 90 1 1 . 1 1 41 41 LYS CA C 41 59.161 59.161 59.252 -0.091 18112 91 1 1 . 1 1 41 41 LYS CB C 41 30.992 30.992 32.363 -1.371 18112 92 1 1 . 1 1 41 41 LYS H H 41 7.632 7.632 7.872 -0.240 18112 93 1 1 . 1 1 42 42 THR N N 42 112.819 112.819 115.465 -2.646 18112 94 1 1 . 1 1 42 42 THR HA H 42 4.230 4.230 4.201 0.029 18112 95 1 1 . 1 1 42 42 THR C C 42 176.142 176.142 176.531 -0.389 18112 96 1 1 . 1 1 42 42 THR CA C 42 65.107 65.107 66.636 -1.529 18112 97 1 1 . 1 1 42 42 THR CB C 42 68.306 68.306 69.288 -0.982 18112 98 1 1 . 1 1 42 42 THR H H 42 7.469 7.469 8.006 -0.537 18112 99 1 1 . 1 1 43 43 TYR N N 43 118.565 118.565 119.317 -0.752 18112 100 1 1 . 1 1 43 43 TYR HA H 43 4.204 4.204 4.332 -0.128 18112 101 1 1 . 1 1 43 43 TYR C C 43 174.240 174.240 176.769 -2.529 18112 102 1 1 . 1 1 43 43 TYR CA C 43 60.886 60.886 57.843 3.043 18112 103 1 1 . 1 1 43 43 TYR CB C 43 38.165 38.165 38.232 -0.067 18112 104 1 1 . 1 1 43 43 TYR H H 43 7.978 7.978 7.825 0.153 18112 105 1 1 . 1 1 44 44 PHE N N 44 120.980 120.980 116.354 4.626 18112 106 1 1 . 1 1 44 44 PHE HA H 44 4.920 4.920 4.831 0.089 18112 107 1 1 . 1 1 44 44 PHE C C 44 176.436 176.436 176.403 0.033 18112 108 1 1 . 1 1 44 44 PHE CA C 44 56.672 56.672 56.123 0.549 18112 109 1 1 . 1 1 44 44 PHE CB C 44 36.570 36.570 37.414 -0.844 18112 110 1 1 . 1 1 44 44 PHE H H 44 7.955 7.955 8.024 -0.069 18112 111 1 1 . 1 1 45 45 SER N N 45 113.407 113.407 116.513 -3.106 18112 112 1 1 . 1 1 45 45 SER HA H 45 4.373 4.373 4.285 0.088 18112 113 1 1 . 1 1 45 45 SER C C 45 174.424 174.424 175.695 -1.271 18112 114 1 1 . 1 1 45 45 SER CA C 45 61.037 61.037 61.458 -0.421 18112 115 1 1 . 1 1 45 45 SER CB C 45 62.711 62.711 63.278 -0.567 18112 116 1 1 . 1 1 45 45 SER H H 45 7.932 7.932 7.992 -0.060 18112 117 1 1 . 1 1 46 46 ASP N N 46 118.099 118.099 119.215 -1.116 18112 118 1 1 . 1 1 46 46 ASP HA H 46 4.572 4.572 4.577 -0.005 18112 119 1 1 . 1 1 46 46 ASP C C 46 174.866 174.866 175.819 -0.953 18112 120 1 1 . 1 1 46 46 ASP CA C 46 53.602 53.602 55.442 -1.840 18112 121 1 1 . 1 1 46 46 ASP CB C 46 38.992 38.992 41.417 -2.425 18112 122 1 1 . 1 1 46 46 ASP H H 46 9.889 9.889 8.657 1.232 18112 123 1 1 . 1 1 47 47 VAL N N 47 121.496 121.496 119.718 1.778 18112 124 1 1 . 1 1 47 47 VAL HA H 47 4.058 4.058 3.679 0.379 18112 125 1 1 . 1 1 47 47 VAL C C 47 174.676 174.676 175.957 -1.281 18112 126 1 1 . 1 1 47 47 VAL CA C 47 61.006 61.006 62.792 -1.786 18112 127 1 1 . 1 1 47 47 VAL CB C 47 32.110 32.110 31.497 0.613 18112 128 1 1 . 1 1 47 47 VAL H H 47 7.781 7.781 7.146 0.635 18112 129 1 1 . 1 1 48 48 LYS N N 48 126.100 126.100 126.445 -0.345 18112 130 1 1 . 1 1 48 48 LYS HA H 48 4.402 4.402 4.003 0.399 18112 131 1 1 . 1 1 48 48 LYS C C 48 175.564 175.564 176.684 -1.120 18112 132 1 1 . 1 1 48 48 LYS CA C 48 54.874 54.874 57.316 -2.442 18112 133 1 1 . 1 1 48 48 LYS CB C 48 30.189 30.189 32.673 -2.484 18112 134 1 1 . 1 1 48 48 LYS H H 48 8.245 8.245 8.176 0.069 18112 135 1 1 . 1 1 49 49 PHE N N 49 125.341 125.341 113.991 11.350 18112 136 1 1 . 1 1 49 49 PHE HA H 49 3.813 3.813 4.154 -0.341 18112 137 1 1 . 1 1 49 49 PHE C C 49 175.708 175.708 174.993 0.715 18112 138 1 1 . 1 1 49 49 PHE CA C 49 60.861 60.861 57.322 3.539 18112 139 1 1 . 1 1 49 49 PHE CB C 49 38.616 38.616 36.047 2.569 18112 140 1 1 . 1 1 49 49 PHE H H 49 8.626 8.626 7.752 0.874 18112 141 1 1 . 1 1 50 50 ASN N N 50 115.408 115.408 120.642 -5.234 18112 142 1 1 . 1 1 50 50 ASN C C 50 176.072 176.072 176.304 -0.232 18112 143 1 1 . 1 1 50 50 ASN CA C 50 51.730 51.730 52.999 -1.270 18112 144 1 1 . 1 1 50 50 ASN H H 50 7.030 7.030 8.170 -1.140 18112 145 1 1 . 1 1 51 51 ARG N N 51 122.706 122.706 125.741 -3.035 18112 146 1 1 . 1 1 51 51 ARG CA C 51 59.534 59.534 59.373 0.161 18112 147 1 1 . 1 1 51 51 ARG H H 51 7.790 7.790 8.887 -1.097 18112 148 1 1 . 1 1 52 52 CYS N N 52 117.340 117.340 116.912 0.428 18112 149 1 1 . 1 1 52 52 CYS HA H 52 4.108 4.108 3.997 0.111 18112 150 1 1 . 1 1 52 52 CYS C C 52 178.200 178.200 177.047 1.153 18112 151 1 1 . 1 1 52 52 CYS CA C 52 61.143 61.143 63.882 -2.739 18112 152 1 1 . 1 1 52 52 CYS H H 52 7.681 7.681 7.876 -0.195 18112 153 1 1 . 1 1 53 53 ILE N N 53 122.321 122.321 117.254 5.067 18112 154 1 1 . 1 1 53 53 ILE HA H 53 3.588 3.588 4.010 -0.422 18112 155 1 1 . 1 1 53 53 ILE C C 53 177.492 177.492 177.471 0.021 18112 156 1 1 . 1 1 53 53 ILE CA C 53 64.109 64.109 63.745 0.364 18112 157 1 1 . 1 1 53 53 ILE CB C 53 37.603 37.603 37.345 0.258 18112 158 1 1 . 1 1 53 53 ILE H H 53 8.035 8.035 7.382 0.653 18112 159 1 1 . 1 1 54 54 THR C C 54 175.903 175.903 176.614 -0.711 18112 160 1 1 . 1 1 54 54 THR CA C 54 67.308 67.308 67.222 0.085 18112 161 1 1 . 1 1 55 55 SER N N 55 113.819 113.819 117.665 -3.846 18112 162 1 1 . 1 1 55 55 SER H H 55 7.844 7.844 8.077 -0.233 18112 163 1 1 . 1 1 56 56 GLN C C 56 179.792 179.792 177.041 2.751 18112 164 1 1 . 1 1 57 57 LEU N N 57 116.701 116.701 120.008 -3.307 18112 165 1 1 . 1 1 57 57 LEU HA H 57 4.519 4.519 2.762 1.757 18112 166 1 1 . 1 1 57 57 LEU C C 57 178.775 178.775 178.590 0.185 18112 167 1 1 . 1 1 57 57 LEU CA C 57 55.232 55.232 57.046 -1.814 18112 168 1 1 . 1 1 57 57 LEU CB C 57 37.131 37.131 41.661 -4.530 18112 169 1 1 . 1 1 57 57 LEU H H 57 8.267 8.267 7.331 0.936 18112 170 1 1 . 1 1 58 58 ILE N N 58 122.522 122.522 117.182 5.340 18112 171 1 1 . 1 1 58 58 ILE HA H 58 4.640 4.640 3.385 1.255 18112 172 1 1 . 1 1 58 58 ILE C C 58 177.380 177.380 177.342 0.038 18112 173 1 1 . 1 1 58 58 ILE CA C 58 62.163 62.163 64.639 -2.476 18112 174 1 1 . 1 1 58 58 ILE CB C 58 30.657 30.657 37.354 -6.697 18112 175 1 1 . 1 1 58 58 ILE H H 58 8.111 8.111 8.020 0.091 18112 176 1 1 . 1 1 59 59 LYS N N 59 121.002 121.002 121.220 -0.218 18112 177 1 1 . 1 1 59 59 LYS C C 59 177.600 177.600 178.765 -1.165 18112 178 1 1 . 1 1 59 59 LYS CA C 59 57.570 57.570 60.055 -2.485 18112 179 1 1 . 1 1 59 59 LYS CB C 59 39.101 39.101 32.213 6.888 18112 180 1 1 . 1 1 59 59 LYS H H 59 7.432 7.432 7.626 -0.194 18112 181 1 1 . 1 1 60 60 TRP N N 60 118.679 118.679 119.273 -0.594 18112 182 1 1 . 1 1 60 60 TRP HA H 60 3.739 3.739 4.367 -0.628 18112 183 1 1 . 1 1 60 60 TRP C C 60 178.246 178.246 179.177 -0.931 18112 184 1 1 . 1 1 60 60 TRP CA C 60 59.818 59.818 59.252 0.566 18112 185 1 1 . 1 1 60 60 TRP CB C 60 31.851 31.851 28.552 3.299 18112 186 1 1 . 1 1 60 60 TRP H H 60 7.565 7.565 7.779 -0.214 18112 187 1 1 . 1 1 61 61 PHE N N 61 118.005 118.005 117.622 0.383 18112 188 1 1 . 1 1 61 61 PHE HA H 61 3.882 3.882 3.638 0.244 18112 189 1 1 . 1 1 61 61 PHE CA C 61 60.054 60.054 59.915 0.139 18112 190 1 1 . 1 1 61 61 PHE H H 61 7.819 7.819 8.443 -0.624 18112 191 1 1 . 1 1 62 62 SER N N 62 121.144 121.144 114.864 6.280 18112 192 1 1 . 1 1 62 62 SER C C 62 177.840 177.840 176.434 1.406 18112 193 1 1 . 1 1 62 62 SER CA C 62 55.892 55.892 61.478 -5.586 18112 194 1 1 . 1 1 62 62 SER H H 62 8.878 8.878 8.345 0.533 18112 195 1 1 . 1 1 63 63 ASN N N 63 115.303 115.303 122.515 -7.212 18112 196 1 1 . 1 1 63 63 ASN C C 63 177.222 177.222 176.826 0.396 18112 197 1 1 . 1 1 63 63 ASN CA C 63 60.467 60.467 56.507 3.960 18112 198 1 1 . 1 1 63 63 ASN H H 63 8.001 8.001 8.156 -0.155 18112 199 1 1 . 1 1 64 64 PHE N N 64 112.571 112.571 121.052 -8.481 18112 200 1 1 . 1 1 64 64 PHE CA C 64 56.453 56.453 61.289 -4.836 18112 201 1 1 . 1 1 64 64 PHE H H 64 7.082 7.082 8.500 -1.418 18112 202 1 1 . 1 1 65 65 ARG N N 65 116.695 116.695 119.698 -3.003 18112 203 1 1 . 1 1 65 65 ARG CA C 65 59.590 59.590 59.235 0.355 18112 204 1 1 . 1 1 65 65 ARG H H 65 8.091 8.091 8.302 -0.211 18112 205 1 1 . 1 1 66 66 GLU N N 66 121.653 121.653 119.698 1.955 18112 206 1 1 . 1 1 66 66 GLU HA H 66 4.739 4.739 4.191 0.548 18112 207 1 1 . 1 1 66 66 GLU C C 66 174.621 174.621 179.295 -4.674 18112 208 1 1 . 1 1 66 66 GLU CA C 66 59.583 59.583 59.985 -0.402 18112 209 1 1 . 1 1 66 66 GLU H H 66 7.597 7.597 8.163 -0.566 18112 210 1 1 . 1 1 67 67 PHE N N 67 111.578 111.578 119.280 -7.702 18112 211 1 1 . 1 1 67 67 PHE C C 67 176.164 176.164 178.209 -2.045 18112 212 1 1 . 1 1 67 67 PHE CA C 67 61.156 61.156 60.460 0.696 18112 213 1 1 . 1 1 67 67 PHE H H 67 7.067 7.067 8.629 -1.562 18112 214 1 1 . 1 1 68 68 TYR N N 68 119.370 119.370 120.702 -1.332 18112 215 1 1 . 1 1 68 68 TYR C C 68 176.844 176.844 177.897 -1.053 18112 216 1 1 . 1 1 68 68 TYR CA C 68 61.758 61.758 61.130 0.628 18112 217 1 1 . 1 1 68 68 TYR H H 68 7.442 7.442 8.388 -0.946 18112 218 1 1 . 1 1 69 69 TYR N N 69 116.047 116.047 120.912 -4.865 18112 219 1 1 . 1 1 69 69 TYR HA H 69 4.086 4.086 4.088 -0.002 18112 220 1 1 . 1 1 69 69 TYR C C 69 180.328 180.328 177.386 2.942 18112 221 1 1 . 1 1 69 69 TYR CA C 69 61.528 61.528 62.096 -0.569 18112 222 1 1 . 1 1 69 69 TYR H H 69 9.127 9.127 8.497 0.630 18112 223 1 1 . 1 1 70 70 ILE N N 70 124.738 124.738 117.922 6.816 18112 224 1 1 . 1 1 70 70 ILE HA H 70 3.828 3.828 3.707 0.121 18112 225 1 1 . 1 1 70 70 ILE C C 70 179.585 179.585 178.523 1.062 18112 226 1 1 . 1 1 70 70 ILE CA C 70 65.787 65.787 63.241 2.546 18112 227 1 1 . 1 1 70 70 ILE CB C 70 36.435 36.435 36.304 0.131 18112 228 1 1 . 1 1 70 70 ILE H H 70 8.631 8.631 8.583 0.048 18112 229 1 1 . 1 1 71 71 GLN N N 71 117.940 117.940 119.944 -2.004 18112 230 1 1 . 1 1 71 71 GLN HA H 71 3.826 3.826 3.641 0.185 18112 231 1 1 . 1 1 71 71 GLN C C 71 178.192 178.192 177.922 0.270 18112 232 1 1 . 1 1 71 71 GLN CA C 71 57.779 57.779 58.449 -0.670 18112 233 1 1 . 1 1 71 71 GLN H H 71 7.738 7.738 7.867 -0.129 18112 234 1 1 . 1 1 72 72 MET N N 72 117.353 117.353 117.547 -0.194 18112 235 1 1 . 1 1 72 72 MET HA H 72 4.112 4.112 3.807 0.305 18112 236 1 1 . 1 1 72 72 MET C C 72 177.203 177.203 178.101 -0.898 18112 237 1 1 . 1 1 72 72 MET CA C 72 57.272 57.272 56.626 0.646 18112 238 1 1 . 1 1 72 72 MET H H 72 7.844 7.844 7.510 0.334 18112 239 1 1 . 1 1 73 73 GLU N N 73 117.858 117.858 119.846 -1.988 18112 240 1 1 . 1 1 73 73 GLU HA H 73 3.572 3.572 3.906 -0.334 18112 241 1 1 . 1 1 73 73 GLU C C 73 177.344 177.344 178.622 -1.278 18112 242 1 1 . 1 1 73 73 GLU CA C 73 60.324 60.324 59.848 0.476 18112 243 1 1 . 1 1 73 73 GLU H H 73 7.503 7.503 7.885 -0.382 18112 244 1 1 . 1 1 74 74 LYS N N 74 118.716 118.716 119.635 -0.919 18112 245 1 1 . 1 1 74 74 LYS HA H 74 3.867 3.867 3.968 -0.101 18112 246 1 1 . 1 1 74 74 LYS C C 74 180.077 180.077 179.265 0.812 18112 247 1 1 . 1 1 74 74 LYS CA C 74 59.754 59.754 59.562 0.192 18112 248 1 1 . 1 1 74 74 LYS H H 74 7.912 7.912 7.550 0.362 18112 249 1 1 . 1 1 75 75 TYR N N 75 117.309 117.309 118.878 -1.569 18112 250 1 1 . 1 1 75 75 TYR HA H 75 4.085 4.085 4.400 -0.315 18112 251 1 1 . 1 1 75 75 TYR C C 75 178.874 178.874 178.801 0.073 18112 252 1 1 . 1 1 75 75 TYR CA C 75 63.306 63.306 58.440 4.866 18112 253 1 1 . 1 1 75 75 TYR H H 75 8.421 8.421 7.869 0.552 18112 254 1 1 . 1 1 76 76 ALA N N 76 125.392 125.392 121.304 4.088 18112 255 1 1 . 1 1 76 76 ALA HA H 76 4.221 4.221 4.137 0.084 18112 256 1 1 . 1 1 76 76 ALA C C 76 178.850 178.850 179.276 -0.426 18112 257 1 1 . 1 1 76 76 ALA CA C 76 56.280 56.280 55.285 0.995 18112 258 1 1 . 1 1 76 76 ALA CB C 76 18.687 18.687 18.441 0.246 18112 259 1 1 . 1 1 76 76 ALA H H 76 8.553 8.553 8.518 0.035 18112 260 1 1 . 1 1 77 77 ARG N N 77 115.067 115.067 119.001 -3.934 18112 261 1 1 . 1 1 77 77 ARG HA H 77 3.935 3.935 3.914 0.021 18112 262 1 1 . 1 1 77 77 ARG C C 77 179.341 179.341 178.360 0.981 18112 263 1 1 . 1 1 77 77 ARG CA C 77 60.499 60.499 59.620 0.879 18112 264 1 1 . 1 1 77 77 ARG H H 77 8.471 8.471 8.208 0.263 18112 265 1 1 . 1 1 78 78 GLN N N 78 120.107 120.107 119.167 0.940 18112 266 1 1 . 1 1 78 78 GLN HA H 78 3.921 3.921 4.117 -0.196 18112 267 1 1 . 1 1 78 78 GLN C C 78 177.289 177.289 178.127 -0.838 18112 268 1 1 . 1 1 78 78 GLN CA C 78 58.619 58.619 58.870 -0.251 18112 269 1 1 . 1 1 78 78 GLN CB C 78 27.752 27.752 28.703 -0.952 18112 270 1 1 . 1 1 78 78 GLN H H 78 8.142 8.142 8.322 -0.180 18112 271 1 1 . 1 1 79 79 ALA N N 79 120.809 120.809 123.290 -2.481 18112 272 1 1 . 1 1 79 79 ALA HA H 79 4.308 4.308 4.072 0.236 18112 273 1 1 . 1 1 79 79 ALA C C 79 179.924 179.924 179.575 0.349 18112 274 1 1 . 1 1 79 79 ALA CA C 79 54.970 54.970 55.365 -0.395 18112 275 1 1 . 1 1 79 79 ALA CB C 79 17.064 17.064 18.654 -1.590 18112 276 1 1 . 1 1 79 79 ALA H H 79 7.811 7.811 8.021 -0.210 18112 277 1 1 . 1 1 80 80 ILE N N 80 118.524 118.524 118.357 0.167 18112 278 1 1 . 1 1 80 80 ILE HA H 80 3.894 3.894 3.621 0.273 18112 279 1 1 . 1 1 80 80 ILE C C 80 181.268 181.268 178.273 2.995 18112 280 1 1 . 1 1 80 80 ILE CA C 80 64.841 64.841 64.585 0.256 18112 281 1 1 . 1 1 80 80 ILE CB C 80 37.125 37.125 37.793 -0.668 18112 282 1 1 . 1 1 80 80 ILE H H 80 7.837 7.837 8.155 -0.318 18112 283 1 1 . 1 1 81 81 ASN N N 81 121.233 121.233 117.623 3.610 18112 284 1 1 . 1 1 81 81 ASN HA H 81 4.398 4.398 4.396 0.002 18112 285 1 1 . 1 1 81 81 ASN C C 81 176.546 176.546 177.036 -0.490 18112 286 1 1 . 1 1 81 81 ASN CA C 81 55.892 55.892 55.882 0.010 18112 287 1 1 . 1 1 81 81 ASN CB C 81 37.603 37.603 38.634 -1.031 18112 288 1 1 . 1 1 81 81 ASN H H 81 8.262 8.262 8.081 0.181 18112 289 1 1 . 1 1 82 82 ASP N N 82 119.240 119.240 117.488 1.752 18112 290 1 1 . 1 1 82 82 ASP HA H 82 4.666 4.666 4.664 0.002 18112 291 1 1 . 1 1 82 82 ASP C C 82 176.767 176.767 177.111 -0.344 18112 292 1 1 . 1 1 82 82 ASP CA C 82 54.771 54.771 54.417 0.354 18112 293 1 1 . 1 1 82 82 ASP CB C 82 40.121 40.121 41.616 -1.495 18112 294 1 1 . 1 1 82 82 ASP H H 82 8.316 8.316 8.070 0.246 18112 295 1 1 . 1 1 83 83 GLY N N 83 106.913 106.913 107.816 -0.903 18112 296 1 1 . 1 1 83 83 GLY C C 83 174.601 174.601 174.828 -0.227 18112 297 1 1 . 1 1 83 83 GLY CA C 83 45.214 45.214 45.108 0.106 18112 298 1 1 . 1 1 83 83 GLY H H 83 7.810 7.810 7.806 0.004 18112 299 1 1 . 1 1 84 84 VAL N N 84 122.981 122.981 120.211 2.770 18112 300 1 1 . 1 1 84 84 VAL HA H 84 3.850 3.850 4.023 -0.173 18112 301 1 1 . 1 1 84 84 VAL C C 84 177.265 177.265 176.998 0.267 18112 302 1 1 . 1 1 84 84 VAL CA C 84 64.270 64.270 63.535 0.735 18112 303 1 1 . 1 1 84 84 VAL CB C 84 30.471 30.471 31.825 -1.353 18112 304 1 1 . 1 1 84 84 VAL H H 84 8.157 8.157 7.952 0.205 18112 305 1 1 . 1 1 85 85 THR N N 85 115.232 115.232 117.445 -2.213 18112 306 1 1 . 1 1 85 85 THR HA H 85 4.716 4.716 4.408 0.308 18112 307 1 1 . 1 1 85 85 THR C C 85 174.489 174.489 174.788 -0.299 18112 308 1 1 . 1 1 85 85 THR CA C 85 61.618 61.618 62.506 -0.888 18112 309 1 1 . 1 1 85 85 THR CB C 85 70.081 70.081 69.444 0.637 18112 310 1 1 . 1 1 85 85 THR H H 85 8.890 8.890 8.193 0.697 18112 311 1 1 . 1 1 86 86 SER N N 86 117.009 117.009 117.981 -0.972 18112 312 1 1 . 1 1 86 86 SER HA H 86 5.046 5.046 4.622 0.424 18112 313 1 1 . 1 1 86 86 SER C C 86 174.473 174.473 174.841 -0.368 18112 314 1 1 . 1 1 86 86 SER CA C 86 55.922 55.922 57.205 -1.282 18112 315 1 1 . 1 1 86 86 SER CB C 86 64.385 64.385 65.166 -0.781 18112 316 1 1 . 1 1 86 86 SER H H 86 7.704 7.704 7.613 0.091 18112 317 1 1 . 1 1 87 87 THR N N 87 118.634 118.634 118.196 0.438 18112 318 1 1 . 1 1 87 87 THR HA H 87 4.065 4.065 3.874 0.191 18112 319 1 1 . 1 1 87 87 THR C C 87 176.047 176.047 175.938 0.109 18112 320 1 1 . 1 1 87 87 THR CA C 87 64.983 64.983 64.379 0.604 18112 321 1 1 . 1 1 87 87 THR CB C 87 68.045 68.045 68.530 -0.485 18112 322 1 1 . 1 1 87 87 THR H H 87 8.711 8.711 8.574 0.137 18112 323 1 1 . 1 1 88 88 GLU N N 88 117.889 117.889 119.726 -1.837 18112 324 1 1 . 1 1 88 88 GLU HA H 88 3.881 3.881 4.085 -0.204 18112 325 1 1 . 1 1 88 88 GLU C C 88 177.146 177.146 177.591 -0.445 18112 326 1 1 . 1 1 88 88 GLU CA C 88 57.814 57.814 58.221 -0.407 18112 327 1 1 . 1 1 88 88 GLU CB C 88 28.050 28.050 28.441 -0.391 18112 328 1 1 . 1 1 88 88 GLU H H 88 8.152 8.152 8.758 -0.606 18112 329 1 1 . 1 1 89 89 GLU N N 89 115.617 115.617 118.874 -3.257 18112 330 1 1 . 1 1 89 89 GLU HA H 89 4.149 4.149 4.224 -0.075 18112 331 1 1 . 1 1 89 89 GLU C C 89 176.192 176.192 176.958 -0.766 18112 332 1 1 . 1 1 89 89 GLU CA C 89 56.133 56.133 57.303 -1.170 18112 333 1 1 . 1 1 89 89 GLU CB C 89 29.415 29.415 30.323 -0.908 18112 334 1 1 . 1 1 89 89 GLU H H 89 7.311 7.311 7.593 -0.282 18112 335 1 1 . 1 1 90 90 LEU N N 90 120.870 120.870 117.569 3.301 18112 336 1 1 . 1 1 90 90 LEU HA H 90 4.439 4.439 4.507 -0.068 18112 337 1 1 . 1 1 90 90 LEU C C 90 175.267 175.267 177.202 -1.935 18112 338 1 1 . 1 1 90 90 LEU CA C 90 53.504 53.504 54.861 -1.357 18112 339 1 1 . 1 1 90 90 LEU CB C 90 40.479 40.479 41.943 -1.464 18112 340 1 1 . 1 1 90 90 LEU H H 90 7.311 7.311 7.628 -0.317 18112 341 1 1 . 1 1 91 91 SER N N 91 118.376 118.376 116.521 1.855 18112 342 1 1 . 1 1 91 91 SER HA H 91 4.747 4.747 4.584 0.163 18112 343 1 1 . 1 1 91 91 SER C C 91 173.332 173.332 173.043 0.289 18112 344 1 1 . 1 1 91 91 SER CA C 91 56.314 56.314 57.438 -1.124 18112 345 1 1 . 1 1 91 91 SER CB C 91 64.615 64.615 61.484 3.131 18112 346 1 1 . 1 1 91 91 SER H H 91 8.221 8.221 8.175 0.046 18112 347 1 1 . 1 1 92 92 ILE N N 92 122.247 122.247 120.526 1.721 18112 348 1 1 . 1 1 92 92 ILE HA H 92 4.537 4.537 4.403 0.134 18112 349 1 1 . 1 1 92 92 ILE C C 92 174.059 174.059 176.404 -2.345 18112 350 1 1 . 1 1 92 92 ILE CA C 92 59.881 59.881 58.094 1.787 18112 351 1 1 . 1 1 92 92 ILE CB C 92 37.820 37.820 41.131 -3.311 18112 352 1 1 . 1 1 92 92 ILE H H 92 8.570 8.570 7.539 1.031 18112 353 1 1 . 1 1 93 93 THR N N 93 116.069 116.069 119.512 -3.443 18112 354 1 1 . 1 1 93 93 THR HA H 93 4.580 4.580 4.164 0.416 18112 355 1 1 . 1 1 93 93 THR C C 93 175.049 175.049 174.084 0.965 18112 356 1 1 . 1 1 93 93 THR CA C 93 58.988 58.988 64.042 -5.054 18112 357 1 1 . 1 1 93 93 THR CB C 93 71.362 71.362 67.475 3.887 18112 358 1 1 . 1 1 93 93 THR H H 93 7.224 7.224 8.575 -1.351 18112 359 1 1 . 1 1 94 94 ARG N N 94 116.595 116.595 126.972 -10.377 18112 360 1 1 . 1 1 94 94 ARG HA H 94 3.077 3.077 4.605 -1.528 18112 361 1 1 . 1 1 94 94 ARG C C 94 175.076 175.076 174.437 0.639 18112 362 1 1 . 1 1 94 94 ARG CA C 94 57.119 57.119 53.970 3.149 18112 363 1 1 . 1 1 94 94 ARG CB C 94 27.838 27.838 31.829 -3.991 18112 364 1 1 . 1 1 94 94 ARG H H 94 8.596 8.596 7.973 0.623 18112 365 1 1 . 1 1 95 95 ASP N N 95 113.735 113.735 126.106 -12.371 18112 366 1 1 . 1 1 95 95 ASP HA H 95 4.765 4.765 4.102 0.663 18112 367 1 1 . 1 1 95 95 ASP C C 95 175.876 175.876 176.991 -1.115 18112 368 1 1 . 1 1 95 95 ASP CA C 95 53.156 53.156 56.544 -3.388 18112 369 1 1 . 1 1 95 95 ASP CB C 95 41.166 41.166 41.453 -0.287 18112 370 1 1 . 1 1 95 95 ASP H H 95 7.607 7.607 8.676 -1.069 18112 371 1 1 . 1 1 96 96 CYS N N 96 116.012 116.012 123.068 -7.056 18112 372 1 1 . 1 1 96 96 CYS C C 96 174.361 174.361 176.513 -2.152 18112 373 1 1 . 1 1 96 96 CYS CA C 96 56.562 56.562 61.505 -4.943 18112 374 1 1 . 1 1 96 96 CYS CB C 96 29.416 29.416 26.270 3.146 18112 375 1 1 . 1 1 96 96 CYS H H 96 7.094 7.094 8.365 -1.271 18112 376 1 1 . 1 1 97 97 GLU N N 97 123.087 123.087 120.212 2.875 18112 377 1 1 . 1 1 97 97 GLU C C 97 178.748 178.748 179.137 -0.389 18112 378 1 1 . 1 1 97 97 GLU CA C 97 59.912 59.912 59.182 0.730 18112 379 1 1 . 1 1 97 97 GLU CB C 97 29.195 29.195 29.553 -0.358 18112 380 1 1 . 1 1 97 97 GLU H H 97 9.003 9.003 7.720 1.283 18112 381 1 1 . 1 1 98 98 LEU N N 98 120.942 120.942 120.450 0.492 18112 382 1 1 . 1 1 98 98 LEU HA H 98 3.614 3.614 4.213 -0.599 18112 383 1 1 . 1 1 98 98 LEU C C 98 177.796 177.796 178.692 -0.896 18112 384 1 1 . 1 1 98 98 LEU CA C 98 58.090 58.090 56.945 1.145 18112 385 1 1 . 1 1 98 98 LEU CB C 98 39.778 39.778 41.697 -1.919 18112 386 1 1 . 1 1 98 98 LEU H H 98 8.656 8.656 8.062 0.594 18112 387 1 1 . 1 1 99 99 TYR N N 99 118.313 118.313 118.684 -0.371 18112 388 1 1 . 1 1 99 99 TYR C C 99 177.077 177.077 178.167 -1.090 18112 389 1 1 . 1 1 99 99 TYR CA C 99 62.622 62.622 61.786 0.836 18112 390 1 1 . 1 1 99 99 TYR CB C 99 38.742 38.742 37.651 1.091 18112 391 1 1 . 1 1 99 99 TYR H H 99 7.522 7.522 8.089 -0.567 18112 392 1 1 . 1 1 100 100 ARG N N 100 118.101 118.101 120.114 -2.013 18112 393 1 1 . 1 1 100 100 ARG C C 100 178.616 178.616 178.490 0.126 18112 394 1 1 . 1 1 100 100 ARG CA C 100 59.915 59.915 59.393 0.522 18112 395 1 1 . 1 1 100 100 ARG CB C 100 29.100 29.100 30.237 -1.137 18112 396 1 1 . 1 1 100 100 ARG H H 100 8.243 8.243 8.586 -0.343 18112 397 1 1 . 1 1 101 101 ALA N N 101 120.972 120.972 123.261 -2.289 18112 398 1 1 . 1 1 101 101 ALA HA H 101 4.145 4.145 4.235 -0.090 18112 399 1 1 . 1 1 101 101 ALA C C 101 181.359 181.359 179.812 1.547 18112 400 1 1 . 1 1 101 101 ALA CA C 101 55.057 55.057 55.353 -0.296 18112 401 1 1 . 1 1 101 101 ALA CB C 101 17.543 17.543 18.582 -1.039 18112 402 1 1 . 1 1 101 101 ALA H H 101 8.352 8.352 8.019 0.333 18112 403 1 1 . 1 1 102 102 LEU N N 102 115.683 115.683 117.781 -2.098 18112 404 1 1 . 1 1 102 102 LEU HA H 102 4.333 4.333 4.335 -0.002 18112 405 1 1 . 1 1 102 102 LEU C C 102 178.583 178.583 179.526 -0.943 18112 406 1 1 . 1 1 102 102 LEU CA C 102 57.634 57.634 57.790 -0.156 18112 407 1 1 . 1 1 102 102 LEU CB C 102 41.716 41.716 41.492 0.223 18112 408 1 1 . 1 1 102 102 LEU H H 102 7.960 7.960 8.275 -0.315 18112 409 1 1 . 1 1 103 103 ASN N N 103 118.957 118.957 119.842 -0.885 18112 410 1 1 . 1 1 103 103 ASN C C 103 177.470 177.470 177.968 -0.498 18112 411 1 1 . 1 1 103 103 ASN CA C 103 56.974 56.974 56.044 0.930 18112 412 1 1 . 1 1 103 103 ASN CB C 103 38.140 38.140 38.557 -0.417 18112 413 1 1 . 1 1 103 103 ASN H H 103 9.301 9.301 8.388 0.913 18112 414 1 1 . 1 1 104 104 MET N N 104 113.763 113.763 119.428 -5.665 18112 415 1 1 . 1 1 104 104 MET CA C 104 57.362 57.362 57.687 -0.325 18112 416 1 1 . 1 1 104 104 MET CB C 104 31.895 31.895 32.531 -0.635 18112 417 1 1 . 1 1 104 104 MET H H 104 8.332 8.332 8.228 0.104 18112 418 1 1 . 1 1 105 105 HIS N N 105 116.024 116.024 116.038 -0.014 18112 419 1 1 . 1 1 105 105 HIS HA H 105 3.764 3.764 4.300 -0.536 18112 420 1 1 . 1 1 105 105 HIS C C 105 176.939 176.939 176.801 0.138 18112 421 1 1 . 1 1 105 105 HIS CA C 105 59.069 59.069 58.915 0.154 18112 422 1 1 . 1 1 105 105 HIS H H 105 7.156 7.156 8.354 -1.198 18112 423 1 1 . 1 1 106 106 TYR N N 106 113.161 113.161 116.382 -3.221 18112 424 1 1 . 1 1 106 106 TYR C C 106 173.767 173.767 175.803 -2.036 18112 425 1 1 . 1 1 106 106 TYR CA C 106 58.488 58.488 59.795 -1.307 18112 426 1 1 . 1 1 106 106 TYR CB C 106 38.225 38.225 40.286 -2.062 18112 427 1 1 . 1 1 106 106 TYR H H 106 7.204 7.204 8.202 -0.998 18112 428 1 1 . 1 1 107 107 ASN N N 107 118.875 118.875 114.980 3.895 18112 429 1 1 . 1 1 107 107 ASN HA H 107 3.922 3.922 4.874 -0.952 18112 430 1 1 . 1 1 107 107 ASN C C 107 175.815 175.815 173.506 2.309 18112 431 1 1 . 1 1 107 107 ASN CA C 107 51.233 51.233 53.000 -1.767 18112 432 1 1 . 1 1 107 107 ASN CB C 107 38.142 38.142 40.764 -2.622 18112 433 1 1 . 1 1 107 107 ASN H H 107 8.127 8.127 8.229 -0.102 18112 434 1 1 . 1 1 108 108 LYS N N 108 122.850 122.850 123.339 -0.489 18112 435 1 1 . 1 1 108 108 LYS HA H 108 3.954 3.954 4.624 -0.670 18112 436 1 1 . 1 1 108 108 LYS C C 108 177.586 177.586 176.846 0.740 18112 437 1 1 . 1 1 108 108 LYS CA C 108 59.749 59.749 55.081 4.668 18112 438 1 1 . 1 1 108 108 LYS CB C 108 31.498 31.498 30.476 1.022 18112 439 1 1 . 1 1 108 108 LYS H H 108 7.772 7.772 8.569 -0.797 18112 440 1 1 . 1 1 109 109 ALA N N 109 118.054 118.054 125.204 -7.150 18112 441 1 1 . 1 1 109 109 ALA HA H 109 4.137 4.137 3.862 0.275 18112 442 1 1 . 1 1 109 109 ALA C C 109 177.889 177.889 176.922 0.967 18112 443 1 1 . 1 1 109 109 ALA CA C 109 52.299 52.299 53.508 -1.209 18112 444 1 1 . 1 1 109 109 ALA CB C 109 17.787 17.787 17.422 0.365 18112 445 1 1 . 1 1 109 109 ALA H H 109 8.307 8.307 8.675 -0.368 18112 446 1 1 . 1 1 110 110 ASN N N 110 115.542 115.542 114.329 1.213 18112 447 1 1 . 1 1 110 110 ASN HA H 110 4.480 4.480 4.645 -0.165 18112 448 1 1 . 1 1 110 110 ASN C C 110 174.277 174.277 174.568 -0.291 18112 449 1 1 . 1 1 110 110 ASN CA C 110 53.504 53.504 52.806 0.698 18112 450 1 1 . 1 1 110 110 ASN CB C 110 37.283 37.283 38.223 -0.940 18112 451 1 1 . 1 1 110 110 ASN H H 110 8.353 8.353 8.286 0.067 18112 452 1 1 . 1 1 111 111 ASP N N 111 114.692 114.692 122.124 -7.432 18112 453 1 1 . 1 1 111 111 ASP HA H 111 4.485 4.485 4.500 -0.015 18112 454 1 1 . 1 1 111 111 ASP C C 111 174.868 174.868 175.165 -0.297 18112 455 1 1 . 1 1 111 111 ASP CA C 111 53.227 53.227 54.005 -0.778 18112 456 1 1 . 1 1 111 111 ASP CB C 111 39.228 39.228 38.777 0.451 18112 457 1 1 . 1 1 111 111 ASP H H 111 8.297 8.297 8.162 0.135 18112 458 1 1 . 1 1 112 112 PHE N N 112 120.927 120.927 118.960 1.967 18112 459 1 1 . 1 1 112 112 PHE HA H 112 4.752 4.752 3.939 0.813 18112 460 1 1 . 1 1 112 112 PHE C C 112 174.633 174.633 175.543 -0.910 18112 461 1 1 . 1 1 112 112 PHE CA C 112 56.346 56.346 59.636 -3.291 18112 462 1 1 . 1 1 112 112 PHE H H 112 7.784 7.784 7.708 0.076 18112 463 1 1 . 1 1 113 113 GLU N N 113 128.111 128.111 116.103 12.008 18112 464 1 1 . 1 1 113 113 GLU HA H 113 4.011 4.011 4.081 -0.070 18112 465 1 1 . 1 1 113 113 GLU C C 113 173.502 173.502 175.948 -2.446 18112 466 1 1 . 1 1 113 113 GLU CA C 113 55.100 55.100 56.919 -1.819 18112 467 1 1 . 1 1 113 113 GLU H H 113 7.752 7.752 8.143 -0.391 18112 468 1 1 . 1 1 114 114 VAL N N 114 129.326 129.326 112.490 16.836 18112 469 1 1 . 1 1 114 114 VAL HA H 114 3.241 3.241 3.397 -0.156 18112 470 1 1 . 1 1 114 114 VAL CA C 114 60.838 60.838 62.399 -1.561 18112 471 1 1 . 1 1 114 114 VAL CB C 114 32.609 32.609 29.781 2.828 18112 472 1 1 . 1 1 114 114 VAL H H 114 8.008 8.008 7.595 0.413 18112 473 1 1 . 1 1 115 115 PRO HA H 115 4.429 4.429 4.556 -0.127 18112 474 1 1 . 1 1 115 115 PRO C C 115 177.421 177.421 178.008 -0.587 18112 475 1 1 . 1 1 115 115 PRO CA C 115 61.882 61.882 62.859 -0.977 18112 476 1 1 . 1 1 115 115 PRO CB C 115 30.974 30.974 32.895 -1.921 18112 477 1 1 . 1 1 116 116 GLU N N 116 123.936 123.936 121.904 2.032 18112 478 1 1 . 1 1 116 116 GLU C C 116 179.034 179.034 178.631 0.403 18112 479 1 1 . 1 1 116 116 GLU CA C 116 58.913 58.913 60.045 -1.132 18112 480 1 1 . 1 1 116 116 GLU CB C 116 28.378 28.378 29.675 -1.297 18112 481 1 1 . 1 1 116 116 GLU H H 116 8.757 8.757 8.807 -0.050 18112 482 1 1 . 1 1 117 117 ARG N N 117 116.943 116.943 118.294 -1.351 18112 483 1 1 . 1 1 117 117 ARG C C 117 177.570 177.570 178.208 -0.638 18112 484 1 1 . 1 1 117 117 ARG CA C 117 57.033 57.033 59.150 -2.117 18112 485 1 1 . 1 1 117 117 ARG CB C 117 28.172 28.172 29.621 -1.449 18112 486 1 1 . 1 1 117 117 ARG H H 117 8.733 8.733 8.444 0.289 18112 487 1 1 . 1 1 118 118 PHE N N 118 117.528 117.528 117.318 0.210 18112 488 1 1 . 1 1 118 118 PHE HA H 118 4.137 4.137 4.476 -0.339 18112 489 1 1 . 1 1 118 118 PHE C C 118 176.992 176.992 178.021 -1.029 18112 490 1 1 . 1 1 118 118 PHE CA C 118 61.627 61.627 61.378 0.249 18112 491 1 1 . 1 1 118 118 PHE CB C 118 37.386 37.386 39.055 -1.669 18112 492 1 1 . 1 1 118 118 PHE H H 118 7.606 7.606 8.119 -0.513 18112 493 1 1 . 1 1 119 119 LEU N N 119 118.483 118.483 119.758 -1.275 18112 494 1 1 . 1 1 119 119 LEU HA H 119 3.684 3.684 4.194 -0.510 18112 495 1 1 . 1 1 119 119 LEU C C 119 178.802 178.802 179.079 -0.277 18112 496 1 1 . 1 1 119 119 LEU CA C 119 59.875 59.875 56.818 3.057 18112 497 1 1 . 1 1 119 119 LEU CB C 119 39.453 39.453 40.365 -0.912 18112 498 1 1 . 1 1 119 119 LEU H H 119 7.248 7.248 7.647 -0.399 18112 499 1 1 . 1 1 120 120 GLU N N 120 117.870 117.870 120.975 -3.105 18112 500 1 1 . 1 1 120 120 GLU C C 120 179.932 179.932 179.040 0.892 18112 501 1 1 . 1 1 120 120 GLU CA C 120 59.150 59.150 58.869 0.281 18112 502 1 1 . 1 1 120 120 GLU CB C 120 28.878 28.878 29.250 -0.371 18112 503 1 1 . 1 1 120 120 GLU H H 120 7.423 7.423 8.260 -0.837 18112 504 1 1 . 1 1 121 121 VAL N N 121 120.777 120.777 120.491 0.286 18112 505 1 1 . 1 1 121 121 VAL HA H 121 3.545 3.545 3.498 0.047 18112 506 1 1 . 1 1 121 121 VAL C C 121 179.302 179.302 177.663 1.639 18112 507 1 1 . 1 1 121 121 VAL CA C 121 66.875 66.875 66.681 0.193 18112 508 1 1 . 1 1 121 121 VAL CB C 121 30.823 30.823 31.035 -0.212 18112 509 1 1 . 1 1 121 121 VAL H H 121 8.313 8.313 7.928 0.385 18112 510 1 1 . 1 1 122 122 ALA N N 122 127.029 127.029 121.695 5.334 18112 511 1 1 . 1 1 122 122 ALA HA H 122 4.251 4.251 4.104 0.147 18112 512 1 1 . 1 1 122 122 ALA C C 122 178.366 178.366 179.770 -1.404 18112 513 1 1 . 1 1 122 122 ALA CA C 122 54.748 54.748 55.210 -0.462 18112 514 1 1 . 1 1 122 122 ALA CB C 122 16.565 16.565 18.291 -1.726 18112 515 1 1 . 1 1 122 122 ALA H H 122 8.896 8.896 7.890 1.006 18112 516 1 1 . 1 1 123 123 GLN N N 123 119.887 119.887 119.250 0.637 18112 517 1 1 . 1 1 123 123 GLN C C 123 177.908 177.908 178.503 -0.595 18112 518 1 1 . 1 1 123 123 GLN CA C 123 60.671 60.671 58.857 1.814 18112 519 1 1 . 1 1 123 123 GLN H H 123 8.349 8.349 7.664 0.685 18112 520 1 1 . 1 1 124 124 ILE N N 124 120.632 120.632 118.450 2.182 18112 521 1 1 . 1 1 124 124 ILE HA H 124 3.651 3.651 3.794 -0.143 18112 522 1 1 . 1 1 124 124 ILE C C 124 178.703 178.703 178.341 0.362 18112 523 1 1 . 1 1 124 124 ILE CA C 124 65.945 65.945 64.909 1.036 18112 524 1 1 . 1 1 124 124 ILE H H 124 8.204 8.204 8.127 0.077 18112 525 1 1 . 1 1 125 125 THR N N 125 115.084 115.084 116.274 -1.190 18112 526 1 1 . 1 1 125 125 THR C C 125 175.568 175.568 176.652 -1.084 18112 527 1 1 . 1 1 125 125 THR CA C 125 67.872 67.872 66.884 0.988 18112 528 1 1 . 1 1 125 125 THR H H 125 8.399 8.399 8.433 -0.034 18112 529 1 1 . 1 1 126 126 LEU N N 126 125.011 125.011 122.286 2.725 18112 530 1 1 . 1 1 126 126 LEU HA H 126 4.085 4.085 4.378 -0.293 18112 531 1 1 . 1 1 126 126 LEU C C 126 178.559 178.559 178.240 0.319 18112 532 1 1 . 1 1 126 126 LEU CA C 126 58.843 58.843 57.678 1.165 18112 533 1 1 . 1 1 126 126 LEU CB C 126 41.421 41.421 41.833 -0.412 18112 534 1 1 . 1 1 126 126 LEU H H 126 8.728 8.728 8.119 0.609 18112 535 1 1 . 1 1 127 127 ARG N N 127 117.076 117.076 120.094 -3.018 18112 536 1 1 . 1 1 127 127 ARG HA H 127 3.929 3.929 3.972 -0.043 18112 537 1 1 . 1 1 127 127 ARG C C 127 177.984 177.984 178.630 -0.646 18112 538 1 1 . 1 1 127 127 ARG CA C 127 60.685 60.685 60.018 0.667 18112 539 1 1 . 1 1 127 127 ARG CB C 127 28.079 28.079 30.043 -1.964 18112 540 1 1 . 1 1 127 127 ARG H H 127 8.213 8.213 8.359 -0.146 18112 541 1 1 . 1 1 128 128 GLU N N 128 118.617 118.617 118.758 -0.141 18112 542 1 1 . 1 1 128 128 GLU HA H 128 4.147 4.147 4.191 -0.044 18112 543 1 1 . 1 1 128 128 GLU C C 128 181.150 181.150 179.332 1.818 18112 544 1 1 . 1 1 128 128 GLU CA C 128 59.508 59.508 58.792 0.716 18112 545 1 1 . 1 1 128 128 GLU H H 128 8.478 8.478 8.001 0.477 18112 546 1 1 . 1 1 129 129 PHE N N 129 119.267 119.267 120.964 -1.697 18112 547 1 1 . 1 1 129 129 PHE HA H 129 4.104 4.104 4.314 -0.210 18112 548 1 1 . 1 1 129 129 PHE C C 129 177.170 177.170 177.588 -0.418 18112 549 1 1 . 1 1 129 129 PHE CA C 129 63.694 63.694 62.312 1.382 18112 550 1 1 . 1 1 129 129 PHE H H 129 8.570 8.570 8.504 0.066 18112 551 1 1 . 1 1 130 130 PHE N N 130 118.739 118.739 119.865 -1.126 18112 552 1 1 . 1 1 130 130 PHE HA H 130 3.884 3.884 4.038 -0.154 18112 553 1 1 . 1 1 130 130 PHE C C 130 175.860 175.860 177.157 -1.297 18112 554 1 1 . 1 1 130 130 PHE CA C 130 62.819 62.819 62.017 0.802 18112 555 1 1 . 1 1 130 130 PHE H H 130 8.740 8.740 8.770 -0.030 18112 556 1 1 . 1 1 131 131 ASN N N 131 116.028 116.028 118.039 -2.011 18112 557 1 1 . 1 1 131 131 ASN HA H 131 4.373 4.373 4.340 0.033 18112 558 1 1 . 1 1 131 131 ASN C C 131 178.228 178.228 177.592 0.636 18112 559 1 1 . 1 1 131 131 ASN CA C 131 55.150 55.150 56.283 -1.133 18112 560 1 1 . 1 1 131 131 ASN H H 131 8.864 8.864 8.496 0.368 18112 561 1 1 . 1 1 132 132 ALA N N 132 120.922 120.922 122.783 -1.861 18112 562 1 1 . 1 1 132 132 ALA HA H 132 4.020 4.020 4.079 -0.059 18112 563 1 1 . 1 1 132 132 ALA C C 132 178.515 178.515 179.814 -1.299 18112 564 1 1 . 1 1 132 132 ALA CA C 132 54.924 54.924 55.100 -0.176 18112 565 1 1 . 1 1 132 132 ALA CB C 132 18.441 18.441 18.596 -0.155 18112 566 1 1 . 1 1 132 132 ALA H H 132 7.745 7.745 7.741 0.004 18112 567 1 1 . 1 1 133 133 ILE N N 133 118.200 118.200 119.552 -1.352 18112 568 1 1 . 1 1 133 133 ILE HA H 133 3.235 3.235 3.964 -0.729 18112 569 1 1 . 1 1 133 133 ILE C C 133 180.606 180.606 178.373 2.233 18112 570 1 1 . 1 1 133 133 ILE CA C 133 65.215 65.215 64.402 0.813 18112 571 1 1 . 1 1 133 133 ILE CB C 133 38.291 38.291 37.669 0.622 18112 572 1 1 . 1 1 133 133 ILE H H 133 7.999 7.999 7.949 0.050 18112 573 1 1 . 1 1 134 134 ILE N N 134 122.564 122.564 120.132 2.432 18112 574 1 1 . 1 1 134 134 ILE HA H 134 3.788 3.788 3.588 0.200 18112 575 1 1 . 1 1 134 134 ILE C C 134 177.215 177.215 176.838 0.377 18112 576 1 1 . 1 1 134 134 ILE CA C 134 63.584 63.584 63.811 -0.227 18112 577 1 1 . 1 1 134 134 ILE CB C 134 35.636 35.636 37.568 -1.932 18112 578 1 1 . 1 1 134 134 ILE H H 134 8.670 8.670 7.940 0.730 18112 579 1 1 . 1 1 135 135 ALA N N 135 119.989 119.989 119.855 0.134 18112 580 1 1 . 1 1 135 135 ALA HA H 135 4.357 4.357 4.286 0.071 18112 581 1 1 . 1 1 135 135 ALA C C 135 177.786 177.786 177.818 -0.032 18112 582 1 1 . 1 1 135 135 ALA CA C 135 51.521 51.521 52.280 -0.759 18112 583 1 1 . 1 1 135 135 ALA CB C 135 18.839 18.839 19.904 -1.065 18112 584 1 1 . 1 1 135 135 ALA H H 135 6.898 6.898 7.859 -0.961 18112 585 1 1 . 1 1 136 136 GLY N N 136 107.682 107.682 106.844 0.838 18112 586 1 1 . 1 1 136 136 GLY C C 136 176.324 176.324 175.194 1.130 18112 587 1 1 . 1 1 136 136 GLY CA C 136 45.469 45.469 44.941 0.528 18112 588 1 1 . 1 1 136 136 GLY H H 136 7.913 7.913 7.759 0.154 18112 589 1 1 . 1 1 137 137 LYS N N 137 117.213 117.213 120.182 -2.969 18112 590 1 1 . 1 1 137 137 LYS HA H 137 4.004 4.004 4.321 -0.317 18112 591 1 1 . 1 1 137 137 LYS C C 137 176.616 176.616 177.747 -1.131 18112 592 1 1 . 1 1 137 137 LYS CA C 137 57.499 57.499 56.746 0.753 18112 593 1 1 . 1 1 137 137 LYS CB C 137 30.927 30.927 32.816 -1.889 18112 594 1 1 . 1 1 137 137 LYS H H 137 8.312 8.312 8.184 0.128 18112 595 1 1 . 1 1 138 138 ASP N N 138 113.545 113.545 119.157 -5.612 18112 596 1 1 . 1 1 138 138 ASP HA H 138 3.061 3.061 3.170 -0.109 18112 597 1 1 . 1 1 138 138 ASP C C 138 174.698 174.698 176.375 -1.677 18112 598 1 1 . 1 1 138 138 ASP CA C 138 53.694 53.694 56.002 -2.308 18112 599 1 1 . 1 1 138 138 ASP CB C 138 36.008 36.008 39.543 -3.535 18112 600 1 1 . 1 1 138 138 ASP H H 138 8.465 8.465 7.712 0.753 18112 601 1 1 . 1 1 139 139 VAL N N 139 115.191 115.191 111.680 3.511 18112 602 1 1 . 1 1 139 139 VAL HA H 139 3.886 3.886 3.941 -0.055 18112 603 1 1 . 1 1 139 139 VAL C C 139 175.889 175.889 176.042 -0.153 18112 604 1 1 . 1 1 139 139 VAL CA C 139 62.793 62.793 62.356 0.437 18112 605 1 1 . 1 1 139 139 VAL CB C 139 30.662 30.662 31.768 -1.106 18112 606 1 1 . 1 1 139 139 VAL H H 139 6.610 6.610 7.203 -0.593 18112 607 1 1 . 1 1 140 140 ASP N N 140 123.363 123.363 122.013 1.350 18112 608 1 1 . 1 1 140 140 ASP C C 140 175.234 175.234 175.437 -0.203 18112 609 1 1 . 1 1 140 140 ASP CA C 140 50.221 50.221 51.266 -1.045 18112 610 1 1 . 1 1 140 140 ASP CB C 140 42.254 42.254 42.908 -0.654 18112 611 1 1 . 1 1 140 140 ASP H H 140 7.553 7.553 7.420 0.133 18112 612 1 1 . 1 1 141 141 PRO HA H 141 4.682 4.682 4.383 0.299 18112 613 1 1 . 1 1 141 141 PRO C C 141 178.678 178.678 178.151 0.527 18112 614 1 1 . 1 1 141 141 PRO CA C 141 64.532 64.532 65.108 -0.576 18112 615 1 1 . 1 1 141 141 PRO CB C 141 31.331 31.331 32.139 -0.808 18112 616 1 1 . 1 1 142 142 SER N N 142 114.421 114.421 114.055 0.366 18112 617 1 1 . 1 1 142 142 SER HA H 142 4.565 4.565 4.379 0.186 18112 618 1 1 . 1 1 142 142 SER C C 142 176.524 176.524 176.110 0.414 18112 619 1 1 . 1 1 142 142 SER CA C 142 58.711 58.711 61.262 -2.551 18112 620 1 1 . 1 1 142 142 SER CB C 142 62.783 62.783 62.687 0.096 18112 621 1 1 . 1 1 142 142 SER H H 142 8.703 8.703 8.299 0.404 18112 622 1 1 . 1 1 143 143 TRP N N 143 123.598 123.598 122.880 0.718 18112 623 1 1 . 1 1 143 143 TRP HA H 143 4.136 4.136 4.199 -0.063 18112 624 1 1 . 1 1 143 143 TRP C C 143 177.113 177.113 176.743 0.370 18112 625 1 1 . 1 1 143 143 TRP CA C 143 59.803 59.803 59.337 0.466 18112 626 1 1 . 1 1 143 143 TRP CB C 143 26.364 26.364 27.919 -1.555 18112 627 1 1 . 1 1 143 143 TRP H H 143 8.374 8.374 8.076 0.298 18112 628 1 1 . 1 1 144 144 LYS N N 144 119.293 119.293 119.155 0.138 18112 629 1 1 . 1 1 144 144 LYS HA H 144 2.719 2.719 3.033 -0.314 18112 630 1 1 . 1 1 144 144 LYS C C 144 177.243 177.243 178.213 -0.970 18112 631 1 1 . 1 1 144 144 LYS CA C 144 58.851 58.851 58.798 0.053 18112 632 1 1 . 1 1 144 144 LYS CB C 144 29.373 29.373 31.273 -1.900 18112 633 1 1 . 1 1 144 144 LYS H H 144 7.196 7.196 7.029 0.167 18112 634 1 1 . 1 1 145 145 LYS N N 145 116.440 116.440 120.873 -4.433 18112 635 1 1 . 1 1 145 145 LYS HA H 145 3.490 3.490 3.665 -0.175 18112 636 1 1 . 1 1 145 145 LYS C C 145 179.149 179.149 178.589 0.560 18112 637 1 1 . 1 1 145 145 LYS CA C 145 59.271 59.271 58.741 0.530 18112 638 1 1 . 1 1 145 145 LYS CB C 145 30.521 30.521 31.709 -1.188 18112 639 1 1 . 1 1 145 145 LYS H H 145 7.389 7.389 7.713 -0.324 18112 640 1 1 . 1 1 146 146 ALA N N 146 118.582 118.582 121.307 -2.725 18112 641 1 1 . 1 1 146 146 ALA HA H 146 3.932 3.932 4.009 -0.077 18112 642 1 1 . 1 1 146 146 ALA C C 146 179.968 179.968 179.760 0.208 18112 643 1 1 . 1 1 146 146 ALA CA C 146 54.241 54.241 54.907 -0.666 18112 644 1 1 . 1 1 146 146 ALA CB C 146 17.689 17.689 18.085 -0.396 18112 645 1 1 . 1 1 146 146 ALA H H 146 7.112 7.112 7.718 -0.606 18112 646 1 1 . 1 1 147 147 ILE N N 147 118.537 118.537 119.455 -0.918 18112 647 1 1 . 1 1 147 147 ILE HA H 147 3.642 3.642 3.503 0.139 18112 648 1 1 . 1 1 147 147 ILE C C 147 178.919 178.919 178.182 0.737 18112 649 1 1 . 1 1 147 147 ILE CA C 147 64.418 64.418 63.769 0.649 18112 650 1 1 . 1 1 147 147 ILE CB C 147 36.519 36.519 36.111 0.408 18112 651 1 1 . 1 1 147 147 ILE H H 147 6.734 6.734 7.621 -0.887 18112 652 1 1 . 1 1 148 148 TYR N N 148 121.033 121.033 117.796 3.237 18112 653 1 1 . 1 1 148 148 TYR HA H 148 4.489 4.489 4.181 0.308 18112 654 1 1 . 1 1 148 148 TYR C C 148 178.348 178.348 178.517 -0.169 18112 655 1 1 . 1 1 148 148 TYR CA C 148 57.389 57.389 59.548 -2.159 18112 656 1 1 . 1 1 148 148 TYR CB C 148 35.280 35.280 37.006 -1.726 18112 657 1 1 . 1 1 148 148 TYR H H 148 8.126 8.126 7.876 0.250 18112 658 1 1 . 1 1 149 149 LYS N N 149 114.484 114.484 120.402 -5.918 18112 659 1 1 . 1 1 149 149 LYS C C 149 178.051 178.051 178.600 -0.549 18112 660 1 1 . 1 1 149 149 LYS CA C 149 59.036 59.036 59.997 -0.961 18112 661 1 1 . 1 1 149 149 LYS CB C 149 31.575 31.575 32.478 -0.903 18112 662 1 1 . 1 1 149 149 LYS H H 149 7.364 7.364 7.965 -0.601 18112 663 1 1 . 1 1 150 150 VAL N N 150 117.812 117.812 116.745 1.067 18112 664 1 1 . 1 1 150 150 VAL HA H 150 3.770 3.770 3.739 0.031 18112 665 1 1 . 1 1 150 150 VAL C C 150 178.786 178.786 178.037 0.749 18112 666 1 1 . 1 1 150 150 VAL CA C 150 65.070 65.070 65.701 -0.631 18112 667 1 1 . 1 1 150 150 VAL CB C 150 29.515 29.515 31.524 -2.009 18112 668 1 1 . 1 1 150 150 VAL H H 150 7.254 7.254 7.880 -0.626 18112 669 1 1 . 1 1 151 151 ILE N N 151 117.884 117.884 115.975 1.909 18112 670 1 1 . 1 1 151 151 ILE C C 151 180.539 180.539 177.385 3.154 18112 671 1 1 . 1 1 151 151 ILE CA C 151 61.490 61.490 63.894 -2.404 18112 672 1 1 . 1 1 151 151 ILE CB C 151 33.994 33.994 37.511 -3.517 18112 673 1 1 . 1 1 151 151 ILE H H 151 8.154 8.154 7.925 0.229 18112 674 1 1 . 1 1 152 152 CYS N N 152 118.649 118.649 121.587 -2.938 18112 675 1 1 . 1 1 152 152 CYS HA H 152 4.153 4.153 4.482 -0.329 18112 676 1 1 . 1 1 152 152 CYS C C 152 174.888 174.888 176.849 -1.961 18112 677 1 1 . 1 1 152 152 CYS CA C 152 61.052 61.052 60.926 0.126 18112 678 1 1 . 1 1 152 152 CYS CB C 152 36.364 36.364 27.838 8.526 18112 679 1 1 . 1 1 152 152 CYS H H 152 8.711 8.711 8.241 0.470 18112 680 1 1 . 1 1 153 153 LYS N N 153 118.498 118.498 120.101 -1.603 18112 681 1 1 . 1 1 153 153 LYS C C 153 177.389 177.389 177.693 -0.304 18112 682 1 1 . 1 1 153 153 LYS CA C 153 56.243 56.243 58.594 -2.351 18112 683 1 1 . 1 1 153 153 LYS CB C 153 31.343 31.343 32.113 -0.770 18112 684 1 1 . 1 1 153 153 LYS H H 153 6.782 6.782 7.853 -1.071 18112 685 1 1 . 1 1 154 154 LEU N N 154 117.318 117.318 118.006 -0.688 18112 686 1 1 . 1 1 154 154 LEU HA H 154 4.576 4.576 4.222 0.354 18112 687 1 1 . 1 1 154 154 LEU C C 154 177.161 177.161 177.735 -0.574 18112 688 1 1 . 1 1 154 154 LEU CA C 154 53.782 53.782 56.699 -2.917 18112 689 1 1 . 1 1 154 154 LEU CB C 154 40.881 40.881 42.596 -1.715 18112 690 1 1 . 1 1 154 154 LEU H H 154 7.616 7.616 7.481 0.135 18112 691 1 1 . 1 1 155 155 ASP N N 155 121.564 121.564 117.905 3.659 18112 692 1 1 . 1 1 155 155 ASP C C 155 177.094 177.094 175.720 1.374 18112 693 1 1 . 1 1 155 155 ASP CA C 155 55.732 55.732 53.633 2.099 18112 694 1 1 . 1 1 155 155 ASP CB C 155 40.139 40.139 42.212 -2.073 18112 695 1 1 . 1 1 155 155 ASP H H 155 7.582 7.582 7.729 -0.147 18112 696 1 1 . 1 1 156 156 SER N N 156 117.352 117.352 115.884 1.468 18112 697 1 1 . 1 1 156 156 SER HA H 156 4.818 4.818 4.644 0.174 18112 698 1 1 . 1 1 156 156 SER C C 156 173.409 173.409 174.622 -1.213 18112 699 1 1 . 1 1 156 156 SER CA C 156 57.073 57.073 60.353 -3.280 18112 700 1 1 . 1 1 156 156 SER CB C 156 65.150 65.150 63.971 1.179 18112 701 1 1 . 1 1 156 156 SER H H 156 8.846 8.846 8.537 0.309 18112 702 1 1 . 1 1 157 157 GLU N N 157 120.688 120.688 118.718 1.970 18112 703 1 1 . 1 1 157 157 GLU HA H 157 4.038 4.038 4.620 -0.582 18112 704 1 1 . 1 1 157 157 GLU C C 157 176.332 176.332 174.826 1.506 18112 705 1 1 . 1 1 157 157 GLU CA C 157 56.464 56.464 54.703 1.761 18112 706 1 1 . 1 1 157 157 GLU CB C 157 29.206 29.206 32.057 -2.851 18112 707 1 1 . 1 1 157 157 GLU H H 157 8.356 8.356 7.720 0.636 18112 708 1 1 . 1 1 158 158 VAL N N 158 126.906 126.906 122.275 4.631 18112 709 1 1 . 1 1 158 158 VAL HA H 158 3.449 3.449 4.365 -0.916 18112 710 1 1 . 1 1 158 158 VAL C C 158 176.382 176.382 175.426 0.956 18112 711 1 1 . 1 1 158 158 VAL CA C 158 59.584 59.584 59.670 -0.086 18112 712 1 1 . 1 1 158 158 VAL CB C 158 31.160 31.160 31.130 0.030 18112 713 1 1 . 1 1 158 158 VAL H H 158 8.561 8.561 8.554 0.007 18112 714 1 1 . 1 1 159 159 PRO HA H 159 4.403 4.403 4.610 -0.207 18112 715 1 1 . 1 1 159 159 PRO C C 159 176.757 176.757 176.265 0.492 18112 716 1 1 . 1 1 159 159 PRO CA C 159 63.845 63.845 63.155 0.690 18112 717 1 1 . 1 1 159 159 PRO CB C 159 32.106 32.106 32.233 -0.127 18112 718 1 1 . 1 1 160 160 GLU N N 160 122.904 122.904 119.547 3.357 18112 719 1 1 . 1 1 160 160 GLU HA H 160 4.008 4.008 4.416 -0.408 18112 720 1 1 . 1 1 160 160 GLU C C 160 179.132 179.132 174.556 4.576 18112 721 1 1 . 1 1 160 160 GLU CA C 160 59.407 59.407 54.914 4.493 18112 722 1 1 . 1 1 160 160 GLU CB C 160 28.991 28.991 31.213 -2.223 18112 723 1 1 . 1 1 160 160 GLU H H 160 8.650 8.650 7.803 0.847 18112 724 1 1 . 1 1 161 161 ILE N N 161 119.782 119.782 125.913 -6.131 18112 725 1 1 . 1 1 161 161 ILE HA H 161 4.146 4.146 3.963 0.183 18112 726 1 1 . 1 1 161 161 ILE C C 161 176.176 176.176 175.321 0.855 18112 727 1 1 . 1 1 161 161 ILE CA C 161 62.034 62.034 60.330 1.704 18112 728 1 1 . 1 1 161 161 ILE CB C 161 37.113 37.113 39.033 -1.920 18112 729 1 1 . 1 1 161 161 ILE H H 161 8.448 8.448 8.487 -0.039 18112 730 1 1 . 1 1 162 162 PHE N N 162 117.594 117.594 127.294 -9.700 18112 731 1 1 . 1 1 162 162 PHE C C 162 176.115 176.115 177.473 -1.358 18112 732 1 1 . 1 1 162 162 PHE CA C 162 61.009 61.009 59.435 1.574 18112 733 1 1 . 1 1 162 162 PHE CB C 162 38.394 38.394 38.803 -0.409 18112 734 1 1 . 1 1 162 162 PHE H H 162 8.145 8.145 8.522 -0.377 18112 735 1 1 . 1 1 163 163 LYS N N 163 116.083 116.083 120.146 -4.063 18112 736 1 1 . 1 1 163 163 LYS C C 163 178.196 178.196 176.030 2.166 18112 737 1 1 . 1 1 163 163 LYS CA C 163 58.136 58.136 58.547 -0.411 18112 738 1 1 . 1 1 163 163 LYS CB C 163 31.694 31.694 32.744 -1.050 18112 739 1 1 . 1 1 163 163 LYS H H 163 8.232 8.232 8.055 0.177 18112 740 1 1 . 1 1 164 164 SER N N 164 113.680 113.680 111.158 2.522 18112 741 1 1 . 1 1 164 164 SER CA C 164 55.205 55.205 56.790 -1.585 18112 742 1 1 . 1 1 164 164 SER CB C 164 63.265 63.265 64.994 -1.729 18112 743 1 1 . 1 1 164 164 SER H H 164 7.708 7.708 7.583 0.125 18112 744 1 1 . 1 1 165 165 PRO HA H 165 4.580 4.580 4.122 0.458 18112 745 1 1 . 1 1 165 165 PRO C C 165 177.541 177.541 177.488 0.053 18112 746 1 1 . 1 1 165 165 PRO CA C 165 63.950 63.950 65.066 -1.116 18112 747 1 1 . 1 1 165 165 PRO CB C 165 30.686 30.686 32.047 -1.361 18112 748 1 1 . 1 1 166 166 ASN N N 166 116.304 116.304 115.898 0.406 18112 749 1 1 . 1 1 166 166 ASN HA H 166 5.029 5.029 4.704 0.325 18112 750 1 1 . 1 1 166 166 ASN C C 166 175.811 175.811 175.221 0.590 18112 751 1 1 . 1 1 166 166 ASN CA C 166 51.962 51.962 53.465 -1.503 18112 752 1 1 . 1 1 166 166 ASN CB C 166 37.915 37.915 38.128 -0.213 18112 753 1 1 . 1 1 166 166 ASN H H 166 8.216 8.216 8.770 -0.554 18112 754 1 1 . 1 1 167 167 CYS N N 167 116.078 116.078 118.907 -2.829 18112 755 1 1 . 1 1 167 167 CYS HA H 167 4.011 4.011 4.822 -0.811 18112 756 1 1 . 1 1 167 167 CYS C C 167 175.057 175.057 174.830 0.227 18112 757 1 1 . 1 1 167 167 CYS CA C 167 59.816 59.816 57.327 2.489 18112 758 1 1 . 1 1 167 167 CYS CB C 167 27.446 27.446 29.044 -1.598 18112 759 1 1 . 1 1 167 167 CYS H H 167 7.246 7.246 7.944 -0.698 18112 760 1 1 . 1 1 168 168 LEU N N 168 120.082 120.082 122.788 -2.706 18112 761 1 1 . 1 1 168 168 LEU HA H 168 3.880 3.880 4.142 -0.262 18112 762 1 1 . 1 1 168 168 LEU C C 168 178.541 178.541 177.870 0.671 18112 763 1 1 . 1 1 168 168 LEU CA C 168 57.734 57.734 58.000 -0.266 18112 764 1 1 . 1 1 168 168 LEU CB C 168 38.825 38.825 41.181 -2.356 18112 765 1 1 . 1 1 168 168 LEU H H 168 8.451 8.451 7.391 1.060 18112 766 1 1 . 1 1 169 169 GLN N N 169 116.700 116.700 119.216 -2.516 18112 767 1 1 . 1 1 169 169 GLN HA H 169 4.064 4.064 3.991 0.073 18112 768 1 1 . 1 1 169 169 GLN C C 169 177.378 177.378 178.565 -1.187 18112 769 1 1 . 1 1 169 169 GLN CA C 169 57.675 57.675 58.923 -1.248 18112 770 1 1 . 1 1 169 169 GLN CB C 169 27.710 27.710 28.012 -0.302 18112 771 1 1 . 1 1 169 169 GLN H H 169 7.665 7.665 8.568 -0.903 18112 772 1 1 . 1 1 170 170 GLU N N 170 116.701 116.701 117.594 -0.893 18112 773 1 1 . 1 1 170 170 GLU HA H 170 4.214 4.214 4.168 0.046 18112 774 1 1 . 1 1 170 170 GLU C C 170 177.730 177.730 177.719 0.011 18112 775 1 1 . 1 1 170 170 GLU CA C 170 56.899 56.899 57.985 -1.086 18112 776 1 1 . 1 1 170 170 GLU H H 170 7.405 7.405 7.645 -0.240 18112 777 1 1 . 1 1 171 171 LEU N N 171 118.021 118.021 117.471 0.550 18112 778 1 1 . 1 1 171 171 LEU HA H 171 4.209 4.209 4.312 -0.103 18112 779 1 1 . 1 1 171 171 LEU C C 171 177.005 177.005 177.221 -0.216 18112 780 1 1 . 1 1 171 171 LEU CA C 171 55.870 55.870 56.492 -0.622 18112 781 1 1 . 1 1 171 171 LEU CB C 171 43.680 43.680 42.398 1.282 18112 782 1 1 . 1 1 171 171 LEU H H 171 7.823 7.823 7.393 0.430 18112 783 1 1 . 1 1 172 172 LEU N N 172 117.580 117.580 119.853 -2.273 18112 784 1 1 . 1 1 172 172 LEU HA H 172 4.571 4.571 4.313 0.258 18112 785 1 1 . 1 1 172 172 LEU C C 172 176.411 176.411 175.957 0.454 18112 786 1 1 . 1 1 172 172 LEU CA C 172 53.972 53.972 54.467 -0.495 18112 787 1 1 . 1 1 172 172 LEU CB C 172 40.483 40.483 39.317 1.166 18112 788 1 1 . 1 1 172 172 LEU H H 172 7.306 7.306 7.413 -0.107 18112 789 1 1 . 1 1 173 173 HIS N N 173 123.310 123.310 119.572 3.738 18112 790 1 1 . 1 1 173 173 HIS C C 173 179.022 179.022 173.804 5.218 18112 791 1 1 . 1 1 173 173 HIS CA C 173 56.693 56.693 55.046 1.647 18112 792 1 1 . 1 1 173 173 HIS CB C 173 29.371 29.371 31.313 -1.942 18112 793 1 1 . 1 1 173 173 HIS H H 173 8.028 8.028 7.784 0.244 18112 794 1 2 . 1 1 12 12 ALA N N 12 125.167 125.167 125.832 -0.665 18112 795 1 2 . 1 1 12 12 ALA C C 12 177.566 177.566 176.567 0.999 18112 796 1 2 . 1 1 12 12 ALA CA C 12 52.067 52.067 51.828 0.239 18112 797 1 2 . 1 1 12 12 ALA CB C 12 18.456 18.456 18.466 -0.010 18112 798 1 2 . 1 1 12 12 ALA H H 12 8.311 8.311 7.801 0.510 18112 799 1 2 . 1 1 13 13 MET N N 13 119.278 119.278 121.391 -2.113 18112 800 1 2 . 1 1 13 13 MET C C 13 176.325 176.325 176.128 0.197 18112 801 1 2 . 1 1 13 13 MET CA C 13 54.992 54.992 53.914 1.078 18112 802 1 2 . 1 1 13 13 MET CB C 13 32.308 32.308 33.559 -1.250 18112 803 1 2 . 1 1 13 13 MET H H 13 8.269 8.269 7.811 0.458 18112 804 1 2 . 1 1 14 14 GLN N N 14 120.869 120.869 124.038 -3.169 18112 805 1 2 . 1 1 14 14 GLN HA H 14 4.399 4.399 4.379 0.020 18112 806 1 2 . 1 1 14 14 GLN C C 14 175.644 175.644 175.127 0.517 18112 807 1 2 . 1 1 14 14 GLN CA C 14 55.139 55.139 56.017 -0.878 18112 808 1 2 . 1 1 14 14 GLN CB C 14 29.051 29.051 27.007 2.044 18112 809 1 2 . 1 1 14 14 GLN H H 14 8.501 8.501 8.859 -0.358 18112 810 1 2 . 1 1 15 15 GLU N N 15 122.042 122.042 122.797 -0.755 18112 811 1 2 . 1 1 15 15 GLU C C 15 176.242 176.242 177.140 -0.898 18112 812 1 2 . 1 1 15 15 GLU CA C 15 56.064 56.064 56.216 -0.152 18112 813 1 2 . 1 1 15 15 GLU CB C 15 29.302 29.302 29.913 -0.611 18112 814 1 2 . 1 1 15 15 GLU H H 15 8.547 8.547 8.075 0.472 18112 815 1 2 . 1 1 16 16 GLY N N 16 108.821 108.821 107.979 0.842 18112 816 1 2 . 1 1 16 16 GLY C C 16 172.949 172.949 174.921 -1.972 18112 817 1 2 . 1 1 16 16 GLY CA C 16 44.227 44.227 44.838 -0.611 18112 818 1 2 . 1 1 16 16 GLY H H 16 8.100 8.100 8.295 -0.195 18112 819 1 2 . 1 1 17 17 LEU N N 17 120.315 120.315 123.611 -3.296 18112 820 1 2 . 1 1 17 17 LEU C C 17 177.334 177.334 176.968 0.366 18112 821 1 2 . 1 1 17 17 LEU CA C 17 53.544 53.544 56.732 -3.188 18112 822 1 2 . 1 1 17 17 LEU CB C 17 42.140 42.140 42.376 -0.236 18112 823 1 2 . 1 1 17 17 LEU H H 17 8.222 8.222 8.828 -0.606 18112 824 1 2 . 1 1 18 18 SER N N 18 126.547 126.547 109.179 17.368 18112 825 1 2 . 1 1 18 18 SER CA C 18 56.851 56.851 56.860 -0.009 18112 826 1 2 . 1 1 18 18 SER CB C 18 64.636 64.636 64.859 -0.223 18112 827 1 2 . 1 1 18 18 SER H H 18 11.627 11.627 7.764 3.863 18112 828 1 2 . 1 1 19 19 PRO C C 19 175.118 175.118 178.224 -3.106 18112 829 1 2 . 1 1 20 20 ASN N N 20 121.372 121.372 114.660 6.712 18112 830 1 2 . 1 1 20 20 ASN H H 20 8.172 8.172 8.969 -0.797 18112 831 1 2 . 1 1 25 25 ALA CB C 25 18.020 18.020 18.622 -0.602 18112 832 1 2 . 1 1 26 26 LYS N N 26 118.490 118.490 118.239 0.251 18112 833 1 2 . 1 1 26 26 LYS CA C 26 56.146 56.146 59.146 -3.000 18112 834 1 2 . 1 1 26 26 LYS H H 26 6.794 6.794 7.894 -1.100 18112 835 1 2 . 1 1 31 31 TYR HA H 31 4.398 4.398 4.309 0.089 18112 836 1 2 . 1 1 31 31 TYR C C 31 173.714 173.714 173.861 -0.147 18112 837 1 2 . 1 1 31 31 TYR CA C 31 59.757 59.757 59.458 0.299 18112 838 1 2 . 1 1 32 32 THR N N 32 111.928 111.928 111.762 0.166 18112 839 1 2 . 1 1 32 32 THR HA H 32 4.209 4.209 4.583 -0.374 18112 840 1 2 . 1 1 32 32 THR C C 32 171.061 171.061 172.649 -1.588 18112 841 1 2 . 1 1 32 32 THR CA C 32 56.905 56.905 62.257 -5.352 18112 842 1 2 . 1 1 32 32 THR CB C 32 69.707 69.707 71.181 -1.474 18112 843 1 2 . 1 1 32 32 THR H H 32 8.237 8.237 7.124 1.113 18112 844 1 2 . 1 1 33 33 ARG N N 33 124.856 124.856 123.461 1.395 18112 845 1 2 . 1 1 33 33 ARG C C 33 176.451 176.451 175.337 1.114 18112 846 1 2 . 1 1 33 33 ARG CA C 33 55.627 55.627 54.765 0.862 18112 847 1 2 . 1 1 33 33 ARG CB C 33 29.861 29.861 32.589 -2.728 18112 848 1 2 . 1 1 33 33 ARG H H 33 9.159 9.159 8.222 0.937 18112 849 1 2 . 1 1 34 34 TYR N N 34 117.908 117.908 117.380 0.528 18112 850 1 2 . 1 1 34 34 TYR CA C 34 55.320 55.320 59.251 -3.931 18112 851 1 2 . 1 1 34 34 TYR H H 34 8.995 8.995 7.637 1.358 18112 852 1 2 . 1 1 35 35 PRO C C 35 177.280 177.280 177.691 -0.411 18112 853 1 2 . 1 1 36 36 SER N N 36 116.410 116.410 120.340 -3.930 18112 854 1 2 . 1 1 36 36 SER C C 36 178.938 178.938 176.360 2.578 18112 855 1 2 . 1 1 36 36 SER CA C 36 64.815 64.815 62.380 2.435 18112 856 1 2 . 1 1 36 36 SER H H 36 8.106 8.106 8.792 -0.686 18112 857 1 2 . 1 1 37 37 SER N N 37 117.488 117.488 114.892 2.596 18112 858 1 2 . 1 1 37 37 SER C C 37 177.698 177.698 176.332 1.366 18112 859 1 2 . 1 1 37 37 SER CA C 37 61.357 61.357 61.307 0.050 18112 860 1 2 . 1 1 37 37 SER CB C 37 68.118 68.118 62.527 5.591 18112 861 1 2 . 1 1 37 37 SER H H 37 8.169 8.169 8.484 -0.315 18112 862 1 2 . 1 1 38 38 ASN N N 38 115.638 115.638 121.706 -6.068 18112 863 1 2 . 1 1 38 38 ASN HA H 38 4.259 4.259 4.373 -0.114 18112 864 1 2 . 1 1 38 38 ASN C C 38 177.868 177.868 177.523 0.345 18112 865 1 2 . 1 1 38 38 ASN CA C 38 55.907 55.907 55.506 0.401 18112 866 1 2 . 1 1 38 38 ASN CB C 38 37.230 37.230 38.139 -0.909 18112 867 1 2 . 1 1 38 38 ASN H H 38 8.284 8.284 7.631 0.653 18112 868 1 2 . 1 1 39 39 MET N N 39 121.352 121.352 120.373 0.979 18112 869 1 2 . 1 1 39 39 MET HA H 39 4.170 4.170 3.751 0.419 18112 870 1 2 . 1 1 39 39 MET C C 39 179.068 179.068 178.085 0.983 18112 871 1 2 . 1 1 39 39 MET CA C 39 58.751 58.751 57.969 0.782 18112 872 1 2 . 1 1 39 39 MET CB C 39 31.850 31.850 31.834 0.016 18112 873 1 2 . 1 1 39 39 MET H H 39 7.857 7.857 7.528 0.329 18112 874 1 2 . 1 1 40 40 LEU N N 40 118.936 118.936 120.483 -1.547 18112 875 1 2 . 1 1 40 40 LEU HA H 40 4.139 4.139 4.115 0.024 18112 876 1 2 . 1 1 40 40 LEU C C 40 178.700 178.700 178.599 0.101 18112 877 1 2 . 1 1 40 40 LEU CA C 40 58.455 58.455 58.656 -0.201 18112 878 1 2 . 1 1 40 40 LEU CB C 40 40.304 40.304 41.642 -1.338 18112 879 1 2 . 1 1 40 40 LEU H H 40 8.167 8.167 8.227 -0.060 18112 880 1 2 . 1 1 41 41 LYS N N 41 116.791 116.791 117.750 -0.959 18112 881 1 2 . 1 1 41 41 LYS HA H 41 3.475 3.475 4.328 -0.853 18112 882 1 2 . 1 1 41 41 LYS C C 41 178.793 178.793 178.902 -0.109 18112 883 1 2 . 1 1 41 41 LYS CA C 41 59.161 59.161 59.435 -0.274 18112 884 1 2 . 1 1 41 41 LYS CB C 41 30.992 30.992 32.315 -1.323 18112 885 1 2 . 1 1 41 41 LYS H H 41 7.632 7.632 8.031 -0.399 18112 886 1 2 . 1 1 42 42 THR N N 42 112.819 112.819 115.196 -2.377 18112 887 1 2 . 1 1 42 42 THR HA H 42 4.230 4.230 4.143 0.087 18112 888 1 2 . 1 1 42 42 THR C C 42 176.142 176.142 175.997 0.145 18112 889 1 2 . 1 1 42 42 THR CA C 42 65.107 65.107 66.281 -1.174 18112 890 1 2 . 1 1 42 42 THR CB C 42 68.306 68.306 68.697 -0.391 18112 891 1 2 . 1 1 42 42 THR H H 42 7.469 7.469 8.008 -0.539 18112 892 1 2 . 1 1 43 43 TYR N N 43 118.565 118.565 118.098 0.467 18112 893 1 2 . 1 1 43 43 TYR HA H 43 4.204 4.204 4.524 -0.320 18112 894 1 2 . 1 1 43 43 TYR C C 43 174.240 174.240 176.975 -2.735 18112 895 1 2 . 1 1 43 43 TYR CA C 43 60.886 60.886 57.484 3.402 18112 896 1 2 . 1 1 43 43 TYR CB C 43 38.165 38.165 38.743 -0.578 18112 897 1 2 . 1 1 43 43 TYR H H 43 7.978 7.978 7.702 0.276 18112 898 1 2 . 1 1 44 44 PHE N N 44 120.980 120.980 119.720 1.260 18112 899 1 2 . 1 1 44 44 PHE HA H 44 4.920 4.920 5.248 -0.328 18112 900 1 2 . 1 1 44 44 PHE C C 44 176.436 176.436 176.083 0.353 18112 901 1 2 . 1 1 44 44 PHE CA C 44 56.672 56.672 55.280 1.392 18112 902 1 2 . 1 1 44 44 PHE CB C 44 36.570 36.570 36.538 0.032 18112 903 1 2 . 1 1 44 44 PHE H H 44 7.955 7.955 8.280 -0.325 18112 904 1 2 . 1 1 45 45 SER N N 45 113.407 113.407 116.789 -3.382 18112 905 1 2 . 1 1 45 45 SER HA H 45 4.373 4.373 4.549 -0.176 18112 906 1 2 . 1 1 45 45 SER C C 45 174.424 174.424 175.502 -1.078 18112 907 1 2 . 1 1 45 45 SER CA C 45 61.037 61.037 59.719 1.318 18112 908 1 2 . 1 1 45 45 SER CB C 45 62.711 62.711 63.919 -1.208 18112 909 1 2 . 1 1 45 45 SER H H 45 7.932 7.932 8.002 -0.070 18112 910 1 2 . 1 1 46 46 ASP N N 46 118.099 118.099 120.610 -2.511 18112 911 1 2 . 1 1 46 46 ASP HA H 46 4.572 4.572 4.407 0.165 18112 912 1 2 . 1 1 46 46 ASP C C 46 174.866 174.866 175.835 -0.969 18112 913 1 2 . 1 1 46 46 ASP CA C 46 53.602 53.602 55.817 -2.215 18112 914 1 2 . 1 1 46 46 ASP CB C 46 38.992 38.992 40.504 -1.512 18112 915 1 2 . 1 1 46 46 ASP H H 46 9.889 9.889 8.692 1.197 18112 916 1 2 . 1 1 47 47 VAL N N 47 121.496 121.496 120.556 0.940 18112 917 1 2 . 1 1 47 47 VAL HA H 47 4.058 4.058 3.865 0.193 18112 918 1 2 . 1 1 47 47 VAL C C 47 174.676 174.676 174.970 -0.294 18112 919 1 2 . 1 1 47 47 VAL CA C 47 61.006 61.006 61.424 -0.418 18112 920 1 2 . 1 1 47 47 VAL CB C 47 32.110 32.110 31.240 0.870 18112 921 1 2 . 1 1 47 47 VAL H H 47 7.781 7.781 7.331 0.450 18112 922 1 2 . 1 1 48 48 LYS N N 48 126.100 126.100 126.835 -0.735 18112 923 1 2 . 1 1 48 48 LYS HA H 48 4.402 4.402 4.048 0.354 18112 924 1 2 . 1 1 48 48 LYS C C 48 175.564 175.564 175.891 -0.327 18112 925 1 2 . 1 1 48 48 LYS CA C 48 54.874 54.874 57.048 -2.175 18112 926 1 2 . 1 1 48 48 LYS CB C 48 30.189 30.189 32.703 -2.514 18112 927 1 2 . 1 1 48 48 LYS H H 48 8.245 8.245 8.304 -0.059 18112 928 1 2 . 1 1 49 49 PHE N N 49 125.341 125.341 113.864 11.477 18112 929 1 2 . 1 1 49 49 PHE HA H 49 3.813 3.813 4.286 -0.473 18112 930 1 2 . 1 1 49 49 PHE C C 49 175.708 175.708 174.818 0.890 18112 931 1 2 . 1 1 49 49 PHE CA C 49 60.861 60.861 57.902 2.959 18112 932 1 2 . 1 1 49 49 PHE CB C 49 38.616 38.616 37.817 0.799 18112 933 1 2 . 1 1 49 49 PHE H H 49 8.626 8.626 7.372 1.254 18112 934 1 2 . 1 1 50 50 ASN N N 50 115.408 115.408 119.686 -4.278 18112 935 1 2 . 1 1 50 50 ASN C C 50 176.072 176.072 175.703 0.369 18112 936 1 2 . 1 1 50 50 ASN CA C 50 51.730 51.730 51.061 0.669 18112 937 1 2 . 1 1 50 50 ASN H H 50 7.030 7.030 8.374 -1.344 18112 938 1 2 . 1 1 51 51 ARG N N 51 122.706 122.706 122.730 -0.024 18112 939 1 2 . 1 1 51 51 ARG CA C 51 59.534 59.534 59.496 0.038 18112 940 1 2 . 1 1 51 51 ARG H H 51 7.790 7.790 8.795 -1.005 18112 941 1 2 . 1 1 52 52 CYS N N 52 117.340 117.340 113.411 3.929 18112 942 1 2 . 1 1 52 52 CYS HA H 52 4.108 4.108 4.298 -0.190 18112 943 1 2 . 1 1 52 52 CYS C C 52 178.200 178.200 176.947 1.253 18112 944 1 2 . 1 1 52 52 CYS CA C 52 61.143 61.143 60.923 0.220 18112 945 1 2 . 1 1 52 52 CYS H H 52 7.681 7.681 8.350 -0.669 18112 946 1 2 . 1 1 53 53 ILE N N 53 122.321 122.321 117.030 5.291 18112 947 1 2 . 1 1 53 53 ILE HA H 53 3.588 3.588 3.866 -0.278 18112 948 1 2 . 1 1 53 53 ILE C C 53 177.492 177.492 176.827 0.665 18112 949 1 2 . 1 1 53 53 ILE CA C 53 64.109 64.109 63.147 0.962 18112 950 1 2 . 1 1 53 53 ILE CB C 53 37.603 37.603 37.225 0.378 18112 951 1 2 . 1 1 53 53 ILE H H 53 8.035 8.035 7.480 0.555 18112 952 1 2 . 1 1 54 54 THR C C 54 175.903 175.903 176.768 -0.865 18112 953 1 2 . 1 1 54 54 THR CA C 54 67.308 67.308 66.431 0.877 18112 954 1 2 . 1 1 55 55 SER N N 55 113.819 113.819 118.908 -5.089 18112 955 1 2 . 1 1 55 55 SER H H 55 7.844 7.844 8.050 -0.206 18112 956 1 2 . 1 1 56 56 GLN C C 56 179.792 179.792 177.327 2.465 18112 957 1 2 . 1 1 57 57 LEU N N 57 116.701 116.701 119.954 -3.253 18112 958 1 2 . 1 1 57 57 LEU HA H 57 4.519 4.519 3.131 1.388 18112 959 1 2 . 1 1 57 57 LEU C C 57 178.775 178.775 178.356 0.419 18112 960 1 2 . 1 1 57 57 LEU CA C 57 55.232 55.232 57.201 -1.969 18112 961 1 2 . 1 1 57 57 LEU CB C 57 37.131 37.131 41.710 -4.579 18112 962 1 2 . 1 1 57 57 LEU H H 57 8.267 8.267 7.444 0.823 18112 963 1 2 . 1 1 58 58 ILE N N 58 122.522 122.522 118.163 4.359 18112 964 1 2 . 1 1 58 58 ILE HA H 58 4.640 4.640 3.462 1.178 18112 965 1 2 . 1 1 58 58 ILE C C 58 177.380 177.380 177.871 -0.491 18112 966 1 2 . 1 1 58 58 ILE CA C 58 62.163 62.163 64.843 -2.680 18112 967 1 2 . 1 1 58 58 ILE CB C 58 30.657 30.657 37.572 -6.915 18112 968 1 2 . 1 1 58 58 ILE H H 58 8.111 8.111 7.896 0.215 18112 969 1 2 . 1 1 59 59 LYS N N 59 121.002 121.002 121.002 0.000 18112 970 1 2 . 1 1 59 59 LYS C C 59 177.600 177.600 179.023 -1.423 18112 971 1 2 . 1 1 59 59 LYS CA C 59 57.570 57.570 59.428 -1.858 18112 972 1 2 . 1 1 59 59 LYS CB C 59 39.101 39.101 31.985 7.116 18112 973 1 2 . 1 1 59 59 LYS H H 59 7.432 7.432 7.662 -0.231 18112 974 1 2 . 1 1 60 60 TRP N N 60 118.679 118.679 120.414 -1.735 18112 975 1 2 . 1 1 60 60 TRP HA H 60 3.739 3.739 4.542 -0.803 18112 976 1 2 . 1 1 60 60 TRP C C 60 178.246 178.246 179.087 -0.841 18112 977 1 2 . 1 1 60 60 TRP CA C 60 59.818 59.818 59.306 0.512 18112 978 1 2 . 1 1 60 60 TRP CB C 60 31.851 31.851 28.476 3.375 18112 979 1 2 . 1 1 60 60 TRP H H 60 7.565 7.565 8.030 -0.465 18112 980 1 2 . 1 1 61 61 PHE N N 61 118.005 118.005 117.138 0.867 18112 981 1 2 . 1 1 61 61 PHE HA H 61 3.882 3.882 3.840 0.042 18112 982 1 2 . 1 1 61 61 PHE CA C 61 60.054 60.054 59.200 0.855 18112 983 1 2 . 1 1 61 61 PHE H H 61 7.819 7.819 8.515 -0.696 18112 984 1 2 . 1 1 62 62 SER N N 62 121.144 121.144 116.182 4.962 18112 985 1 2 . 1 1 62 62 SER C C 62 177.840 177.840 176.470 1.370 18112 986 1 2 . 1 1 62 62 SER CA C 62 55.892 55.892 61.600 -5.708 18112 987 1 2 . 1 1 62 62 SER H H 62 8.878 8.878 8.236 0.642 18112 988 1 2 . 1 1 63 63 ASN N N 63 115.303 115.303 120.451 -5.148 18112 989 1 2 . 1 1 63 63 ASN C C 63 177.222 177.222 177.464 -0.242 18112 990 1 2 . 1 1 63 63 ASN CA C 63 60.467 60.467 56.519 3.948 18112 991 1 2 . 1 1 63 63 ASN H H 63 8.001 8.001 8.096 -0.095 18112 992 1 2 . 1 1 64 64 PHE N N 64 112.571 112.571 121.026 -8.455 18112 993 1 2 . 1 1 64 64 PHE CA C 64 56.453 56.453 61.612 -5.159 18112 994 1 2 . 1 1 64 64 PHE H H 64 7.082 7.082 8.376 -1.294 18112 995 1 2 . 1 1 65 65 ARG N N 65 116.695 116.695 118.004 -1.309 18112 996 1 2 . 1 1 65 65 ARG CA C 65 59.590 59.590 59.922 -0.332 18112 997 1 2 . 1 1 65 65 ARG H H 65 8.091 8.091 8.295 -0.204 18112 998 1 2 . 1 1 66 66 GLU N N 66 121.653 121.653 119.861 1.792 18112 999 1 2 . 1 1 66 66 GLU HA H 66 4.739 4.739 4.387 0.352 18112 1000 1 2 . 1 1 66 66 GLU C C 66 174.621 174.621 179.264 -4.643 18112 1001 1 2 . 1 1 66 66 GLU CA C 66 59.583 59.583 59.143 0.440 18112 1002 1 2 . 1 1 66 66 GLU H H 66 7.597 7.597 8.429 -0.832 18112 1003 1 2 . 1 1 67 67 PHE N N 67 111.578 111.578 119.732 -8.154 18112 1004 1 2 . 1 1 67 67 PHE C C 67 176.164 176.164 177.566 -1.402 18112 1005 1 2 . 1 1 67 67 PHE CA C 67 61.156 61.156 58.658 2.498 18112 1006 1 2 . 1 1 67 67 PHE H H 67 7.067 7.067 8.337 -1.270 18112 1007 1 2 . 1 1 68 68 TYR N N 68 119.370 119.370 123.455 -4.085 18112 1008 1 2 . 1 1 68 68 TYR C C 68 176.844 176.844 176.978 -0.134 18112 1009 1 2 . 1 1 68 68 TYR CA C 68 61.758 61.758 62.254 -0.496 18112 1010 1 2 . 1 1 68 68 TYR H H 68 7.442 7.442 8.254 -0.812 18112 1011 1 2 . 1 1 69 69 TYR N N 69 116.047 116.047 120.061 -4.014 18112 1012 1 2 . 1 1 69 69 TYR HA H 69 4.086 4.086 4.331 -0.245 18112 1013 1 2 . 1 1 69 69 TYR C C 69 180.328 180.328 177.867 2.461 18112 1014 1 2 . 1 1 69 69 TYR CA C 69 61.528 61.528 62.176 -0.648 18112 1015 1 2 . 1 1 69 69 TYR H H 69 9.127 9.127 8.250 0.877 18112 1016 1 2 . 1 1 70 70 ILE N N 70 124.738 124.738 116.798 7.940 18112 1017 1 2 . 1 1 70 70 ILE HA H 70 3.828 3.828 3.759 0.069 18112 1018 1 2 . 1 1 70 70 ILE C C 70 179.585 179.585 178.114 1.471 18112 1019 1 2 . 1 1 70 70 ILE CA C 70 65.787 65.787 63.056 2.731 18112 1020 1 2 . 1 1 70 70 ILE CB C 70 36.435 36.435 36.372 0.063 18112 1021 1 2 . 1 1 70 70 ILE H H 70 8.631 8.631 8.394 0.237 18112 1022 1 2 . 1 1 71 71 GLN N N 71 117.940 117.940 120.859 -2.919 18112 1023 1 2 . 1 1 71 71 GLN HA H 71 3.826 3.826 3.734 0.092 18112 1024 1 2 . 1 1 71 71 GLN C C 71 178.192 178.192 177.956 0.236 18112 1025 1 2 . 1 1 71 71 GLN CA C 71 57.779 57.779 59.098 -1.319 18112 1026 1 2 . 1 1 71 71 GLN H H 71 7.738 7.738 7.757 -0.019 18112 1027 1 2 . 1 1 72 72 MET N N 72 117.353 117.353 117.594 -0.241 18112 1028 1 2 . 1 1 72 72 MET HA H 72 4.112 4.112 3.818 0.294 18112 1029 1 2 . 1 1 72 72 MET C C 72 177.203 177.203 178.290 -1.087 18112 1030 1 2 . 1 1 72 72 MET CA C 72 57.272 57.272 57.104 0.168 18112 1031 1 2 . 1 1 72 72 MET H H 72 7.844 7.844 7.548 0.296 18112 1032 1 2 . 1 1 73 73 GLU N N 73 117.858 117.858 120.488 -2.630 18112 1033 1 2 . 1 1 73 73 GLU HA H 73 3.572 3.572 4.156 -0.584 18112 1034 1 2 . 1 1 73 73 GLU C C 73 177.344 177.344 179.005 -1.661 18112 1035 1 2 . 1 1 73 73 GLU CA C 73 60.324 60.324 60.085 0.239 18112 1036 1 2 . 1 1 73 73 GLU H H 73 7.503 7.503 8.141 -0.638 18112 1037 1 2 . 1 1 74 74 LYS N N 74 118.716 118.716 118.572 0.144 18112 1038 1 2 . 1 1 74 74 LYS HA H 74 3.867 3.867 4.142 -0.275 18112 1039 1 2 . 1 1 74 74 LYS C C 74 180.077 180.077 179.471 0.606 18112 1040 1 2 . 1 1 74 74 LYS CA C 74 59.754 59.754 58.181 1.573 18112 1041 1 2 . 1 1 74 74 LYS H H 74 7.912 7.912 7.842 0.070 18112 1042 1 2 . 1 1 75 75 TYR N N 75 117.309 117.309 119.748 -2.439 18112 1043 1 2 . 1 1 75 75 TYR HA H 75 4.085 4.085 4.140 -0.055 18112 1044 1 2 . 1 1 75 75 TYR C C 75 178.874 178.874 178.159 0.715 18112 1045 1 2 . 1 1 75 75 TYR CA C 75 63.306 63.306 59.859 3.446 18112 1046 1 2 . 1 1 75 75 TYR H H 75 8.421 8.421 8.256 0.165 18112 1047 1 2 . 1 1 76 76 ALA N N 76 125.392 125.392 120.870 4.522 18112 1048 1 2 . 1 1 76 76 ALA HA H 76 4.221 4.221 4.204 0.017 18112 1049 1 2 . 1 1 76 76 ALA C C 76 178.850 178.850 179.873 -1.023 18112 1050 1 2 . 1 1 76 76 ALA CA C 76 56.280 56.280 55.140 1.140 18112 1051 1 2 . 1 1 76 76 ALA CB C 76 18.687 18.687 18.432 0.255 18112 1052 1 2 . 1 1 76 76 ALA H H 76 8.553 8.553 8.324 0.229 18112 1053 1 2 . 1 1 77 77 ARG N N 77 115.067 115.067 117.974 -2.907 18112 1054 1 2 . 1 1 77 77 ARG HA H 77 3.935 3.935 3.924 0.011 18112 1055 1 2 . 1 1 77 77 ARG C C 77 179.341 179.341 179.085 0.256 18112 1056 1 2 . 1 1 77 77 ARG CA C 77 60.499 60.499 59.904 0.595 18112 1057 1 2 . 1 1 77 77 ARG H H 77 8.471 8.471 8.274 0.197 18112 1058 1 2 . 1 1 78 78 GLN N N 78 120.107 120.107 117.920 2.187 18112 1059 1 2 . 1 1 78 78 GLN HA H 78 3.921 3.921 4.179 -0.258 18112 1060 1 2 . 1 1 78 78 GLN C C 78 177.289 177.289 178.325 -1.036 18112 1061 1 2 . 1 1 78 78 GLN CA C 78 58.619 58.619 57.789 0.830 18112 1062 1 2 . 1 1 78 78 GLN CB C 78 27.752 27.752 27.910 -0.158 18112 1063 1 2 . 1 1 78 78 GLN H H 78 8.142 8.142 8.230 -0.088 18112 1064 1 2 . 1 1 79 79 ALA N N 79 120.809 120.809 124.035 -3.226 18112 1065 1 2 . 1 1 79 79 ALA HA H 79 4.308 4.308 4.031 0.277 18112 1066 1 2 . 1 1 79 79 ALA C C 79 179.924 179.924 179.508 0.416 18112 1067 1 2 . 1 1 79 79 ALA CA C 79 54.970 54.970 55.361 -0.391 18112 1068 1 2 . 1 1 79 79 ALA CB C 79 17.064 17.064 18.581 -1.517 18112 1069 1 2 . 1 1 79 79 ALA H H 79 7.811 7.811 8.056 -0.245 18112 1070 1 2 . 1 1 80 80 ILE N N 80 118.524 118.524 118.769 -0.245 18112 1071 1 2 . 1 1 80 80 ILE HA H 80 3.894 3.894 3.647 0.247 18112 1072 1 2 . 1 1 80 80 ILE C C 80 181.268 181.268 178.177 3.091 18112 1073 1 2 . 1 1 80 80 ILE CA C 80 64.841 64.841 64.723 0.118 18112 1074 1 2 . 1 1 80 80 ILE CB C 80 37.125 37.125 37.582 -0.457 18112 1075 1 2 . 1 1 80 80 ILE H H 80 7.837 7.837 8.031 -0.194 18112 1076 1 2 . 1 1 81 81 ASN N N 81 121.233 121.233 117.723 3.510 18112 1077 1 2 . 1 1 81 81 ASN HA H 81 4.398 4.398 4.401 -0.003 18112 1078 1 2 . 1 1 81 81 ASN C C 81 176.546 176.546 176.874 -0.328 18112 1079 1 2 . 1 1 81 81 ASN CA C 81 55.892 55.892 55.992 -0.100 18112 1080 1 2 . 1 1 81 81 ASN CB C 81 37.603 37.603 38.710 -1.107 18112 1081 1 2 . 1 1 81 81 ASN H H 81 8.262 8.262 8.096 0.166 18112 1082 1 2 . 1 1 82 82 ASP N N 82 119.240 119.240 117.645 1.595 18112 1083 1 2 . 1 1 82 82 ASP HA H 82 4.666 4.666 4.626 0.040 18112 1084 1 2 . 1 1 82 82 ASP C C 82 176.767 176.767 177.037 -0.270 18112 1085 1 2 . 1 1 82 82 ASP CA C 82 54.771 54.771 54.558 0.213 18112 1086 1 2 . 1 1 82 82 ASP CB C 82 40.121 40.121 41.917 -1.796 18112 1087 1 2 . 1 1 82 82 ASP H H 82 8.316 8.316 8.015 0.301 18112 1088 1 2 . 1 1 83 83 GLY N N 83 106.913 106.913 107.162 -0.249 18112 1089 1 2 . 1 1 83 83 GLY C C 83 174.601 174.601 174.584 0.017 18112 1090 1 2 . 1 1 83 83 GLY CA C 83 45.214 45.214 44.873 0.341 18112 1091 1 2 . 1 1 83 83 GLY H H 83 7.810 7.810 7.931 -0.121 18112 1092 1 2 . 1 1 84 84 VAL N N 84 122.981 122.981 121.597 1.384 18112 1093 1 2 . 1 1 84 84 VAL HA H 84 3.850 3.850 4.010 -0.160 18112 1094 1 2 . 1 1 84 84 VAL C C 84 177.265 177.265 175.866 1.399 18112 1095 1 2 . 1 1 84 84 VAL CA C 84 64.270 64.270 63.116 1.154 18112 1096 1 2 . 1 1 84 84 VAL CB C 84 30.471 30.471 31.406 -0.935 18112 1097 1 2 . 1 1 84 84 VAL H H 84 8.157 8.157 7.847 0.310 18112 1098 1 2 . 1 1 85 85 THR N N 85 115.232 115.232 117.103 -1.871 18112 1099 1 2 . 1 1 85 85 THR HA H 85 4.716 4.716 5.005 -0.289 18112 1100 1 2 . 1 1 85 85 THR C C 85 174.489 174.489 174.538 -0.049 18112 1101 1 2 . 1 1 85 85 THR CA C 85 61.618 61.618 61.044 0.575 18112 1102 1 2 . 1 1 85 85 THR CB C 85 70.081 70.081 69.757 0.324 18112 1103 1 2 . 1 1 85 85 THR H H 85 8.890 8.890 8.412 0.478 18112 1104 1 2 . 1 1 86 86 SER N N 86 117.009 117.009 117.825 -0.816 18112 1105 1 2 . 1 1 86 86 SER HA H 86 5.046 5.046 4.602 0.444 18112 1106 1 2 . 1 1 86 86 SER C C 86 174.473 174.473 175.045 -0.572 18112 1107 1 2 . 1 1 86 86 SER CA C 86 55.922 55.922 57.463 -1.541 18112 1108 1 2 . 1 1 86 86 SER CB C 86 64.385 64.385 65.503 -1.118 18112 1109 1 2 . 1 1 86 86 SER H H 86 7.704 7.704 7.612 0.092 18112 1110 1 2 . 1 1 87 87 THR N N 87 118.634 118.634 116.940 1.694 18112 1111 1 2 . 1 1 87 87 THR HA H 87 4.065 4.065 3.849 0.216 18112 1112 1 2 . 1 1 87 87 THR C C 87 176.047 176.047 175.328 0.719 18112 1113 1 2 . 1 1 87 87 THR CA C 87 64.983 64.983 64.736 0.247 18112 1114 1 2 . 1 1 87 87 THR CB C 87 68.045 68.045 68.516 -0.471 18112 1115 1 2 . 1 1 87 87 THR H H 87 8.711 8.711 8.448 0.263 18112 1116 1 2 . 1 1 88 88 GLU N N 88 117.889 117.889 119.875 -1.986 18112 1117 1 2 . 1 1 88 88 GLU HA H 88 3.881 3.881 4.200 -0.319 18112 1118 1 2 . 1 1 88 88 GLU C C 88 177.146 177.146 177.413 -0.267 18112 1119 1 2 . 1 1 88 88 GLU CA C 88 57.814 57.814 58.089 -0.275 18112 1120 1 2 . 1 1 88 88 GLU CB C 88 28.050 28.050 28.452 -0.402 18112 1121 1 2 . 1 1 88 88 GLU H H 88 8.152 8.152 8.845 -0.693 18112 1122 1 2 . 1 1 89 89 GLU N N 89 115.617 115.617 118.843 -3.226 18112 1123 1 2 . 1 1 89 89 GLU HA H 89 4.149 4.149 4.321 -0.172 18112 1124 1 2 . 1 1 89 89 GLU C C 89 176.192 176.192 177.365 -1.173 18112 1125 1 2 . 1 1 89 89 GLU CA C 89 56.133 56.133 57.636 -1.503 18112 1126 1 2 . 1 1 89 89 GLU CB C 89 29.415 29.415 30.724 -1.309 18112 1127 1 2 . 1 1 89 89 GLU H H 89 7.311 7.311 7.907 -0.596 18112 1128 1 2 . 1 1 90 90 LEU N N 90 120.870 120.870 114.518 6.352 18112 1129 1 2 . 1 1 90 90 LEU HA H 90 4.439 4.439 4.527 -0.088 18112 1130 1 2 . 1 1 90 90 LEU C C 90 175.267 175.267 176.067 -0.800 18112 1131 1 2 . 1 1 90 90 LEU CA C 90 53.504 53.504 54.891 -1.387 18112 1132 1 2 . 1 1 90 90 LEU CB C 90 40.479 40.479 43.413 -2.934 18112 1133 1 2 . 1 1 90 90 LEU H H 90 7.311 7.311 7.402 -0.091 18112 1134 1 2 . 1 1 91 91 SER N N 91 118.376 118.376 113.455 4.921 18112 1135 1 2 . 1 1 91 91 SER HA H 91 4.747 4.747 4.615 0.132 18112 1136 1 2 . 1 1 91 91 SER C C 91 173.332 173.332 172.427 0.905 18112 1137 1 2 . 1 1 91 91 SER CA C 91 56.314 56.314 59.350 -3.036 18112 1138 1 2 . 1 1 91 91 SER CB C 91 64.615 64.615 64.977 -0.362 18112 1139 1 2 . 1 1 91 91 SER H H 91 8.221 8.221 7.880 0.341 18112 1140 1 2 . 1 1 92 92 ILE N N 92 122.247 122.247 123.341 -1.094 18112 1141 1 2 . 1 1 92 92 ILE HA H 92 4.537 4.537 4.299 0.238 18112 1142 1 2 . 1 1 92 92 ILE C C 92 174.059 174.059 174.308 -0.249 18112 1143 1 2 . 1 1 92 92 ILE CA C 92 59.881 59.881 60.343 -0.462 18112 1144 1 2 . 1 1 92 92 ILE CB C 92 37.820 37.820 42.748 -4.928 18112 1145 1 2 . 1 1 92 92 ILE H H 92 8.570 8.570 8.248 0.322 18112 1146 1 2 . 1 1 93 93 THR N N 93 116.069 116.069 122.257 -6.188 18112 1147 1 2 . 1 1 93 93 THR HA H 93 4.580 4.580 4.360 0.220 18112 1148 1 2 . 1 1 93 93 THR C C 93 175.049 175.049 174.656 0.393 18112 1149 1 2 . 1 1 93 93 THR CA C 93 58.988 58.988 65.325 -6.337 18112 1150 1 2 . 1 1 93 93 THR CB C 93 71.362 71.362 68.344 3.018 18112 1151 1 2 . 1 1 93 93 THR H H 93 7.224 7.224 8.701 -1.477 18112 1152 1 2 . 1 1 94 94 ARG N N 94 116.595 116.595 125.327 -8.732 18112 1153 1 2 . 1 1 94 94 ARG HA H 94 3.077 3.077 4.332 -1.255 18112 1154 1 2 . 1 1 94 94 ARG C C 94 175.076 175.076 174.246 0.830 18112 1155 1 2 . 1 1 94 94 ARG CA C 94 57.119 57.119 57.406 -0.287 18112 1156 1 2 . 1 1 94 94 ARG CB C 94 27.838 27.838 30.880 -3.042 18112 1157 1 2 . 1 1 94 94 ARG H H 94 8.596 8.596 8.611 -0.015 18112 1158 1 2 . 1 1 95 95 ASP N N 95 113.735 113.735 122.297 -8.562 18112 1159 1 2 . 1 1 95 95 ASP HA H 95 4.765 4.765 4.750 0.015 18112 1160 1 2 . 1 1 95 95 ASP C C 95 175.876 175.876 177.276 -1.400 18112 1161 1 2 . 1 1 95 95 ASP CA C 95 53.156 53.156 54.504 -1.348 18112 1162 1 2 . 1 1 95 95 ASP CB C 95 41.166 41.166 41.420 -0.254 18112 1163 1 2 . 1 1 95 95 ASP H H 95 7.607 7.607 7.926 -0.319 18112 1164 1 2 . 1 1 96 96 CYS N N 96 116.012 116.012 125.436 -9.424 18112 1165 1 2 . 1 1 96 96 CYS C C 96 174.361 174.361 176.207 -1.846 18112 1166 1 2 . 1 1 96 96 CYS CA C 96 56.562 56.562 62.697 -6.136 18112 1167 1 2 . 1 1 96 96 CYS CB C 96 29.416 29.416 27.754 1.662 18112 1168 1 2 . 1 1 96 96 CYS H H 96 7.094 7.094 8.557 -1.463 18112 1169 1 2 . 1 1 97 97 GLU N N 97 123.087 123.087 120.064 3.023 18112 1170 1 2 . 1 1 97 97 GLU C C 97 178.748 178.748 178.242 0.506 18112 1171 1 2 . 1 1 97 97 GLU CA C 97 59.912 59.912 59.116 0.796 18112 1172 1 2 . 1 1 97 97 GLU CB C 97 29.195 29.195 29.435 -0.240 18112 1173 1 2 . 1 1 97 97 GLU H H 97 9.003 9.003 8.146 0.857 18112 1174 1 2 . 1 1 98 98 LEU N N 98 120.942 120.942 120.934 0.008 18112 1175 1 2 . 1 1 98 98 LEU HA H 98 3.614 3.614 4.117 -0.503 18112 1176 1 2 . 1 1 98 98 LEU C C 98 177.796 177.796 178.844 -1.048 18112 1177 1 2 . 1 1 98 98 LEU CA C 98 58.090 58.090 57.831 0.259 18112 1178 1 2 . 1 1 98 98 LEU CB C 98 39.778 39.778 41.830 -2.052 18112 1179 1 2 . 1 1 98 98 LEU H H 98 8.656 8.656 7.933 0.723 18112 1180 1 2 . 1 1 99 99 TYR N N 99 118.313 118.313 118.523 -0.210 18112 1181 1 2 . 1 1 99 99 TYR C C 99 177.077 177.077 178.107 -1.030 18112 1182 1 2 . 1 1 99 99 TYR CA C 99 62.622 62.622 61.327 1.295 18112 1183 1 2 . 1 1 99 99 TYR CB C 99 38.742 38.742 37.600 1.141 18112 1184 1 2 . 1 1 99 99 TYR H H 99 7.522 7.522 8.520 -0.998 18112 1185 1 2 . 1 1 100 100 ARG N N 100 118.101 118.101 116.563 1.538 18112 1186 1 2 . 1 1 100 100 ARG C C 100 178.616 178.616 178.600 0.016 18112 1187 1 2 . 1 1 100 100 ARG CA C 100 59.915 59.915 56.909 3.006 18112 1188 1 2 . 1 1 100 100 ARG CB C 100 29.100 29.100 29.082 0.017 18112 1189 1 2 . 1 1 100 100 ARG H H 100 8.243 8.243 8.346 -0.103 18112 1190 1 2 . 1 1 101 101 ALA N N 101 120.972 120.972 123.808 -2.836 18112 1191 1 2 . 1 1 101 101 ALA HA H 101 4.145 4.145 3.971 0.174 18112 1192 1 2 . 1 1 101 101 ALA C C 101 181.359 181.359 178.819 2.540 18112 1193 1 2 . 1 1 101 101 ALA CA C 101 55.057 55.057 54.782 0.275 18112 1194 1 2 . 1 1 101 101 ALA CB C 101 17.543 17.543 18.284 -0.741 18112 1195 1 2 . 1 1 101 101 ALA H H 101 8.352 8.352 8.051 0.301 18112 1196 1 2 . 1 1 102 102 LEU N N 102 115.683 115.683 119.507 -3.824 18112 1197 1 2 . 1 1 102 102 LEU HA H 102 4.333 4.333 3.786 0.547 18112 1198 1 2 . 1 1 102 102 LEU C C 102 178.583 178.583 179.485 -0.902 18112 1199 1 2 . 1 1 102 102 LEU CA C 102 57.634 57.634 57.804 -0.170 18112 1200 1 2 . 1 1 102 102 LEU CB C 102 41.716 41.716 41.628 0.088 18112 1201 1 2 . 1 1 102 102 LEU H H 102 7.960 7.960 8.379 -0.419 18112 1202 1 2 . 1 1 103 103 ASN N N 103 118.957 118.957 117.283 1.674 18112 1203 1 2 . 1 1 103 103 ASN C C 103 177.470 177.470 177.731 -0.261 18112 1204 1 2 . 1 1 103 103 ASN CA C 103 56.974 56.974 56.234 0.739 18112 1205 1 2 . 1 1 103 103 ASN CB C 103 38.140 38.140 38.122 0.018 18112 1206 1 2 . 1 1 103 103 ASN H H 103 9.301 9.301 8.253 1.048 18112 1207 1 2 . 1 1 104 104 MET N N 104 113.763 113.763 120.067 -6.304 18112 1208 1 2 . 1 1 104 104 MET CA C 104 57.362 57.362 59.383 -2.021 18112 1209 1 2 . 1 1 104 104 MET CB C 104 31.895 31.895 32.588 -0.693 18112 1210 1 2 . 1 1 104 104 MET H H 104 8.332 8.332 7.874 0.458 18112 1211 1 2 . 1 1 105 105 HIS N N 105 116.024 116.024 116.833 -0.809 18112 1212 1 2 . 1 1 105 105 HIS HA H 105 3.764 3.764 4.160 -0.396 18112 1213 1 2 . 1 1 105 105 HIS C C 105 176.939 176.939 177.659 -0.720 18112 1214 1 2 . 1 1 105 105 HIS CA C 105 59.069 59.069 58.531 0.539 18112 1215 1 2 . 1 1 105 105 HIS H H 105 7.156 7.156 7.719 -0.563 18112 1216 1 2 . 1 1 106 106 TYR N N 106 113.161 113.161 116.535 -3.374 18112 1217 1 2 . 1 1 106 106 TYR C C 106 173.767 173.767 175.462 -1.695 18112 1218 1 2 . 1 1 106 106 TYR CA C 106 58.488 58.488 59.468 -0.980 18112 1219 1 2 . 1 1 106 106 TYR CB C 106 38.225 38.225 39.451 -1.226 18112 1220 1 2 . 1 1 106 106 TYR H H 106 7.204 7.204 8.194 -0.990 18112 1221 1 2 . 1 1 107 107 ASN N N 107 118.875 118.875 115.491 3.384 18112 1222 1 2 . 1 1 107 107 ASN HA H 107 3.922 3.922 5.077 -1.155 18112 1223 1 2 . 1 1 107 107 ASN C C 107 175.815 175.815 175.837 -0.022 18112 1224 1 2 . 1 1 107 107 ASN CA C 107 51.233 51.233 51.822 -0.589 18112 1225 1 2 . 1 1 107 107 ASN CB C 107 38.142 38.142 38.768 -0.626 18112 1226 1 2 . 1 1 107 107 ASN H H 107 8.127 8.127 8.546 -0.419 18112 1227 1 2 . 1 1 108 108 LYS N N 108 122.850 122.850 125.165 -2.315 18112 1228 1 2 . 1 1 108 108 LYS HA H 108 3.954 3.954 4.085 -0.131 18112 1229 1 2 . 1 1 108 108 LYS C C 108 177.586 177.586 177.167 0.419 18112 1230 1 2 . 1 1 108 108 LYS CA C 108 59.749 59.749 58.841 0.908 18112 1231 1 2 . 1 1 108 108 LYS CB C 108 31.498 31.498 32.419 -0.921 18112 1232 1 2 . 1 1 108 108 LYS H H 108 7.772 7.772 8.821 -1.049 18112 1233 1 2 . 1 1 109 109 ALA N N 109 118.054 118.054 120.925 -2.871 18112 1234 1 2 . 1 1 109 109 ALA HA H 109 4.137 4.137 4.513 -0.376 18112 1235 1 2 . 1 1 109 109 ALA C C 109 177.889 177.889 176.186 1.703 18112 1236 1 2 . 1 1 109 109 ALA CA C 109 52.299 52.299 50.564 1.735 18112 1237 1 2 . 1 1 109 109 ALA CB C 109 17.787 17.787 18.766 -0.979 18112 1238 1 2 . 1 1 109 109 ALA H H 109 8.307 8.307 7.767 0.540 18112 1239 1 2 . 1 1 110 110 ASN N N 110 115.542 115.542 119.220 -3.678 18112 1240 1 2 . 1 1 110 110 ASN HA H 110 4.480 4.480 4.430 0.050 18112 1241 1 2 . 1 1 110 110 ASN C C 110 174.277 174.277 175.178 -0.901 18112 1242 1 2 . 1 1 110 110 ASN CA C 110 53.504 53.504 53.602 -0.098 18112 1243 1 2 . 1 1 110 110 ASN CB C 110 37.283 37.283 37.710 -0.427 18112 1244 1 2 . 1 1 110 110 ASN H H 110 8.353 8.353 7.809 0.544 18112 1245 1 2 . 1 1 111 111 ASP N N 111 114.692 114.692 125.308 -10.616 18112 1246 1 2 . 1 1 111 111 ASP HA H 111 4.485 4.485 4.348 0.137 18112 1247 1 2 . 1 1 111 111 ASP C C 111 174.868 174.868 176.487 -1.619 18112 1248 1 2 . 1 1 111 111 ASP CA C 111 53.227 53.227 55.818 -2.591 18112 1249 1 2 . 1 1 111 111 ASP CB C 111 39.228 39.228 41.224 -1.996 18112 1250 1 2 . 1 1 111 111 ASP H H 111 8.297 8.297 8.160 0.137 18112 1251 1 2 . 1 1 112 112 PHE N N 112 120.927 120.927 118.401 2.526 18112 1252 1 2 . 1 1 112 112 PHE HA H 112 4.752 4.752 4.608 0.144 18112 1253 1 2 . 1 1 112 112 PHE C C 112 174.633 174.633 175.679 -1.046 18112 1254 1 2 . 1 1 112 112 PHE CA C 112 56.346 56.346 56.986 -0.640 18112 1255 1 2 . 1 1 112 112 PHE H H 112 7.784 7.784 7.816 -0.032 18112 1256 1 2 . 1 1 113 113 GLU N N 113 128.111 128.111 123.604 4.507 18112 1257 1 2 . 1 1 113 113 GLU HA H 113 4.011 4.011 4.366 -0.355 18112 1258 1 2 . 1 1 113 113 GLU C C 113 173.502 173.502 175.893 -2.391 18112 1259 1 2 . 1 1 113 113 GLU CA C 113 55.100 55.100 55.871 -0.771 18112 1260 1 2 . 1 1 113 113 GLU H H 113 7.752 7.752 8.695 -0.943 18112 1261 1 2 . 1 1 114 114 VAL N N 114 129.326 129.326 123.190 6.136 18112 1262 1 2 . 1 1 114 114 VAL HA H 114 3.241 3.241 3.818 -0.577 18112 1263 1 2 . 1 1 114 114 VAL CA C 114 60.838 60.838 60.775 0.063 18112 1264 1 2 . 1 1 114 114 VAL CB C 114 32.609 32.609 30.863 1.746 18112 1265 1 2 . 1 1 114 114 VAL H H 114 8.008 8.008 7.877 0.131 18112 1266 1 2 . 1 1 115 115 PRO HA H 115 4.429 4.429 4.370 0.058 18112 1267 1 2 . 1 1 115 115 PRO C C 115 177.421 177.421 177.993 -0.572 18112 1268 1 2 . 1 1 115 115 PRO CA C 115 61.882 61.882 62.658 -0.776 18112 1269 1 2 . 1 1 115 115 PRO CB C 115 30.974 30.974 32.702 -1.728 18112 1270 1 2 . 1 1 116 116 GLU N N 116 123.936 123.936 123.020 0.916 18112 1271 1 2 . 1 1 116 116 GLU C C 116 179.034 179.034 178.388 0.646 18112 1272 1 2 . 1 1 116 116 GLU CA C 116 58.913 58.913 60.146 -1.233 18112 1273 1 2 . 1 1 116 116 GLU CB C 116 28.378 28.378 29.720 -1.342 18112 1274 1 2 . 1 1 116 116 GLU H H 116 8.757 8.757 8.834 -0.077 18112 1275 1 2 . 1 1 117 117 ARG N N 117 116.943 116.943 117.461 -0.518 18112 1276 1 2 . 1 1 117 117 ARG C C 117 177.570 177.570 178.536 -0.966 18112 1277 1 2 . 1 1 117 117 ARG CA C 117 57.033 57.033 58.837 -1.804 18112 1278 1 2 . 1 1 117 117 ARG CB C 117 28.172 28.172 29.032 -0.860 18112 1279 1 2 . 1 1 117 117 ARG H H 117 8.733 8.733 8.526 0.207 18112 1280 1 2 . 1 1 118 118 PHE N N 118 117.528 117.528 120.856 -3.328 18112 1281 1 2 . 1 1 118 118 PHE HA H 118 4.137 4.137 4.403 -0.266 18112 1282 1 2 . 1 1 118 118 PHE C C 118 176.992 176.992 177.284 -0.292 18112 1283 1 2 . 1 1 118 118 PHE CA C 118 61.627 61.627 61.485 0.142 18112 1284 1 2 . 1 1 118 118 PHE CB C 118 37.386 37.386 39.201 -1.815 18112 1285 1 2 . 1 1 118 118 PHE H H 118 7.606 7.606 8.005 -0.399 18112 1286 1 2 . 1 1 119 119 LEU N N 119 118.483 118.483 118.030 0.453 18112 1287 1 2 . 1 1 119 119 LEU HA H 119 3.684 3.684 3.927 -0.243 18112 1288 1 2 . 1 1 119 119 LEU C C 119 178.802 178.802 179.016 -0.214 18112 1289 1 2 . 1 1 119 119 LEU CA C 119 59.875 59.875 56.636 3.239 18112 1290 1 2 . 1 1 119 119 LEU CB C 119 39.453 39.453 40.368 -0.915 18112 1291 1 2 . 1 1 119 119 LEU H H 119 7.248 7.248 7.725 -0.477 18112 1292 1 2 . 1 1 120 120 GLU N N 120 117.870 117.870 120.736 -2.866 18112 1293 1 2 . 1 1 120 120 GLU C C 120 179.932 179.932 179.510 0.422 18112 1294 1 2 . 1 1 120 120 GLU CA C 120 59.150 59.150 59.067 0.083 18112 1295 1 2 . 1 1 120 120 GLU CB C 120 28.878 28.878 29.253 -0.375 18112 1296 1 2 . 1 1 120 120 GLU H H 120 7.423 7.423 8.349 -0.926 18112 1297 1 2 . 1 1 121 121 VAL N N 121 120.777 120.777 120.493 0.284 18112 1298 1 2 . 1 1 121 121 VAL HA H 121 3.545 3.545 3.497 0.048 18112 1299 1 2 . 1 1 121 121 VAL C C 121 179.302 179.302 177.847 1.455 18112 1300 1 2 . 1 1 121 121 VAL CA C 121 66.875 66.875 66.732 0.143 18112 1301 1 2 . 1 1 121 121 VAL CB C 121 30.823 30.823 31.548 -0.725 18112 1302 1 2 . 1 1 121 121 VAL H H 121 8.313 8.313 8.177 0.136 18112 1303 1 2 . 1 1 122 122 ALA N N 122 127.029 127.029 120.460 6.569 18112 1304 1 2 . 1 1 122 122 ALA HA H 122 4.251 4.251 3.895 0.356 18112 1305 1 2 . 1 1 122 122 ALA C C 122 178.366 178.366 179.433 -1.067 18112 1306 1 2 . 1 1 122 122 ALA CA C 122 54.748 54.748 54.881 -0.133 18112 1307 1 2 . 1 1 122 122 ALA CB C 122 16.565 16.565 18.087 -1.522 18112 1308 1 2 . 1 1 122 122 ALA H H 122 8.896 8.896 7.867 1.029 18112 1309 1 2 . 1 1 123 123 GLN N N 123 119.887 119.887 119.520 0.367 18112 1310 1 2 . 1 1 123 123 GLN C C 123 177.908 177.908 178.429 -0.521 18112 1311 1 2 . 1 1 123 123 GLN CA C 123 60.671 60.671 58.933 1.738 18112 1312 1 2 . 1 1 123 123 GLN H H 123 8.349 8.349 7.758 0.591 18112 1313 1 2 . 1 1 124 124 ILE N N 124 120.632 120.632 119.478 1.154 18112 1314 1 2 . 1 1 124 124 ILE HA H 124 3.651 3.651 3.746 -0.095 18112 1315 1 2 . 1 1 124 124 ILE C C 124 178.703 178.703 178.363 0.340 18112 1316 1 2 . 1 1 124 124 ILE CA C 124 65.945 65.945 64.644 1.301 18112 1317 1 2 . 1 1 124 124 ILE H H 124 8.204 8.204 8.205 -0.001 18112 1318 1 2 . 1 1 125 125 THR N N 125 115.084 115.084 118.003 -2.919 18112 1319 1 2 . 1 1 125 125 THR C C 125 175.568 175.568 176.210 -0.642 18112 1320 1 2 . 1 1 125 125 THR CA C 125 67.872 67.872 67.896 -0.024 18112 1321 1 2 . 1 1 125 125 THR H H 125 8.399 8.399 8.282 0.117 18112 1322 1 2 . 1 1 126 126 LEU N N 126 125.011 125.011 121.694 3.317 18112 1323 1 2 . 1 1 126 126 LEU HA H 126 4.085 4.085 4.354 -0.269 18112 1324 1 2 . 1 1 126 126 LEU C C 126 178.559 178.559 178.163 0.396 18112 1325 1 2 . 1 1 126 126 LEU CA C 126 58.843 58.843 57.182 1.661 18112 1326 1 2 . 1 1 126 126 LEU CB C 126 41.421 41.421 41.707 -0.286 18112 1327 1 2 . 1 1 126 126 LEU H H 126 8.728 8.728 8.061 0.667 18112 1328 1 2 . 1 1 127 127 ARG N N 127 117.076 117.076 120.383 -3.307 18112 1329 1 2 . 1 1 127 127 ARG HA H 127 3.929 3.929 3.991 -0.062 18112 1330 1 2 . 1 1 127 127 ARG C C 127 177.984 177.984 178.092 -0.108 18112 1331 1 2 . 1 1 127 127 ARG CA C 127 60.685 60.685 59.078 1.607 18112 1332 1 2 . 1 1 127 127 ARG CB C 127 28.079 28.079 29.402 -1.323 18112 1333 1 2 . 1 1 127 127 ARG H H 127 8.213 8.213 8.452 -0.239 18112 1334 1 2 . 1 1 128 128 GLU N N 128 118.617 118.617 119.479 -0.862 18112 1335 1 2 . 1 1 128 128 GLU HA H 128 4.147 4.147 4.038 0.109 18112 1336 1 2 . 1 1 128 128 GLU C C 128 181.150 181.150 178.999 2.151 18112 1337 1 2 . 1 1 128 128 GLU CA C 128 59.508 59.508 59.028 0.480 18112 1338 1 2 . 1 1 128 128 GLU H H 128 8.478 8.478 7.837 0.641 18112 1339 1 2 . 1 1 129 129 PHE N N 129 119.267 119.267 118.872 0.395 18112 1340 1 2 . 1 1 129 129 PHE HA H 129 4.104 4.104 4.104 -0.000 18112 1341 1 2 . 1 1 129 129 PHE C C 129 177.170 177.170 177.934 -0.764 18112 1342 1 2 . 1 1 129 129 PHE CA C 129 63.694 63.694 62.209 1.485 18112 1343 1 2 . 1 1 129 129 PHE H H 129 8.570 8.570 8.247 0.323 18112 1344 1 2 . 1 1 130 130 PHE N N 130 118.739 118.739 119.228 -0.489 18112 1345 1 2 . 1 1 130 130 PHE HA H 130 3.884 3.884 4.059 -0.175 18112 1346 1 2 . 1 1 130 130 PHE C C 130 175.860 175.860 177.310 -1.450 18112 1347 1 2 . 1 1 130 130 PHE CA C 130 62.819 62.819 62.324 0.495 18112 1348 1 2 . 1 1 130 130 PHE H H 130 8.740 8.740 8.521 0.219 18112 1349 1 2 . 1 1 131 131 ASN N N 131 116.028 116.028 117.904 -1.876 18112 1350 1 2 . 1 1 131 131 ASN HA H 131 4.373 4.373 4.422 -0.049 18112 1351 1 2 . 1 1 131 131 ASN C C 131 178.228 178.228 177.776 0.452 18112 1352 1 2 . 1 1 131 131 ASN CA C 131 55.150 55.150 56.608 -1.458 18112 1353 1 2 . 1 1 131 131 ASN H H 131 8.864 8.864 8.495 0.369 18112 1354 1 2 . 1 1 132 132 ALA N N 132 120.922 120.922 122.777 -1.855 18112 1355 1 2 . 1 1 132 132 ALA HA H 132 4.020 4.020 4.092 -0.072 18112 1356 1 2 . 1 1 132 132 ALA C C 132 178.515 178.515 179.656 -1.141 18112 1357 1 2 . 1 1 132 132 ALA CA C 132 54.924 54.924 55.369 -0.445 18112 1358 1 2 . 1 1 132 132 ALA CB C 132 18.441 18.441 18.773 -0.333 18112 1359 1 2 . 1 1 132 132 ALA H H 132 7.745 7.745 7.953 -0.208 18112 1360 1 2 . 1 1 133 133 ILE N N 133 118.200 118.200 119.544 -1.344 18112 1361 1 2 . 1 1 133 133 ILE HA H 133 3.235 3.235 4.022 -0.787 18112 1362 1 2 . 1 1 133 133 ILE C C 133 180.606 180.606 178.334 2.272 18112 1363 1 2 . 1 1 133 133 ILE CA C 133 65.215 65.215 64.988 0.227 18112 1364 1 2 . 1 1 133 133 ILE CB C 133 38.291 38.291 38.009 0.282 18112 1365 1 2 . 1 1 133 133 ILE H H 133 7.999 7.999 8.059 -0.060 18112 1366 1 2 . 1 1 134 134 ILE N N 134 122.564 122.564 119.989 2.575 18112 1367 1 2 . 1 1 134 134 ILE HA H 134 3.788 3.788 3.700 0.088 18112 1368 1 2 . 1 1 134 134 ILE C C 134 177.215 177.215 176.911 0.304 18112 1369 1 2 . 1 1 134 134 ILE CA C 134 63.584 63.584 63.596 -0.012 18112 1370 1 2 . 1 1 134 134 ILE CB C 134 35.636 35.636 37.587 -1.951 18112 1371 1 2 . 1 1 134 134 ILE H H 134 8.670 8.670 8.015 0.655 18112 1372 1 2 . 1 1 135 135 ALA N N 135 119.989 119.989 120.879 -0.890 18112 1373 1 2 . 1 1 135 135 ALA HA H 135 4.357 4.357 4.264 0.093 18112 1374 1 2 . 1 1 135 135 ALA C C 135 177.786 177.786 177.989 -0.203 18112 1375 1 2 . 1 1 135 135 ALA CA C 135 51.521 51.521 52.754 -1.233 18112 1376 1 2 . 1 1 135 135 ALA CB C 135 18.839 18.839 19.798 -0.959 18112 1377 1 2 . 1 1 135 135 ALA H H 135 6.898 6.898 7.911 -1.013 18112 1378 1 2 . 1 1 136 136 GLY N N 136 107.682 107.682 106.314 1.368 18112 1379 1 2 . 1 1 136 136 GLY C C 136 176.324 176.324 174.991 1.333 18112 1380 1 2 . 1 1 136 136 GLY CA C 136 45.469 45.469 44.917 0.552 18112 1381 1 2 . 1 1 136 136 GLY H H 136 7.913 7.913 7.839 0.074 18112 1382 1 2 . 1 1 137 137 LYS N N 137 117.213 117.213 120.329 -3.116 18112 1383 1 2 . 1 1 137 137 LYS HA H 137 4.004 4.004 4.530 -0.526 18112 1384 1 2 . 1 1 137 137 LYS C C 137 176.616 176.616 177.709 -1.093 18112 1385 1 2 . 1 1 137 137 LYS CA C 137 57.499 57.499 56.600 0.899 18112 1386 1 2 . 1 1 137 137 LYS CB C 137 30.927 30.927 33.019 -2.092 18112 1387 1 2 . 1 1 137 137 LYS H H 137 8.312 8.312 8.334 -0.022 18112 1388 1 2 . 1 1 138 138 ASP N N 138 113.545 113.545 119.525 -5.980 18112 1389 1 2 . 1 1 138 138 ASP HA H 138 3.061 3.061 3.887 -0.826 18112 1390 1 2 . 1 1 138 138 ASP C C 138 174.698 174.698 176.776 -2.078 18112 1391 1 2 . 1 1 138 138 ASP CA C 138 53.694 53.694 56.191 -2.497 18112 1392 1 2 . 1 1 138 138 ASP CB C 138 36.008 36.008 39.918 -3.910 18112 1393 1 2 . 1 1 138 138 ASP H H 138 8.465 8.465 8.236 0.229 18112 1394 1 2 . 1 1 139 139 VAL N N 139 115.191 115.191 112.429 2.762 18112 1395 1 2 . 1 1 139 139 VAL HA H 139 3.886 3.886 4.079 -0.193 18112 1396 1 2 . 1 1 139 139 VAL C C 139 175.889 175.889 176.001 -0.112 18112 1397 1 2 . 1 1 139 139 VAL CA C 139 62.793 62.793 61.841 0.952 18112 1398 1 2 . 1 1 139 139 VAL CB C 139 30.662 30.662 31.672 -1.010 18112 1399 1 2 . 1 1 139 139 VAL H H 139 6.610 6.610 7.455 -0.845 18112 1400 1 2 . 1 1 140 140 ASP N N 140 123.363 123.363 121.486 1.877 18112 1401 1 2 . 1 1 140 140 ASP C C 140 175.234 175.234 175.663 -0.429 18112 1402 1 2 . 1 1 140 140 ASP CA C 140 50.221 50.221 51.722 -1.501 18112 1403 1 2 . 1 1 140 140 ASP CB C 140 42.254 42.254 43.360 -1.106 18112 1404 1 2 . 1 1 140 140 ASP H H 140 7.553 7.553 7.759 -0.206 18112 1405 1 2 . 1 1 141 141 PRO HA H 141 4.682 4.682 4.370 0.312 18112 1406 1 2 . 1 1 141 141 PRO C C 141 178.678 178.678 177.880 0.798 18112 1407 1 2 . 1 1 141 141 PRO CA C 141 64.532 64.532 63.956 0.576 18112 1408 1 2 . 1 1 141 141 PRO CB C 141 31.331 31.331 32.091 -0.760 18112 1409 1 2 . 1 1 142 142 SER N N 142 114.421 114.421 114.190 0.231 18112 1410 1 2 . 1 1 142 142 SER HA H 142 4.565 4.565 4.345 0.220 18112 1411 1 2 . 1 1 142 142 SER C C 142 176.524 176.524 176.152 0.372 18112 1412 1 2 . 1 1 142 142 SER CA C 142 58.711 58.711 60.844 -2.133 18112 1413 1 2 . 1 1 142 142 SER CB C 142 62.783 62.783 62.608 0.175 18112 1414 1 2 . 1 1 142 142 SER H H 142 8.703 8.703 8.626 0.077 18112 1415 1 2 . 1 1 143 143 TRP N N 143 123.598 123.598 122.937 0.661 18112 1416 1 2 . 1 1 143 143 TRP HA H 143 4.136 4.136 4.124 0.012 18112 1417 1 2 . 1 1 143 143 TRP C C 143 177.113 177.113 177.844 -0.731 18112 1418 1 2 . 1 1 143 143 TRP CA C 143 59.803 59.803 62.493 -2.690 18112 1419 1 2 . 1 1 143 143 TRP CB C 143 26.364 26.364 29.188 -2.824 18112 1420 1 2 . 1 1 143 143 TRP H H 143 8.374 8.374 7.719 0.655 18112 1421 1 2 . 1 1 144 144 LYS N N 144 119.293 119.293 117.055 2.238 18112 1422 1 2 . 1 1 144 144 LYS HA H 144 2.719 2.719 3.628 -0.909 18112 1423 1 2 . 1 1 144 144 LYS C C 144 177.243 177.243 178.384 -1.141 18112 1424 1 2 . 1 1 144 144 LYS CA C 144 58.851 58.851 59.485 -0.634 18112 1425 1 2 . 1 1 144 144 LYS CB C 144 29.373 29.373 31.124 -1.751 18112 1426 1 2 . 1 1 144 144 LYS H H 144 7.196 7.196 8.535 -1.339 18112 1427 1 2 . 1 1 145 145 LYS N N 145 116.440 116.440 119.150 -2.710 18112 1428 1 2 . 1 1 145 145 LYS HA H 145 3.490 3.490 4.221 -0.731 18112 1429 1 2 . 1 1 145 145 LYS C C 145 179.149 179.149 179.028 0.121 18112 1430 1 2 . 1 1 145 145 LYS CA C 145 59.271 59.271 58.495 0.776 18112 1431 1 2 . 1 1 145 145 LYS CB C 145 30.521 30.521 31.761 -1.240 18112 1432 1 2 . 1 1 145 145 LYS H H 145 7.389 7.389 7.657 -0.268 18112 1433 1 2 . 1 1 146 146 ALA N N 146 118.582 118.582 123.287 -4.705 18112 1434 1 2 . 1 1 146 146 ALA HA H 146 3.932 3.932 4.036 -0.104 18112 1435 1 2 . 1 1 146 146 ALA C C 146 179.968 179.968 179.740 0.228 18112 1436 1 2 . 1 1 146 146 ALA CA C 146 54.241 54.241 55.050 -0.809 18112 1437 1 2 . 1 1 146 146 ALA CB C 146 17.689 17.689 18.084 -0.395 18112 1438 1 2 . 1 1 146 146 ALA H H 146 7.112 7.112 7.910 -0.798 18112 1439 1 2 . 1 1 147 147 ILE N N 147 118.537 118.537 118.662 -0.125 18112 1440 1 2 . 1 1 147 147 ILE HA H 147 3.642 3.642 3.490 0.152 18112 1441 1 2 . 1 1 147 147 ILE C C 147 178.919 178.919 178.212 0.707 18112 1442 1 2 . 1 1 147 147 ILE CA C 147 64.418 64.418 63.907 0.511 18112 1443 1 2 . 1 1 147 147 ILE CB C 147 36.519 36.519 36.262 0.257 18112 1444 1 2 . 1 1 147 147 ILE H H 147 6.734 6.734 8.052 -1.318 18112 1445 1 2 . 1 1 148 148 TYR N N 148 121.033 121.033 118.846 2.187 18112 1446 1 2 . 1 1 148 148 TYR HA H 148 4.489 4.489 4.076 0.413 18112 1447 1 2 . 1 1 148 148 TYR C C 148 178.348 178.348 178.300 0.048 18112 1448 1 2 . 1 1 148 148 TYR CA C 148 57.389 57.389 60.181 -2.792 18112 1449 1 2 . 1 1 148 148 TYR CB C 148 35.280 35.280 37.151 -1.871 18112 1450 1 2 . 1 1 148 148 TYR H H 148 8.126 8.126 8.083 0.043 18112 1451 1 2 . 1 1 149 149 LYS N N 149 114.484 114.484 118.836 -4.352 18112 1452 1 2 . 1 1 149 149 LYS C C 149 178.051 178.051 178.952 -0.901 18112 1453 1 2 . 1 1 149 149 LYS CA C 149 59.036 59.036 59.478 -0.442 18112 1454 1 2 . 1 1 149 149 LYS CB C 149 31.575 31.575 32.294 -0.719 18112 1455 1 2 . 1 1 149 149 LYS H H 149 7.364 7.364 8.111 -0.747 18112 1456 1 2 . 1 1 150 150 VAL N N 150 117.812 117.812 117.096 0.716 18112 1457 1 2 . 1 1 150 150 VAL HA H 150 3.770 3.770 3.824 -0.054 18112 1458 1 2 . 1 1 150 150 VAL C C 150 178.786 178.786 177.126 1.660 18112 1459 1 2 . 1 1 150 150 VAL CA C 150 65.070 65.070 65.382 -0.312 18112 1460 1 2 . 1 1 150 150 VAL CB C 150 29.515 29.515 31.498 -1.983 18112 1461 1 2 . 1 1 150 150 VAL H H 150 7.254 7.254 7.896 -0.642 18112 1462 1 2 . 1 1 151 151 ILE N N 151 117.884 117.884 113.797 4.087 18112 1463 1 2 . 1 1 151 151 ILE C C 151 180.539 180.539 176.699 3.840 18112 1464 1 2 . 1 1 151 151 ILE CA C 151 61.490 61.490 62.537 -1.047 18112 1465 1 2 . 1 1 151 151 ILE CB C 151 33.994 33.994 38.605 -4.611 18112 1466 1 2 . 1 1 151 151 ILE H H 151 8.154 8.154 8.015 0.139 18112 1467 1 2 . 1 1 152 152 CYS N N 152 118.649 118.649 120.581 -1.932 18112 1468 1 2 . 1 1 152 152 CYS HA H 152 4.153 4.153 4.402 -0.249 18112 1469 1 2 . 1 1 152 152 CYS C C 152 174.888 174.888 176.582 -1.694 18112 1470 1 2 . 1 1 152 152 CYS CA C 152 61.052 61.052 59.049 2.003 18112 1471 1 2 . 1 1 152 152 CYS CB C 152 36.364 36.364 28.695 7.669 18112 1472 1 2 . 1 1 152 152 CYS H H 152 8.711 8.711 8.306 0.405 18112 1473 1 2 . 1 1 153 153 LYS N N 153 118.498 118.498 121.169 -2.671 18112 1474 1 2 . 1 1 153 153 LYS C C 153 177.389 177.389 176.791 0.598 18112 1475 1 2 . 1 1 153 153 LYS CA C 153 56.243 56.243 58.692 -2.449 18112 1476 1 2 . 1 1 153 153 LYS CB C 153 31.343 31.343 32.216 -0.873 18112 1477 1 2 . 1 1 153 153 LYS H H 153 6.782 6.782 8.132 -1.350 18112 1478 1 2 . 1 1 154 154 LEU N N 154 117.318 117.318 111.771 5.547 18112 1479 1 2 . 1 1 154 154 LEU HA H 154 4.576 4.576 4.566 0.010 18112 1480 1 2 . 1 1 154 154 LEU C C 154 177.161 177.161 175.697 1.464 18112 1481 1 2 . 1 1 154 154 LEU CA C 154 53.782 53.782 53.651 0.131 18112 1482 1 2 . 1 1 154 154 LEU CB C 154 40.881 40.881 42.611 -1.730 18112 1483 1 2 . 1 1 154 154 LEU H H 154 7.616 7.616 7.214 0.402 18112 1484 1 2 . 1 1 155 155 ASP N N 155 121.564 121.564 120.629 0.935 18112 1485 1 2 . 1 1 155 155 ASP C C 155 177.094 177.094 175.783 1.311 18112 1486 1 2 . 1 1 155 155 ASP CA C 155 55.732 55.732 54.759 0.973 18112 1487 1 2 . 1 1 155 155 ASP CB C 155 40.139 40.139 41.467 -1.328 18112 1488 1 2 . 1 1 155 155 ASP H H 155 7.582 7.582 7.753 -0.171 18112 1489 1 2 . 1 1 156 156 SER N N 156 117.352 117.352 120.734 -3.382 18112 1490 1 2 . 1 1 156 156 SER HA H 156 4.818 4.818 4.652 0.166 18112 1491 1 2 . 1 1 156 156 SER C C 156 173.409 173.409 173.286 0.123 18112 1492 1 2 . 1 1 156 156 SER CA C 156 57.073 57.073 57.503 -0.430 18112 1493 1 2 . 1 1 156 156 SER CB C 156 65.150 65.150 65.420 -0.270 18112 1494 1 2 . 1 1 156 156 SER H H 156 8.846 8.846 8.190 0.656 18112 1495 1 2 . 1 1 157 157 GLU N N 157 120.688 120.688 120.840 -0.152 18112 1496 1 2 . 1 1 157 157 GLU HA H 157 4.038 4.038 4.755 -0.717 18112 1497 1 2 . 1 1 157 157 GLU C C 157 176.332 176.332 176.595 -0.263 18112 1498 1 2 . 1 1 157 157 GLU CA C 157 56.464 56.464 54.692 1.772 18112 1499 1 2 . 1 1 157 157 GLU CB C 157 29.206 29.206 31.249 -2.043 18112 1500 1 2 . 1 1 157 157 GLU H H 157 8.356 8.356 8.424 -0.068 18112 1501 1 2 . 1 1 158 158 VAL N N 158 126.906 126.906 119.886 7.020 18112 1502 1 2 . 1 1 158 158 VAL HA H 158 3.449 3.449 4.229 -0.780 18112 1503 1 2 . 1 1 158 158 VAL C C 158 176.382 176.382 174.130 2.252 18112 1504 1 2 . 1 1 158 158 VAL CA C 158 59.584 59.584 59.687 -0.103 18112 1505 1 2 . 1 1 158 158 VAL CB C 158 31.160 31.160 30.596 0.564 18112 1506 1 2 . 1 1 158 158 VAL H H 158 8.561 8.561 7.927 0.634 18112 1507 1 2 . 1 1 159 159 PRO HA H 159 4.403 4.403 4.125 0.278 18112 1508 1 2 . 1 1 159 159 PRO C C 159 176.757 176.757 177.117 -0.360 18112 1509 1 2 . 1 1 159 159 PRO CA C 159 63.845 63.845 63.330 0.515 18112 1510 1 2 . 1 1 159 159 PRO CB C 159 32.106 32.106 31.450 0.656 18112 1511 1 2 . 1 1 160 160 GLU N N 160 122.904 122.904 120.828 2.076 18112 1512 1 2 . 1 1 160 160 GLU HA H 160 4.008 4.008 3.902 0.106 18112 1513 1 2 . 1 1 160 160 GLU C C 160 179.132 179.132 176.015 3.117 18112 1514 1 2 . 1 1 160 160 GLU CA C 160 59.407 59.407 58.239 1.168 18112 1515 1 2 . 1 1 160 160 GLU CB C 160 28.991 28.991 29.898 -0.907 18112 1516 1 2 . 1 1 160 160 GLU H H 160 8.650 8.650 8.640 0.010 18112 1517 1 2 . 1 1 161 161 ILE N N 161 119.782 119.782 117.580 2.202 18112 1518 1 2 . 1 1 161 161 ILE HA H 161 4.146 4.146 4.285 -0.139 18112 1519 1 2 . 1 1 161 161 ILE C C 161 176.176 176.176 174.457 1.719 18112 1520 1 2 . 1 1 161 161 ILE CA C 161 62.034 62.034 60.096 1.938 18112 1521 1 2 . 1 1 161 161 ILE CB C 161 37.113 37.113 39.382 -2.269 18112 1522 1 2 . 1 1 161 161 ILE H H 161 8.448 8.448 7.364 1.084 18112 1523 1 2 . 1 1 162 162 PHE N N 162 117.594 117.594 125.752 -8.158 18112 1524 1 2 . 1 1 162 162 PHE C C 162 176.115 176.115 176.892 -0.777 18112 1525 1 2 . 1 1 162 162 PHE CA C 162 61.009 61.009 60.625 0.384 18112 1526 1 2 . 1 1 162 162 PHE CB C 162 38.394 38.394 38.916 -0.522 18112 1527 1 2 . 1 1 162 162 PHE H H 162 8.145 8.145 8.996 -0.851 18112 1528 1 2 . 1 1 163 163 LYS N N 163 116.083 116.083 117.823 -1.740 18112 1529 1 2 . 1 1 163 163 LYS C C 163 178.196 178.196 176.470 1.726 18112 1530 1 2 . 1 1 163 163 LYS CA C 163 58.136 58.136 58.188 -0.052 18112 1531 1 2 . 1 1 163 163 LYS CB C 163 31.694 31.694 32.655 -0.961 18112 1532 1 2 . 1 1 163 163 LYS H H 163 8.232 8.232 8.297 -0.065 18112 1533 1 2 . 1 1 164 164 SER N N 164 113.680 113.680 112.999 0.681 18112 1534 1 2 . 1 1 164 164 SER CA C 164 55.205 55.205 56.252 -1.047 18112 1535 1 2 . 1 1 164 164 SER CB C 164 63.265 63.265 64.196 -0.931 18112 1536 1 2 . 1 1 164 164 SER H H 164 7.708 7.708 7.587 0.121 18112 1537 1 2 . 1 1 165 165 PRO HA H 165 4.580 4.580 4.349 0.231 18112 1538 1 2 . 1 1 165 165 PRO C C 165 177.541 177.541 176.493 1.048 18112 1539 1 2 . 1 1 165 165 PRO CA C 165 63.950 63.950 64.008 -0.058 18112 1540 1 2 . 1 1 165 165 PRO CB C 165 30.686 30.686 31.114 -0.428 18112 1541 1 2 . 1 1 166 166 ASN N N 166 116.304 116.304 118.121 -1.817 18112 1542 1 2 . 1 1 166 166 ASN HA H 166 5.029 5.029 4.351 0.678 18112 1543 1 2 . 1 1 166 166 ASN C C 166 175.811 175.811 176.535 -0.724 18112 1544 1 2 . 1 1 166 166 ASN CA C 166 51.962 51.962 55.058 -3.096 18112 1545 1 2 . 1 1 166 166 ASN CB C 166 37.915 37.915 37.568 0.347 18112 1546 1 2 . 1 1 166 166 ASN H H 166 8.216 8.216 8.840 -0.624 18112 1547 1 2 . 1 1 167 167 CYS N N 167 116.078 116.078 118.994 -2.916 18112 1548 1 2 . 1 1 167 167 CYS HA H 167 4.011 4.011 4.391 -0.380 18112 1549 1 2 . 1 1 167 167 CYS C C 167 175.057 175.057 175.935 -0.878 18112 1550 1 2 . 1 1 167 167 CYS CA C 167 59.816 59.816 60.138 -0.322 18112 1551 1 2 . 1 1 167 167 CYS CB C 167 27.446 27.446 27.070 0.376 18112 1552 1 2 . 1 1 167 167 CYS H H 167 7.246 7.246 8.084 -0.838 18112 1553 1 2 . 1 1 168 168 LEU N N 168 120.082 120.082 121.080 -0.998 18112 1554 1 2 . 1 1 168 168 LEU HA H 168 3.880 3.880 4.223 -0.343 18112 1555 1 2 . 1 1 168 168 LEU C C 168 178.541 178.541 177.879 0.662 18112 1556 1 2 . 1 1 168 168 LEU CA C 168 57.734 57.734 56.772 0.963 18112 1557 1 2 . 1 1 168 168 LEU CB C 168 38.825 38.825 40.135 -1.310 18112 1558 1 2 . 1 1 168 168 LEU H H 168 8.451 8.451 8.297 0.154 18112 1559 1 2 . 1 1 169 169 GLN N N 169 116.700 116.700 119.961 -3.261 18112 1560 1 2 . 1 1 169 169 GLN HA H 169 4.064 4.064 4.006 0.058 18112 1561 1 2 . 1 1 169 169 GLN C C 169 177.378 177.378 177.475 -0.097 18112 1562 1 2 . 1 1 169 169 GLN CA C 169 57.675 57.675 58.425 -0.750 18112 1563 1 2 . 1 1 169 169 GLN CB C 169 27.710 27.710 28.530 -0.821 18112 1564 1 2 . 1 1 169 169 GLN H H 169 7.665 7.665 7.656 0.009 18112 1565 1 2 . 1 1 170 170 GLU N N 170 116.701 116.701 119.266 -2.565 18112 1566 1 2 . 1 1 170 170 GLU HA H 170 4.214 4.214 4.143 0.071 18112 1567 1 2 . 1 1 170 170 GLU C C 170 177.730 177.730 178.153 -0.423 18112 1568 1 2 . 1 1 170 170 GLU CA C 170 56.899 56.899 58.368 -1.469 18112 1569 1 2 . 1 1 170 170 GLU H H 170 7.405 7.405 7.734 -0.329 18112 1570 1 2 . 1 1 171 171 LEU N N 171 118.021 118.021 117.908 0.113 18112 1571 1 2 . 1 1 171 171 LEU HA H 171 4.209 4.209 4.143 0.066 18112 1572 1 2 . 1 1 171 171 LEU C C 171 177.005 177.005 177.108 -0.103 18112 1573 1 2 . 1 1 171 171 LEU CA C 171 55.870 55.870 56.715 -0.846 18112 1574 1 2 . 1 1 171 171 LEU CB C 171 43.680 43.680 42.015 1.665 18112 1575 1 2 . 1 1 171 171 LEU H H 171 7.823 7.823 7.583 0.240 18112 1576 1 2 . 1 1 172 172 LEU N N 172 117.580 117.580 117.832 -0.252 18112 1577 1 2 . 1 1 172 172 LEU HA H 172 4.571 4.571 4.266 0.305 18112 1578 1 2 . 1 1 172 172 LEU C C 172 176.411 176.411 176.092 0.319 18112 1579 1 2 . 1 1 172 172 LEU CA C 172 53.972 53.972 54.861 -0.889 18112 1580 1 2 . 1 1 172 172 LEU CB C 172 40.483 40.483 39.031 1.452 18112 1581 1 2 . 1 1 172 172 LEU H H 172 7.306 7.306 7.541 -0.235 18112 1582 1 2 . 1 1 173 173 HIS N N 173 123.310 123.310 122.953 0.357 18112 1583 1 2 . 1 1 173 173 HIS C C 173 179.022 179.022 173.826 5.196 18112 1584 1 2 . 1 1 173 173 HIS CA C 173 56.693 56.693 55.844 0.849 18112 1585 1 2 . 1 1 173 173 HIS CB C 173 29.371 29.371 31.417 -2.046 18112 1586 1 2 . 1 1 173 173 HIS H H 173 8.028 8.028 7.967 0.061 18112 1587 1 3 . 1 1 12 12 ALA N N 12 125.167 125.167 121.291 3.876 18112 1588 1 3 . 1 1 12 12 ALA C C 12 177.566 177.566 176.352 1.214 18112 1589 1 3 . 1 1 12 12 ALA CA C 12 52.067 52.067 51.833 0.234 18112 1590 1 3 . 1 1 12 12 ALA CB C 12 18.456 18.456 19.496 -1.040 18112 1591 1 3 . 1 1 12 12 ALA H H 12 8.311 8.311 8.122 0.189 18112 1592 1 3 . 1 1 13 13 MET N N 13 119.278 119.278 120.973 -1.695 18112 1593 1 3 . 1 1 13 13 MET C C 13 176.325 176.325 175.928 0.397 18112 1594 1 3 . 1 1 13 13 MET CA C 13 54.992 54.992 56.526 -1.534 18112 1595 1 3 . 1 1 13 13 MET CB C 13 32.308 32.308 35.064 -2.756 18112 1596 1 3 . 1 1 13 13 MET H H 13 8.269 8.269 8.918 -0.649 18112 1597 1 3 . 1 1 14 14 GLN N N 14 120.869 120.869 121.311 -0.442 18112 1598 1 3 . 1 1 14 14 GLN HA H 14 4.399 4.399 4.454 -0.055 18112 1599 1 3 . 1 1 14 14 GLN C C 14 175.644 175.644 174.600 1.044 18112 1600 1 3 . 1 1 14 14 GLN CA C 14 55.139 55.139 55.001 0.138 18112 1601 1 3 . 1 1 14 14 GLN CB C 14 29.051 29.051 29.116 -0.065 18112 1602 1 3 . 1 1 14 14 GLN H H 14 8.501 8.501 8.246 0.255 18112 1603 1 3 . 1 1 15 15 GLU N N 15 122.042 122.042 125.220 -3.178 18112 1604 1 3 . 1 1 15 15 GLU C C 15 176.242 176.242 176.412 -0.170 18112 1605 1 3 . 1 1 15 15 GLU CA C 15 56.064 56.064 55.488 0.576 18112 1606 1 3 . 1 1 15 15 GLU CB C 15 29.302 29.302 30.176 -0.874 18112 1607 1 3 . 1 1 15 15 GLU H H 15 8.547 8.547 8.515 0.032 18112 1608 1 3 . 1 1 16 16 GLY N N 16 108.821 108.821 110.813 -1.992 18112 1609 1 3 . 1 1 16 16 GLY C C 16 172.949 172.949 174.383 -1.434 18112 1610 1 3 . 1 1 16 16 GLY CA C 16 44.227 44.227 45.283 -1.056 18112 1611 1 3 . 1 1 16 16 GLY H H 16 8.100 8.100 8.560 -0.460 18112 1612 1 3 . 1 1 17 17 LEU N N 17 120.315 120.315 119.843 0.472 18112 1613 1 3 . 1 1 17 17 LEU C C 17 177.334 177.334 177.199 0.135 18112 1614 1 3 . 1 1 17 17 LEU CA C 17 53.544 53.544 53.902 -0.358 18112 1615 1 3 . 1 1 17 17 LEU CB C 17 42.140 42.140 41.550 0.590 18112 1616 1 3 . 1 1 17 17 LEU H H 17 8.222 8.222 7.599 0.623 18112 1617 1 3 . 1 1 18 18 SER N N 18 126.547 126.547 116.790 9.757 18112 1618 1 3 . 1 1 18 18 SER CA C 18 56.851 56.851 60.681 -3.830 18112 1619 1 3 . 1 1 18 18 SER CB C 18 64.636 64.636 62.630 2.006 18112 1620 1 3 . 1 1 18 18 SER H H 18 11.627 11.627 8.363 3.264 18112 1621 1 3 . 1 1 19 19 PRO C C 19 175.118 175.118 176.033 -0.915 18112 1622 1 3 . 1 1 20 20 ASN N N 20 121.372 121.372 119.921 1.451 18112 1623 1 3 . 1 1 20 20 ASN H H 20 8.172 8.172 8.386 -0.214 18112 1624 1 3 . 1 1 25 25 ALA CB C 25 18.020 18.020 18.833 -0.813 18112 1625 1 3 . 1 1 26 26 LYS N N 26 118.490 118.490 119.328 -0.838 18112 1626 1 3 . 1 1 26 26 LYS CA C 26 56.146 56.146 59.464 -3.318 18112 1627 1 3 . 1 1 26 26 LYS H H 26 6.794 6.794 7.876 -1.082 18112 1628 1 3 . 1 1 31 31 TYR HA H 31 4.398 4.398 4.533 -0.135 18112 1629 1 3 . 1 1 31 31 TYR C C 31 173.714 173.714 176.827 -3.113 18112 1630 1 3 . 1 1 31 31 TYR CA C 31 59.757 59.757 61.222 -1.465 18112 1631 1 3 . 1 1 32 32 THR N N 32 111.928 111.928 111.814 0.114 18112 1632 1 3 . 1 1 32 32 THR HA H 32 4.209 4.209 4.855 -0.646 18112 1633 1 3 . 1 1 32 32 THR C C 32 171.061 171.061 174.577 -3.516 18112 1634 1 3 . 1 1 32 32 THR CA C 32 56.905 56.905 60.522 -3.617 18112 1635 1 3 . 1 1 32 32 THR CB C 32 69.707 69.707 70.015 -0.308 18112 1636 1 3 . 1 1 32 32 THR H H 32 8.237 8.237 7.880 0.357 18112 1637 1 3 . 1 1 33 33 ARG N N 33 124.856 124.856 123.947 0.909 18112 1638 1 3 . 1 1 33 33 ARG C C 33 176.451 176.451 176.254 0.197 18112 1639 1 3 . 1 1 33 33 ARG CA C 33 55.627 55.627 54.286 1.341 18112 1640 1 3 . 1 1 33 33 ARG CB C 33 29.861 29.861 31.560 -1.699 18112 1641 1 3 . 1 1 33 33 ARG H H 33 9.159 9.159 8.580 0.579 18112 1642 1 3 . 1 1 34 34 TYR N N 34 117.908 117.908 122.345 -4.437 18112 1643 1 3 . 1 1 34 34 TYR CA C 34 55.320 55.320 58.390 -3.070 18112 1644 1 3 . 1 1 34 34 TYR H H 34 8.995 8.995 7.690 1.305 18112 1645 1 3 . 1 1 35 35 PRO C C 35 177.280 177.280 177.844 -0.564 18112 1646 1 3 . 1 1 36 36 SER N N 36 116.410 116.410 120.284 -3.874 18112 1647 1 3 . 1 1 36 36 SER C C 36 178.938 178.938 176.364 2.574 18112 1648 1 3 . 1 1 36 36 SER CA C 36 64.815 64.815 62.132 2.683 18112 1649 1 3 . 1 1 36 36 SER H H 36 8.106 8.106 8.976 -0.870 18112 1650 1 3 . 1 1 37 37 SER N N 37 117.488 117.488 118.814 -1.326 18112 1651 1 3 . 1 1 37 37 SER C C 37 177.698 177.698 176.667 1.031 18112 1652 1 3 . 1 1 37 37 SER CA C 37 61.357 61.357 61.580 -0.223 18112 1653 1 3 . 1 1 37 37 SER CB C 37 68.118 68.118 62.399 5.719 18112 1654 1 3 . 1 1 37 37 SER H H 37 8.169 8.169 8.417 -0.248 18112 1655 1 3 . 1 1 38 38 ASN N N 38 115.638 115.638 121.111 -5.473 18112 1656 1 3 . 1 1 38 38 ASN HA H 38 4.259 4.259 4.431 -0.172 18112 1657 1 3 . 1 1 38 38 ASN C C 38 177.868 177.868 177.478 0.390 18112 1658 1 3 . 1 1 38 38 ASN CA C 38 55.907 55.907 55.925 -0.018 18112 1659 1 3 . 1 1 38 38 ASN CB C 38 37.230 37.230 38.328 -1.098 18112 1660 1 3 . 1 1 38 38 ASN H H 38 8.284 8.284 7.948 0.336 18112 1661 1 3 . 1 1 39 39 MET N N 39 121.352 121.352 118.363 2.989 18112 1662 1 3 . 1 1 39 39 MET HA H 39 4.170 4.170 3.584 0.586 18112 1663 1 3 . 1 1 39 39 MET C C 39 179.068 179.068 178.652 0.416 18112 1664 1 3 . 1 1 39 39 MET CA C 39 58.751 58.751 58.438 0.313 18112 1665 1 3 . 1 1 39 39 MET CB C 39 31.850 31.850 32.444 -0.594 18112 1666 1 3 . 1 1 39 39 MET H H 39 7.857 7.857 7.551 0.306 18112 1667 1 3 . 1 1 40 40 LEU N N 40 118.936 118.936 122.863 -3.927 18112 1668 1 3 . 1 1 40 40 LEU HA H 40 4.139 4.139 4.594 -0.455 18112 1669 1 3 . 1 1 40 40 LEU C C 40 178.700 178.700 178.952 -0.252 18112 1670 1 3 . 1 1 40 40 LEU CA C 40 58.455 58.455 58.914 -0.459 18112 1671 1 3 . 1 1 40 40 LEU CB C 40 40.304 40.304 41.814 -1.510 18112 1672 1 3 . 1 1 40 40 LEU H H 40 8.167 8.167 8.379 -0.212 18112 1673 1 3 . 1 1 41 41 LYS N N 41 116.791 116.791 116.339 0.452 18112 1674 1 3 . 1 1 41 41 LYS HA H 41 3.475 3.475 4.339 -0.864 18112 1675 1 3 . 1 1 41 41 LYS C C 41 178.793 178.793 179.034 -0.241 18112 1676 1 3 . 1 1 41 41 LYS CA C 41 59.161 59.161 58.256 0.905 18112 1677 1 3 . 1 1 41 41 LYS CB C 41 30.992 30.992 31.706 -0.714 18112 1678 1 3 . 1 1 41 41 LYS H H 41 7.632 7.632 7.990 -0.358 18112 1679 1 3 . 1 1 42 42 THR N N 42 112.819 112.819 115.484 -2.665 18112 1680 1 3 . 1 1 42 42 THR HA H 42 4.230 4.230 4.123 0.107 18112 1681 1 3 . 1 1 42 42 THR C C 42 176.142 176.142 175.744 0.398 18112 1682 1 3 . 1 1 42 42 THR CA C 42 65.107 65.107 65.650 -0.543 18112 1683 1 3 . 1 1 42 42 THR CB C 42 68.306 68.306 68.986 -0.679 18112 1684 1 3 . 1 1 42 42 THR H H 42 7.469 7.469 8.074 -0.605 18112 1685 1 3 . 1 1 43 43 TYR N N 43 118.565 118.565 117.279 1.286 18112 1686 1 3 . 1 1 43 43 TYR HA H 43 4.204 4.204 4.344 -0.140 18112 1687 1 3 . 1 1 43 43 TYR C C 43 174.240 174.240 176.964 -2.724 18112 1688 1 3 . 1 1 43 43 TYR CA C 43 60.886 60.886 57.700 3.186 18112 1689 1 3 . 1 1 43 43 TYR CB C 43 38.165 38.165 38.598 -0.433 18112 1690 1 3 . 1 1 43 43 TYR H H 43 7.978 7.978 7.463 0.515 18112 1691 1 3 . 1 1 44 44 PHE N N 44 120.980 120.980 118.421 2.559 18112 1692 1 3 . 1 1 44 44 PHE HA H 44 4.920 4.920 4.670 0.250 18112 1693 1 3 . 1 1 44 44 PHE C C 44 176.436 176.436 175.595 0.841 18112 1694 1 3 . 1 1 44 44 PHE CA C 44 56.672 56.672 58.327 -1.655 18112 1695 1 3 . 1 1 44 44 PHE CB C 44 36.570 36.570 37.105 -0.535 18112 1696 1 3 . 1 1 44 44 PHE H H 44 7.955 7.955 8.064 -0.109 18112 1697 1 3 . 1 1 45 45 SER N N 45 113.407 113.407 117.739 -4.332 18112 1698 1 3 . 1 1 45 45 SER HA H 45 4.373 4.373 4.499 -0.126 18112 1699 1 3 . 1 1 45 45 SER C C 45 174.424 174.424 175.439 -1.015 18112 1700 1 3 . 1 1 45 45 SER CA C 45 61.037 61.037 60.624 0.413 18112 1701 1 3 . 1 1 45 45 SER CB C 45 62.711 62.711 64.091 -1.379 18112 1702 1 3 . 1 1 45 45 SER H H 45 7.932 7.932 8.013 -0.081 18112 1703 1 3 . 1 1 46 46 ASP N N 46 118.099 118.099 120.541 -2.442 18112 1704 1 3 . 1 1 46 46 ASP HA H 46 4.572 4.572 4.579 -0.007 18112 1705 1 3 . 1 1 46 46 ASP C C 46 174.866 174.866 175.941 -1.075 18112 1706 1 3 . 1 1 46 46 ASP CA C 46 53.602 53.602 56.042 -2.440 18112 1707 1 3 . 1 1 46 46 ASP CB C 46 38.992 38.992 41.157 -2.164 18112 1708 1 3 . 1 1 46 46 ASP H H 46 9.889 9.889 8.653 1.236 18112 1709 1 3 . 1 1 47 47 VAL N N 47 121.496 121.496 119.460 2.036 18112 1710 1 3 . 1 1 47 47 VAL HA H 47 4.058 4.058 3.714 0.344 18112 1711 1 3 . 1 1 47 47 VAL C C 47 174.676 174.676 175.543 -0.867 18112 1712 1 3 . 1 1 47 47 VAL CA C 47 61.006 61.006 62.628 -1.622 18112 1713 1 3 . 1 1 47 47 VAL CB C 47 32.110 32.110 30.735 1.375 18112 1714 1 3 . 1 1 47 47 VAL H H 47 7.781 7.781 7.636 0.145 18112 1715 1 3 . 1 1 48 48 LYS N N 48 126.100 126.100 126.544 -0.444 18112 1716 1 3 . 1 1 48 48 LYS HA H 48 4.402 4.402 4.072 0.330 18112 1717 1 3 . 1 1 48 48 LYS C C 48 175.564 175.564 176.465 -0.901 18112 1718 1 3 . 1 1 48 48 LYS CA C 48 54.874 54.874 56.643 -1.769 18112 1719 1 3 . 1 1 48 48 LYS CB C 48 30.189 30.189 32.473 -2.284 18112 1720 1 3 . 1 1 48 48 LYS H H 48 8.245 8.245 8.342 -0.097 18112 1721 1 3 . 1 1 49 49 PHE N N 49 125.341 125.341 114.160 11.181 18112 1722 1 3 . 1 1 49 49 PHE HA H 49 3.813 3.813 4.136 -0.323 18112 1723 1 3 . 1 1 49 49 PHE C C 49 175.708 175.708 174.413 1.295 18112 1724 1 3 . 1 1 49 49 PHE CA C 49 60.861 60.861 57.318 3.543 18112 1725 1 3 . 1 1 49 49 PHE CB C 49 38.616 38.616 36.190 2.426 18112 1726 1 3 . 1 1 49 49 PHE H H 49 8.626 8.626 7.535 1.091 18112 1727 1 3 . 1 1 50 50 ASN N N 50 115.408 115.408 119.300 -3.892 18112 1728 1 3 . 1 1 50 50 ASN C C 50 176.072 176.072 176.752 -0.680 18112 1729 1 3 . 1 1 50 50 ASN CA C 50 51.730 51.730 52.631 -0.901 18112 1730 1 3 . 1 1 50 50 ASN H H 50 7.030 7.030 8.025 -0.995 18112 1731 1 3 . 1 1 51 51 ARG N N 51 122.706 122.706 125.709 -3.003 18112 1732 1 3 . 1 1 51 51 ARG CA C 51 59.534 59.534 59.016 0.518 18112 1733 1 3 . 1 1 51 51 ARG H H 51 7.790 7.790 8.897 -1.107 18112 1734 1 3 . 1 1 52 52 CYS N N 52 117.340 117.340 115.063 2.277 18112 1735 1 3 . 1 1 52 52 CYS HA H 52 4.108 4.108 4.420 -0.312 18112 1736 1 3 . 1 1 52 52 CYS C C 52 178.200 178.200 177.135 1.065 18112 1737 1 3 . 1 1 52 52 CYS CA C 52 61.143 61.143 61.323 -0.180 18112 1738 1 3 . 1 1 52 52 CYS H H 52 7.681 7.681 8.131 -0.450 18112 1739 1 3 . 1 1 53 53 ILE N N 53 122.321 122.321 118.637 3.684 18112 1740 1 3 . 1 1 53 53 ILE HA H 53 3.588 3.588 4.107 -0.519 18112 1741 1 3 . 1 1 53 53 ILE C C 53 177.492 177.492 177.313 0.179 18112 1742 1 3 . 1 1 53 53 ILE CA C 53 64.109 64.109 63.710 0.399 18112 1743 1 3 . 1 1 53 53 ILE CB C 53 37.603 37.603 37.392 0.212 18112 1744 1 3 . 1 1 53 53 ILE H H 53 8.035 8.035 7.380 0.655 18112 1745 1 3 . 1 1 54 54 THR C C 54 175.903 175.903 176.419 -0.516 18112 1746 1 3 . 1 1 54 54 THR CA C 54 67.308 67.308 67.369 -0.061 18112 1747 1 3 . 1 1 55 55 SER N N 55 113.819 113.819 116.842 -3.023 18112 1748 1 3 . 1 1 55 55 SER H H 55 7.844 7.844 8.065 -0.221 18112 1749 1 3 . 1 1 56 56 GLN C C 56 179.792 179.792 177.635 2.157 18112 1750 1 3 . 1 1 57 57 LEU N N 57 116.701 116.701 120.684 -3.983 18112 1751 1 3 . 1 1 57 57 LEU HA H 57 4.519 4.519 2.385 2.134 18112 1752 1 3 . 1 1 57 57 LEU C C 57 178.775 178.775 178.126 0.649 18112 1753 1 3 . 1 1 57 57 LEU CA C 57 55.232 55.232 57.100 -1.868 18112 1754 1 3 . 1 1 57 57 LEU CB C 57 37.131 37.131 41.485 -4.354 18112 1755 1 3 . 1 1 57 57 LEU H H 57 8.267 8.267 7.454 0.813 18112 1756 1 3 . 1 1 58 58 ILE N N 58 122.522 122.522 117.846 4.676 18112 1757 1 3 . 1 1 58 58 ILE HA H 58 4.640 4.640 3.418 1.222 18112 1758 1 3 . 1 1 58 58 ILE C C 58 177.380 177.380 177.724 -0.344 18112 1759 1 3 . 1 1 58 58 ILE CA C 58 62.163 62.163 64.793 -2.630 18112 1760 1 3 . 1 1 58 58 ILE CB C 58 30.657 30.657 37.497 -6.840 18112 1761 1 3 . 1 1 58 58 ILE H H 58 8.111 8.111 7.885 0.226 18112 1762 1 3 . 1 1 59 59 LYS N N 59 121.002 121.002 121.453 -0.451 18112 1763 1 3 . 1 1 59 59 LYS C C 59 177.600 177.600 178.611 -1.011 18112 1764 1 3 . 1 1 59 59 LYS CA C 59 57.570 57.570 58.836 -1.266 18112 1765 1 3 . 1 1 59 59 LYS CB C 59 39.101 39.101 31.702 7.399 18112 1766 1 3 . 1 1 59 59 LYS H H 59 7.432 7.432 7.631 -0.199 18112 1767 1 3 . 1 1 60 60 TRP N N 60 118.679 118.679 118.540 0.139 18112 1768 1 3 . 1 1 60 60 TRP HA H 60 3.739 3.739 3.992 -0.253 18112 1769 1 3 . 1 1 60 60 TRP C C 60 178.246 178.246 178.605 -0.359 18112 1770 1 3 . 1 1 60 60 TRP CA C 60 59.818 59.818 58.278 1.540 18112 1771 1 3 . 1 1 60 60 TRP CB C 60 31.851 31.851 28.078 3.773 18112 1772 1 3 . 1 1 60 60 TRP H H 60 7.565 7.565 7.457 0.108 18112 1773 1 3 . 1 1 61 61 PHE N N 61 118.005 118.005 116.944 1.061 18112 1774 1 3 . 1 1 61 61 PHE HA H 61 3.882 3.882 3.324 0.558 18112 1775 1 3 . 1 1 61 61 PHE CA C 61 60.054 60.054 59.689 0.365 18112 1776 1 3 . 1 1 61 61 PHE H H 61 7.819 7.819 8.339 -0.520 18112 1777 1 3 . 1 1 62 62 SER N N 62 121.144 121.144 114.385 6.759 18112 1778 1 3 . 1 1 62 62 SER C C 62 177.840 177.840 176.912 0.928 18112 1779 1 3 . 1 1 62 62 SER CA C 62 55.892 55.892 61.620 -5.728 18112 1780 1 3 . 1 1 62 62 SER H H 62 8.878 8.878 8.301 0.577 18112 1781 1 3 . 1 1 63 63 ASN N N 63 115.303 115.303 121.524 -6.221 18112 1782 1 3 . 1 1 63 63 ASN C C 63 177.222 177.222 177.273 -0.051 18112 1783 1 3 . 1 1 63 63 ASN CA C 63 60.467 60.467 56.328 4.139 18112 1784 1 3 . 1 1 63 63 ASN H H 63 8.001 8.001 8.021 -0.020 18112 1785 1 3 . 1 1 64 64 PHE N N 64 112.571 112.571 119.132 -6.561 18112 1786 1 3 . 1 1 64 64 PHE CA C 64 56.453 56.453 59.574 -3.121 18112 1787 1 3 . 1 1 64 64 PHE H H 64 7.082 7.082 8.092 -1.010 18112 1788 1 3 . 1 1 65 65 ARG N N 65 116.695 116.695 120.411 -3.716 18112 1789 1 3 . 1 1 65 65 ARG CA C 65 59.590 59.590 59.376 0.214 18112 1790 1 3 . 1 1 65 65 ARG H H 65 8.091 8.091 8.609 -0.518 18112 1791 1 3 . 1 1 66 66 GLU N N 66 121.653 121.653 120.224 1.429 18112 1792 1 3 . 1 1 66 66 GLU HA H 66 4.739 4.739 4.260 0.479 18112 1793 1 3 . 1 1 66 66 GLU C C 66 174.621 174.621 179.310 -4.689 18112 1794 1 3 . 1 1 66 66 GLU CA C 66 59.583 59.583 59.781 -0.198 18112 1795 1 3 . 1 1 66 66 GLU H H 66 7.597 7.597 8.257 -0.660 18112 1796 1 3 . 1 1 67 67 PHE N N 67 111.578 111.578 118.578 -7.000 18112 1797 1 3 . 1 1 67 67 PHE C C 67 176.164 176.164 178.119 -1.955 18112 1798 1 3 . 1 1 67 67 PHE CA C 67 61.156 61.156 61.510 -0.354 18112 1799 1 3 . 1 1 67 67 PHE H H 67 7.067 7.067 8.574 -1.507 18112 1800 1 3 . 1 1 68 68 TYR N N 68 119.370 119.370 121.292 -1.922 18112 1801 1 3 . 1 1 68 68 TYR C C 68 176.844 176.844 177.897 -1.053 18112 1802 1 3 . 1 1 68 68 TYR CA C 68 61.758 61.758 61.961 -0.203 18112 1803 1 3 . 1 1 68 68 TYR H H 68 7.442 7.442 8.635 -1.193 18112 1804 1 3 . 1 1 69 69 TYR N N 69 116.047 116.047 119.022 -2.975 18112 1805 1 3 . 1 1 69 69 TYR HA H 69 4.086 4.086 4.103 -0.017 18112 1806 1 3 . 1 1 69 69 TYR C C 69 180.328 180.328 177.588 2.740 18112 1807 1 3 . 1 1 69 69 TYR CA C 69 61.528 61.528 62.417 -0.889 18112 1808 1 3 . 1 1 69 69 TYR H H 69 9.127 9.127 8.474 0.653 18112 1809 1 3 . 1 1 70 70 ILE N N 70 124.738 124.738 119.153 5.585 18112 1810 1 3 . 1 1 70 70 ILE HA H 70 3.828 3.828 3.502 0.326 18112 1811 1 3 . 1 1 70 70 ILE C C 70 179.585 179.585 178.017 1.568 18112 1812 1 3 . 1 1 70 70 ILE CA C 70 65.787 65.787 64.515 1.272 18112 1813 1 3 . 1 1 70 70 ILE CB C 70 36.435 36.435 37.514 -1.079 18112 1814 1 3 . 1 1 70 70 ILE H H 70 8.631 8.631 8.412 0.219 18112 1815 1 3 . 1 1 71 71 GLN N N 71 117.940 117.940 118.533 -0.593 18112 1816 1 3 . 1 1 71 71 GLN HA H 71 3.826 3.826 3.482 0.344 18112 1817 1 3 . 1 1 71 71 GLN C C 71 178.192 178.192 178.244 -0.052 18112 1818 1 3 . 1 1 71 71 GLN CA C 71 57.779 57.779 58.560 -0.782 18112 1819 1 3 . 1 1 71 71 GLN H H 71 7.738 7.738 7.759 -0.021 18112 1820 1 3 . 1 1 72 72 MET N N 72 117.353 117.353 118.295 -0.942 18112 1821 1 3 . 1 1 72 72 MET HA H 72 4.112 4.112 3.970 0.142 18112 1822 1 3 . 1 1 72 72 MET C C 72 177.203 177.203 178.124 -0.921 18112 1823 1 3 . 1 1 72 72 MET CA C 72 57.272 57.272 57.512 -0.240 18112 1824 1 3 . 1 1 72 72 MET H H 72 7.844 7.844 7.984 -0.140 18112 1825 1 3 . 1 1 73 73 GLU N N 73 117.858 117.858 118.387 -0.529 18112 1826 1 3 . 1 1 73 73 GLU HA H 73 3.572 3.572 2.868 0.704 18112 1827 1 3 . 1 1 73 73 GLU C C 73 177.344 177.344 178.347 -1.003 18112 1828 1 3 . 1 1 73 73 GLU CA C 73 60.324 60.324 58.624 1.700 18112 1829 1 3 . 1 1 73 73 GLU H H 73 7.503 7.503 7.566 -0.063 18112 1830 1 3 . 1 1 74 74 LYS N N 74 118.716 118.716 120.526 -1.810 18112 1831 1 3 . 1 1 74 74 LYS HA H 74 3.867 3.867 3.865 0.002 18112 1832 1 3 . 1 1 74 74 LYS C C 74 180.077 180.077 179.010 1.067 18112 1833 1 3 . 1 1 74 74 LYS CA C 74 59.754 59.754 58.443 1.311 18112 1834 1 3 . 1 1 74 74 LYS H H 74 7.912 7.912 7.357 0.555 18112 1835 1 3 . 1 1 75 75 TYR N N 75 117.309 117.309 118.895 -1.586 18112 1836 1 3 . 1 1 75 75 TYR HA H 75 4.085 4.085 4.338 -0.253 18112 1837 1 3 . 1 1 75 75 TYR C C 75 178.874 178.874 178.673 0.201 18112 1838 1 3 . 1 1 75 75 TYR CA C 75 63.306 63.306 59.132 4.174 18112 1839 1 3 . 1 1 75 75 TYR H H 75 8.421 8.421 7.789 0.632 18112 1840 1 3 . 1 1 76 76 ALA N N 76 125.392 125.392 120.986 4.406 18112 1841 1 3 . 1 1 76 76 ALA HA H 76 4.221 4.221 4.081 0.140 18112 1842 1 3 . 1 1 76 76 ALA C C 76 178.850 178.850 179.126 -0.276 18112 1843 1 3 . 1 1 76 76 ALA CA C 76 56.280 56.280 55.315 0.965 18112 1844 1 3 . 1 1 76 76 ALA CB C 76 18.687 18.687 18.351 0.336 18112 1845 1 3 . 1 1 76 76 ALA H H 76 8.553 8.553 8.236 0.317 18112 1846 1 3 . 1 1 77 77 ARG N N 77 115.067 115.067 118.508 -3.441 18112 1847 1 3 . 1 1 77 77 ARG HA H 77 3.935 3.935 3.952 -0.017 18112 1848 1 3 . 1 1 77 77 ARG C C 77 179.341 179.341 178.236 1.105 18112 1849 1 3 . 1 1 77 77 ARG CA C 77 60.499 60.499 59.056 1.443 18112 1850 1 3 . 1 1 77 77 ARG H H 77 8.471 8.471 8.081 0.390 18112 1851 1 3 . 1 1 78 78 GLN N N 78 120.107 120.107 119.353 0.754 18112 1852 1 3 . 1 1 78 78 GLN HA H 78 3.921 3.921 4.124 -0.203 18112 1853 1 3 . 1 1 78 78 GLN C C 78 177.289 177.289 177.904 -0.615 18112 1854 1 3 . 1 1 78 78 GLN CA C 78 58.619 58.619 58.805 -0.186 18112 1855 1 3 . 1 1 78 78 GLN CB C 78 27.752 27.752 28.648 -0.896 18112 1856 1 3 . 1 1 78 78 GLN H H 78 8.142 8.142 8.316 -0.174 18112 1857 1 3 . 1 1 79 79 ALA N N 79 120.809 120.809 123.396 -2.587 18112 1858 1 3 . 1 1 79 79 ALA HA H 79 4.308 4.308 4.047 0.261 18112 1859 1 3 . 1 1 79 79 ALA C C 79 179.924 179.924 179.610 0.314 18112 1860 1 3 . 1 1 79 79 ALA CA C 79 54.970 54.970 55.489 -0.519 18112 1861 1 3 . 1 1 79 79 ALA CB C 79 17.064 17.064 18.548 -1.484 18112 1862 1 3 . 1 1 79 79 ALA H H 79 7.811 7.811 8.009 -0.198 18112 1863 1 3 . 1 1 80 80 ILE N N 80 118.524 118.524 117.959 0.565 18112 1864 1 3 . 1 1 80 80 ILE HA H 80 3.894 3.894 3.662 0.232 18112 1865 1 3 . 1 1 80 80 ILE C C 80 181.268 181.268 178.090 3.178 18112 1866 1 3 . 1 1 80 80 ILE CA C 80 64.841 64.841 63.810 1.031 18112 1867 1 3 . 1 1 80 80 ILE CB C 80 37.125 37.125 36.535 0.590 18112 1868 1 3 . 1 1 80 80 ILE H H 80 7.837 7.837 7.999 -0.162 18112 1869 1 3 . 1 1 81 81 ASN N N 81 121.233 121.233 118.313 2.920 18112 1870 1 3 . 1 1 81 81 ASN HA H 81 4.398 4.398 4.417 -0.019 18112 1871 1 3 . 1 1 81 81 ASN C C 81 176.546 176.546 176.971 -0.425 18112 1872 1 3 . 1 1 81 81 ASN CA C 81 55.892 55.892 55.835 0.057 18112 1873 1 3 . 1 1 81 81 ASN CB C 81 37.603 37.603 38.840 -1.237 18112 1874 1 3 . 1 1 81 81 ASN H H 81 8.262 8.262 8.057 0.205 18112 1875 1 3 . 1 1 82 82 ASP N N 82 119.240 119.240 117.645 1.595 18112 1876 1 3 . 1 1 82 82 ASP HA H 82 4.666 4.666 4.593 0.073 18112 1877 1 3 . 1 1 82 82 ASP C C 82 176.767 176.767 177.166 -0.399 18112 1878 1 3 . 1 1 82 82 ASP CA C 82 54.771 54.771 54.750 0.021 18112 1879 1 3 . 1 1 82 82 ASP CB C 82 40.121 40.121 41.783 -1.662 18112 1880 1 3 . 1 1 82 82 ASP H H 82 8.316 8.316 8.046 0.270 18112 1881 1 3 . 1 1 83 83 GLY N N 83 106.913 106.913 106.150 0.763 18112 1882 1 3 . 1 1 83 83 GLY C C 83 174.601 174.601 174.629 -0.028 18112 1883 1 3 . 1 1 83 83 GLY CA C 83 45.214 45.214 44.930 0.284 18112 1884 1 3 . 1 1 83 83 GLY H H 83 7.810 7.810 8.013 -0.203 18112 1885 1 3 . 1 1 84 84 VAL N N 84 122.981 122.981 121.115 1.866 18112 1886 1 3 . 1 1 84 84 VAL HA H 84 3.850 3.850 4.030 -0.180 18112 1887 1 3 . 1 1 84 84 VAL C C 84 177.265 177.265 176.015 1.250 18112 1888 1 3 . 1 1 84 84 VAL CA C 84 64.270 64.270 63.377 0.892 18112 1889 1 3 . 1 1 84 84 VAL CB C 84 30.471 30.471 32.235 -1.764 18112 1890 1 3 . 1 1 84 84 VAL H H 84 8.157 8.157 7.641 0.516 18112 1891 1 3 . 1 1 85 85 THR N N 85 115.232 115.232 117.493 -2.261 18112 1892 1 3 . 1 1 85 85 THR HA H 85 4.716 4.716 4.776 -0.060 18112 1893 1 3 . 1 1 85 85 THR C C 85 174.489 174.489 174.405 0.084 18112 1894 1 3 . 1 1 85 85 THR CA C 85 61.618 61.618 61.589 0.029 18112 1895 1 3 . 1 1 85 85 THR CB C 85 70.081 70.081 69.376 0.705 18112 1896 1 3 . 1 1 85 85 THR H H 85 8.890 8.890 8.299 0.591 18112 1897 1 3 . 1 1 86 86 SER N N 86 117.009 117.009 118.219 -1.210 18112 1898 1 3 . 1 1 86 86 SER HA H 86 5.046 5.046 4.632 0.414 18112 1899 1 3 . 1 1 86 86 SER C C 86 174.473 174.473 175.090 -0.617 18112 1900 1 3 . 1 1 86 86 SER CA C 86 55.922 55.922 56.852 -0.930 18112 1901 1 3 . 1 1 86 86 SER CB C 86 64.385 64.385 64.076 0.309 18112 1902 1 3 . 1 1 86 86 SER H H 86 7.704 7.704 7.809 -0.105 18112 1903 1 3 . 1 1 87 87 THR N N 87 118.634 118.634 117.326 1.308 18112 1904 1 3 . 1 1 87 87 THR HA H 87 4.065 4.065 3.977 0.088 18112 1905 1 3 . 1 1 87 87 THR C C 87 176.047 176.047 175.403 0.644 18112 1906 1 3 . 1 1 87 87 THR CA C 87 64.983 64.983 64.535 0.448 18112 1907 1 3 . 1 1 87 87 THR CB C 87 68.045 68.045 68.769 -0.724 18112 1908 1 3 . 1 1 87 87 THR H H 87 8.711 8.711 8.530 0.181 18112 1909 1 3 . 1 1 88 88 GLU N N 88 117.889 117.889 118.861 -0.972 18112 1910 1 3 . 1 1 88 88 GLU HA H 88 3.881 3.881 4.092 -0.211 18112 1911 1 3 . 1 1 88 88 GLU C C 88 177.146 177.146 177.012 0.134 18112 1912 1 3 . 1 1 88 88 GLU CA C 88 57.814 57.814 58.014 -0.200 18112 1913 1 3 . 1 1 88 88 GLU CB C 88 28.050 28.050 28.630 -0.580 18112 1914 1 3 . 1 1 88 88 GLU H H 88 8.152 8.152 8.503 -0.351 18112 1915 1 3 . 1 1 89 89 GLU N N 89 115.617 115.617 117.585 -1.968 18112 1916 1 3 . 1 1 89 89 GLU HA H 89 4.149 4.149 4.299 -0.150 18112 1917 1 3 . 1 1 89 89 GLU C C 89 176.192 176.192 177.140 -0.948 18112 1918 1 3 . 1 1 89 89 GLU CA C 89 56.133 56.133 56.898 -0.765 18112 1919 1 3 . 1 1 89 89 GLU CB C 89 29.415 29.415 30.304 -0.889 18112 1920 1 3 . 1 1 89 89 GLU H H 89 7.311 7.311 7.528 -0.217 18112 1921 1 3 . 1 1 90 90 LEU N N 90 120.870 120.870 118.765 2.105 18112 1922 1 3 . 1 1 90 90 LEU HA H 90 4.439 4.439 4.204 0.235 18112 1923 1 3 . 1 1 90 90 LEU C C 90 175.267 175.267 176.508 -1.241 18112 1924 1 3 . 1 1 90 90 LEU CA C 90 53.504 53.504 55.730 -2.226 18112 1925 1 3 . 1 1 90 90 LEU CB C 90 40.479 40.479 43.453 -2.974 18112 1926 1 3 . 1 1 90 90 LEU H H 90 7.311 7.311 7.437 -0.126 18112 1927 1 3 . 1 1 91 91 SER N N 91 118.376 118.376 110.368 8.008 18112 1928 1 3 . 1 1 91 91 SER HA H 91 4.747 4.747 4.459 0.288 18112 1929 1 3 . 1 1 91 91 SER C C 91 173.332 173.332 172.662 0.670 18112 1930 1 3 . 1 1 91 91 SER CA C 91 56.314 56.314 58.636 -2.322 18112 1931 1 3 . 1 1 91 91 SER CB C 91 64.615 64.615 63.970 0.645 18112 1932 1 3 . 1 1 91 91 SER H H 91 8.221 8.221 7.570 0.651 18112 1933 1 3 . 1 1 92 92 ILE N N 92 122.247 122.247 122.176 0.071 18112 1934 1 3 . 1 1 92 92 ILE HA H 92 4.537 4.537 4.440 0.097 18112 1935 1 3 . 1 1 92 92 ILE C C 92 174.059 174.059 176.716 -2.657 18112 1936 1 3 . 1 1 92 92 ILE CA C 92 59.881 59.881 58.492 1.389 18112 1937 1 3 . 1 1 92 92 ILE CB C 92 37.820 37.820 41.960 -4.140 18112 1938 1 3 . 1 1 92 92 ILE H H 92 8.570 8.570 7.717 0.853 18112 1939 1 3 . 1 1 93 93 THR N N 93 116.069 116.069 119.253 -3.184 18112 1940 1 3 . 1 1 93 93 THR HA H 93 4.580 4.580 4.213 0.367 18112 1941 1 3 . 1 1 93 93 THR C C 93 175.049 175.049 175.240 -0.191 18112 1942 1 3 . 1 1 93 93 THR CA C 93 58.988 58.988 64.851 -5.863 18112 1943 1 3 . 1 1 93 93 THR CB C 93 71.362 71.362 69.094 2.268 18112 1944 1 3 . 1 1 93 93 THR H H 93 7.224 7.224 8.560 -1.336 18112 1945 1 3 . 1 1 94 94 ARG N N 94 116.595 116.595 117.423 -0.828 18112 1946 1 3 . 1 1 94 94 ARG HA H 94 3.077 3.077 3.888 -0.811 18112 1947 1 3 . 1 1 94 94 ARG C C 94 175.076 175.076 175.591 -0.515 18112 1948 1 3 . 1 1 94 94 ARG CA C 94 57.119 57.119 58.340 -1.221 18112 1949 1 3 . 1 1 94 94 ARG CB C 94 27.838 27.838 27.895 -0.057 18112 1950 1 3 . 1 1 94 94 ARG H H 94 8.596 8.596 9.065 -0.469 18112 1951 1 3 . 1 1 95 95 ASP N N 95 113.735 113.735 122.411 -8.676 18112 1952 1 3 . 1 1 95 95 ASP HA H 95 4.765 4.765 4.751 0.014 18112 1953 1 3 . 1 1 95 95 ASP C C 95 175.876 175.876 176.950 -1.074 18112 1954 1 3 . 1 1 95 95 ASP CA C 95 53.156 53.156 54.755 -1.599 18112 1955 1 3 . 1 1 95 95 ASP CB C 95 41.166 41.166 40.756 0.410 18112 1956 1 3 . 1 1 95 95 ASP H H 95 7.607 7.607 7.905 -0.298 18112 1957 1 3 . 1 1 96 96 CYS N N 96 116.012 116.012 122.548 -6.536 18112 1958 1 3 . 1 1 96 96 CYS C C 96 174.361 174.361 176.162 -1.801 18112 1959 1 3 . 1 1 96 96 CYS CA C 96 56.562 56.562 62.583 -6.021 18112 1960 1 3 . 1 1 96 96 CYS CB C 96 29.416 29.416 27.437 1.979 18112 1961 1 3 . 1 1 96 96 CYS H H 96 7.094 7.094 8.209 -1.115 18112 1962 1 3 . 1 1 97 97 GLU N N 97 123.087 123.087 120.317 2.770 18112 1963 1 3 . 1 1 97 97 GLU C C 97 178.748 178.748 178.054 0.694 18112 1964 1 3 . 1 1 97 97 GLU CA C 97 59.912 59.912 59.164 0.748 18112 1965 1 3 . 1 1 97 97 GLU CB C 97 29.195 29.195 29.129 0.066 18112 1966 1 3 . 1 1 97 97 GLU H H 97 9.003 9.003 8.259 0.744 18112 1967 1 3 . 1 1 98 98 LEU N N 98 120.942 120.942 120.851 0.091 18112 1968 1 3 . 1 1 98 98 LEU HA H 98 3.614 3.614 4.069 -0.455 18112 1969 1 3 . 1 1 98 98 LEU C C 98 177.796 177.796 178.589 -0.793 18112 1970 1 3 . 1 1 98 98 LEU CA C 98 58.090 58.090 57.605 0.485 18112 1971 1 3 . 1 1 98 98 LEU CB C 98 39.778 39.778 41.696 -1.917 18112 1972 1 3 . 1 1 98 98 LEU H H 98 8.656 8.656 7.670 0.986 18112 1973 1 3 . 1 1 99 99 TYR N N 99 118.313 118.313 118.802 -0.489 18112 1974 1 3 . 1 1 99 99 TYR C C 99 177.077 177.077 178.402 -1.325 18112 1975 1 3 . 1 1 99 99 TYR CA C 99 62.622 62.622 62.029 0.593 18112 1976 1 3 . 1 1 99 99 TYR CB C 99 38.742 38.742 37.684 1.058 18112 1977 1 3 . 1 1 99 99 TYR H H 99 7.522 7.522 8.423 -0.901 18112 1978 1 3 . 1 1 100 100 ARG N N 100 118.101 118.101 118.755 -0.654 18112 1979 1 3 . 1 1 100 100 ARG C C 100 178.616 178.616 178.826 -0.210 18112 1980 1 3 . 1 1 100 100 ARG CA C 100 59.915 59.915 57.640 2.275 18112 1981 1 3 . 1 1 100 100 ARG CB C 100 29.100 29.100 29.489 -0.389 18112 1982 1 3 . 1 1 100 100 ARG H H 100 8.243 8.243 8.259 -0.016 18112 1983 1 3 . 1 1 101 101 ALA N N 101 120.972 120.972 123.780 -2.808 18112 1984 1 3 . 1 1 101 101 ALA HA H 101 4.145 4.145 4.186 -0.041 18112 1985 1 3 . 1 1 101 101 ALA C C 101 181.359 181.359 179.523 1.836 18112 1986 1 3 . 1 1 101 101 ALA CA C 101 55.057 55.057 55.247 -0.190 18112 1987 1 3 . 1 1 101 101 ALA CB C 101 17.543 17.543 18.552 -1.009 18112 1988 1 3 . 1 1 101 101 ALA H H 101 8.352 8.352 7.999 0.353 18112 1989 1 3 . 1 1 102 102 LEU N N 102 115.683 115.683 118.780 -3.097 18112 1990 1 3 . 1 1 102 102 LEU HA H 102 4.333 4.333 4.098 0.235 18112 1991 1 3 . 1 1 102 102 LEU C C 102 178.583 178.583 179.246 -0.663 18112 1992 1 3 . 1 1 102 102 LEU CA C 102 57.634 57.634 57.847 -0.213 18112 1993 1 3 . 1 1 102 102 LEU CB C 102 41.716 41.716 41.240 0.476 18112 1994 1 3 . 1 1 102 102 LEU H H 102 7.960 7.960 8.326 -0.366 18112 1995 1 3 . 1 1 103 103 ASN N N 103 118.957 118.957 118.578 0.379 18112 1996 1 3 . 1 1 103 103 ASN C C 103 177.470 177.470 177.379 0.091 18112 1997 1 3 . 1 1 103 103 ASN CA C 103 56.974 56.974 56.406 0.568 18112 1998 1 3 . 1 1 103 103 ASN CB C 103 38.140 38.140 38.699 -0.559 18112 1999 1 3 . 1 1 103 103 ASN H H 103 9.301 9.301 8.188 1.113 18112 2000 1 3 . 1 1 104 104 MET N N 104 113.763 113.763 117.531 -3.768 18112 2001 1 3 . 1 1 104 104 MET CA C 104 57.362 57.362 58.142 -0.780 18112 2002 1 3 . 1 1 104 104 MET CB C 104 31.895 31.895 32.843 -0.948 18112 2003 1 3 . 1 1 104 104 MET H H 104 8.332 8.332 8.026 0.306 18112 2004 1 3 . 1 1 105 105 HIS N N 105 116.024 116.024 117.526 -1.502 18112 2005 1 3 . 1 1 105 105 HIS HA H 105 3.764 3.764 4.543 -0.779 18112 2006 1 3 . 1 1 105 105 HIS C C 105 176.939 176.939 176.719 0.220 18112 2007 1 3 . 1 1 105 105 HIS CA C 105 59.069 59.069 59.070 -0.001 18112 2008 1 3 . 1 1 105 105 HIS H H 105 7.156 7.156 8.239 -1.083 18112 2009 1 3 . 1 1 106 106 TYR N N 106 113.161 113.161 118.254 -5.093 18112 2010 1 3 . 1 1 106 106 TYR C C 106 173.767 173.767 175.648 -1.881 18112 2011 1 3 . 1 1 106 106 TYR CA C 106 58.488 58.488 61.045 -2.558 18112 2012 1 3 . 1 1 106 106 TYR CB C 106 38.225 38.225 39.779 -1.554 18112 2013 1 3 . 1 1 106 106 TYR H H 106 7.204 7.204 8.463 -1.259 18112 2014 1 3 . 1 1 107 107 ASN N N 107 118.875 118.875 110.627 8.248 18112 2015 1 3 . 1 1 107 107 ASN HA H 107 3.922 3.922 4.902 -0.980 18112 2016 1 3 . 1 1 107 107 ASN C C 107 175.815 175.815 172.940 2.875 18112 2017 1 3 . 1 1 107 107 ASN CA C 107 51.233 51.233 53.214 -1.981 18112 2018 1 3 . 1 1 107 107 ASN CB C 107 38.142 38.142 39.811 -1.669 18112 2019 1 3 . 1 1 107 107 ASN H H 107 8.127 8.127 8.217 -0.090 18112 2020 1 3 . 1 1 108 108 LYS N N 108 122.850 122.850 118.249 4.601 18112 2021 1 3 . 1 1 108 108 LYS HA H 108 3.954 3.954 4.697 -0.743 18112 2022 1 3 . 1 1 108 108 LYS C C 108 177.586 177.586 176.648 0.938 18112 2023 1 3 . 1 1 108 108 LYS CA C 108 59.749 59.749 55.480 4.269 18112 2024 1 3 . 1 1 108 108 LYS CB C 108 31.498 31.498 32.781 -1.283 18112 2025 1 3 . 1 1 108 108 LYS H H 108 7.772 7.772 8.553 -0.781 18112 2026 1 3 . 1 1 109 109 ALA N N 109 118.054 118.054 121.282 -3.228 18112 2027 1 3 . 1 1 109 109 ALA HA H 109 4.137 4.137 4.162 -0.025 18112 2028 1 3 . 1 1 109 109 ALA C C 109 177.889 177.889 177.787 0.102 18112 2029 1 3 . 1 1 109 109 ALA CA C 109 52.299 52.299 53.109 -0.810 18112 2030 1 3 . 1 1 109 109 ALA CB C 109 17.787 17.787 18.739 -0.952 18112 2031 1 3 . 1 1 109 109 ALA H H 109 8.307 8.307 7.956 0.351 18112 2032 1 3 . 1 1 110 110 ASN N N 110 115.542 115.542 117.568 -2.026 18112 2033 1 3 . 1 1 110 110 ASN HA H 110 4.480 4.480 4.263 0.217 18112 2034 1 3 . 1 1 110 110 ASN C C 110 174.277 174.277 175.187 -0.910 18112 2035 1 3 . 1 1 110 110 ASN CA C 110 53.504 53.504 53.092 0.412 18112 2036 1 3 . 1 1 110 110 ASN CB C 110 37.283 37.283 38.301 -1.018 18112 2037 1 3 . 1 1 110 110 ASN H H 110 8.353 8.353 7.896 0.457 18112 2038 1 3 . 1 1 111 111 ASP N N 111 114.692 114.692 123.868 -9.176 18112 2039 1 3 . 1 1 111 111 ASP HA H 111 4.485 4.485 4.270 0.215 18112 2040 1 3 . 1 1 111 111 ASP C C 111 174.868 174.868 176.306 -1.438 18112 2041 1 3 . 1 1 111 111 ASP CA C 111 53.227 53.227 56.430 -3.203 18112 2042 1 3 . 1 1 111 111 ASP CB C 111 39.228 39.228 41.246 -2.018 18112 2043 1 3 . 1 1 111 111 ASP H H 111 8.297 8.297 8.313 -0.016 18112 2044 1 3 . 1 1 112 112 PHE N N 112 120.927 120.927 116.822 4.105 18112 2045 1 3 . 1 1 112 112 PHE HA H 112 4.752 4.752 4.670 0.082 18112 2046 1 3 . 1 1 112 112 PHE C C 112 174.633 174.633 176.259 -1.626 18112 2047 1 3 . 1 1 112 112 PHE CA C 112 56.346 56.346 56.919 -0.573 18112 2048 1 3 . 1 1 112 112 PHE H H 112 7.784 7.784 7.575 0.209 18112 2049 1 3 . 1 1 113 113 GLU N N 113 128.111 128.111 119.699 8.412 18112 2050 1 3 . 1 1 113 113 GLU HA H 113 4.011 4.011 4.031 -0.020 18112 2051 1 3 . 1 1 113 113 GLU C C 113 173.502 173.502 176.187 -2.685 18112 2052 1 3 . 1 1 113 113 GLU CA C 113 55.100 55.100 58.871 -3.771 18112 2053 1 3 . 1 1 113 113 GLU H H 113 7.752 7.752 8.821 -1.069 18112 2054 1 3 . 1 1 114 114 VAL N N 114 129.326 129.326 111.074 18.252 18112 2055 1 3 . 1 1 114 114 VAL HA H 114 3.241 3.241 4.186 -0.945 18112 2056 1 3 . 1 1 114 114 VAL CA C 114 60.838 60.838 58.504 2.334 18112 2057 1 3 . 1 1 114 114 VAL CB C 114 32.609 32.609 33.102 -0.493 18112 2058 1 3 . 1 1 114 114 VAL H H 114 8.008 8.008 7.467 0.541 18112 2059 1 3 . 1 1 115 115 PRO HA H 115 4.429 4.429 4.229 0.200 18112 2060 1 3 . 1 1 115 115 PRO C C 115 177.421 177.421 177.475 -0.054 18112 2061 1 3 . 1 1 115 115 PRO CA C 115 61.882 61.882 62.428 -0.546 18112 2062 1 3 . 1 1 115 115 PRO CB C 115 30.974 30.974 32.309 -1.335 18112 2063 1 3 . 1 1 116 116 GLU N N 116 123.936 123.936 123.703 0.233 18112 2064 1 3 . 1 1 116 116 GLU C C 116 179.034 179.034 178.458 0.576 18112 2065 1 3 . 1 1 116 116 GLU CA C 116 58.913 58.913 60.496 -1.583 18112 2066 1 3 . 1 1 116 116 GLU CB C 116 28.378 28.378 29.712 -1.334 18112 2067 1 3 . 1 1 116 116 GLU H H 116 8.757 8.757 8.797 -0.040 18112 2068 1 3 . 1 1 117 117 ARG N N 117 116.943 116.943 117.403 -0.460 18112 2069 1 3 . 1 1 117 117 ARG C C 117 177.570 177.570 178.625 -1.055 18112 2070 1 3 . 1 1 117 117 ARG CA C 117 57.033 57.033 58.767 -1.734 18112 2071 1 3 . 1 1 117 117 ARG CB C 117 28.172 28.172 29.233 -1.061 18112 2072 1 3 . 1 1 117 117 ARG H H 117 8.733 8.733 8.645 0.088 18112 2073 1 3 . 1 1 118 118 PHE N N 118 117.528 117.528 120.358 -2.830 18112 2074 1 3 . 1 1 118 118 PHE HA H 118 4.137 4.137 4.239 -0.102 18112 2075 1 3 . 1 1 118 118 PHE C C 118 176.992 176.992 177.792 -0.800 18112 2076 1 3 . 1 1 118 118 PHE CA C 118 61.627 61.627 61.248 0.379 18112 2077 1 3 . 1 1 118 118 PHE CB C 118 37.386 37.386 38.928 -1.542 18112 2078 1 3 . 1 1 118 118 PHE H H 118 7.606 7.606 7.353 0.253 18112 2079 1 3 . 1 1 119 119 LEU N N 119 118.483 118.483 120.052 -1.569 18112 2080 1 3 . 1 1 119 119 LEU HA H 119 3.684 3.684 3.916 -0.232 18112 2081 1 3 . 1 1 119 119 LEU C C 119 178.802 178.802 178.749 0.053 18112 2082 1 3 . 1 1 119 119 LEU CA C 119 59.875 59.875 57.418 2.457 18112 2083 1 3 . 1 1 119 119 LEU CB C 119 39.453 39.453 40.292 -0.839 18112 2084 1 3 . 1 1 119 119 LEU H H 119 7.248 7.248 7.924 -0.676 18112 2085 1 3 . 1 1 120 120 GLU N N 120 117.870 117.870 120.898 -3.028 18112 2086 1 3 . 1 1 120 120 GLU C C 120 179.932 179.932 179.525 0.407 18112 2087 1 3 . 1 1 120 120 GLU CA C 120 59.150 59.150 59.575 -0.425 18112 2088 1 3 . 1 1 120 120 GLU CB C 120 28.878 28.878 29.808 -0.930 18112 2089 1 3 . 1 1 120 120 GLU H H 120 7.423 7.423 8.171 -0.748 18112 2090 1 3 . 1 1 121 121 VAL N N 121 120.777 120.777 119.683 1.094 18112 2091 1 3 . 1 1 121 121 VAL HA H 121 3.545 3.545 3.646 -0.101 18112 2092 1 3 . 1 1 121 121 VAL C C 121 179.302 179.302 177.616 1.686 18112 2093 1 3 . 1 1 121 121 VAL CA C 121 66.875 66.875 66.869 0.006 18112 2094 1 3 . 1 1 121 121 VAL CB C 121 30.823 30.823 31.471 -0.648 18112 2095 1 3 . 1 1 121 121 VAL H H 121 8.313 8.313 8.221 0.092 18112 2096 1 3 . 1 1 122 122 ALA N N 122 127.029 127.029 122.813 4.216 18112 2097 1 3 . 1 1 122 122 ALA HA H 122 4.251 4.251 4.006 0.245 18112 2098 1 3 . 1 1 122 122 ALA C C 122 178.366 178.366 179.739 -1.373 18112 2099 1 3 . 1 1 122 122 ALA CA C 122 54.748 54.748 55.122 -0.374 18112 2100 1 3 . 1 1 122 122 ALA CB C 122 16.565 16.565 18.401 -1.837 18112 2101 1 3 . 1 1 122 122 ALA H H 122 8.896 8.896 7.724 1.172 18112 2102 1 3 . 1 1 123 123 GLN N N 123 119.887 119.887 118.108 1.779 18112 2103 1 3 . 1 1 123 123 GLN C C 123 177.908 177.908 178.703 -0.795 18112 2104 1 3 . 1 1 123 123 GLN CA C 123 60.671 60.671 58.441 2.231 18112 2105 1 3 . 1 1 123 123 GLN H H 123 8.349 8.349 8.070 0.279 18112 2106 1 3 . 1 1 124 124 ILE N N 124 120.632 120.632 121.065 -0.433 18112 2107 1 3 . 1 1 124 124 ILE HA H 124 3.651 3.651 3.832 -0.181 18112 2108 1 3 . 1 1 124 124 ILE C C 124 178.703 178.703 178.275 0.428 18112 2109 1 3 . 1 1 124 124 ILE CA C 124 65.945 65.945 65.011 0.934 18112 2110 1 3 . 1 1 124 124 ILE H H 124 8.204 8.204 8.206 -0.002 18112 2111 1 3 . 1 1 125 125 THR N N 125 115.084 115.084 116.279 -1.195 18112 2112 1 3 . 1 1 125 125 THR C C 125 175.568 175.568 176.850 -1.282 18112 2113 1 3 . 1 1 125 125 THR CA C 125 67.872 67.872 66.441 1.431 18112 2114 1 3 . 1 1 125 125 THR H H 125 8.399 8.399 8.148 0.251 18112 2115 1 3 . 1 1 126 126 LEU N N 126 125.011 125.011 122.961 2.050 18112 2116 1 3 . 1 1 126 126 LEU HA H 126 4.085 4.085 4.281 -0.196 18112 2117 1 3 . 1 1 126 126 LEU C C 126 178.559 178.559 178.146 0.413 18112 2118 1 3 . 1 1 126 126 LEU CA C 126 58.843 58.843 58.127 0.716 18112 2119 1 3 . 1 1 126 126 LEU CB C 126 41.421 41.421 41.723 -0.302 18112 2120 1 3 . 1 1 126 126 LEU H H 126 8.728 8.728 8.241 0.487 18112 2121 1 3 . 1 1 127 127 ARG N N 127 117.076 117.076 119.325 -2.249 18112 2122 1 3 . 1 1 127 127 ARG HA H 127 3.929 3.929 3.942 -0.013 18112 2123 1 3 . 1 1 127 127 ARG C C 127 177.984 177.984 178.539 -0.555 18112 2124 1 3 . 1 1 127 127 ARG CA C 127 60.685 60.685 59.839 0.846 18112 2125 1 3 . 1 1 127 127 ARG CB C 127 28.079 28.079 30.002 -1.923 18112 2126 1 3 . 1 1 127 127 ARG H H 127 8.213 8.213 8.125 0.088 18112 2127 1 3 . 1 1 128 128 GLU N N 128 118.617 118.617 119.134 -0.517 18112 2128 1 3 . 1 1 128 128 GLU HA H 128 4.147 4.147 4.136 0.011 18112 2129 1 3 . 1 1 128 128 GLU C C 128 181.150 181.150 179.188 1.962 18112 2130 1 3 . 1 1 128 128 GLU CA C 128 59.508 59.508 58.785 0.723 18112 2131 1 3 . 1 1 128 128 GLU H H 128 8.478 8.478 8.081 0.397 18112 2132 1 3 . 1 1 129 129 PHE N N 129 119.267 119.267 120.506 -1.239 18112 2133 1 3 . 1 1 129 129 PHE HA H 129 4.104 4.104 4.433 -0.329 18112 2134 1 3 . 1 1 129 129 PHE C C 129 177.170 177.170 177.876 -0.706 18112 2135 1 3 . 1 1 129 129 PHE CA C 129 63.694 63.694 62.194 1.500 18112 2136 1 3 . 1 1 129 129 PHE H H 129 8.570 8.570 8.441 0.129 18112 2137 1 3 . 1 1 130 130 PHE N N 130 118.739 118.739 118.968 -0.229 18112 2138 1 3 . 1 1 130 130 PHE HA H 130 3.884 3.884 4.021 -0.137 18112 2139 1 3 . 1 1 130 130 PHE C C 130 175.860 175.860 177.424 -1.564 18112 2140 1 3 . 1 1 130 130 PHE CA C 130 62.819 62.819 61.963 0.856 18112 2141 1 3 . 1 1 130 130 PHE H H 130 8.740 8.740 8.679 0.061 18112 2142 1 3 . 1 1 131 131 ASN N N 131 116.028 116.028 117.947 -1.919 18112 2143 1 3 . 1 1 131 131 ASN HA H 131 4.373 4.373 4.416 -0.043 18112 2144 1 3 . 1 1 131 131 ASN C C 131 178.228 178.228 177.759 0.469 18112 2145 1 3 . 1 1 131 131 ASN CA C 131 55.150 55.150 56.584 -1.433 18112 2146 1 3 . 1 1 131 131 ASN H H 131 8.864 8.864 8.532 0.332 18112 2147 1 3 . 1 1 132 132 ALA N N 132 120.922 120.922 122.828 -1.906 18112 2148 1 3 . 1 1 132 132 ALA HA H 132 4.020 4.020 4.073 -0.053 18112 2149 1 3 . 1 1 132 132 ALA C C 132 178.515 178.515 179.642 -1.127 18112 2150 1 3 . 1 1 132 132 ALA CA C 132 54.924 54.924 55.016 -0.092 18112 2151 1 3 . 1 1 132 132 ALA CB C 132 18.441 18.441 18.668 -0.227 18112 2152 1 3 . 1 1 132 132 ALA H H 132 7.745 7.745 7.990 -0.245 18112 2153 1 3 . 1 1 133 133 ILE N N 133 118.200 118.200 119.927 -1.727 18112 2154 1 3 . 1 1 133 133 ILE HA H 133 3.235 3.235 3.909 -0.674 18112 2155 1 3 . 1 1 133 133 ILE C C 133 180.606 180.606 177.795 2.811 18112 2156 1 3 . 1 1 133 133 ILE CA C 133 65.215 65.215 65.377 -0.163 18112 2157 1 3 . 1 1 133 133 ILE CB C 133 38.291 38.291 38.137 0.154 18112 2158 1 3 . 1 1 133 133 ILE H H 133 7.999 7.999 8.092 -0.093 18112 2159 1 3 . 1 1 134 134 ILE N N 134 122.564 122.564 118.555 4.009 18112 2160 1 3 . 1 1 134 134 ILE HA H 134 3.788 3.788 3.720 0.068 18112 2161 1 3 . 1 1 134 134 ILE C C 134 177.215 177.215 177.661 -0.446 18112 2162 1 3 . 1 1 134 134 ILE CA C 134 63.584 63.584 63.319 0.265 18112 2163 1 3 . 1 1 134 134 ILE CB C 134 35.636 35.636 37.525 -1.889 18112 2164 1 3 . 1 1 134 134 ILE H H 134 8.670 8.670 7.959 0.711 18112 2165 1 3 . 1 1 135 135 ALA N N 135 119.989 119.989 120.731 -0.742 18112 2166 1 3 . 1 1 135 135 ALA HA H 135 4.357 4.357 4.138 0.219 18112 2167 1 3 . 1 1 135 135 ALA C C 135 177.786 177.786 178.169 -0.383 18112 2168 1 3 . 1 1 135 135 ALA CA C 135 51.521 51.521 54.028 -2.507 18112 2169 1 3 . 1 1 135 135 ALA CB C 135 18.839 18.839 19.582 -0.743 18112 2170 1 3 . 1 1 135 135 ALA H H 135 6.898 6.898 7.865 -0.967 18112 2171 1 3 . 1 1 136 136 GLY N N 136 107.682 107.682 103.530 4.152 18112 2172 1 3 . 1 1 136 136 GLY C C 136 176.324 176.324 174.891 1.433 18112 2173 1 3 . 1 1 136 136 GLY CA C 136 45.469 45.469 44.840 0.629 18112 2174 1 3 . 1 1 136 136 GLY H H 136 7.913 7.913 7.713 0.200 18112 2175 1 3 . 1 1 137 137 LYS N N 137 117.213 117.213 118.486 -1.273 18112 2176 1 3 . 1 1 137 137 LYS HA H 137 4.004 4.004 4.287 -0.283 18112 2177 1 3 . 1 1 137 137 LYS C C 137 176.616 176.616 174.810 1.806 18112 2178 1 3 . 1 1 137 137 LYS CA C 137 57.499 57.499 59.089 -1.590 18112 2179 1 3 . 1 1 137 137 LYS CB C 137 30.927 30.927 31.603 -0.676 18112 2180 1 3 . 1 1 137 137 LYS H H 137 8.312 8.312 8.482 -0.170 18112 2181 1 3 . 1 1 138 138 ASP N N 138 113.545 113.545 120.178 -6.633 18112 2182 1 3 . 1 1 138 138 ASP HA H 138 3.061 3.061 4.774 -1.713 18112 2183 1 3 . 1 1 138 138 ASP C C 138 174.698 174.698 176.522 -1.824 18112 2184 1 3 . 1 1 138 138 ASP CA C 138 53.694 53.694 54.941 -1.247 18112 2185 1 3 . 1 1 138 138 ASP CB C 138 36.008 36.008 39.521 -3.513 18112 2186 1 3 . 1 1 138 138 ASP H H 138 8.465 8.465 8.470 -0.005 18112 2187 1 3 . 1 1 139 139 VAL N N 139 115.191 115.191 120.880 -5.689 18112 2188 1 3 . 1 1 139 139 VAL HA H 139 3.886 3.886 4.029 -0.143 18112 2189 1 3 . 1 1 139 139 VAL C C 139 175.889 175.889 174.598 1.291 18112 2190 1 3 . 1 1 139 139 VAL CA C 139 62.793 62.793 60.895 1.898 18112 2191 1 3 . 1 1 139 139 VAL CB C 139 30.662 30.662 32.882 -2.220 18112 2192 1 3 . 1 1 139 139 VAL H H 139 6.610 6.610 8.185 -1.575 18112 2193 1 3 . 1 1 140 140 ASP N N 140 123.363 123.363 117.512 5.851 18112 2194 1 3 . 1 1 140 140 ASP C C 140 175.234 175.234 174.892 0.342 18112 2195 1 3 . 1 1 140 140 ASP CA C 140 50.221 50.221 55.386 -5.165 18112 2196 1 3 . 1 1 140 140 ASP CB C 140 42.254 42.254 39.357 2.897 18112 2197 1 3 . 1 1 140 140 ASP H H 140 7.553 7.553 7.953 -0.400 18112 2198 1 3 . 1 1 141 141 PRO HA H 141 4.682 4.682 4.358 0.324 18112 2199 1 3 . 1 1 141 141 PRO C C 141 178.678 178.678 178.183 0.495 18112 2200 1 3 . 1 1 141 141 PRO CA C 141 64.532 64.532 64.814 -0.282 18112 2201 1 3 . 1 1 141 141 PRO CB C 141 31.331 31.331 31.580 -0.249 18112 2202 1 3 . 1 1 142 142 SER N N 142 114.421 114.421 115.741 -1.320 18112 2203 1 3 . 1 1 142 142 SER HA H 142 4.565 4.565 4.251 0.314 18112 2204 1 3 . 1 1 142 142 SER C C 142 176.524 176.524 176.088 0.436 18112 2205 1 3 . 1 1 142 142 SER CA C 142 58.711 58.711 61.105 -2.394 18112 2206 1 3 . 1 1 142 142 SER CB C 142 62.783 62.783 62.291 0.492 18112 2207 1 3 . 1 1 142 142 SER H H 142 8.703 8.703 8.280 0.423 18112 2208 1 3 . 1 1 143 143 TRP N N 143 123.598 123.598 122.255 1.343 18112 2209 1 3 . 1 1 143 143 TRP HA H 143 4.136 4.136 4.095 0.041 18112 2210 1 3 . 1 1 143 143 TRP C C 143 177.113 177.113 177.576 -0.463 18112 2211 1 3 . 1 1 143 143 TRP CA C 143 59.803 59.803 61.656 -1.853 18112 2212 1 3 . 1 1 143 143 TRP CB C 143 26.364 26.364 29.300 -2.936 18112 2213 1 3 . 1 1 143 143 TRP H H 143 8.374 8.374 8.061 0.313 18112 2214 1 3 . 1 1 144 144 LYS N N 144 119.293 119.293 116.714 2.579 18112 2215 1 3 . 1 1 144 144 LYS HA H 144 2.719 2.719 3.657 -0.938 18112 2216 1 3 . 1 1 144 144 LYS C C 144 177.243 177.243 178.351 -1.108 18112 2217 1 3 . 1 1 144 144 LYS CA C 144 58.851 58.851 59.648 -0.797 18112 2218 1 3 . 1 1 144 144 LYS CB C 144 29.373 29.373 31.485 -2.111 18112 2219 1 3 . 1 1 144 144 LYS H H 144 7.196 7.196 8.194 -0.998 18112 2220 1 3 . 1 1 145 145 LYS N N 145 116.440 116.440 120.140 -3.700 18112 2221 1 3 . 1 1 145 145 LYS HA H 145 3.490 3.490 4.198 -0.708 18112 2222 1 3 . 1 1 145 145 LYS C C 145 179.149 179.149 178.886 0.263 18112 2223 1 3 . 1 1 145 145 LYS CA C 145 59.271 59.271 58.380 0.891 18112 2224 1 3 . 1 1 145 145 LYS CB C 145 30.521 30.521 31.953 -1.432 18112 2225 1 3 . 1 1 145 145 LYS H H 145 7.389 7.389 8.009 -0.620 18112 2226 1 3 . 1 1 146 146 ALA N N 146 118.582 118.582 122.584 -4.002 18112 2227 1 3 . 1 1 146 146 ALA HA H 146 3.932 3.932 4.122 -0.190 18112 2228 1 3 . 1 1 146 146 ALA C C 146 179.968 179.968 179.861 0.107 18112 2229 1 3 . 1 1 146 146 ALA CA C 146 54.241 54.241 55.095 -0.854 18112 2230 1 3 . 1 1 146 146 ALA CB C 146 17.689 17.689 18.172 -0.483 18112 2231 1 3 . 1 1 146 146 ALA H H 146 7.112 7.112 8.181 -1.069 18112 2232 1 3 . 1 1 147 147 ILE N N 147 118.537 118.537 118.974 -0.437 18112 2233 1 3 . 1 1 147 147 ILE HA H 147 3.642 3.642 3.629 0.013 18112 2234 1 3 . 1 1 147 147 ILE C C 147 178.919 178.919 178.202 0.717 18112 2235 1 3 . 1 1 147 147 ILE CA C 147 64.418 64.418 63.535 0.883 18112 2236 1 3 . 1 1 147 147 ILE CB C 147 36.519 36.519 36.285 0.234 18112 2237 1 3 . 1 1 147 147 ILE H H 147 6.734 6.734 8.131 -1.397 18112 2238 1 3 . 1 1 148 148 TYR N N 148 121.033 121.033 119.111 1.922 18112 2239 1 3 . 1 1 148 148 TYR HA H 148 4.489 4.489 4.133 0.356 18112 2240 1 3 . 1 1 148 148 TYR C C 148 178.348 178.348 178.566 -0.218 18112 2241 1 3 . 1 1 148 148 TYR CA C 148 57.389 57.389 59.812 -2.423 18112 2242 1 3 . 1 1 148 148 TYR CB C 148 35.280 35.280 36.922 -1.642 18112 2243 1 3 . 1 1 148 148 TYR H H 148 8.126 8.126 8.181 -0.055 18112 2244 1 3 . 1 1 149 149 LYS N N 149 114.484 114.484 119.881 -5.397 18112 2245 1 3 . 1 1 149 149 LYS C C 149 178.051 178.051 179.156 -1.105 18112 2246 1 3 . 1 1 149 149 LYS CA C 149 59.036 59.036 58.880 0.156 18112 2247 1 3 . 1 1 149 149 LYS CB C 149 31.575 31.575 32.145 -0.570 18112 2248 1 3 . 1 1 149 149 LYS H H 149 7.364 7.364 7.986 -0.622 18112 2249 1 3 . 1 1 150 150 VAL N N 150 117.812 117.812 117.230 0.582 18112 2250 1 3 . 1 1 150 150 VAL HA H 150 3.770 3.770 3.729 0.040 18112 2251 1 3 . 1 1 150 150 VAL C C 150 178.786 178.786 178.172 0.614 18112 2252 1 3 . 1 1 150 150 VAL CA C 150 65.070 65.070 66.174 -1.104 18112 2253 1 3 . 1 1 150 150 VAL CB C 150 29.515 29.515 31.278 -1.763 18112 2254 1 3 . 1 1 150 150 VAL H H 150 7.254 7.254 7.800 -0.546 18112 2255 1 3 . 1 1 151 151 ILE N N 151 117.884 117.884 115.763 2.121 18112 2256 1 3 . 1 1 151 151 ILE C C 151 180.539 180.539 177.228 3.311 18112 2257 1 3 . 1 1 151 151 ILE CA C 151 61.490 61.490 63.642 -2.152 18112 2258 1 3 . 1 1 151 151 ILE CB C 151 33.994 33.994 37.998 -4.004 18112 2259 1 3 . 1 1 151 151 ILE H H 151 8.154 8.154 7.872 0.282 18112 2260 1 3 . 1 1 152 152 CYS N N 152 118.649 118.649 119.721 -1.072 18112 2261 1 3 . 1 1 152 152 CYS HA H 152 4.153 4.153 4.157 -0.004 18112 2262 1 3 . 1 1 152 152 CYS C C 152 174.888 174.888 176.038 -1.150 18112 2263 1 3 . 1 1 152 152 CYS CA C 152 61.052 61.052 59.945 1.107 18112 2264 1 3 . 1 1 152 152 CYS CB C 152 36.364 36.364 27.155 9.209 18112 2265 1 3 . 1 1 152 152 CYS H H 152 8.711 8.711 8.029 0.682 18112 2266 1 3 . 1 1 153 153 LYS N N 153 118.498 118.498 119.821 -1.323 18112 2267 1 3 . 1 1 153 153 LYS C C 153 177.389 177.389 178.204 -0.815 18112 2268 1 3 . 1 1 153 153 LYS CA C 153 56.243 56.243 58.089 -1.846 18112 2269 1 3 . 1 1 153 153 LYS CB C 153 31.343 31.343 32.438 -1.095 18112 2270 1 3 . 1 1 153 153 LYS H H 153 6.782 6.782 7.610 -0.828 18112 2271 1 3 . 1 1 154 154 LEU N N 154 117.318 117.318 117.936 -0.618 18112 2272 1 3 . 1 1 154 154 LEU HA H 154 4.576 4.576 4.238 0.338 18112 2273 1 3 . 1 1 154 154 LEU C C 154 177.161 177.161 177.650 -0.489 18112 2274 1 3 . 1 1 154 154 LEU CA C 154 53.782 53.782 55.889 -2.107 18112 2275 1 3 . 1 1 154 154 LEU CB C 154 40.881 40.881 42.147 -1.266 18112 2276 1 3 . 1 1 154 154 LEU H H 154 7.616 7.616 7.536 0.080 18112 2277 1 3 . 1 1 155 155 ASP N N 155 121.564 121.564 118.174 3.390 18112 2278 1 3 . 1 1 155 155 ASP C C 155 177.094 177.094 175.480 1.614 18112 2279 1 3 . 1 1 155 155 ASP CA C 155 55.732 55.732 55.741 -0.009 18112 2280 1 3 . 1 1 155 155 ASP CB C 155 40.139 40.139 41.736 -1.597 18112 2281 1 3 . 1 1 155 155 ASP H H 155 7.582 7.582 7.559 0.023 18112 2282 1 3 . 1 1 156 156 SER N N 156 117.352 117.352 116.139 1.213 18112 2283 1 3 . 1 1 156 156 SER HA H 156 4.818 4.818 4.725 0.093 18112 2284 1 3 . 1 1 156 156 SER C C 156 173.409 173.409 173.314 0.095 18112 2285 1 3 . 1 1 156 156 SER CA C 156 57.073 57.073 57.342 -0.269 18112 2286 1 3 . 1 1 156 156 SER CB C 156 65.150 65.150 65.086 0.064 18112 2287 1 3 . 1 1 156 156 SER H H 156 8.846 8.846 8.391 0.455 18112 2288 1 3 . 1 1 157 157 GLU N N 157 120.688 120.688 120.240 0.448 18112 2289 1 3 . 1 1 157 157 GLU HA H 157 4.038 4.038 4.582 -0.544 18112 2290 1 3 . 1 1 157 157 GLU C C 157 176.332 176.332 176.268 0.064 18112 2291 1 3 . 1 1 157 157 GLU CA C 157 56.464 56.464 55.685 0.779 18112 2292 1 3 . 1 1 157 157 GLU CB C 157 29.206 29.206 30.220 -1.014 18112 2293 1 3 . 1 1 157 157 GLU H H 157 8.356 8.356 8.344 0.012 18112 2294 1 3 . 1 1 158 158 VAL N N 158 126.906 126.906 115.200 11.706 18112 2295 1 3 . 1 1 158 158 VAL HA H 158 3.449 3.449 4.313 -0.864 18112 2296 1 3 . 1 1 158 158 VAL C C 158 176.382 176.382 174.009 2.373 18112 2297 1 3 . 1 1 158 158 VAL CA C 158 59.584 59.584 58.428 1.156 18112 2298 1 3 . 1 1 158 158 VAL CB C 158 31.160 31.160 32.389 -1.229 18112 2299 1 3 . 1 1 158 158 VAL H H 158 8.561 8.561 7.664 0.897 18112 2300 1 3 . 1 1 159 159 PRO HA H 159 4.403 4.403 4.193 0.210 18112 2301 1 3 . 1 1 159 159 PRO C C 159 176.757 176.757 176.062 0.695 18112 2302 1 3 . 1 1 159 159 PRO CA C 159 63.845 63.845 62.758 1.087 18112 2303 1 3 . 1 1 159 159 PRO CB C 159 32.106 32.106 31.907 0.199 18112 2304 1 3 . 1 1 160 160 GLU N N 160 122.904 122.904 122.582 0.322 18112 2305 1 3 . 1 1 160 160 GLU HA H 160 4.008 4.008 3.868 0.140 18112 2306 1 3 . 1 1 160 160 GLU C C 160 179.132 179.132 175.355 3.777 18112 2307 1 3 . 1 1 160 160 GLU CA C 160 59.407 59.407 57.046 2.361 18112 2308 1 3 . 1 1 160 160 GLU CB C 160 28.991 28.991 29.984 -0.993 18112 2309 1 3 . 1 1 160 160 GLU H H 160 8.650 8.650 8.435 0.215 18112 2310 1 3 . 1 1 161 161 ILE N N 161 119.782 119.782 116.053 3.729 18112 2311 1 3 . 1 1 161 161 ILE HA H 161 4.146 4.146 4.059 0.087 18112 2312 1 3 . 1 1 161 161 ILE C C 161 176.176 176.176 174.140 2.036 18112 2313 1 3 . 1 1 161 161 ILE CA C 161 62.034 62.034 59.430 2.604 18112 2314 1 3 . 1 1 161 161 ILE CB C 161 37.113 37.113 39.174 -2.061 18112 2315 1 3 . 1 1 161 161 ILE H H 161 8.448 8.448 7.141 1.307 18112 2316 1 3 . 1 1 162 162 PHE N N 162 117.594 117.594 127.371 -9.777 18112 2317 1 3 . 1 1 162 162 PHE C C 162 176.115 176.115 176.426 -0.311 18112 2318 1 3 . 1 1 162 162 PHE CA C 162 61.009 61.009 59.277 1.732 18112 2319 1 3 . 1 1 162 162 PHE CB C 162 38.394 38.394 38.903 -0.509 18112 2320 1 3 . 1 1 162 162 PHE H H 162 8.145 8.145 8.607 -0.462 18112 2321 1 3 . 1 1 163 163 LYS N N 163 116.083 116.083 119.628 -3.545 18112 2322 1 3 . 1 1 163 163 LYS C C 163 178.196 178.196 176.550 1.646 18112 2323 1 3 . 1 1 163 163 LYS CA C 163 58.136 58.136 58.170 -0.035 18112 2324 1 3 . 1 1 163 163 LYS CB C 163 31.694 31.694 32.609 -0.915 18112 2325 1 3 . 1 1 163 163 LYS H H 163 8.232 8.232 8.009 0.223 18112 2326 1 3 . 1 1 164 164 SER N N 164 113.680 113.680 112.990 0.690 18112 2327 1 3 . 1 1 164 164 SER CA C 164 55.205 55.205 56.906 -1.701 18112 2328 1 3 . 1 1 164 164 SER CB C 164 63.265 63.265 64.234 -0.968 18112 2329 1 3 . 1 1 164 164 SER H H 164 7.708 7.708 7.714 -0.006 18112 2330 1 3 . 1 1 165 165 PRO HA H 165 4.580 4.580 4.367 0.213 18112 2331 1 3 . 1 1 165 165 PRO C C 165 177.541 177.541 175.877 1.664 18112 2332 1 3 . 1 1 165 165 PRO CA C 165 63.950 63.950 63.746 0.204 18112 2333 1 3 . 1 1 165 165 PRO CB C 165 30.686 30.686 30.464 0.222 18112 2334 1 3 . 1 1 166 166 ASN N N 166 116.304 116.304 118.606 -2.302 18112 2335 1 3 . 1 1 166 166 ASN HA H 166 5.029 5.029 4.654 0.375 18112 2336 1 3 . 1 1 166 166 ASN C C 166 175.811 175.811 176.898 -1.087 18112 2337 1 3 . 1 1 166 166 ASN CA C 166 51.962 51.962 54.208 -2.246 18112 2338 1 3 . 1 1 166 166 ASN CB C 166 37.915 37.915 38.817 -0.902 18112 2339 1 3 . 1 1 166 166 ASN H H 166 8.216 8.216 8.634 -0.418 18112 2340 1 3 . 1 1 167 167 CYS N N 167 116.078 116.078 122.532 -6.454 18112 2341 1 3 . 1 1 167 167 CYS HA H 167 4.011 4.011 4.141 -0.130 18112 2342 1 3 . 1 1 167 167 CYS C C 167 175.057 175.057 176.249 -1.192 18112 2343 1 3 . 1 1 167 167 CYS CA C 167 59.816 59.816 62.303 -2.487 18112 2344 1 3 . 1 1 167 167 CYS CB C 167 27.446 27.446 27.683 -0.237 18112 2345 1 3 . 1 1 167 167 CYS H H 167 7.246 7.246 8.213 -0.967 18112 2346 1 3 . 1 1 168 168 LEU N N 168 120.082 120.082 119.374 0.708 18112 2347 1 3 . 1 1 168 168 LEU HA H 168 3.880 3.880 4.120 -0.240 18112 2348 1 3 . 1 1 168 168 LEU C C 168 178.541 178.541 178.611 -0.070 18112 2349 1 3 . 1 1 168 168 LEU CA C 168 57.734 57.734 56.255 1.479 18112 2350 1 3 . 1 1 168 168 LEU CB C 168 38.825 38.825 40.185 -1.360 18112 2351 1 3 . 1 1 168 168 LEU H H 168 8.451 8.451 8.016 0.435 18112 2352 1 3 . 1 1 169 169 GLN N N 169 116.700 116.700 121.359 -4.659 18112 2353 1 3 . 1 1 169 169 GLN HA H 169 4.064 4.064 3.972 0.092 18112 2354 1 3 . 1 1 169 169 GLN C C 169 177.378 177.378 177.656 -0.278 18112 2355 1 3 . 1 1 169 169 GLN CA C 169 57.675 57.675 58.680 -1.005 18112 2356 1 3 . 1 1 169 169 GLN CB C 169 27.710 27.710 28.592 -0.882 18112 2357 1 3 . 1 1 169 169 GLN H H 169 7.665 7.665 7.944 -0.279 18112 2358 1 3 . 1 1 170 170 GLU N N 170 116.701 116.701 116.670 0.031 18112 2359 1 3 . 1 1 170 170 GLU HA H 170 4.214 4.214 4.235 -0.021 18112 2360 1 3 . 1 1 170 170 GLU C C 170 177.730 177.730 177.615 0.115 18112 2361 1 3 . 1 1 170 170 GLU CA C 170 56.899 56.899 57.316 -0.417 18112 2362 1 3 . 1 1 170 170 GLU H H 170 7.405 7.405 7.691 -0.286 18112 2363 1 3 . 1 1 171 171 LEU N N 171 118.021 118.021 119.401 -1.380 18112 2364 1 3 . 1 1 171 171 LEU HA H 171 4.209 4.209 4.122 0.087 18112 2365 1 3 . 1 1 171 171 LEU C C 171 177.005 177.005 177.236 -0.231 18112 2366 1 3 . 1 1 171 171 LEU CA C 171 55.870 55.870 57.074 -1.204 18112 2367 1 3 . 1 1 171 171 LEU CB C 171 43.680 43.680 42.079 1.601 18112 2368 1 3 . 1 1 171 171 LEU H H 171 7.823 7.823 7.524 0.299 18112 2369 1 3 . 1 1 172 172 LEU N N 172 117.580 117.580 116.846 0.734 18112 2370 1 3 . 1 1 172 172 LEU HA H 172 4.571 4.571 4.357 0.214 18112 2371 1 3 . 1 1 172 172 LEU C C 172 176.411 176.411 176.044 0.367 18112 2372 1 3 . 1 1 172 172 LEU CA C 172 53.972 53.972 54.491 -0.519 18112 2373 1 3 . 1 1 172 172 LEU CB C 172 40.483 40.483 38.857 1.626 18112 2374 1 3 . 1 1 172 172 LEU H H 172 7.306 7.306 7.613 -0.307 18112 2375 1 3 . 1 1 173 173 HIS N N 173 123.310 123.310 123.571 -0.261 18112 2376 1 3 . 1 1 173 173 HIS C C 173 179.022 179.022 173.554 5.468 18112 2377 1 3 . 1 1 173 173 HIS CA C 173 56.693 56.693 55.901 0.792 18112 2378 1 3 . 1 1 173 173 HIS CB C 173 29.371 29.371 30.654 -1.283 18112 2379 1 3 . 1 1 173 173 HIS H H 173 8.028 8.028 7.953 0.075 18112 2380 1 4 . 1 1 12 12 ALA N N 12 125.167 125.167 125.036 0.131 18112 2381 1 4 . 1 1 12 12 ALA C C 12 177.566 177.566 177.857 -0.291 18112 2382 1 4 . 1 1 12 12 ALA CA C 12 52.067 52.067 51.026 1.041 18112 2383 1 4 . 1 1 12 12 ALA CB C 12 18.456 18.456 20.580 -2.124 18112 2384 1 4 . 1 1 12 12 ALA H H 12 8.311 8.311 8.101 0.210 18112 2385 1 4 . 1 1 13 13 MET N N 13 119.278 119.278 116.413 2.865 18112 2386 1 4 . 1 1 13 13 MET C C 13 176.325 176.325 177.098 -0.773 18112 2387 1 4 . 1 1 13 13 MET CA C 13 54.992 54.992 57.436 -2.444 18112 2388 1 4 . 1 1 13 13 MET CB C 13 32.308 32.308 31.513 0.795 18112 2389 1 4 . 1 1 13 13 MET H H 13 8.269 8.269 8.408 -0.139 18112 2390 1 4 . 1 1 14 14 GLN N N 14 120.869 120.869 116.704 4.165 18112 2391 1 4 . 1 1 14 14 GLN HA H 14 4.399 4.399 4.099 0.300 18112 2392 1 4 . 1 1 14 14 GLN C C 14 175.644 175.644 175.030 0.614 18112 2393 1 4 . 1 1 14 14 GLN CA C 14 55.139 55.139 58.015 -2.876 18112 2394 1 4 . 1 1 14 14 GLN CB C 14 29.051 29.051 27.303 1.748 18112 2395 1 4 . 1 1 14 14 GLN H H 14 8.501 8.501 8.342 0.159 18112 2396 1 4 . 1 1 15 15 GLU N N 15 122.042 122.042 120.728 1.314 18112 2397 1 4 . 1 1 15 15 GLU C C 15 176.242 176.242 175.989 0.253 18112 2398 1 4 . 1 1 15 15 GLU CA C 15 56.064 56.064 55.531 0.533 18112 2399 1 4 . 1 1 15 15 GLU CB C 15 29.302 29.302 30.762 -1.460 18112 2400 1 4 . 1 1 15 15 GLU H H 15 8.547 8.547 8.041 0.506 18112 2401 1 4 . 1 1 16 16 GLY N N 16 108.821 108.821 107.903 0.918 18112 2402 1 4 . 1 1 16 16 GLY C C 16 172.949 172.949 172.937 0.012 18112 2403 1 4 . 1 1 16 16 GLY CA C 16 44.227 44.227 45.072 -0.845 18112 2404 1 4 . 1 1 16 16 GLY H H 16 8.100 8.100 8.508 -0.408 18112 2405 1 4 . 1 1 17 17 LEU N N 17 120.315 120.315 121.076 -0.761 18112 2406 1 4 . 1 1 17 17 LEU C C 17 177.334 177.334 175.190 2.144 18112 2407 1 4 . 1 1 17 17 LEU CA C 17 53.544 53.544 54.766 -1.222 18112 2408 1 4 . 1 1 17 17 LEU CB C 17 42.140 42.140 43.845 -1.705 18112 2409 1 4 . 1 1 17 17 LEU H H 17 8.222 8.222 7.927 0.295 18112 2410 1 4 . 1 1 18 18 SER N N 18 126.547 126.547 118.248 8.299 18112 2411 1 4 . 1 1 18 18 SER CA C 18 56.851 56.851 58.429 -1.578 18112 2412 1 4 . 1 1 18 18 SER CB C 18 64.636 64.636 62.646 1.990 18112 2413 1 4 . 1 1 18 18 SER H H 18 11.627 11.627 8.684 2.943 18112 2414 1 4 . 1 1 19 19 PRO C C 19 175.118 175.118 177.427 -2.309 18112 2415 1 4 . 1 1 20 20 ASN N N 20 121.372 121.372 115.214 6.158 18112 2416 1 4 . 1 1 20 20 ASN H H 20 8.172 8.172 8.675 -0.503 18112 2417 1 4 . 1 1 25 25 ALA CB C 25 18.020 18.020 17.794 0.226 18112 2418 1 4 . 1 1 26 26 LYS N N 26 118.490 118.490 118.963 -0.473 18112 2419 1 4 . 1 1 26 26 LYS CA C 26 56.146 56.146 59.026 -2.880 18112 2420 1 4 . 1 1 26 26 LYS H H 26 6.794 6.794 7.472 -0.678 18112 2421 1 4 . 1 1 31 31 TYR HA H 31 4.398 4.398 4.722 -0.324 18112 2422 1 4 . 1 1 31 31 TYR C C 31 173.714 173.714 173.395 0.319 18112 2423 1 4 . 1 1 31 31 TYR CA C 31 59.757 59.757 58.014 1.744 18112 2424 1 4 . 1 1 32 32 THR N N 32 111.928 111.928 115.424 -3.496 18112 2425 1 4 . 1 1 32 32 THR HA H 32 4.209 4.209 4.536 -0.327 18112 2426 1 4 . 1 1 32 32 THR C C 32 171.061 171.061 173.495 -2.434 18112 2427 1 4 . 1 1 32 32 THR CA C 32 56.905 56.905 60.361 -3.456 18112 2428 1 4 . 1 1 32 32 THR CB C 32 69.707 69.707 71.800 -2.093 18112 2429 1 4 . 1 1 32 32 THR H H 32 8.237 8.237 7.686 0.551 18112 2430 1 4 . 1 1 33 33 ARG N N 33 124.856 124.856 121.404 3.452 18112 2431 1 4 . 1 1 33 33 ARG C C 33 176.451 176.451 177.902 -1.451 18112 2432 1 4 . 1 1 33 33 ARG CA C 33 55.627 55.627 54.395 1.232 18112 2433 1 4 . 1 1 33 33 ARG CB C 33 29.861 29.861 29.558 0.303 18112 2434 1 4 . 1 1 33 33 ARG H H 33 9.159 9.159 8.695 0.464 18112 2435 1 4 . 1 1 34 34 TYR N N 34 117.908 117.908 129.062 -11.154 18112 2436 1 4 . 1 1 34 34 TYR CA C 34 55.320 55.320 60.304 -4.984 18112 2437 1 4 . 1 1 34 34 TYR H H 34 8.995 8.995 8.662 0.333 18112 2438 1 4 . 1 1 35 35 PRO C C 35 177.280 177.280 176.470 0.810 18112 2439 1 4 . 1 1 36 36 SER N N 36 116.410 116.410 120.189 -3.779 18112 2440 1 4 . 1 1 36 36 SER C C 36 178.938 178.938 176.210 2.728 18112 2441 1 4 . 1 1 36 36 SER CA C 36 64.815 64.815 61.972 2.843 18112 2442 1 4 . 1 1 36 36 SER H H 36 8.106 8.106 8.083 0.023 18112 2443 1 4 . 1 1 37 37 SER N N 37 117.488 117.488 118.840 -1.352 18112 2444 1 4 . 1 1 37 37 SER C C 37 177.698 177.698 176.482 1.216 18112 2445 1 4 . 1 1 37 37 SER CA C 37 61.357 61.357 61.883 -0.527 18112 2446 1 4 . 1 1 37 37 SER CB C 37 68.118 68.118 62.507 5.612 18112 2447 1 4 . 1 1 37 37 SER H H 37 8.169 8.169 8.562 -0.393 18112 2448 1 4 . 1 1 38 38 ASN N N 38 115.638 115.638 120.387 -4.749 18112 2449 1 4 . 1 1 38 38 ASN HA H 38 4.259 4.259 4.398 -0.139 18112 2450 1 4 . 1 1 38 38 ASN C C 38 177.868 177.868 177.629 0.239 18112 2451 1 4 . 1 1 38 38 ASN CA C 38 55.907 55.907 56.030 -0.123 18112 2452 1 4 . 1 1 38 38 ASN CB C 38 37.230 37.230 37.904 -0.674 18112 2453 1 4 . 1 1 38 38 ASN H H 38 8.284 8.284 7.476 0.808 18112 2454 1 4 . 1 1 39 39 MET N N 39 121.352 121.352 118.506 2.846 18112 2455 1 4 . 1 1 39 39 MET HA H 39 4.170 4.170 3.605 0.565 18112 2456 1 4 . 1 1 39 39 MET C C 39 179.068 179.068 178.500 0.568 18112 2457 1 4 . 1 1 39 39 MET CA C 39 58.751 58.751 58.490 0.261 18112 2458 1 4 . 1 1 39 39 MET CB C 39 31.850 31.850 32.124 -0.274 18112 2459 1 4 . 1 1 39 39 MET H H 39 7.857 7.857 7.670 0.187 18112 2460 1 4 . 1 1 40 40 LEU N N 40 118.936 118.936 122.476 -3.540 18112 2461 1 4 . 1 1 40 40 LEU HA H 40 4.139 4.139 4.414 -0.275 18112 2462 1 4 . 1 1 40 40 LEU C C 40 178.700 178.700 178.801 -0.101 18112 2463 1 4 . 1 1 40 40 LEU CA C 40 58.455 58.455 58.684 -0.229 18112 2464 1 4 . 1 1 40 40 LEU CB C 40 40.304 40.304 41.307 -1.003 18112 2465 1 4 . 1 1 40 40 LEU H H 40 8.167 8.167 8.365 -0.198 18112 2466 1 4 . 1 1 41 41 LYS N N 41 116.791 116.791 117.150 -0.359 18112 2467 1 4 . 1 1 41 41 LYS HA H 41 3.475 3.475 4.277 -0.802 18112 2468 1 4 . 1 1 41 41 LYS C C 41 178.793 178.793 179.206 -0.413 18112 2469 1 4 . 1 1 41 41 LYS CA C 41 59.161 59.161 59.645 -0.484 18112 2470 1 4 . 1 1 41 41 LYS CB C 41 30.992 30.992 32.425 -1.433 18112 2471 1 4 . 1 1 41 41 LYS H H 41 7.632 7.632 8.027 -0.395 18112 2472 1 4 . 1 1 42 42 THR N N 42 112.819 112.819 115.920 -3.101 18112 2473 1 4 . 1 1 42 42 THR HA H 42 4.230 4.230 4.251 -0.021 18112 2474 1 4 . 1 1 42 42 THR C C 42 176.142 176.142 177.267 -1.125 18112 2475 1 4 . 1 1 42 42 THR CA C 42 65.107 65.107 66.213 -1.105 18112 2476 1 4 . 1 1 42 42 THR CB C 42 68.306 68.306 69.082 -0.775 18112 2477 1 4 . 1 1 42 42 THR H H 42 7.469 7.469 8.067 -0.598 18112 2478 1 4 . 1 1 43 43 TYR N N 43 118.565 118.565 120.178 -1.613 18112 2479 1 4 . 1 1 43 43 TYR HA H 43 4.204 4.204 4.386 -0.182 18112 2480 1 4 . 1 1 43 43 TYR C C 43 174.240 174.240 176.877 -2.637 18112 2481 1 4 . 1 1 43 43 TYR CA C 43 60.886 60.886 57.911 2.975 18112 2482 1 4 . 1 1 43 43 TYR CB C 43 38.165 38.165 38.394 -0.229 18112 2483 1 4 . 1 1 43 43 TYR H H 43 7.978 7.978 7.607 0.371 18112 2484 1 4 . 1 1 44 44 PHE N N 44 120.980 120.980 116.268 4.712 18112 2485 1 4 . 1 1 44 44 PHE HA H 44 4.920 4.920 4.907 0.013 18112 2486 1 4 . 1 1 44 44 PHE C C 44 176.436 176.436 176.647 -0.211 18112 2487 1 4 . 1 1 44 44 PHE CA C 44 56.672 56.672 56.417 0.255 18112 2488 1 4 . 1 1 44 44 PHE CB C 44 36.570 36.570 37.719 -1.149 18112 2489 1 4 . 1 1 44 44 PHE H H 44 7.955 7.955 8.037 -0.082 18112 2490 1 4 . 1 1 45 45 SER N N 45 113.407 113.407 117.249 -3.842 18112 2491 1 4 . 1 1 45 45 SER HA H 45 4.373 4.373 4.495 -0.122 18112 2492 1 4 . 1 1 45 45 SER C C 45 174.424 174.424 175.472 -1.048 18112 2493 1 4 . 1 1 45 45 SER CA C 45 61.037 61.037 60.652 0.385 18112 2494 1 4 . 1 1 45 45 SER CB C 45 62.711 62.711 63.504 -0.793 18112 2495 1 4 . 1 1 45 45 SER H H 45 7.932 7.932 7.735 0.197 18112 2496 1 4 . 1 1 46 46 ASP N N 46 118.099 118.099 118.553 -0.454 18112 2497 1 4 . 1 1 46 46 ASP HA H 46 4.572 4.572 4.680 -0.108 18112 2498 1 4 . 1 1 46 46 ASP C C 46 174.866 174.866 175.596 -0.730 18112 2499 1 4 . 1 1 46 46 ASP CA C 46 53.602 53.602 54.660 -1.058 18112 2500 1 4 . 1 1 46 46 ASP CB C 46 38.992 38.992 41.201 -2.209 18112 2501 1 4 . 1 1 46 46 ASP H H 46 9.889 9.889 8.695 1.194 18112 2502 1 4 . 1 1 47 47 VAL N N 47 121.496 121.496 121.495 0.001 18112 2503 1 4 . 1 1 47 47 VAL HA H 47 4.058 4.058 3.825 0.233 18112 2504 1 4 . 1 1 47 47 VAL C C 47 174.676 174.676 175.018 -0.342 18112 2505 1 4 . 1 1 47 47 VAL CA C 47 61.006 61.006 61.838 -0.832 18112 2506 1 4 . 1 1 47 47 VAL CB C 47 32.110 32.110 30.249 1.861 18112 2507 1 4 . 1 1 47 47 VAL H H 47 7.781 7.781 7.282 0.499 18112 2508 1 4 . 1 1 48 48 LYS N N 48 126.100 126.100 128.064 -1.964 18112 2509 1 4 . 1 1 48 48 LYS HA H 48 4.402 4.402 4.161 0.241 18112 2510 1 4 . 1 1 48 48 LYS C C 48 175.564 175.564 176.024 -0.460 18112 2511 1 4 . 1 1 48 48 LYS CA C 48 54.874 54.874 55.396 -0.522 18112 2512 1 4 . 1 1 48 48 LYS CB C 48 30.189 30.189 30.546 -0.357 18112 2513 1 4 . 1 1 48 48 LYS H H 48 8.245 8.245 8.121 0.124 18112 2514 1 4 . 1 1 49 49 PHE N N 49 125.341 125.341 123.278 2.063 18112 2515 1 4 . 1 1 49 49 PHE HA H 49 3.813 3.813 4.170 -0.357 18112 2516 1 4 . 1 1 49 49 PHE C C 49 175.708 175.708 175.955 -0.247 18112 2517 1 4 . 1 1 49 49 PHE CA C 49 60.861 60.861 59.023 1.838 18112 2518 1 4 . 1 1 49 49 PHE CB C 49 38.616 38.616 37.624 0.992 18112 2519 1 4 . 1 1 49 49 PHE H H 49 8.626 8.626 7.709 0.917 18112 2520 1 4 . 1 1 50 50 ASN N N 50 115.408 115.408 123.524 -8.116 18112 2521 1 4 . 1 1 50 50 ASN C C 50 176.072 176.072 176.197 -0.125 18112 2522 1 4 . 1 1 50 50 ASN CA C 50 51.730 51.730 51.933 -0.203 18112 2523 1 4 . 1 1 50 50 ASN H H 50 7.030 7.030 8.092 -1.062 18112 2524 1 4 . 1 1 51 51 ARG N N 51 122.706 122.706 122.849 -0.143 18112 2525 1 4 . 1 1 51 51 ARG CA C 51 59.534 59.534 60.088 -0.554 18112 2526 1 4 . 1 1 51 51 ARG H H 51 7.790 7.790 8.914 -1.124 18112 2527 1 4 . 1 1 52 52 CYS N N 52 117.340 117.340 116.276 1.064 18112 2528 1 4 . 1 1 52 52 CYS HA H 52 4.108 4.108 4.179 -0.071 18112 2529 1 4 . 1 1 52 52 CYS C C 52 178.200 178.200 177.097 1.103 18112 2530 1 4 . 1 1 52 52 CYS CA C 52 61.143 61.143 62.867 -1.724 18112 2531 1 4 . 1 1 52 52 CYS H H 52 7.681 7.681 8.332 -0.651 18112 2532 1 4 . 1 1 53 53 ILE N N 53 122.321 122.321 117.535 4.786 18112 2533 1 4 . 1 1 53 53 ILE HA H 53 3.588 3.588 3.797 -0.209 18112 2534 1 4 . 1 1 53 53 ILE C C 53 177.492 177.492 177.424 0.068 18112 2535 1 4 . 1 1 53 53 ILE CA C 53 64.109 64.109 63.823 0.286 18112 2536 1 4 . 1 1 53 53 ILE CB C 53 37.603 37.603 37.332 0.271 18112 2537 1 4 . 1 1 53 53 ILE H H 53 8.035 8.035 7.629 0.406 18112 2538 1 4 . 1 1 54 54 THR C C 54 175.903 175.903 176.605 -0.702 18112 2539 1 4 . 1 1 54 54 THR CA C 54 67.308 67.308 67.016 0.292 18112 2540 1 4 . 1 1 55 55 SER N N 55 113.819 113.819 116.977 -3.158 18112 2541 1 4 . 1 1 55 55 SER H H 55 7.844 7.844 8.047 -0.203 18112 2542 1 4 . 1 1 56 56 GLN C C 56 179.792 179.792 178.001 1.791 18112 2543 1 4 . 1 1 57 57 LEU N N 57 116.701 116.701 120.879 -4.178 18112 2544 1 4 . 1 1 57 57 LEU HA H 57 4.519 4.519 3.359 1.160 18112 2545 1 4 . 1 1 57 57 LEU C C 57 178.775 178.775 178.691 0.084 18112 2546 1 4 . 1 1 57 57 LEU CA C 57 55.232 55.232 57.592 -2.360 18112 2547 1 4 . 1 1 57 57 LEU CB C 57 37.131 37.131 41.875 -4.744 18112 2548 1 4 . 1 1 57 57 LEU H H 57 8.267 8.267 7.536 0.731 18112 2549 1 4 . 1 1 58 58 ILE N N 58 122.522 122.522 118.415 4.107 18112 2550 1 4 . 1 1 58 58 ILE HA H 58 4.640 4.640 3.409 1.231 18112 2551 1 4 . 1 1 58 58 ILE C C 58 177.380 177.380 177.900 -0.520 18112 2552 1 4 . 1 1 58 58 ILE CA C 58 62.163 62.163 64.963 -2.800 18112 2553 1 4 . 1 1 58 58 ILE CB C 58 30.657 30.657 37.467 -6.810 18112 2554 1 4 . 1 1 58 58 ILE H H 58 8.111 8.111 8.095 0.016 18112 2555 1 4 . 1 1 59 59 LYS N N 59 121.002 121.002 120.919 0.083 18112 2556 1 4 . 1 1 59 59 LYS C C 59 177.600 177.600 178.722 -1.122 18112 2557 1 4 . 1 1 59 59 LYS CA C 59 57.570 57.570 59.098 -1.528 18112 2558 1 4 . 1 1 59 59 LYS CB C 59 39.101 39.101 31.700 7.401 18112 2559 1 4 . 1 1 59 59 LYS H H 59 7.432 7.432 7.962 -0.530 18112 2560 1 4 . 1 1 60 60 TRP N N 60 118.679 118.679 119.999 -1.320 18112 2561 1 4 . 1 1 60 60 TRP HA H 60 3.739 3.739 4.569 -0.830 18112 2562 1 4 . 1 1 60 60 TRP C C 60 178.246 178.246 179.068 -0.822 18112 2563 1 4 . 1 1 60 60 TRP CA C 60 59.818 59.818 58.855 0.963 18112 2564 1 4 . 1 1 60 60 TRP CB C 60 31.851 31.851 28.709 3.142 18112 2565 1 4 . 1 1 60 60 TRP H H 60 7.565 7.565 7.964 -0.399 18112 2566 1 4 . 1 1 61 61 PHE N N 61 118.005 118.005 118.477 -0.472 18112 2567 1 4 . 1 1 61 61 PHE HA H 61 3.882 3.882 3.348 0.534 18112 2568 1 4 . 1 1 61 61 PHE CA C 61 60.054 60.054 62.213 -2.159 18112 2569 1 4 . 1 1 61 61 PHE H H 61 7.819 7.819 8.843 -1.024 18112 2570 1 4 . 1 1 62 62 SER N N 62 121.144 121.144 113.589 7.555 18112 2571 1 4 . 1 1 62 62 SER C C 62 177.840 177.840 177.106 0.734 18112 2572 1 4 . 1 1 62 62 SER CA C 62 55.892 55.892 61.494 -5.602 18112 2573 1 4 . 1 1 62 62 SER H H 62 8.878 8.878 8.296 0.582 18112 2574 1 4 . 1 1 63 63 ASN N N 63 115.303 115.303 120.960 -5.657 18112 2575 1 4 . 1 1 63 63 ASN C C 63 177.222 177.222 177.596 -0.374 18112 2576 1 4 . 1 1 63 63 ASN CA C 63 60.467 60.467 56.695 3.772 18112 2577 1 4 . 1 1 63 63 ASN H H 63 8.001 8.001 8.235 -0.234 18112 2578 1 4 . 1 1 64 64 PHE N N 64 112.571 112.571 120.990 -8.419 18112 2579 1 4 . 1 1 64 64 PHE CA C 64 56.453 56.453 62.047 -5.594 18112 2580 1 4 . 1 1 64 64 PHE H H 64 7.082 7.082 8.355 -1.273 18112 2581 1 4 . 1 1 65 65 ARG N N 65 116.695 116.695 118.613 -1.918 18112 2582 1 4 . 1 1 65 65 ARG CA C 65 59.590 59.590 60.287 -0.697 18112 2583 1 4 . 1 1 65 65 ARG H H 65 8.091 8.091 8.385 -0.294 18112 2584 1 4 . 1 1 66 66 GLU N N 66 121.653 121.653 119.392 2.261 18112 2585 1 4 . 1 1 66 66 GLU HA H 66 4.739 4.739 4.249 0.490 18112 2586 1 4 . 1 1 66 66 GLU C C 66 174.621 174.621 178.716 -4.095 18112 2587 1 4 . 1 1 66 66 GLU CA C 66 59.583 59.583 59.102 0.481 18112 2588 1 4 . 1 1 66 66 GLU H H 66 7.597 7.597 8.302 -0.705 18112 2589 1 4 . 1 1 67 67 PHE N N 67 111.578 111.578 122.526 -10.948 18112 2590 1 4 . 1 1 67 67 PHE C C 67 176.164 176.164 177.069 -0.905 18112 2591 1 4 . 1 1 67 67 PHE CA C 67 61.156 61.156 61.737 -0.581 18112 2592 1 4 . 1 1 67 67 PHE H H 67 7.067 7.067 8.274 -1.207 18112 2593 1 4 . 1 1 68 68 TYR N N 68 119.370 119.370 120.581 -1.211 18112 2594 1 4 . 1 1 68 68 TYR C C 68 176.844 176.844 177.613 -0.769 18112 2595 1 4 . 1 1 68 68 TYR CA C 68 61.758 61.758 61.337 0.421 18112 2596 1 4 . 1 1 68 68 TYR H H 68 7.442 7.442 8.734 -1.292 18112 2597 1 4 . 1 1 69 69 TYR N N 69 116.047 116.047 120.197 -4.150 18112 2598 1 4 . 1 1 69 69 TYR HA H 69 4.086 4.086 4.045 0.041 18112 2599 1 4 . 1 1 69 69 TYR C C 69 180.328 180.328 177.199 3.129 18112 2600 1 4 . 1 1 69 69 TYR CA C 69 61.528 61.528 61.886 -0.358 18112 2601 1 4 . 1 1 69 69 TYR H H 69 9.127 9.127 8.297 0.830 18112 2602 1 4 . 1 1 70 70 ILE N N 70 124.738 124.738 119.129 5.609 18112 2603 1 4 . 1 1 70 70 ILE HA H 70 3.828 3.828 3.378 0.450 18112 2604 1 4 . 1 1 70 70 ILE C C 70 179.585 179.585 177.899 1.686 18112 2605 1 4 . 1 1 70 70 ILE CA C 70 65.787 65.787 64.230 1.557 18112 2606 1 4 . 1 1 70 70 ILE CB C 70 36.435 36.435 37.402 -0.967 18112 2607 1 4 . 1 1 70 70 ILE H H 70 8.631 8.631 8.091 0.540 18112 2608 1 4 . 1 1 71 71 GLN N N 71 117.940 117.940 118.550 -0.610 18112 2609 1 4 . 1 1 71 71 GLN HA H 71 3.826 3.826 3.409 0.417 18112 2610 1 4 . 1 1 71 71 GLN C C 71 178.192 178.192 178.312 -0.120 18112 2611 1 4 . 1 1 71 71 GLN CA C 71 57.779 57.779 58.123 -0.344 18112 2612 1 4 . 1 1 71 71 GLN H H 71 7.738 7.738 7.751 -0.013 18112 2613 1 4 . 1 1 72 72 MET N N 72 117.353 117.353 117.681 -0.328 18112 2614 1 4 . 1 1 72 72 MET HA H 72 4.112 4.112 3.985 0.127 18112 2615 1 4 . 1 1 72 72 MET C C 72 177.203 177.203 178.074 -0.871 18112 2616 1 4 . 1 1 72 72 MET CA C 72 57.272 57.272 56.873 0.399 18112 2617 1 4 . 1 1 72 72 MET H H 72 7.844 7.844 7.752 0.092 18112 2618 1 4 . 1 1 73 73 GLU N N 73 117.858 117.858 119.677 -1.819 18112 2619 1 4 . 1 1 73 73 GLU HA H 73 3.572 3.572 3.367 0.205 18112 2620 1 4 . 1 1 73 73 GLU C C 73 177.344 177.344 178.453 -1.109 18112 2621 1 4 . 1 1 73 73 GLU CA C 73 60.324 60.324 59.571 0.753 18112 2622 1 4 . 1 1 73 73 GLU H H 73 7.503 7.503 7.586 -0.083 18112 2623 1 4 . 1 1 74 74 LYS N N 74 118.716 118.716 119.066 -0.350 18112 2624 1 4 . 1 1 74 74 LYS HA H 74 3.867 3.867 3.928 -0.060 18112 2625 1 4 . 1 1 74 74 LYS C C 74 180.077 180.077 179.342 0.735 18112 2626 1 4 . 1 1 74 74 LYS CA C 74 59.754 59.754 58.599 1.155 18112 2627 1 4 . 1 1 74 74 LYS H H 74 7.912 7.912 7.522 0.390 18112 2628 1 4 . 1 1 75 75 TYR N N 75 117.309 117.309 119.176 -1.867 18112 2629 1 4 . 1 1 75 75 TYR HA H 75 4.085 4.085 4.203 -0.118 18112 2630 1 4 . 1 1 75 75 TYR C C 75 178.874 178.874 178.222 0.652 18112 2631 1 4 . 1 1 75 75 TYR CA C 75 63.306 63.306 59.699 3.607 18112 2632 1 4 . 1 1 75 75 TYR H H 75 8.421 8.421 7.790 0.631 18112 2633 1 4 . 1 1 76 76 ALA N N 76 125.392 125.392 121.450 3.942 18112 2634 1 4 . 1 1 76 76 ALA HA H 76 4.221 4.221 4.081 0.140 18112 2635 1 4 . 1 1 76 76 ALA C C 76 178.850 178.850 179.064 -0.214 18112 2636 1 4 . 1 1 76 76 ALA CA C 76 56.280 56.280 55.229 1.051 18112 2637 1 4 . 1 1 76 76 ALA CB C 76 18.687 18.687 18.299 0.388 18112 2638 1 4 . 1 1 76 76 ALA H H 76 8.553 8.553 8.375 0.178 18112 2639 1 4 . 1 1 77 77 ARG N N 77 115.067 115.067 119.054 -3.987 18112 2640 1 4 . 1 1 77 77 ARG HA H 77 3.935 3.935 3.859 0.076 18112 2641 1 4 . 1 1 77 77 ARG C C 77 179.341 179.341 178.199 1.142 18112 2642 1 4 . 1 1 77 77 ARG CA C 77 60.499 60.499 59.700 0.799 18112 2643 1 4 . 1 1 77 77 ARG H H 77 8.471 8.471 8.268 0.203 18112 2644 1 4 . 1 1 78 78 GLN N N 78 120.107 120.107 118.834 1.273 18112 2645 1 4 . 1 1 78 78 GLN HA H 78 3.921 3.921 4.134 -0.213 18112 2646 1 4 . 1 1 78 78 GLN C C 78 177.289 177.289 178.197 -0.908 18112 2647 1 4 . 1 1 78 78 GLN CA C 78 58.619 58.619 58.606 0.013 18112 2648 1 4 . 1 1 78 78 GLN CB C 78 27.752 27.752 28.713 -0.961 18112 2649 1 4 . 1 1 78 78 GLN H H 78 8.142 8.142 8.188 -0.046 18112 2650 1 4 . 1 1 79 79 ALA N N 79 120.809 120.809 123.608 -2.799 18112 2651 1 4 . 1 1 79 79 ALA HA H 79 4.308 4.308 4.090 0.218 18112 2652 1 4 . 1 1 79 79 ALA C C 79 179.924 179.924 179.662 0.262 18112 2653 1 4 . 1 1 79 79 ALA CA C 79 54.970 54.970 55.381 -0.411 18112 2654 1 4 . 1 1 79 79 ALA CB C 79 17.064 17.064 18.625 -1.561 18112 2655 1 4 . 1 1 79 79 ALA H H 79 7.811 7.811 7.993 -0.182 18112 2656 1 4 . 1 1 80 80 ILE N N 80 118.524 118.524 118.204 0.320 18112 2657 1 4 . 1 1 80 80 ILE HA H 80 3.894 3.894 3.608 0.286 18112 2658 1 4 . 1 1 80 80 ILE C C 80 181.268 181.268 178.332 2.936 18112 2659 1 4 . 1 1 80 80 ILE CA C 80 64.841 64.841 64.552 0.289 18112 2660 1 4 . 1 1 80 80 ILE CB C 80 37.125 37.125 37.752 -0.627 18112 2661 1 4 . 1 1 80 80 ILE H H 80 7.837 7.837 7.983 -0.146 18112 2662 1 4 . 1 1 81 81 ASN N N 81 121.233 121.233 117.406 3.827 18112 2663 1 4 . 1 1 81 81 ASN HA H 81 4.398 4.398 4.419 -0.021 18112 2664 1 4 . 1 1 81 81 ASN C C 81 176.546 176.546 176.963 -0.417 18112 2665 1 4 . 1 1 81 81 ASN CA C 81 55.892 55.892 55.690 0.202 18112 2666 1 4 . 1 1 81 81 ASN CB C 81 37.603 37.603 38.594 -0.991 18112 2667 1 4 . 1 1 81 81 ASN H H 81 8.262 8.262 8.002 0.260 18112 2668 1 4 . 1 1 82 82 ASP N N 82 119.240 119.240 116.935 2.305 18112 2669 1 4 . 1 1 82 82 ASP HA H 82 4.666 4.666 4.601 0.065 18112 2670 1 4 . 1 1 82 82 ASP C C 82 176.767 176.767 177.237 -0.470 18112 2671 1 4 . 1 1 82 82 ASP CA C 82 54.771 54.771 54.699 0.072 18112 2672 1 4 . 1 1 82 82 ASP CB C 82 40.121 40.121 42.358 -2.237 18112 2673 1 4 . 1 1 82 82 ASP H H 82 8.316 8.316 7.981 0.335 18112 2674 1 4 . 1 1 83 83 GLY N N 83 106.913 106.913 107.813 -0.900 18112 2675 1 4 . 1 1 83 83 GLY C C 83 174.601 174.601 174.484 0.117 18112 2676 1 4 . 1 1 83 83 GLY CA C 83 45.214 45.214 44.922 0.292 18112 2677 1 4 . 1 1 83 83 GLY H H 83 7.810 7.810 8.014 -0.204 18112 2678 1 4 . 1 1 84 84 VAL N N 84 122.981 122.981 120.249 2.732 18112 2679 1 4 . 1 1 84 84 VAL HA H 84 3.850 3.850 4.071 -0.221 18112 2680 1 4 . 1 1 84 84 VAL C C 84 177.265 177.265 176.331 0.934 18112 2681 1 4 . 1 1 84 84 VAL CA C 84 64.270 64.270 63.485 0.785 18112 2682 1 4 . 1 1 84 84 VAL CB C 84 30.471 30.471 32.265 -1.794 18112 2683 1 4 . 1 1 84 84 VAL H H 84 8.157 8.157 7.572 0.585 18112 2684 1 4 . 1 1 85 85 THR N N 85 115.232 115.232 116.288 -1.056 18112 2685 1 4 . 1 1 85 85 THR HA H 85 4.716 4.716 4.581 0.135 18112 2686 1 4 . 1 1 85 85 THR C C 85 174.489 174.489 174.809 -0.320 18112 2687 1 4 . 1 1 85 85 THR CA C 85 61.618 61.618 62.051 -0.433 18112 2688 1 4 . 1 1 85 85 THR CB C 85 70.081 70.081 69.526 0.555 18112 2689 1 4 . 1 1 85 85 THR H H 85 8.890 8.890 8.147 0.743 18112 2690 1 4 . 1 1 86 86 SER N N 86 117.009 117.009 118.741 -1.732 18112 2691 1 4 . 1 1 86 86 SER HA H 86 5.046 5.046 4.652 0.394 18112 2692 1 4 . 1 1 86 86 SER C C 86 174.473 174.473 175.035 -0.562 18112 2693 1 4 . 1 1 86 86 SER CA C 86 55.922 55.922 57.625 -1.703 18112 2694 1 4 . 1 1 86 86 SER CB C 86 64.385 64.385 64.534 -0.149 18112 2695 1 4 . 1 1 86 86 SER H H 86 7.704 7.704 7.873 -0.169 18112 2696 1 4 . 1 1 87 87 THR N N 87 118.634 118.634 118.249 0.385 18112 2697 1 4 . 1 1 87 87 THR HA H 87 4.065 4.065 4.082 -0.017 18112 2698 1 4 . 1 1 87 87 THR C C 87 176.047 176.047 176.024 0.023 18112 2699 1 4 . 1 1 87 87 THR CA C 87 64.983 64.983 64.778 0.205 18112 2700 1 4 . 1 1 87 87 THR CB C 87 68.045 68.045 68.924 -0.879 18112 2701 1 4 . 1 1 87 87 THR H H 87 8.711 8.711 8.685 0.026 18112 2702 1 4 . 1 1 88 88 GLU N N 88 117.889 117.889 120.433 -2.544 18112 2703 1 4 . 1 1 88 88 GLU HA H 88 3.881 3.881 4.091 -0.210 18112 2704 1 4 . 1 1 88 88 GLU C C 88 177.146 177.146 177.511 -0.365 18112 2705 1 4 . 1 1 88 88 GLU CA C 88 57.814 57.814 58.323 -0.509 18112 2706 1 4 . 1 1 88 88 GLU CB C 88 28.050 28.050 29.024 -0.974 18112 2707 1 4 . 1 1 88 88 GLU H H 88 8.152 8.152 8.699 -0.547 18112 2708 1 4 . 1 1 89 89 GLU N N 89 115.617 115.617 119.187 -3.570 18112 2709 1 4 . 1 1 89 89 GLU HA H 89 4.149 4.149 4.270 -0.121 18112 2710 1 4 . 1 1 89 89 GLU C C 89 176.192 176.192 177.272 -1.080 18112 2711 1 4 . 1 1 89 89 GLU CA C 89 56.133 56.133 57.352 -1.219 18112 2712 1 4 . 1 1 89 89 GLU CB C 89 29.415 29.415 29.777 -0.362 18112 2713 1 4 . 1 1 89 89 GLU H H 89 7.311 7.311 7.680 -0.369 18112 2714 1 4 . 1 1 90 90 LEU N N 90 120.870 120.870 118.742 2.128 18112 2715 1 4 . 1 1 90 90 LEU HA H 90 4.439 4.439 4.389 0.050 18112 2716 1 4 . 1 1 90 90 LEU C C 90 175.267 175.267 177.604 -2.337 18112 2717 1 4 . 1 1 90 90 LEU CA C 90 53.504 53.504 56.177 -2.673 18112 2718 1 4 . 1 1 90 90 LEU CB C 90 40.479 40.479 43.045 -2.566 18112 2719 1 4 . 1 1 90 90 LEU H H 90 7.311 7.311 7.569 -0.258 18112 2720 1 4 . 1 1 91 91 SER N N 91 118.376 118.376 110.664 7.712 18112 2721 1 4 . 1 1 91 91 SER HA H 91 4.747 4.747 4.479 0.269 18112 2722 1 4 . 1 1 91 91 SER C C 91 173.332 173.332 174.002 -0.670 18112 2723 1 4 . 1 1 91 91 SER CA C 91 56.314 56.314 58.205 -1.891 18112 2724 1 4 . 1 1 91 91 SER CB C 91 64.615 64.615 64.355 0.260 18112 2725 1 4 . 1 1 91 91 SER H H 91 8.221 8.221 7.608 0.613 18112 2726 1 4 . 1 1 92 92 ILE N N 92 122.247 122.247 121.370 0.877 18112 2727 1 4 . 1 1 92 92 ILE HA H 92 4.537 4.537 4.262 0.275 18112 2728 1 4 . 1 1 92 92 ILE C C 92 174.059 174.059 176.233 -2.174 18112 2729 1 4 . 1 1 92 92 ILE CA C 92 59.881 59.881 59.011 0.870 18112 2730 1 4 . 1 1 92 92 ILE CB C 92 37.820 37.820 38.914 -1.094 18112 2731 1 4 . 1 1 92 92 ILE H H 92 8.570 8.570 7.344 1.226 18112 2732 1 4 . 1 1 93 93 THR N N 93 116.069 116.069 119.332 -3.263 18112 2733 1 4 . 1 1 93 93 THR HA H 93 4.580 4.580 4.197 0.383 18112 2734 1 4 . 1 1 93 93 THR C C 93 175.049 175.049 174.460 0.589 18112 2735 1 4 . 1 1 93 93 THR CA C 93 58.988 58.988 64.220 -5.232 18112 2736 1 4 . 1 1 93 93 THR CB C 93 71.362 71.362 68.654 2.708 18112 2737 1 4 . 1 1 93 93 THR H H 93 7.224 7.224 8.622 -1.398 18112 2738 1 4 . 1 1 94 94 ARG N N 94 116.595 116.595 126.675 -10.080 18112 2739 1 4 . 1 1 94 94 ARG HA H 94 3.077 3.077 4.398 -1.321 18112 2740 1 4 . 1 1 94 94 ARG C C 94 175.076 175.076 176.112 -1.036 18112 2741 1 4 . 1 1 94 94 ARG CA C 94 57.119 57.119 55.893 1.226 18112 2742 1 4 . 1 1 94 94 ARG CB C 94 27.838 27.838 31.388 -3.550 18112 2743 1 4 . 1 1 94 94 ARG H H 94 8.596 8.596 8.327 0.269 18112 2744 1 4 . 1 1 95 95 ASP N N 95 113.735 113.735 118.777 -5.042 18112 2745 1 4 . 1 1 95 95 ASP HA H 95 4.765 4.765 3.359 1.406 18112 2746 1 4 . 1 1 95 95 ASP C C 95 175.876 175.876 176.691 -0.815 18112 2747 1 4 . 1 1 95 95 ASP CA C 95 53.156 53.156 57.243 -4.087 18112 2748 1 4 . 1 1 95 95 ASP CB C 95 41.166 41.166 39.471 1.695 18112 2749 1 4 . 1 1 95 95 ASP H H 95 7.607 7.607 8.364 -0.757 18112 2750 1 4 . 1 1 96 96 CYS N N 96 116.012 116.012 120.696 -4.684 18112 2751 1 4 . 1 1 96 96 CYS C C 96 174.361 174.361 177.040 -2.679 18112 2752 1 4 . 1 1 96 96 CYS CA C 96 56.562 56.562 63.036 -6.474 18112 2753 1 4 . 1 1 96 96 CYS CB C 96 29.416 29.416 27.050 2.366 18112 2754 1 4 . 1 1 96 96 CYS H H 96 7.094 7.094 7.972 -0.878 18112 2755 1 4 . 1 1 97 97 GLU N N 97 123.087 123.087 119.772 3.315 18112 2756 1 4 . 1 1 97 97 GLU C C 97 178.748 178.748 179.136 -0.388 18112 2757 1 4 . 1 1 97 97 GLU CA C 97 59.912 59.912 59.185 0.727 18112 2758 1 4 . 1 1 97 97 GLU CB C 97 29.195 29.195 28.424 0.770 18112 2759 1 4 . 1 1 97 97 GLU H H 97 9.003 9.003 8.421 0.582 18112 2760 1 4 . 1 1 98 98 LEU N N 98 120.942 120.942 121.537 -0.595 18112 2761 1 4 . 1 1 98 98 LEU HA H 98 3.614 3.614 4.183 -0.569 18112 2762 1 4 . 1 1 98 98 LEU C C 98 177.796 177.796 179.021 -1.225 18112 2763 1 4 . 1 1 98 98 LEU CA C 98 58.090 58.090 57.738 0.352 18112 2764 1 4 . 1 1 98 98 LEU CB C 98 39.778 39.778 41.691 -1.913 18112 2765 1 4 . 1 1 98 98 LEU H H 98 8.656 8.656 7.972 0.684 18112 2766 1 4 . 1 1 99 99 TYR N N 99 118.313 118.313 118.025 0.288 18112 2767 1 4 . 1 1 99 99 TYR C C 99 177.077 177.077 178.360 -1.283 18112 2768 1 4 . 1 1 99 99 TYR CA C 99 62.622 62.622 59.832 2.790 18112 2769 1 4 . 1 1 99 99 TYR CB C 99 38.742 38.742 37.247 1.495 18112 2770 1 4 . 1 1 99 99 TYR H H 99 7.522 7.522 8.576 -1.054 18112 2771 1 4 . 1 1 100 100 ARG N N 100 118.101 118.101 120.352 -2.251 18112 2772 1 4 . 1 1 100 100 ARG C C 100 178.616 178.616 178.335 0.281 18112 2773 1 4 . 1 1 100 100 ARG CA C 100 59.915 59.915 58.752 1.163 18112 2774 1 4 . 1 1 100 100 ARG CB C 100 29.100 29.100 29.471 -0.371 18112 2775 1 4 . 1 1 100 100 ARG H H 100 8.243 8.243 8.266 -0.023 18112 2776 1 4 . 1 1 101 101 ALA N N 101 120.972 120.972 121.868 -0.896 18112 2777 1 4 . 1 1 101 101 ALA HA H 101 4.145 4.145 3.891 0.254 18112 2778 1 4 . 1 1 101 101 ALA C C 101 181.359 181.359 179.609 1.750 18112 2779 1 4 . 1 1 101 101 ALA CA C 101 55.057 55.057 54.890 0.167 18112 2780 1 4 . 1 1 101 101 ALA CB C 101 17.543 17.543 18.353 -0.810 18112 2781 1 4 . 1 1 101 101 ALA H H 101 8.352 8.352 7.859 0.493 18112 2782 1 4 . 1 1 102 102 LEU N N 102 115.683 115.683 117.654 -1.971 18112 2783 1 4 . 1 1 102 102 LEU HA H 102 4.333 4.333 4.275 0.058 18112 2784 1 4 . 1 1 102 102 LEU C C 102 178.583 178.583 179.781 -1.198 18112 2785 1 4 . 1 1 102 102 LEU CA C 102 57.634 57.634 57.866 -0.232 18112 2786 1 4 . 1 1 102 102 LEU CB C 102 41.716 41.716 41.195 0.521 18112 2787 1 4 . 1 1 102 102 LEU H H 102 7.960 7.960 8.170 -0.210 18112 2788 1 4 . 1 1 103 103 ASN N N 103 118.957 118.957 119.585 -0.628 18112 2789 1 4 . 1 1 103 103 ASN C C 103 177.470 177.470 178.189 -0.719 18112 2790 1 4 . 1 1 103 103 ASN CA C 103 56.974 56.974 55.806 1.167 18112 2791 1 4 . 1 1 103 103 ASN CB C 103 38.140 38.140 38.821 -0.681 18112 2792 1 4 . 1 1 103 103 ASN H H 103 9.301 9.301 8.393 0.908 18112 2793 1 4 . 1 1 104 104 MET N N 104 113.763 113.763 116.589 -2.826 18112 2794 1 4 . 1 1 104 104 MET CA C 104 57.362 57.362 57.355 0.007 18112 2795 1 4 . 1 1 104 104 MET CB C 104 31.895 31.895 31.951 -0.056 18112 2796 1 4 . 1 1 104 104 MET H H 104 8.332 8.332 8.159 0.173 18112 2797 1 4 . 1 1 105 105 HIS N N 105 116.024 116.024 115.728 0.296 18112 2798 1 4 . 1 1 105 105 HIS HA H 105 3.764 3.764 4.589 -0.825 18112 2799 1 4 . 1 1 105 105 HIS C C 105 176.939 176.939 176.789 0.150 18112 2800 1 4 . 1 1 105 105 HIS CA C 105 59.069 59.069 57.797 1.272 18112 2801 1 4 . 1 1 105 105 HIS H H 105 7.156 7.156 8.355 -1.199 18112 2802 1 4 . 1 1 106 106 TYR N N 106 113.161 113.161 116.533 -3.372 18112 2803 1 4 . 1 1 106 106 TYR C C 106 173.767 173.767 175.850 -2.083 18112 2804 1 4 . 1 1 106 106 TYR CA C 106 58.488 58.488 59.407 -0.919 18112 2805 1 4 . 1 1 106 106 TYR CB C 106 38.225 38.225 40.141 -1.916 18112 2806 1 4 . 1 1 106 106 TYR H H 106 7.204 7.204 8.417 -1.213 18112 2807 1 4 . 1 1 107 107 ASN N N 107 118.875 118.875 115.726 3.149 18112 2808 1 4 . 1 1 107 107 ASN HA H 107 3.922 3.922 4.773 -0.851 18112 2809 1 4 . 1 1 107 107 ASN C C 107 175.815 175.815 174.863 0.952 18112 2810 1 4 . 1 1 107 107 ASN CA C 107 51.233 51.233 53.272 -2.039 18112 2811 1 4 . 1 1 107 107 ASN CB C 107 38.142 38.142 39.335 -1.193 18112 2812 1 4 . 1 1 107 107 ASN H H 107 8.127 8.127 8.318 -0.191 18112 2813 1 4 . 1 1 108 108 LYS N N 108 122.850 122.850 121.757 1.093 18112 2814 1 4 . 1 1 108 108 LYS HA H 108 3.954 3.954 4.333 -0.379 18112 2815 1 4 . 1 1 108 108 LYS C C 108 177.586 177.586 176.573 1.013 18112 2816 1 4 . 1 1 108 108 LYS CA C 108 59.749 59.749 58.103 1.646 18112 2817 1 4 . 1 1 108 108 LYS CB C 108 31.498 31.498 32.766 -1.268 18112 2818 1 4 . 1 1 108 108 LYS H H 108 7.772 7.772 8.891 -1.119 18112 2819 1 4 . 1 1 109 109 ALA N N 109 118.054 118.054 119.585 -1.531 18112 2820 1 4 . 1 1 109 109 ALA HA H 109 4.137 4.137 3.953 0.184 18112 2821 1 4 . 1 1 109 109 ALA C C 109 177.889 177.889 176.497 1.392 18112 2822 1 4 . 1 1 109 109 ALA CA C 109 52.299 52.299 52.681 -0.382 18112 2823 1 4 . 1 1 109 109 ALA CB C 109 17.787 17.787 17.026 0.761 18112 2824 1 4 . 1 1 109 109 ALA H H 109 8.307 8.307 7.878 0.429 18112 2825 1 4 . 1 1 110 110 ASN N N 110 115.542 115.542 116.938 -1.396 18112 2826 1 4 . 1 1 110 110 ASN HA H 110 4.480 4.480 4.440 0.040 18112 2827 1 4 . 1 1 110 110 ASN C C 110 174.277 174.277 174.369 -0.092 18112 2828 1 4 . 1 1 110 110 ASN CA C 110 53.504 53.504 53.549 -0.045 18112 2829 1 4 . 1 1 110 110 ASN CB C 110 37.283 37.283 36.640 0.643 18112 2830 1 4 . 1 1 110 110 ASN H H 110 8.353 8.353 8.336 0.017 18112 2831 1 4 . 1 1 111 111 ASP N N 111 114.692 114.692 121.337 -6.645 18112 2832 1 4 . 1 1 111 111 ASP HA H 111 4.485 4.485 4.447 0.038 18112 2833 1 4 . 1 1 111 111 ASP C C 111 174.868 174.868 175.051 -0.183 18112 2834 1 4 . 1 1 111 111 ASP CA C 111 53.227 53.227 54.766 -1.539 18112 2835 1 4 . 1 1 111 111 ASP CB C 111 39.228 39.228 41.813 -2.585 18112 2836 1 4 . 1 1 111 111 ASP H H 111 8.297 8.297 8.001 0.296 18112 2837 1 4 . 1 1 112 112 PHE N N 112 120.927 120.927 120.644 0.283 18112 2838 1 4 . 1 1 112 112 PHE HA H 112 4.752 4.752 4.684 0.068 18112 2839 1 4 . 1 1 112 112 PHE C C 112 174.633 174.633 175.787 -1.154 18112 2840 1 4 . 1 1 112 112 PHE CA C 112 56.346 56.346 57.436 -1.090 18112 2841 1 4 . 1 1 112 112 PHE H H 112 7.784 7.784 7.825 -0.041 18112 2842 1 4 . 1 1 113 113 GLU N N 113 128.111 128.111 123.402 4.709 18112 2843 1 4 . 1 1 113 113 GLU HA H 113 4.011 4.011 4.266 -0.255 18112 2844 1 4 . 1 1 113 113 GLU C C 113 173.502 173.502 175.936 -2.434 18112 2845 1 4 . 1 1 113 113 GLU CA C 113 55.100 55.100 56.466 -1.366 18112 2846 1 4 . 1 1 113 113 GLU H H 113 7.752 7.752 8.862 -1.110 18112 2847 1 4 . 1 1 114 114 VAL N N 114 129.326 129.326 112.643 16.683 18112 2848 1 4 . 1 1 114 114 VAL HA H 114 3.241 3.241 3.585 -0.344 18112 2849 1 4 . 1 1 114 114 VAL CA C 114 60.838 60.838 61.465 -0.627 18112 2850 1 4 . 1 1 114 114 VAL CB C 114 32.609 32.609 30.359 2.250 18112 2851 1 4 . 1 1 114 114 VAL H H 114 8.008 8.008 7.845 0.163 18112 2852 1 4 . 1 1 115 115 PRO HA H 115 4.429 4.429 4.550 -0.121 18112 2853 1 4 . 1 1 115 115 PRO C C 115 177.421 177.421 177.840 -0.419 18112 2854 1 4 . 1 1 115 115 PRO CA C 115 61.882 61.882 62.395 -0.513 18112 2855 1 4 . 1 1 115 115 PRO CB C 115 30.974 30.974 32.918 -1.944 18112 2856 1 4 . 1 1 116 116 GLU N N 116 123.936 123.936 120.808 3.128 18112 2857 1 4 . 1 1 116 116 GLU C C 116 179.034 179.034 178.781 0.253 18112 2858 1 4 . 1 1 116 116 GLU CA C 116 58.913 58.913 60.111 -1.198 18112 2859 1 4 . 1 1 116 116 GLU CB C 116 28.378 28.378 29.351 -0.973 18112 2860 1 4 . 1 1 116 116 GLU H H 116 8.757 8.757 8.779 -0.022 18112 2861 1 4 . 1 1 117 117 ARG N N 117 116.943 116.943 118.321 -1.378 18112 2862 1 4 . 1 1 117 117 ARG C C 117 177.570 177.570 178.581 -1.011 18112 2863 1 4 . 1 1 117 117 ARG CA C 117 57.033 57.033 59.158 -2.125 18112 2864 1 4 . 1 1 117 117 ARG CB C 117 28.172 28.172 29.626 -1.454 18112 2865 1 4 . 1 1 117 117 ARG H H 117 8.733 8.733 8.309 0.424 18112 2866 1 4 . 1 1 118 118 PHE N N 118 117.528 117.528 120.334 -2.806 18112 2867 1 4 . 1 1 118 118 PHE HA H 118 4.137 4.137 4.398 -0.261 18112 2868 1 4 . 1 1 118 118 PHE C C 118 176.992 176.992 177.404 -0.412 18112 2869 1 4 . 1 1 118 118 PHE CA C 118 61.627 61.627 61.214 0.413 18112 2870 1 4 . 1 1 118 118 PHE CB C 118 37.386 37.386 39.202 -1.816 18112 2871 1 4 . 1 1 118 118 PHE H H 118 7.606 7.606 7.988 -0.382 18112 2872 1 4 . 1 1 119 119 LEU N N 119 118.483 118.483 118.643 -0.160 18112 2873 1 4 . 1 1 119 119 LEU HA H 119 3.684 3.684 4.022 -0.338 18112 2874 1 4 . 1 1 119 119 LEU C C 119 178.802 178.802 179.273 -0.471 18112 2875 1 4 . 1 1 119 119 LEU CA C 119 59.875 59.875 56.796 3.079 18112 2876 1 4 . 1 1 119 119 LEU CB C 119 39.453 39.453 40.247 -0.794 18112 2877 1 4 . 1 1 119 119 LEU H H 119 7.248 7.248 7.898 -0.650 18112 2878 1 4 . 1 1 120 120 GLU N N 120 117.870 117.870 121.119 -3.249 18112 2879 1 4 . 1 1 120 120 GLU C C 120 179.932 179.932 179.221 0.711 18112 2880 1 4 . 1 1 120 120 GLU CA C 120 59.150 59.150 59.137 0.013 18112 2881 1 4 . 1 1 120 120 GLU CB C 120 28.878 28.878 29.365 -0.487 18112 2882 1 4 . 1 1 120 120 GLU H H 120 7.423 7.423 8.278 -0.855 18112 2883 1 4 . 1 1 121 121 VAL N N 121 120.777 120.777 120.228 0.549 18112 2884 1 4 . 1 1 121 121 VAL HA H 121 3.545 3.545 3.577 -0.032 18112 2885 1 4 . 1 1 121 121 VAL C C 121 179.302 179.302 178.034 1.268 18112 2886 1 4 . 1 1 121 121 VAL CA C 121 66.875 66.875 66.848 0.027 18112 2887 1 4 . 1 1 121 121 VAL CB C 121 30.823 30.823 31.724 -0.901 18112 2888 1 4 . 1 1 121 121 VAL H H 121 8.313 8.313 8.015 0.298 18112 2889 1 4 . 1 1 122 122 ALA N N 122 127.029 127.029 121.148 5.881 18112 2890 1 4 . 1 1 122 122 ALA HA H 122 4.251 4.251 4.154 0.097 18112 2891 1 4 . 1 1 122 122 ALA C C 122 178.366 178.366 179.610 -1.244 18112 2892 1 4 . 1 1 122 122 ALA CA C 122 54.748 54.748 54.919 -0.171 18112 2893 1 4 . 1 1 122 122 ALA CB C 122 16.565 16.565 18.320 -1.755 18112 2894 1 4 . 1 1 122 122 ALA H H 122 8.896 8.896 8.143 0.753 18112 2895 1 4 . 1 1 123 123 GLN N N 123 119.887 119.887 118.970 0.917 18112 2896 1 4 . 1 1 123 123 GLN C C 123 177.908 177.908 178.508 -0.600 18112 2897 1 4 . 1 1 123 123 GLN CA C 123 60.671 60.671 59.146 1.525 18112 2898 1 4 . 1 1 123 123 GLN H H 123 8.349 8.349 7.797 0.552 18112 2899 1 4 . 1 1 124 124 ILE N N 124 120.632 120.632 118.733 1.899 18112 2900 1 4 . 1 1 124 124 ILE HA H 124 3.651 3.651 3.753 -0.102 18112 2901 1 4 . 1 1 124 124 ILE C C 124 178.703 178.703 178.329 0.374 18112 2902 1 4 . 1 1 124 124 ILE CA C 124 65.945 65.945 65.203 0.742 18112 2903 1 4 . 1 1 124 124 ILE H H 124 8.204 8.204 8.154 0.050 18112 2904 1 4 . 1 1 125 125 THR N N 125 115.084 115.084 115.533 -0.449 18112 2905 1 4 . 1 1 125 125 THR C C 125 175.568 175.568 176.509 -0.941 18112 2906 1 4 . 1 1 125 125 THR CA C 125 67.872 67.872 66.910 0.962 18112 2907 1 4 . 1 1 125 125 THR H H 125 8.399 8.399 8.157 0.242 18112 2908 1 4 . 1 1 126 126 LEU N N 126 125.011 125.011 122.369 2.642 18112 2909 1 4 . 1 1 126 126 LEU HA H 126 4.085 4.085 4.384 -0.299 18112 2910 1 4 . 1 1 126 126 LEU C C 126 178.559 178.559 178.142 0.417 18112 2911 1 4 . 1 1 126 126 LEU CA C 126 58.843 58.843 58.330 0.513 18112 2912 1 4 . 1 1 126 126 LEU CB C 126 41.421 41.421 41.911 -0.490 18112 2913 1 4 . 1 1 126 126 LEU H H 126 8.728 8.728 8.155 0.573 18112 2914 1 4 . 1 1 127 127 ARG N N 127 117.076 117.076 119.376 -2.300 18112 2915 1 4 . 1 1 127 127 ARG HA H 127 3.929 3.929 4.036 -0.107 18112 2916 1 4 . 1 1 127 127 ARG C C 127 177.984 177.984 178.691 -0.707 18112 2917 1 4 . 1 1 127 127 ARG CA C 127 60.685 60.685 59.755 0.930 18112 2918 1 4 . 1 1 127 127 ARG CB C 127 28.079 28.079 30.038 -1.959 18112 2919 1 4 . 1 1 127 127 ARG H H 127 8.213 8.213 8.218 -0.005 18112 2920 1 4 . 1 1 128 128 GLU N N 128 118.617 118.617 119.554 -0.937 18112 2921 1 4 . 1 1 128 128 GLU HA H 128 4.147 4.147 4.196 -0.049 18112 2922 1 4 . 1 1 128 128 GLU C C 128 181.150 181.150 179.203 1.947 18112 2923 1 4 . 1 1 128 128 GLU CA C 128 59.508 59.508 58.725 0.783 18112 2924 1 4 . 1 1 128 128 GLU H H 128 8.478 8.478 8.093 0.385 18112 2925 1 4 . 1 1 129 129 PHE N N 129 119.267 119.267 121.101 -1.834 18112 2926 1 4 . 1 1 129 129 PHE HA H 129 4.104 4.104 4.297 -0.193 18112 2927 1 4 . 1 1 129 129 PHE C C 129 177.170 177.170 177.655 -0.485 18112 2928 1 4 . 1 1 129 129 PHE CA C 129 63.694 63.694 62.264 1.430 18112 2929 1 4 . 1 1 129 129 PHE H H 129 8.570 8.570 8.507 0.063 18112 2930 1 4 . 1 1 130 130 PHE N N 130 118.739 118.739 119.900 -1.161 18112 2931 1 4 . 1 1 130 130 PHE HA H 130 3.884 3.884 4.038 -0.154 18112 2932 1 4 . 1 1 130 130 PHE C C 130 175.860 175.860 177.217 -1.357 18112 2933 1 4 . 1 1 130 130 PHE CA C 130 62.819 62.819 61.986 0.833 18112 2934 1 4 . 1 1 130 130 PHE H H 130 8.740 8.740 8.892 -0.152 18112 2935 1 4 . 1 1 131 131 ASN N N 131 116.028 116.028 118.026 -1.998 18112 2936 1 4 . 1 1 131 131 ASN HA H 131 4.373 4.373 4.447 -0.074 18112 2937 1 4 . 1 1 131 131 ASN C C 131 178.228 178.228 177.701 0.527 18112 2938 1 4 . 1 1 131 131 ASN CA C 131 55.150 55.150 56.192 -1.042 18112 2939 1 4 . 1 1 131 131 ASN H H 131 8.864 8.864 8.418 0.446 18112 2940 1 4 . 1 1 132 132 ALA N N 132 120.922 120.922 122.940 -2.018 18112 2941 1 4 . 1 1 132 132 ALA HA H 132 4.020 4.020 4.063 -0.043 18112 2942 1 4 . 1 1 132 132 ALA C C 132 178.515 178.515 179.404 -0.889 18112 2943 1 4 . 1 1 132 132 ALA CA C 132 54.924 54.924 55.215 -0.291 18112 2944 1 4 . 1 1 132 132 ALA CB C 132 18.441 18.441 18.806 -0.365 18112 2945 1 4 . 1 1 132 132 ALA H H 132 7.745 7.745 7.749 -0.004 18112 2946 1 4 . 1 1 133 133 ILE N N 133 118.200 118.200 120.211 -2.011 18112 2947 1 4 . 1 1 133 133 ILE HA H 133 3.235 3.235 3.858 -0.623 18112 2948 1 4 . 1 1 133 133 ILE C C 133 180.606 180.606 178.153 2.453 18112 2949 1 4 . 1 1 133 133 ILE CA C 133 65.215 65.215 64.397 0.818 18112 2950 1 4 . 1 1 133 133 ILE CB C 133 38.291 38.291 37.664 0.627 18112 2951 1 4 . 1 1 133 133 ILE H H 133 7.999 7.999 8.047 -0.048 18112 2952 1 4 . 1 1 134 134 ILE N N 134 122.564 122.564 119.806 2.758 18112 2953 1 4 . 1 1 134 134 ILE HA H 134 3.788 3.788 3.600 0.188 18112 2954 1 4 . 1 1 134 134 ILE C C 134 177.215 177.215 177.084 0.131 18112 2955 1 4 . 1 1 134 134 ILE CA C 134 63.584 63.584 63.654 -0.070 18112 2956 1 4 . 1 1 134 134 ILE CB C 134 35.636 35.636 37.412 -1.776 18112 2957 1 4 . 1 1 134 134 ILE H H 134 8.670 8.670 7.867 0.803 18112 2958 1 4 . 1 1 135 135 ALA N N 135 119.989 119.989 120.938 -0.949 18112 2959 1 4 . 1 1 135 135 ALA HA H 135 4.357 4.357 4.190 0.167 18112 2960 1 4 . 1 1 135 135 ALA C C 135 177.786 177.786 177.945 -0.159 18112 2961 1 4 . 1 1 135 135 ALA CA C 135 51.521 51.521 52.875 -1.354 18112 2962 1 4 . 1 1 135 135 ALA CB C 135 18.839 18.839 19.708 -0.869 18112 2963 1 4 . 1 1 135 135 ALA H H 135 6.898 6.898 7.928 -1.030 18112 2964 1 4 . 1 1 136 136 GLY N N 136 107.682 107.682 105.186 2.496 18112 2965 1 4 . 1 1 136 136 GLY C C 136 176.324 176.324 175.367 0.957 18112 2966 1 4 . 1 1 136 136 GLY CA C 136 45.469 45.469 44.906 0.563 18112 2967 1 4 . 1 1 136 136 GLY H H 136 7.913 7.913 7.677 0.236 18112 2968 1 4 . 1 1 137 137 LYS N N 137 117.213 117.213 118.877 -1.664 18112 2969 1 4 . 1 1 137 137 LYS HA H 137 4.004 4.004 4.428 -0.424 18112 2970 1 4 . 1 1 137 137 LYS C C 137 176.616 176.616 176.730 -0.114 18112 2971 1 4 . 1 1 137 137 LYS CA C 137 57.499 57.499 56.040 1.459 18112 2972 1 4 . 1 1 137 137 LYS CB C 137 30.927 30.927 32.039 -1.112 18112 2973 1 4 . 1 1 137 137 LYS H H 137 8.312 8.312 8.212 0.100 18112 2974 1 4 . 1 1 138 138 ASP N N 138 113.545 113.545 118.433 -4.888 18112 2975 1 4 . 1 1 138 138 ASP HA H 138 3.061 3.061 2.740 0.321 18112 2976 1 4 . 1 1 138 138 ASP C C 138 174.698 174.698 176.427 -1.729 18112 2977 1 4 . 1 1 138 138 ASP CA C 138 53.694 53.694 55.300 -1.606 18112 2978 1 4 . 1 1 138 138 ASP CB C 138 36.008 36.008 39.221 -3.213 18112 2979 1 4 . 1 1 138 138 ASP H H 138 8.465 8.465 7.739 0.726 18112 2980 1 4 . 1 1 139 139 VAL N N 139 115.191 115.191 118.418 -3.227 18112 2981 1 4 . 1 1 139 139 VAL HA H 139 3.886 3.886 3.587 0.299 18112 2982 1 4 . 1 1 139 139 VAL C C 139 175.889 175.889 176.641 -0.752 18112 2983 1 4 . 1 1 139 139 VAL CA C 139 62.793 62.793 64.877 -2.084 18112 2984 1 4 . 1 1 139 139 VAL CB C 139 30.662 30.662 31.977 -1.315 18112 2985 1 4 . 1 1 139 139 VAL H H 139 6.610 6.610 7.533 -0.923 18112 2986 1 4 . 1 1 140 140 ASP N N 140 123.363 123.363 113.377 9.986 18112 2987 1 4 . 1 1 140 140 ASP C C 140 175.234 175.234 174.255 0.979 18112 2988 1 4 . 1 1 140 140 ASP CA C 140 50.221 50.221 55.784 -5.563 18112 2989 1 4 . 1 1 140 140 ASP CB C 140 42.254 42.254 39.732 2.522 18112 2990 1 4 . 1 1 140 140 ASP H H 140 7.553 7.553 7.752 -0.199 18112 2991 1 4 . 1 1 141 141 PRO HA H 141 4.682 4.682 4.596 0.086 18112 2992 1 4 . 1 1 141 141 PRO C C 141 178.678 178.678 177.577 1.101 18112 2993 1 4 . 1 1 141 141 PRO CA C 141 64.532 64.532 64.914 -0.382 18112 2994 1 4 . 1 1 141 141 PRO CB C 141 31.331 31.331 31.859 -0.528 18112 2995 1 4 . 1 1 142 142 SER N N 142 114.421 114.421 113.238 1.183 18112 2996 1 4 . 1 1 142 142 SER HA H 142 4.565 4.565 4.667 -0.102 18112 2997 1 4 . 1 1 142 142 SER C C 142 176.524 176.524 176.409 0.115 18112 2998 1 4 . 1 1 142 142 SER CA C 142 58.711 58.711 60.614 -1.903 18112 2999 1 4 . 1 1 142 142 SER CB C 142 62.783 62.783 63.995 -1.212 18112 3000 1 4 . 1 1 142 142 SER H H 142 8.703 8.703 8.107 0.596 18112 3001 1 4 . 1 1 143 143 TRP N N 143 123.598 123.598 122.963 0.635 18112 3002 1 4 . 1 1 143 143 TRP HA H 143 4.136 4.136 4.410 -0.274 18112 3003 1 4 . 1 1 143 143 TRP C C 143 177.113 177.113 177.052 0.061 18112 3004 1 4 . 1 1 143 143 TRP CA C 143 59.803 59.803 58.742 1.061 18112 3005 1 4 . 1 1 143 143 TRP CB C 143 26.364 26.364 28.028 -1.664 18112 3006 1 4 . 1 1 143 143 TRP H H 143 8.374 8.374 7.927 0.447 18112 3007 1 4 . 1 1 144 144 LYS N N 144 119.293 119.293 119.031 0.262 18112 3008 1 4 . 1 1 144 144 LYS HA H 144 2.719 2.719 3.006 -0.287 18112 3009 1 4 . 1 1 144 144 LYS C C 144 177.243 177.243 177.689 -0.446 18112 3010 1 4 . 1 1 144 144 LYS CA C 144 58.851 58.851 59.103 -0.252 18112 3011 1 4 . 1 1 144 144 LYS CB C 144 29.373 29.373 31.004 -1.631 18112 3012 1 4 . 1 1 144 144 LYS H H 144 7.196 7.196 6.882 0.314 18112 3013 1 4 . 1 1 145 145 LYS N N 145 116.440 116.440 119.620 -3.180 18112 3014 1 4 . 1 1 145 145 LYS HA H 145 3.490 3.490 4.112 -0.622 18112 3015 1 4 . 1 1 145 145 LYS C C 145 179.149 179.149 178.749 0.400 18112 3016 1 4 . 1 1 145 145 LYS CA C 145 59.271 59.271 59.037 0.234 18112 3017 1 4 . 1 1 145 145 LYS CB C 145 30.521 30.521 32.002 -1.481 18112 3018 1 4 . 1 1 145 145 LYS H H 145 7.389 7.389 7.812 -0.423 18112 3019 1 4 . 1 1 146 146 ALA N N 146 118.582 118.582 123.429 -4.847 18112 3020 1 4 . 1 1 146 146 ALA HA H 146 3.932 3.932 4.009 -0.077 18112 3021 1 4 . 1 1 146 146 ALA C C 146 179.968 179.968 179.609 0.359 18112 3022 1 4 . 1 1 146 146 ALA CA C 146 54.241 54.241 54.953 -0.711 18112 3023 1 4 . 1 1 146 146 ALA CB C 146 17.689 17.689 18.151 -0.462 18112 3024 1 4 . 1 1 146 146 ALA H H 146 7.112 7.112 7.722 -0.610 18112 3025 1 4 . 1 1 147 147 ILE N N 147 118.537 118.537 119.425 -0.888 18112 3026 1 4 . 1 1 147 147 ILE HA H 147 3.642 3.642 3.450 0.192 18112 3027 1 4 . 1 1 147 147 ILE C C 147 178.919 178.919 177.806 1.113 18112 3028 1 4 . 1 1 147 147 ILE CA C 147 64.418 64.418 64.963 -0.545 18112 3029 1 4 . 1 1 147 147 ILE CB C 147 36.519 36.519 37.102 -0.583 18112 3030 1 4 . 1 1 147 147 ILE H H 147 6.734 6.734 7.825 -1.091 18112 3031 1 4 . 1 1 148 148 TYR N N 148 121.033 121.033 118.042 2.991 18112 3032 1 4 . 1 1 148 148 TYR HA H 148 4.489 4.489 3.718 0.771 18112 3033 1 4 . 1 1 148 148 TYR C C 148 178.348 178.348 178.267 0.081 18112 3034 1 4 . 1 1 148 148 TYR CA C 148 57.389 57.389 59.349 -1.960 18112 3035 1 4 . 1 1 148 148 TYR CB C 148 35.280 35.280 36.472 -1.192 18112 3036 1 4 . 1 1 148 148 TYR H H 148 8.126 8.126 7.730 0.396 18112 3037 1 4 . 1 1 149 149 LYS N N 149 114.484 114.484 119.394 -4.910 18112 3038 1 4 . 1 1 149 149 LYS C C 149 178.051 178.051 179.107 -1.056 18112 3039 1 4 . 1 1 149 149 LYS CA C 149 59.036 59.036 59.133 -0.097 18112 3040 1 4 . 1 1 149 149 LYS CB C 149 31.575 31.575 32.797 -1.222 18112 3041 1 4 . 1 1 149 149 LYS H H 149 7.364 7.364 7.778 -0.414 18112 3042 1 4 . 1 1 150 150 VAL N N 150 117.812 117.812 116.785 1.027 18112 3043 1 4 . 1 1 150 150 VAL HA H 150 3.770 3.770 3.753 0.017 18112 3044 1 4 . 1 1 150 150 VAL C C 150 178.786 178.786 177.817 0.969 18112 3045 1 4 . 1 1 150 150 VAL CA C 150 65.070 65.070 65.818 -0.748 18112 3046 1 4 . 1 1 150 150 VAL CB C 150 29.515 29.515 31.672 -2.157 18112 3047 1 4 . 1 1 150 150 VAL H H 150 7.254 7.254 7.685 -0.431 18112 3048 1 4 . 1 1 151 151 ILE N N 151 117.884 117.884 116.051 1.833 18112 3049 1 4 . 1 1 151 151 ILE C C 151 180.539 180.539 177.175 3.364 18112 3050 1 4 . 1 1 151 151 ILE CA C 151 61.490 61.490 63.655 -2.165 18112 3051 1 4 . 1 1 151 151 ILE CB C 151 33.994 33.994 38.221 -4.228 18112 3052 1 4 . 1 1 151 151 ILE H H 151 8.154 8.154 8.063 0.091 18112 3053 1 4 . 1 1 152 152 CYS N N 152 118.649 118.649 117.335 1.314 18112 3054 1 4 . 1 1 152 152 CYS HA H 152 4.153 4.153 4.375 -0.222 18112 3055 1 4 . 1 1 152 152 CYS C C 152 174.888 174.888 176.600 -1.712 18112 3056 1 4 . 1 1 152 152 CYS CA C 152 61.052 61.052 59.878 1.174 18112 3057 1 4 . 1 1 152 152 CYS CB C 152 36.364 36.364 27.945 8.419 18112 3058 1 4 . 1 1 152 152 CYS H H 152 8.711 8.711 8.104 0.607 18112 3059 1 4 . 1 1 153 153 LYS N N 153 118.498 118.498 121.264 -2.766 18112 3060 1 4 . 1 1 153 153 LYS C C 153 177.389 177.389 177.920 -0.531 18112 3061 1 4 . 1 1 153 153 LYS CA C 153 56.243 56.243 58.937 -2.694 18112 3062 1 4 . 1 1 153 153 LYS CB C 153 31.343 31.343 32.310 -0.967 18112 3063 1 4 . 1 1 153 153 LYS H H 153 6.782 6.782 7.992 -1.210 18112 3064 1 4 . 1 1 154 154 LEU N N 154 117.318 117.318 116.865 0.453 18112 3065 1 4 . 1 1 154 154 LEU HA H 154 4.576 4.576 4.332 0.244 18112 3066 1 4 . 1 1 154 154 LEU C C 154 177.161 177.161 177.400 -0.239 18112 3067 1 4 . 1 1 154 154 LEU CA C 154 53.782 53.782 55.423 -1.641 18112 3068 1 4 . 1 1 154 154 LEU CB C 154 40.881 40.881 42.066 -1.185 18112 3069 1 4 . 1 1 154 154 LEU H H 154 7.616 7.616 7.287 0.329 18112 3070 1 4 . 1 1 155 155 ASP N N 155 121.564 121.564 119.902 1.662 18112 3071 1 4 . 1 1 155 155 ASP C C 155 177.094 177.094 175.295 1.799 18112 3072 1 4 . 1 1 155 155 ASP CA C 155 55.732 55.732 55.611 0.121 18112 3073 1 4 . 1 1 155 155 ASP CB C 155 40.139 40.139 41.452 -1.313 18112 3074 1 4 . 1 1 155 155 ASP H H 155 7.582 7.582 7.637 -0.055 18112 3075 1 4 . 1 1 156 156 SER N N 156 117.352 117.352 120.522 -3.170 18112 3076 1 4 . 1 1 156 156 SER HA H 156 4.818 4.818 4.724 0.094 18112 3077 1 4 . 1 1 156 156 SER C C 156 173.409 173.409 173.036 0.373 18112 3078 1 4 . 1 1 156 156 SER CA C 156 57.073 57.073 57.757 -0.684 18112 3079 1 4 . 1 1 156 156 SER CB C 156 65.150 65.150 67.377 -2.227 18112 3080 1 4 . 1 1 156 156 SER H H 156 8.846 8.846 8.366 0.480 18112 3081 1 4 . 1 1 157 157 GLU N N 157 120.688 120.688 121.050 -0.362 18112 3082 1 4 . 1 1 157 157 GLU HA H 157 4.038 4.038 4.690 -0.652 18112 3083 1 4 . 1 1 157 157 GLU C C 157 176.332 176.332 176.978 -0.646 18112 3084 1 4 . 1 1 157 157 GLU CA C 157 56.464 56.464 55.160 1.304 18112 3085 1 4 . 1 1 157 157 GLU CB C 157 29.206 29.206 30.301 -1.095 18112 3086 1 4 . 1 1 157 157 GLU H H 157 8.356 8.356 8.400 -0.044 18112 3087 1 4 . 1 1 158 158 VAL N N 158 126.906 126.906 116.741 10.165 18112 3088 1 4 . 1 1 158 158 VAL HA H 158 3.449 3.449 4.199 -0.750 18112 3089 1 4 . 1 1 158 158 VAL C C 158 176.382 176.382 175.149 1.233 18112 3090 1 4 . 1 1 158 158 VAL CA C 158 59.584 59.584 60.102 -0.518 18112 3091 1 4 . 1 1 158 158 VAL CB C 158 31.160 31.160 31.161 -0.001 18112 3092 1 4 . 1 1 158 158 VAL H H 158 8.561 8.561 7.468 1.093 18112 3093 1 4 . 1 1 159 159 PRO HA H 159 4.403 4.403 4.376 0.027 18112 3094 1 4 . 1 1 159 159 PRO C C 159 176.757 176.757 178.129 -1.372 18112 3095 1 4 . 1 1 159 159 PRO CA C 159 63.845 63.845 63.266 0.579 18112 3096 1 4 . 1 1 159 159 PRO CB C 159 32.106 32.106 32.136 -0.030 18112 3097 1 4 . 1 1 160 160 GLU N N 160 122.904 122.904 120.970 1.934 18112 3098 1 4 . 1 1 160 160 GLU HA H 160 4.008 4.008 3.547 0.461 18112 3099 1 4 . 1 1 160 160 GLU C C 160 179.132 179.132 176.260 2.872 18112 3100 1 4 . 1 1 160 160 GLU CA C 160 59.407 59.407 59.067 0.340 18112 3101 1 4 . 1 1 160 160 GLU CB C 160 28.991 28.991 29.701 -0.710 18112 3102 1 4 . 1 1 160 160 GLU H H 160 8.650 8.650 8.659 -0.009 18112 3103 1 4 . 1 1 161 161 ILE N N 161 119.782 119.782 114.614 5.168 18112 3104 1 4 . 1 1 161 161 ILE HA H 161 4.146 4.146 3.993 0.153 18112 3105 1 4 . 1 1 161 161 ILE C C 161 176.176 176.176 174.270 1.906 18112 3106 1 4 . 1 1 161 161 ILE CA C 161 62.034 62.034 60.392 1.642 18112 3107 1 4 . 1 1 161 161 ILE CB C 161 37.113 37.113 39.456 -2.343 18112 3108 1 4 . 1 1 161 161 ILE H H 161 8.448 8.448 7.371 1.077 18112 3109 1 4 . 1 1 162 162 PHE N N 162 117.594 117.594 123.210 -5.616 18112 3110 1 4 . 1 1 162 162 PHE C C 162 176.115 176.115 176.723 -0.608 18112 3111 1 4 . 1 1 162 162 PHE CA C 162 61.009 61.009 59.956 1.053 18112 3112 1 4 . 1 1 162 162 PHE CB C 162 38.394 38.394 39.013 -0.619 18112 3113 1 4 . 1 1 162 162 PHE H H 162 8.145 8.145 8.406 -0.261 18112 3114 1 4 . 1 1 163 163 LYS N N 163 116.083 116.083 119.176 -3.093 18112 3115 1 4 . 1 1 163 163 LYS C C 163 178.196 178.196 176.857 1.339 18112 3116 1 4 . 1 1 163 163 LYS CA C 163 58.136 58.136 58.083 0.053 18112 3117 1 4 . 1 1 163 163 LYS CB C 163 31.694 31.694 32.881 -1.187 18112 3118 1 4 . 1 1 163 163 LYS H H 163 8.232 8.232 7.942 0.290 18112 3119 1 4 . 1 1 164 164 SER N N 164 113.680 113.680 111.481 2.199 18112 3120 1 4 . 1 1 164 164 SER CA C 164 55.205 55.205 56.913 -1.708 18112 3121 1 4 . 1 1 164 164 SER CB C 164 63.265 63.265 64.396 -1.131 18112 3122 1 4 . 1 1 164 164 SER H H 164 7.708 7.708 7.480 0.228 18112 3123 1 4 . 1 1 165 165 PRO HA H 165 4.580 4.580 4.339 0.241 18112 3124 1 4 . 1 1 165 165 PRO C C 165 177.541 177.541 176.549 0.992 18112 3125 1 4 . 1 1 165 165 PRO CA C 165 63.950 63.950 64.361 -0.411 18112 3126 1 4 . 1 1 165 165 PRO CB C 165 30.686 30.686 31.837 -1.151 18112 3127 1 4 . 1 1 166 166 ASN N N 166 116.304 116.304 118.660 -2.356 18112 3128 1 4 . 1 1 166 166 ASN HA H 166 5.029 5.029 3.776 1.253 18112 3129 1 4 . 1 1 166 166 ASN C C 166 175.811 175.811 176.857 -1.046 18112 3130 1 4 . 1 1 166 166 ASN CA C 166 51.962 51.962 54.608 -2.646 18112 3131 1 4 . 1 1 166 166 ASN CB C 166 37.915 37.915 37.529 0.386 18112 3132 1 4 . 1 1 166 166 ASN H H 166 8.216 8.216 8.257 -0.041 18112 3133 1 4 . 1 1 167 167 CYS N N 167 116.078 116.078 119.508 -3.430 18112 3134 1 4 . 1 1 167 167 CYS HA H 167 4.011 4.011 4.156 -0.145 18112 3135 1 4 . 1 1 167 167 CYS C C 167 175.057 175.057 175.935 -0.878 18112 3136 1 4 . 1 1 167 167 CYS CA C 167 59.816 59.816 60.962 -1.146 18112 3137 1 4 . 1 1 167 167 CYS CB C 167 27.446 27.446 26.584 0.862 18112 3138 1 4 . 1 1 167 167 CYS H H 167 7.246 7.246 7.894 -0.648 18112 3139 1 4 . 1 1 168 168 LEU N N 168 120.082 120.082 119.982 0.100 18112 3140 1 4 . 1 1 168 168 LEU HA H 168 3.880 3.880 4.113 -0.233 18112 3141 1 4 . 1 1 168 168 LEU C C 168 178.541 178.541 178.503 0.038 18112 3142 1 4 . 1 1 168 168 LEU CA C 168 57.734 57.734 56.580 1.154 18112 3143 1 4 . 1 1 168 168 LEU CB C 168 38.825 38.825 40.047 -1.222 18112 3144 1 4 . 1 1 168 168 LEU H H 168 8.451 8.451 8.020 0.431 18112 3145 1 4 . 1 1 169 169 GLN N N 169 116.700 116.700 120.468 -3.768 18112 3146 1 4 . 1 1 169 169 GLN HA H 169 4.064 4.064 3.964 0.100 18112 3147 1 4 . 1 1 169 169 GLN C C 169 177.378 177.378 177.809 -0.431 18112 3148 1 4 . 1 1 169 169 GLN CA C 169 57.675 57.675 58.703 -1.028 18112 3149 1 4 . 1 1 169 169 GLN CB C 169 27.710 27.710 28.477 -0.767 18112 3150 1 4 . 1 1 169 169 GLN H H 169 7.665 7.665 7.716 -0.051 18112 3151 1 4 . 1 1 170 170 GLU N N 170 116.701 116.701 119.151 -2.450 18112 3152 1 4 . 1 1 170 170 GLU HA H 170 4.214 4.214 4.095 0.119 18112 3153 1 4 . 1 1 170 170 GLU C C 170 177.730 177.730 177.891 -0.161 18112 3154 1 4 . 1 1 170 170 GLU CA C 170 56.899 56.899 58.373 -1.474 18112 3155 1 4 . 1 1 170 170 GLU H H 170 7.405 7.405 7.678 -0.273 18112 3156 1 4 . 1 1 171 171 LEU N N 171 118.021 118.021 117.293 0.728 18112 3157 1 4 . 1 1 171 171 LEU HA H 171 4.209 4.209 4.156 0.053 18112 3158 1 4 . 1 1 171 171 LEU C C 171 177.005 177.005 177.500 -0.495 18112 3159 1 4 . 1 1 171 171 LEU CA C 171 55.870 55.870 55.883 -0.013 18112 3160 1 4 . 1 1 171 171 LEU CB C 171 43.680 43.680 42.017 1.663 18112 3161 1 4 . 1 1 171 171 LEU H H 171 7.823 7.823 7.476 0.347 18112 3162 1 4 . 1 1 172 172 LEU N N 172 117.580 117.580 117.901 -0.321 18112 3163 1 4 . 1 1 172 172 LEU HA H 172 4.571 4.571 4.356 0.215 18112 3164 1 4 . 1 1 172 172 LEU C C 172 176.411 176.411 176.278 0.133 18112 3165 1 4 . 1 1 172 172 LEU CA C 172 53.972 53.972 53.564 0.408 18112 3166 1 4 . 1 1 172 172 LEU CB C 172 40.483 40.483 38.868 1.615 18112 3167 1 4 . 1 1 172 172 LEU H H 172 7.306 7.306 7.452 -0.146 18112 3168 1 4 . 1 1 173 173 HIS N N 173 123.310 123.310 124.827 -1.517 18112 3169 1 4 . 1 1 173 173 HIS C C 173 179.022 179.022 174.345 4.677 18112 3170 1 4 . 1 1 173 173 HIS CA C 173 56.693 56.693 55.610 1.083 18112 3171 1 4 . 1 1 173 173 HIS CB C 173 29.371 29.371 29.341 0.030 18112 3172 1 4 . 1 1 173 173 HIS H H 173 8.028 8.028 8.672 -0.644 18112 3173 1 5 . 1 1 12 12 ALA N N 12 125.167 125.167 126.122 -0.955 18112 3174 1 5 . 1 1 12 12 ALA C C 12 177.566 177.566 177.227 0.339 18112 3175 1 5 . 1 1 12 12 ALA CA C 12 52.067 52.067 50.958 1.109 18112 3176 1 5 . 1 1 12 12 ALA CB C 12 18.456 18.456 20.819 -2.363 18112 3177 1 5 . 1 1 12 12 ALA H H 12 8.311 8.311 8.369 -0.058 18112 3178 1 5 . 1 1 13 13 MET N N 13 119.278 119.278 121.866 -2.588 18112 3179 1 5 . 1 1 13 13 MET C C 13 176.325 176.325 176.466 -0.141 18112 3180 1 5 . 1 1 13 13 MET CA C 13 54.992 54.992 55.191 -0.199 18112 3181 1 5 . 1 1 13 13 MET CB C 13 32.308 32.308 31.572 0.736 18112 3182 1 5 . 1 1 13 13 MET H H 13 8.269 8.269 8.634 -0.365 18112 3183 1 5 . 1 1 14 14 GLN N N 14 120.869 120.869 125.355 -4.486 18112 3184 1 5 . 1 1 14 14 GLN HA H 14 4.399 4.399 4.256 0.143 18112 3185 1 5 . 1 1 14 14 GLN C C 14 175.644 175.644 175.315 0.329 18112 3186 1 5 . 1 1 14 14 GLN CA C 14 55.139 55.139 56.276 -1.137 18112 3187 1 5 . 1 1 14 14 GLN CB C 14 29.051 29.051 28.664 0.387 18112 3188 1 5 . 1 1 14 14 GLN H H 14 8.501 8.501 8.617 -0.116 18112 3189 1 5 . 1 1 15 15 GLU N N 15 122.042 122.042 125.712 -3.670 18112 3190 1 5 . 1 1 15 15 GLU C C 15 176.242 176.242 174.926 1.316 18112 3191 1 5 . 1 1 15 15 GLU CA C 15 56.064 56.064 55.846 0.218 18112 3192 1 5 . 1 1 15 15 GLU CB C 15 29.302 29.302 30.180 -0.878 18112 3193 1 5 . 1 1 15 15 GLU H H 15 8.547 8.547 8.175 0.372 18112 3194 1 5 . 1 1 16 16 GLY N N 16 108.821 108.821 111.302 -2.481 18112 3195 1 5 . 1 1 16 16 GLY C C 16 172.949 172.949 174.759 -1.810 18112 3196 1 5 . 1 1 16 16 GLY CA C 16 44.227 44.227 45.242 -1.015 18112 3197 1 5 . 1 1 16 16 GLY H H 16 8.100 8.100 8.255 -0.155 18112 3198 1 5 . 1 1 17 17 LEU N N 17 120.315 120.315 122.015 -1.700 18112 3199 1 5 . 1 1 17 17 LEU C C 17 177.334 177.334 176.169 1.165 18112 3200 1 5 . 1 1 17 17 LEU CA C 17 53.544 53.544 55.839 -2.295 18112 3201 1 5 . 1 1 17 17 LEU CB C 17 42.140 42.140 42.428 -0.288 18112 3202 1 5 . 1 1 17 17 LEU H H 17 8.222 8.222 8.147 0.075 18112 3203 1 5 . 1 1 18 18 SER N N 18 126.547 126.547 109.896 16.651 18112 3204 1 5 . 1 1 18 18 SER CA C 18 56.851 56.851 58.669 -1.819 18112 3205 1 5 . 1 1 18 18 SER CB C 18 64.636 64.636 61.451 3.185 18112 3206 1 5 . 1 1 18 18 SER H H 18 11.627 11.627 7.576 4.051 18112 3207 1 5 . 1 1 19 19 PRO C C 19 175.118 175.118 178.275 -3.157 18112 3208 1 5 . 1 1 20 20 ASN N N 20 121.372 121.372 113.798 7.574 18112 3209 1 5 . 1 1 20 20 ASN H H 20 8.172 8.172 8.773 -0.601 18112 3210 1 5 . 1 1 25 25 ALA CB C 25 18.020 18.020 18.761 -0.741 18112 3211 1 5 . 1 1 26 26 LYS N N 26 118.490 118.490 118.798 -0.308 18112 3212 1 5 . 1 1 26 26 LYS CA C 26 56.146 56.146 59.128 -2.982 18112 3213 1 5 . 1 1 26 26 LYS H H 26 6.794 6.794 8.104 -1.310 18112 3214 1 5 . 1 1 31 31 TYR HA H 31 4.398 4.398 3.813 0.585 18112 3215 1 5 . 1 1 31 31 TYR C C 31 173.714 173.714 173.326 0.388 18112 3216 1 5 . 1 1 31 31 TYR CA C 31 59.757 59.757 56.669 3.088 18112 3217 1 5 . 1 1 32 32 THR N N 32 111.928 111.928 115.791 -3.863 18112 3218 1 5 . 1 1 32 32 THR HA H 32 4.209 4.209 4.490 -0.281 18112 3219 1 5 . 1 1 32 32 THR C C 32 171.061 171.061 174.904 -3.843 18112 3220 1 5 . 1 1 32 32 THR CA C 32 56.905 56.905 61.361 -4.456 18112 3221 1 5 . 1 1 32 32 THR CB C 32 69.707 69.707 70.710 -1.003 18112 3222 1 5 . 1 1 32 32 THR H H 32 8.237 8.237 7.492 0.745 18112 3223 1 5 . 1 1 33 33 ARG N N 33 124.856 124.856 122.053 2.803 18112 3224 1 5 . 1 1 33 33 ARG C C 33 176.451 176.451 176.818 -0.367 18112 3225 1 5 . 1 1 33 33 ARG CA C 33 55.627 55.627 58.712 -3.084 18112 3226 1 5 . 1 1 33 33 ARG CB C 33 29.861 29.861 30.553 -0.692 18112 3227 1 5 . 1 1 33 33 ARG H H 33 9.159 9.159 8.163 0.996 18112 3228 1 5 . 1 1 34 34 TYR N N 34 117.908 117.908 120.047 -2.139 18112 3229 1 5 . 1 1 34 34 TYR CA C 34 55.320 55.320 56.380 -1.060 18112 3230 1 5 . 1 1 34 34 TYR H H 34 8.995 8.995 7.824 1.171 18112 3231 1 5 . 1 1 35 35 PRO C C 35 177.280 177.280 177.854 -0.574 18112 3232 1 5 . 1 1 36 36 SER N N 36 116.410 116.410 116.718 -0.308 18112 3233 1 5 . 1 1 36 36 SER C C 36 178.938 178.938 176.694 2.244 18112 3234 1 5 . 1 1 36 36 SER CA C 36 64.815 64.815 62.557 2.258 18112 3235 1 5 . 1 1 36 36 SER H H 36 8.106 8.106 8.583 -0.477 18112 3236 1 5 . 1 1 37 37 SER N N 37 117.488 117.488 114.857 2.631 18112 3237 1 5 . 1 1 37 37 SER C C 37 177.698 177.698 176.433 1.265 18112 3238 1 5 . 1 1 37 37 SER CA C 37 61.357 61.357 61.248 0.109 18112 3239 1 5 . 1 1 37 37 SER CB C 37 68.118 68.118 62.789 5.329 18112 3240 1 5 . 1 1 37 37 SER H H 37 8.169 8.169 8.280 -0.111 18112 3241 1 5 . 1 1 38 38 ASN N N 38 115.638 115.638 120.387 -4.749 18112 3242 1 5 . 1 1 38 38 ASN HA H 38 4.259 4.259 4.424 -0.165 18112 3243 1 5 . 1 1 38 38 ASN C C 38 177.868 177.868 177.683 0.185 18112 3244 1 5 . 1 1 38 38 ASN CA C 38 55.907 55.907 56.569 -0.662 18112 3245 1 5 . 1 1 38 38 ASN CB C 38 37.230 37.230 38.227 -0.997 18112 3246 1 5 . 1 1 38 38 ASN H H 38 8.284 8.284 7.791 0.493 18112 3247 1 5 . 1 1 39 39 MET N N 39 121.352 121.352 120.105 1.247 18112 3248 1 5 . 1 1 39 39 MET HA H 39 4.170 4.170 3.637 0.533 18112 3249 1 5 . 1 1 39 39 MET C C 39 179.068 179.068 177.847 1.221 18112 3250 1 5 . 1 1 39 39 MET CA C 39 58.751 58.751 57.816 0.935 18112 3251 1 5 . 1 1 39 39 MET CB C 39 31.850 31.850 31.645 0.205 18112 3252 1 5 . 1 1 39 39 MET H H 39 7.857 7.857 8.256 -0.399 18112 3253 1 5 . 1 1 40 40 LEU N N 40 118.936 118.936 120.382 -1.446 18112 3254 1 5 . 1 1 40 40 LEU HA H 40 4.139 4.139 4.051 0.088 18112 3255 1 5 . 1 1 40 40 LEU C C 40 178.700 178.700 178.718 -0.018 18112 3256 1 5 . 1 1 40 40 LEU CA C 40 58.455 58.455 58.297 0.158 18112 3257 1 5 . 1 1 40 40 LEU CB C 40 40.304 40.304 41.746 -1.442 18112 3258 1 5 . 1 1 40 40 LEU H H 40 8.167 8.167 8.157 0.010 18112 3259 1 5 . 1 1 41 41 LYS N N 41 116.791 116.791 117.880 -1.089 18112 3260 1 5 . 1 1 41 41 LYS HA H 41 3.475 3.475 4.298 -0.823 18112 3261 1 5 . 1 1 41 41 LYS C C 41 178.793 178.793 178.812 -0.019 18112 3262 1 5 . 1 1 41 41 LYS CA C 41 59.161 59.161 59.592 -0.431 18112 3263 1 5 . 1 1 41 41 LYS CB C 41 30.992 30.992 32.581 -1.589 18112 3264 1 5 . 1 1 41 41 LYS H H 41 7.632 7.632 7.976 -0.344 18112 3265 1 5 . 1 1 42 42 THR N N 42 112.819 112.819 115.699 -2.880 18112 3266 1 5 . 1 1 42 42 THR HA H 42 4.230 4.230 4.218 0.012 18112 3267 1 5 . 1 1 42 42 THR C C 42 176.142 176.142 177.625 -1.483 18112 3268 1 5 . 1 1 42 42 THR CA C 42 65.107 65.107 67.067 -1.960 18112 3269 1 5 . 1 1 42 42 THR CB C 42 68.306 68.306 69.049 -0.743 18112 3270 1 5 . 1 1 42 42 THR H H 42 7.469 7.469 8.201 -0.732 18112 3271 1 5 . 1 1 43 43 TYR N N 43 118.565 118.565 119.558 -0.993 18112 3272 1 5 . 1 1 43 43 TYR HA H 43 4.204 4.204 4.309 -0.105 18112 3273 1 5 . 1 1 43 43 TYR C C 43 174.240 174.240 176.737 -2.497 18112 3274 1 5 . 1 1 43 43 TYR CA C 43 60.886 60.886 58.506 2.380 18112 3275 1 5 . 1 1 43 43 TYR CB C 43 38.165 38.165 38.261 -0.096 18112 3276 1 5 . 1 1 43 43 TYR H H 43 7.978 7.978 8.039 -0.061 18112 3277 1 5 . 1 1 44 44 PHE N N 44 120.980 120.980 116.342 4.638 18112 3278 1 5 . 1 1 44 44 PHE HA H 44 4.920 4.920 4.959 -0.039 18112 3279 1 5 . 1 1 44 44 PHE C C 44 176.436 176.436 176.207 0.229 18112 3280 1 5 . 1 1 44 44 PHE CA C 44 56.672 56.672 55.452 1.220 18112 3281 1 5 . 1 1 44 44 PHE CB C 44 36.570 36.570 37.625 -1.055 18112 3282 1 5 . 1 1 44 44 PHE H H 44 7.955 7.955 8.101 -0.146 18112 3283 1 5 . 1 1 45 45 SER N N 45 113.407 113.407 116.391 -2.984 18112 3284 1 5 . 1 1 45 45 SER HA H 45 4.373 4.373 4.506 -0.133 18112 3285 1 5 . 1 1 45 45 SER C C 45 174.424 174.424 175.397 -0.973 18112 3286 1 5 . 1 1 45 45 SER CA C 45 61.037 61.037 60.494 0.543 18112 3287 1 5 . 1 1 45 45 SER CB C 45 62.711 62.711 63.491 -0.780 18112 3288 1 5 . 1 1 45 45 SER H H 45 7.932 7.932 7.834 0.098 18112 3289 1 5 . 1 1 46 46 ASP N N 46 118.099 118.099 120.162 -2.063 18112 3290 1 5 . 1 1 46 46 ASP HA H 46 4.572 4.572 4.803 -0.231 18112 3291 1 5 . 1 1 46 46 ASP C C 46 174.866 174.866 175.515 -0.649 18112 3292 1 5 . 1 1 46 46 ASP CA C 46 53.602 53.602 54.229 -0.627 18112 3293 1 5 . 1 1 46 46 ASP CB C 46 38.992 38.992 41.205 -2.213 18112 3294 1 5 . 1 1 46 46 ASP H H 46 9.889 9.889 8.455 1.434 18112 3295 1 5 . 1 1 47 47 VAL N N 47 121.496 121.496 121.483 0.013 18112 3296 1 5 . 1 1 47 47 VAL HA H 47 4.058 4.058 3.976 0.082 18112 3297 1 5 . 1 1 47 47 VAL C C 47 174.676 174.676 175.235 -0.559 18112 3298 1 5 . 1 1 47 47 VAL CA C 47 61.006 61.006 61.123 -0.117 18112 3299 1 5 . 1 1 47 47 VAL CB C 47 32.110 32.110 32.431 -0.321 18112 3300 1 5 . 1 1 47 47 VAL H H 47 7.781 7.781 7.408 0.373 18112 3301 1 5 . 1 1 48 48 LYS N N 48 126.100 126.100 127.537 -1.437 18112 3302 1 5 . 1 1 48 48 LYS HA H 48 4.402 4.402 3.931 0.471 18112 3303 1 5 . 1 1 48 48 LYS C C 48 175.564 175.564 176.357 -0.793 18112 3304 1 5 . 1 1 48 48 LYS CA C 48 54.874 54.874 57.356 -2.482 18112 3305 1 5 . 1 1 48 48 LYS CB C 48 30.189 30.189 32.653 -2.464 18112 3306 1 5 . 1 1 48 48 LYS H H 48 8.245 8.245 8.370 -0.125 18112 3307 1 5 . 1 1 49 49 PHE N N 49 125.341 125.341 113.233 12.108 18112 3308 1 5 . 1 1 49 49 PHE HA H 49 3.813 3.813 4.171 -0.358 18112 3309 1 5 . 1 1 49 49 PHE C C 49 175.708 175.708 174.271 1.437 18112 3310 1 5 . 1 1 49 49 PHE CA C 49 60.861 60.861 57.645 3.216 18112 3311 1 5 . 1 1 49 49 PHE CB C 49 38.616 38.616 36.124 2.492 18112 3312 1 5 . 1 1 49 49 PHE H H 49 8.626 8.626 7.683 0.943 18112 3313 1 5 . 1 1 50 50 ASN N N 50 115.408 115.408 118.870 -3.462 18112 3314 1 5 . 1 1 50 50 ASN C C 50 176.072 176.072 176.365 -0.293 18112 3315 1 5 . 1 1 50 50 ASN CA C 50 51.730 51.730 52.442 -0.712 18112 3316 1 5 . 1 1 50 50 ASN H H 50 7.030 7.030 8.012 -0.982 18112 3317 1 5 . 1 1 51 51 ARG N N 51 122.706 122.706 124.401 -1.695 18112 3318 1 5 . 1 1 51 51 ARG CA C 51 59.534 59.534 59.210 0.324 18112 3319 1 5 . 1 1 51 51 ARG H H 51 7.790 7.790 8.902 -1.112 18112 3320 1 5 . 1 1 52 52 CYS N N 52 117.340 117.340 117.168 0.172 18112 3321 1 5 . 1 1 52 52 CYS HA H 52 4.108 4.108 4.162 -0.054 18112 3322 1 5 . 1 1 52 52 CYS C C 52 178.200 178.200 177.351 0.849 18112 3323 1 5 . 1 1 52 52 CYS CA C 52 61.143 61.143 61.562 -0.419 18112 3324 1 5 . 1 1 52 52 CYS H H 52 7.681 7.681 8.380 -0.699 18112 3325 1 5 . 1 1 53 53 ILE N N 53 122.321 122.321 117.135 5.186 18112 3326 1 5 . 1 1 53 53 ILE HA H 53 3.588 3.588 3.671 -0.083 18112 3327 1 5 . 1 1 53 53 ILE C C 53 177.492 177.492 177.469 0.023 18112 3328 1 5 . 1 1 53 53 ILE CA C 53 64.109 64.109 64.326 -0.217 18112 3329 1 5 . 1 1 53 53 ILE CB C 53 37.603 37.603 37.462 0.140 18112 3330 1 5 . 1 1 53 53 ILE H H 53 8.035 8.035 7.544 0.491 18112 3331 1 5 . 1 1 54 54 THR C C 54 175.903 175.903 176.558 -0.655 18112 3332 1 5 . 1 1 54 54 THR CA C 54 67.308 67.308 66.684 0.624 18112 3333 1 5 . 1 1 55 55 SER N N 55 113.819 113.819 117.036 -3.217 18112 3334 1 5 . 1 1 55 55 SER H H 55 7.844 7.844 8.033 -0.189 18112 3335 1 5 . 1 1 56 56 GLN C C 56 179.792 179.792 177.592 2.200 18112 3336 1 5 . 1 1 57 57 LEU N N 57 116.701 116.701 121.375 -4.674 18112 3337 1 5 . 1 1 57 57 LEU HA H 57 4.519 4.519 2.970 1.549 18112 3338 1 5 . 1 1 57 57 LEU C C 57 178.775 178.775 178.247 0.528 18112 3339 1 5 . 1 1 57 57 LEU CA C 57 55.232 55.232 57.346 -2.114 18112 3340 1 5 . 1 1 57 57 LEU CB C 57 37.131 37.131 41.441 -4.310 18112 3341 1 5 . 1 1 57 57 LEU H H 57 8.267 8.267 7.427 0.840 18112 3342 1 5 . 1 1 58 58 ILE N N 58 122.522 122.522 118.947 3.575 18112 3343 1 5 . 1 1 58 58 ILE HA H 58 4.640 4.640 3.321 1.319 18112 3344 1 5 . 1 1 58 58 ILE C C 58 177.380 177.380 178.026 -0.646 18112 3345 1 5 . 1 1 58 58 ILE CA C 58 62.163 62.163 65.054 -2.891 18112 3346 1 5 . 1 1 58 58 ILE CB C 58 30.657 30.657 37.425 -6.768 18112 3347 1 5 . 1 1 58 58 ILE H H 58 8.111 8.111 7.983 0.128 18112 3348 1 5 . 1 1 59 59 LYS N N 59 121.002 121.002 119.878 1.124 18112 3349 1 5 . 1 1 59 59 LYS C C 59 177.600 177.600 179.489 -1.889 18112 3350 1 5 . 1 1 59 59 LYS CA C 59 57.570 57.570 59.167 -1.597 18112 3351 1 5 . 1 1 59 59 LYS CB C 59 39.101 39.101 31.691 7.410 18112 3352 1 5 . 1 1 59 59 LYS H H 59 7.432 7.432 7.768 -0.336 18112 3353 1 5 . 1 1 60 60 TRP N N 60 118.679 118.679 120.396 -1.717 18112 3354 1 5 . 1 1 60 60 TRP HA H 60 3.739 3.739 4.580 -0.841 18112 3355 1 5 . 1 1 60 60 TRP C C 60 178.246 178.246 179.312 -1.066 18112 3356 1 5 . 1 1 60 60 TRP CA C 60 59.818 59.818 58.988 0.830 18112 3357 1 5 . 1 1 60 60 TRP CB C 60 31.851 31.851 28.596 3.255 18112 3358 1 5 . 1 1 60 60 TRP H H 60 7.565 7.565 8.012 -0.447 18112 3359 1 5 . 1 1 61 61 PHE N N 61 118.005 118.005 118.289 -0.284 18112 3360 1 5 . 1 1 61 61 PHE HA H 61 3.882 3.882 3.895 -0.013 18112 3361 1 5 . 1 1 61 61 PHE CA C 61 60.054 60.054 59.423 0.631 18112 3362 1 5 . 1 1 61 61 PHE H H 61 7.819 7.819 8.594 -0.775 18112 3363 1 5 . 1 1 62 62 SER N N 62 121.144 121.144 114.089 7.055 18112 3364 1 5 . 1 1 62 62 SER C C 62 177.840 177.840 177.058 0.782 18112 3365 1 5 . 1 1 62 62 SER CA C 62 55.892 55.892 61.634 -5.742 18112 3366 1 5 . 1 1 62 62 SER H H 62 8.878 8.878 8.528 0.350 18112 3367 1 5 . 1 1 63 63 ASN N N 63 115.303 115.303 120.943 -5.640 18112 3368 1 5 . 1 1 63 63 ASN C C 63 177.222 177.222 177.173 0.049 18112 3369 1 5 . 1 1 63 63 ASN CA C 63 60.467 60.467 56.589 3.878 18112 3370 1 5 . 1 1 63 63 ASN H H 63 8.001 8.001 8.112 -0.111 18112 3371 1 5 . 1 1 64 64 PHE N N 64 112.571 112.571 121.966 -9.395 18112 3372 1 5 . 1 1 64 64 PHE CA C 64 56.453 56.453 62.284 -5.831 18112 3373 1 5 . 1 1 64 64 PHE H H 64 7.082 7.082 8.630 -1.548 18112 3374 1 5 . 1 1 65 65 ARG N N 65 116.695 116.695 118.573 -1.878 18112 3375 1 5 . 1 1 65 65 ARG CA C 65 59.590 59.590 58.593 0.997 18112 3376 1 5 . 1 1 65 65 ARG H H 65 8.091 8.091 8.720 -0.629 18112 3377 1 5 . 1 1 66 66 GLU N N 66 121.653 121.653 121.655 -0.002 18112 3378 1 5 . 1 1 66 66 GLU HA H 66 4.739 4.739 4.264 0.474 18112 3379 1 5 . 1 1 66 66 GLU C C 66 174.621 174.621 178.430 -3.809 18112 3380 1 5 . 1 1 66 66 GLU CA C 66 59.583 59.583 59.546 0.037 18112 3381 1 5 . 1 1 66 66 GLU H H 66 7.597 7.597 8.198 -0.601 18112 3382 1 5 . 1 1 67 67 PHE N N 67 111.578 111.578 118.592 -7.014 18112 3383 1 5 . 1 1 67 67 PHE C C 67 176.164 176.164 178.144 -1.980 18112 3384 1 5 . 1 1 67 67 PHE CA C 67 61.156 61.156 61.359 -0.203 18112 3385 1 5 . 1 1 67 67 PHE H H 67 7.067 7.067 7.976 -0.909 18112 3386 1 5 . 1 1 68 68 TYR N N 68 119.370 119.370 120.794 -1.424 18112 3387 1 5 . 1 1 68 68 TYR C C 68 176.844 176.844 177.629 -0.785 18112 3388 1 5 . 1 1 68 68 TYR CA C 68 61.758 61.758 61.492 0.266 18112 3389 1 5 . 1 1 68 68 TYR H H 68 7.442 7.442 8.669 -1.227 18112 3390 1 5 . 1 1 69 69 TYR N N 69 116.047 116.047 119.509 -3.462 18112 3391 1 5 . 1 1 69 69 TYR HA H 69 4.086 4.086 3.992 0.094 18112 3392 1 5 . 1 1 69 69 TYR C C 69 180.328 180.328 177.526 2.802 18112 3393 1 5 . 1 1 69 69 TYR CA C 69 61.528 61.528 61.564 -0.036 18112 3394 1 5 . 1 1 69 69 TYR H H 69 9.127 9.127 8.134 0.993 18112 3395 1 5 . 1 1 70 70 ILE N N 70 124.738 124.738 118.958 5.780 18112 3396 1 5 . 1 1 70 70 ILE HA H 70 3.828 3.828 3.419 0.409 18112 3397 1 5 . 1 1 70 70 ILE C C 70 179.585 179.585 177.417 2.168 18112 3398 1 5 . 1 1 70 70 ILE CA C 70 65.787 65.787 63.280 2.507 18112 3399 1 5 . 1 1 70 70 ILE CB C 70 36.435 36.435 37.893 -1.458 18112 3400 1 5 . 1 1 70 70 ILE H H 70 8.631 8.631 8.302 0.329 18112 3401 1 5 . 1 1 71 71 GLN N N 71 117.940 117.940 119.626 -1.686 18112 3402 1 5 . 1 1 71 71 GLN HA H 71 3.826 3.826 3.664 0.162 18112 3403 1 5 . 1 1 71 71 GLN C C 71 178.192 178.192 177.716 0.476 18112 3404 1 5 . 1 1 71 71 GLN CA C 71 57.779 57.779 58.807 -1.028 18112 3405 1 5 . 1 1 71 71 GLN H H 71 7.738 7.738 8.037 -0.299 18112 3406 1 5 . 1 1 72 72 MET N N 72 117.353 117.353 118.480 -1.127 18112 3407 1 5 . 1 1 72 72 MET HA H 72 4.112 4.112 3.895 0.217 18112 3408 1 5 . 1 1 72 72 MET C C 72 177.203 177.203 177.725 -0.522 18112 3409 1 5 . 1 1 72 72 MET CA C 72 57.272 57.272 57.435 -0.163 18112 3410 1 5 . 1 1 72 72 MET H H 72 7.844 7.844 7.762 0.082 18112 3411 1 5 . 1 1 73 73 GLU N N 73 117.858 117.858 119.857 -1.999 18112 3412 1 5 . 1 1 73 73 GLU HA H 73 3.572 3.572 3.379 0.193 18112 3413 1 5 . 1 1 73 73 GLU C C 73 177.344 177.344 178.190 -0.846 18112 3414 1 5 . 1 1 73 73 GLU CA C 73 60.324 60.324 59.954 0.370 18112 3415 1 5 . 1 1 73 73 GLU H H 73 7.503 7.503 7.733 -0.230 18112 3416 1 5 . 1 1 74 74 LYS N N 74 118.716 118.716 118.902 -0.186 18112 3417 1 5 . 1 1 74 74 LYS HA H 74 3.867 3.867 3.974 -0.107 18112 3418 1 5 . 1 1 74 74 LYS C C 74 180.077 180.077 179.625 0.452 18112 3419 1 5 . 1 1 74 74 LYS CA C 74 59.754 59.754 58.465 1.289 18112 3420 1 5 . 1 1 74 74 LYS H H 74 7.912 7.912 7.400 0.512 18112 3421 1 5 . 1 1 75 75 TYR N N 75 117.309 117.309 119.028 -1.719 18112 3422 1 5 . 1 1 75 75 TYR HA H 75 4.085 4.085 4.237 -0.152 18112 3423 1 5 . 1 1 75 75 TYR C C 75 178.874 178.874 178.163 0.711 18112 3424 1 5 . 1 1 75 75 TYR CA C 75 63.306 63.306 59.025 4.281 18112 3425 1 5 . 1 1 75 75 TYR H H 75 8.421 8.421 7.914 0.507 18112 3426 1 5 . 1 1 76 76 ALA N N 76 125.392 125.392 121.280 4.112 18112 3427 1 5 . 1 1 76 76 ALA HA H 76 4.221 4.221 4.137 0.084 18112 3428 1 5 . 1 1 76 76 ALA C C 76 178.850 178.850 179.542 -0.692 18112 3429 1 5 . 1 1 76 76 ALA CA C 76 56.280 56.280 55.023 1.258 18112 3430 1 5 . 1 1 76 76 ALA CB C 76 18.687 18.687 18.299 0.388 18112 3431 1 5 . 1 1 76 76 ALA H H 76 8.553 8.553 8.169 0.384 18112 3432 1 5 . 1 1 77 77 ARG N N 77 115.067 115.067 119.210 -4.143 18112 3433 1 5 . 1 1 77 77 ARG HA H 77 3.935 3.935 3.854 0.081 18112 3434 1 5 . 1 1 77 77 ARG C C 77 179.341 179.341 178.100 1.241 18112 3435 1 5 . 1 1 77 77 ARG CA C 77 60.499 60.499 59.843 0.656 18112 3436 1 5 . 1 1 77 77 ARG H H 77 8.471 8.471 8.571 -0.100 18112 3437 1 5 . 1 1 78 78 GLN N N 78 120.107 120.107 119.081 1.026 18112 3438 1 5 . 1 1 78 78 GLN HA H 78 3.921 3.921 4.074 -0.153 18112 3439 1 5 . 1 1 78 78 GLN C C 78 177.289 177.289 178.117 -0.828 18112 3440 1 5 . 1 1 78 78 GLN CA C 78 58.619 58.619 58.739 -0.120 18112 3441 1 5 . 1 1 78 78 GLN CB C 78 27.752 27.752 28.647 -0.895 18112 3442 1 5 . 1 1 78 78 GLN H H 78 8.142 8.142 7.971 0.171 18112 3443 1 5 . 1 1 79 79 ALA N N 79 120.809 120.809 123.339 -2.530 18112 3444 1 5 . 1 1 79 79 ALA HA H 79 4.308 4.308 4.016 0.292 18112 3445 1 5 . 1 1 79 79 ALA C C 79 179.924 179.924 179.550 0.374 18112 3446 1 5 . 1 1 79 79 ALA CA C 79 54.970 54.970 55.362 -0.392 18112 3447 1 5 . 1 1 79 79 ALA CB C 79 17.064 17.064 18.562 -1.498 18112 3448 1 5 . 1 1 79 79 ALA H H 79 7.811 7.811 7.999 -0.188 18112 3449 1 5 . 1 1 80 80 ILE N N 80 118.524 118.524 118.217 0.307 18112 3450 1 5 . 1 1 80 80 ILE HA H 80 3.894 3.894 3.583 0.311 18112 3451 1 5 . 1 1 80 80 ILE C C 80 181.268 181.268 178.284 2.984 18112 3452 1 5 . 1 1 80 80 ILE CA C 80 64.841 64.841 64.421 0.420 18112 3453 1 5 . 1 1 80 80 ILE CB C 80 37.125 37.125 37.748 -0.623 18112 3454 1 5 . 1 1 80 80 ILE H H 80 7.837 7.837 7.916 -0.079 18112 3455 1 5 . 1 1 81 81 ASN N N 81 121.233 121.233 117.343 3.890 18112 3456 1 5 . 1 1 81 81 ASN HA H 81 4.398 4.398 4.381 0.017 18112 3457 1 5 . 1 1 81 81 ASN C C 81 176.546 176.546 176.914 -0.368 18112 3458 1 5 . 1 1 81 81 ASN CA C 81 55.892 55.892 55.778 0.114 18112 3459 1 5 . 1 1 81 81 ASN CB C 81 37.603 37.603 38.669 -1.066 18112 3460 1 5 . 1 1 81 81 ASN H H 81 8.262 8.262 7.980 0.282 18112 3461 1 5 . 1 1 82 82 ASP N N 82 119.240 119.240 117.012 2.228 18112 3462 1 5 . 1 1 82 82 ASP HA H 82 4.666 4.666 4.691 -0.025 18112 3463 1 5 . 1 1 82 82 ASP C C 82 176.767 176.767 177.101 -0.334 18112 3464 1 5 . 1 1 82 82 ASP CA C 82 54.771 54.771 54.248 0.523 18112 3465 1 5 . 1 1 82 82 ASP CB C 82 40.121 40.121 41.810 -1.689 18112 3466 1 5 . 1 1 82 82 ASP H H 82 8.316 8.316 8.081 0.235 18112 3467 1 5 . 1 1 83 83 GLY N N 83 106.913 106.913 107.311 -0.398 18112 3468 1 5 . 1 1 83 83 GLY C C 83 174.601 174.601 174.705 -0.104 18112 3469 1 5 . 1 1 83 83 GLY CA C 83 45.214 45.214 44.968 0.246 18112 3470 1 5 . 1 1 83 83 GLY H H 83 7.810 7.810 7.883 -0.073 18112 3471 1 5 . 1 1 84 84 VAL N N 84 122.981 122.981 121.170 1.811 18112 3472 1 5 . 1 1 84 84 VAL HA H 84 3.850 3.850 3.950 -0.100 18112 3473 1 5 . 1 1 84 84 VAL C C 84 177.265 177.265 176.208 1.057 18112 3474 1 5 . 1 1 84 84 VAL CA C 84 64.270 64.270 63.698 0.572 18112 3475 1 5 . 1 1 84 84 VAL CB C 84 30.471 30.471 31.939 -1.468 18112 3476 1 5 . 1 1 84 84 VAL H H 84 8.157 8.157 7.809 0.348 18112 3477 1 5 . 1 1 85 85 THR N N 85 115.232 115.232 119.808 -4.576 18112 3478 1 5 . 1 1 85 85 THR HA H 85 4.716 4.716 4.704 0.012 18112 3479 1 5 . 1 1 85 85 THR C C 85 174.489 174.489 175.078 -0.589 18112 3480 1 5 . 1 1 85 85 THR CA C 85 61.618 61.618 62.513 -0.895 18112 3481 1 5 . 1 1 85 85 THR CB C 85 70.081 70.081 69.894 0.187 18112 3482 1 5 . 1 1 85 85 THR H H 85 8.890 8.890 8.528 0.362 18112 3483 1 5 . 1 1 86 86 SER N N 86 117.009 117.009 117.039 -0.030 18112 3484 1 5 . 1 1 86 86 SER HA H 86 5.046 5.046 4.536 0.510 18112 3485 1 5 . 1 1 86 86 SER C C 86 174.473 174.473 175.051 -0.578 18112 3486 1 5 . 1 1 86 86 SER CA C 86 55.922 55.922 56.586 -0.664 18112 3487 1 5 . 1 1 86 86 SER CB C 86 64.385 64.385 65.938 -1.553 18112 3488 1 5 . 1 1 86 86 SER H H 86 7.704 7.704 7.922 -0.218 18112 3489 1 5 . 1 1 87 87 THR N N 87 118.634 118.634 115.133 3.501 18112 3490 1 5 . 1 1 87 87 THR HA H 87 4.065 4.065 4.005 0.060 18112 3491 1 5 . 1 1 87 87 THR C C 87 176.047 176.047 175.138 0.909 18112 3492 1 5 . 1 1 87 87 THR CA C 87 64.983 64.983 65.055 -0.072 18112 3493 1 5 . 1 1 87 87 THR CB C 87 68.045 68.045 68.573 -0.528 18112 3494 1 5 . 1 1 87 87 THR H H 87 8.711 8.711 8.532 0.179 18112 3495 1 5 . 1 1 88 88 GLU N N 88 117.889 117.889 119.908 -2.019 18112 3496 1 5 . 1 1 88 88 GLU HA H 88 3.881 3.881 4.285 -0.404 18112 3497 1 5 . 1 1 88 88 GLU C C 88 177.146 177.146 177.123 0.023 18112 3498 1 5 . 1 1 88 88 GLU CA C 88 57.814 57.814 57.951 -0.137 18112 3499 1 5 . 1 1 88 88 GLU CB C 88 28.050 28.050 28.099 -0.049 18112 3500 1 5 . 1 1 88 88 GLU H H 88 8.152 8.152 8.857 -0.705 18112 3501 1 5 . 1 1 89 89 GLU N N 89 115.617 115.617 118.850 -3.233 18112 3502 1 5 . 1 1 89 89 GLU HA H 89 4.149 4.149 4.319 -0.170 18112 3503 1 5 . 1 1 89 89 GLU C C 89 176.192 176.192 177.300 -1.108 18112 3504 1 5 . 1 1 89 89 GLU CA C 89 56.133 56.133 57.596 -1.463 18112 3505 1 5 . 1 1 89 89 GLU CB C 89 29.415 29.415 30.562 -1.147 18112 3506 1 5 . 1 1 89 89 GLU H H 89 7.311 7.311 7.888 -0.577 18112 3507 1 5 . 1 1 90 90 LEU N N 90 120.870 120.870 115.025 5.845 18112 3508 1 5 . 1 1 90 90 LEU HA H 90 4.439 4.439 4.619 -0.180 18112 3509 1 5 . 1 1 90 90 LEU C C 90 175.267 175.267 176.802 -1.535 18112 3510 1 5 . 1 1 90 90 LEU CA C 90 53.504 53.504 55.050 -1.546 18112 3511 1 5 . 1 1 90 90 LEU CB C 90 40.479 40.479 43.651 -3.172 18112 3512 1 5 . 1 1 90 90 LEU H H 90 7.311 7.311 7.424 -0.113 18112 3513 1 5 . 1 1 91 91 SER N N 91 118.376 118.376 114.689 3.687 18112 3514 1 5 . 1 1 91 91 SER HA H 91 4.747 4.747 4.514 0.233 18112 3515 1 5 . 1 1 91 91 SER C C 91 173.332 173.332 172.337 0.995 18112 3516 1 5 . 1 1 91 91 SER CA C 91 56.314 56.314 58.869 -2.555 18112 3517 1 5 . 1 1 91 91 SER CB C 91 64.615 64.615 65.652 -1.037 18112 3518 1 5 . 1 1 91 91 SER H H 91 8.221 8.221 8.070 0.151 18112 3519 1 5 . 1 1 92 92 ILE N N 92 122.247 122.247 122.119 0.128 18112 3520 1 5 . 1 1 92 92 ILE HA H 92 4.537 4.537 4.304 0.233 18112 3521 1 5 . 1 1 92 92 ILE C C 92 174.059 174.059 174.321 -0.262 18112 3522 1 5 . 1 1 92 92 ILE CA C 92 59.881 59.881 59.809 0.072 18112 3523 1 5 . 1 1 92 92 ILE CB C 92 37.820 37.820 42.385 -4.565 18112 3524 1 5 . 1 1 92 92 ILE H H 92 8.570 8.570 8.343 0.227 18112 3525 1 5 . 1 1 93 93 THR N N 93 116.069 116.069 120.183 -4.114 18112 3526 1 5 . 1 1 93 93 THR HA H 93 4.580 4.580 4.349 0.231 18112 3527 1 5 . 1 1 93 93 THR C C 93 175.049 175.049 174.491 0.558 18112 3528 1 5 . 1 1 93 93 THR CA C 93 58.988 58.988 64.543 -5.555 18112 3529 1 5 . 1 1 93 93 THR CB C 93 71.362 71.362 68.151 3.211 18112 3530 1 5 . 1 1 93 93 THR H H 93 7.224 7.224 8.591 -1.367 18112 3531 1 5 . 1 1 94 94 ARG N N 94 116.595 116.595 128.142 -11.547 18112 3532 1 5 . 1 1 94 94 ARG HA H 94 3.077 3.077 4.507 -1.430 18112 3533 1 5 . 1 1 94 94 ARG C C 94 175.076 175.076 175.371 -0.295 18112 3534 1 5 . 1 1 94 94 ARG CA C 94 57.119 57.119 54.452 2.667 18112 3535 1 5 . 1 1 94 94 ARG CB C 94 27.838 27.838 30.698 -2.860 18112 3536 1 5 . 1 1 94 94 ARG H H 94 8.596 8.596 8.496 0.100 18112 3537 1 5 . 1 1 95 95 ASP N N 95 113.735 113.735 118.793 -5.058 18112 3538 1 5 . 1 1 95 95 ASP HA H 95 4.765 4.765 3.925 0.840 18112 3539 1 5 . 1 1 95 95 ASP C C 95 175.876 175.876 175.568 0.308 18112 3540 1 5 . 1 1 95 95 ASP CA C 95 53.156 53.156 56.944 -3.788 18112 3541 1 5 . 1 1 95 95 ASP CB C 95 41.166 41.166 39.133 2.033 18112 3542 1 5 . 1 1 95 95 ASP H H 95 7.607 7.607 8.453 -0.846 18112 3543 1 5 . 1 1 96 96 CYS N N 96 116.012 116.012 118.936 -2.924 18112 3544 1 5 . 1 1 96 96 CYS C C 96 174.361 174.361 176.424 -2.063 18112 3545 1 5 . 1 1 96 96 CYS CA C 96 56.562 56.562 60.052 -3.490 18112 3546 1 5 . 1 1 96 96 CYS CB C 96 29.416 29.416 30.747 -1.331 18112 3547 1 5 . 1 1 96 96 CYS H H 96 7.094 7.094 8.005 -0.911 18112 3548 1 5 . 1 1 97 97 GLU N N 97 123.087 123.087 121.817 1.270 18112 3549 1 5 . 1 1 97 97 GLU C C 97 178.748 178.748 178.500 0.248 18112 3550 1 5 . 1 1 97 97 GLU CA C 97 59.912 59.912 59.914 -0.002 18112 3551 1 5 . 1 1 97 97 GLU CB C 97 29.195 29.195 29.485 -0.290 18112 3552 1 5 . 1 1 97 97 GLU H H 97 9.003 9.003 7.860 1.143 18112 3553 1 5 . 1 1 98 98 LEU N N 98 120.942 120.942 118.930 2.012 18112 3554 1 5 . 1 1 98 98 LEU HA H 98 3.614 3.614 4.120 -0.506 18112 3555 1 5 . 1 1 98 98 LEU C C 98 177.796 177.796 178.325 -0.529 18112 3556 1 5 . 1 1 98 98 LEU CA C 98 58.090 58.090 57.532 0.558 18112 3557 1 5 . 1 1 98 98 LEU CB C 98 39.778 39.778 41.945 -2.167 18112 3558 1 5 . 1 1 98 98 LEU H H 98 8.656 8.656 8.096 0.560 18112 3559 1 5 . 1 1 99 99 TYR N N 99 118.313 118.313 117.959 0.354 18112 3560 1 5 . 1 1 99 99 TYR C C 99 177.077 177.077 177.909 -0.832 18112 3561 1 5 . 1 1 99 99 TYR CA C 99 62.622 62.622 61.273 1.349 18112 3562 1 5 . 1 1 99 99 TYR CB C 99 38.742 38.742 37.675 1.067 18112 3563 1 5 . 1 1 99 99 TYR H H 99 7.522 7.522 8.007 -0.485 18112 3564 1 5 . 1 1 100 100 ARG N N 100 118.101 118.101 119.843 -1.742 18112 3565 1 5 . 1 1 100 100 ARG C C 100 178.616 178.616 178.374 0.242 18112 3566 1 5 . 1 1 100 100 ARG CA C 100 59.915 59.915 59.311 0.604 18112 3567 1 5 . 1 1 100 100 ARG CB C 100 29.100 29.100 30.157 -1.057 18112 3568 1 5 . 1 1 100 100 ARG H H 100 8.243 8.243 8.333 -0.090 18112 3569 1 5 . 1 1 101 101 ALA N N 101 120.972 120.972 122.454 -1.482 18112 3570 1 5 . 1 1 101 101 ALA HA H 101 4.145 4.145 3.791 0.354 18112 3571 1 5 . 1 1 101 101 ALA C C 101 181.359 181.359 179.303 2.056 18112 3572 1 5 . 1 1 101 101 ALA CA C 101 55.057 55.057 54.640 0.417 18112 3573 1 5 . 1 1 101 101 ALA CB C 101 17.543 17.543 18.211 -0.668 18112 3574 1 5 . 1 1 101 101 ALA H H 101 8.352 8.352 7.748 0.604 18112 3575 1 5 . 1 1 102 102 LEU N N 102 115.683 115.683 119.133 -3.450 18112 3576 1 5 . 1 1 102 102 LEU HA H 102 4.333 4.333 3.621 0.712 18112 3577 1 5 . 1 1 102 102 LEU C C 102 178.583 178.583 179.482 -0.899 18112 3578 1 5 . 1 1 102 102 LEU CA C 102 57.634 57.634 58.133 -0.499 18112 3579 1 5 . 1 1 102 102 LEU CB C 102 41.716 41.716 41.503 0.213 18112 3580 1 5 . 1 1 102 102 LEU H H 102 7.960 7.960 8.143 -0.183 18112 3581 1 5 . 1 1 103 103 ASN N N 103 118.957 118.957 116.888 2.069 18112 3582 1 5 . 1 1 103 103 ASN C C 103 177.470 177.470 177.861 -0.391 18112 3583 1 5 . 1 1 103 103 ASN CA C 103 56.974 56.974 56.233 0.741 18112 3584 1 5 . 1 1 103 103 ASN CB C 103 38.140 38.140 38.251 -0.111 18112 3585 1 5 . 1 1 103 103 ASN H H 103 9.301 9.301 8.085 1.216 18112 3586 1 5 . 1 1 104 104 MET N N 104 113.763 113.763 119.712 -5.949 18112 3587 1 5 . 1 1 104 104 MET CA C 104 57.362 57.362 58.715 -1.353 18112 3588 1 5 . 1 1 104 104 MET CB C 104 31.895 31.895 32.869 -0.974 18112 3589 1 5 . 1 1 104 104 MET H H 104 8.332 8.332 7.868 0.464 18112 3590 1 5 . 1 1 105 105 HIS N N 105 116.024 116.024 115.944 0.080 18112 3591 1 5 . 1 1 105 105 HIS HA H 105 3.764 3.764 4.130 -0.366 18112 3592 1 5 . 1 1 105 105 HIS C C 105 176.939 176.939 176.628 0.311 18112 3593 1 5 . 1 1 105 105 HIS CA C 105 59.069 59.069 57.538 1.531 18112 3594 1 5 . 1 1 105 105 HIS H H 105 7.156 7.156 7.835 -0.679 18112 3595 1 5 . 1 1 106 106 TYR N N 106 113.161 113.161 117.840 -4.679 18112 3596 1 5 . 1 1 106 106 TYR C C 106 173.767 173.767 175.226 -1.459 18112 3597 1 5 . 1 1 106 106 TYR CA C 106 58.488 58.488 60.934 -2.446 18112 3598 1 5 . 1 1 106 106 TYR CB C 106 38.225 38.225 39.853 -1.628 18112 3599 1 5 . 1 1 106 106 TYR H H 106 7.204 7.204 8.065 -0.861 18112 3600 1 5 . 1 1 107 107 ASN N N 107 118.875 118.875 112.779 6.096 18112 3601 1 5 . 1 1 107 107 ASN HA H 107 3.922 3.922 4.751 -0.829 18112 3602 1 5 . 1 1 107 107 ASN C C 107 175.815 175.815 173.391 2.424 18112 3603 1 5 . 1 1 107 107 ASN CA C 107 51.233 51.233 53.278 -2.045 18112 3604 1 5 . 1 1 107 107 ASN CB C 107 38.142 38.142 39.550 -1.408 18112 3605 1 5 . 1 1 107 107 ASN H H 107 8.127 8.127 8.203 -0.076 18112 3606 1 5 . 1 1 108 108 LYS N N 108 122.850 122.850 118.374 4.476 18112 3607 1 5 . 1 1 108 108 LYS HA H 108 3.954 3.954 4.443 -0.489 18112 3608 1 5 . 1 1 108 108 LYS C C 108 177.586 177.586 176.906 0.680 18112 3609 1 5 . 1 1 108 108 LYS CA C 108 59.749 59.749 56.630 3.119 18112 3610 1 5 . 1 1 108 108 LYS CB C 108 31.498 31.498 32.553 -1.055 18112 3611 1 5 . 1 1 108 108 LYS H H 108 7.772 7.772 8.551 -0.779 18112 3612 1 5 . 1 1 109 109 ALA N N 109 118.054 118.054 122.372 -4.318 18112 3613 1 5 . 1 1 109 109 ALA HA H 109 4.137 4.137 4.068 0.069 18112 3614 1 5 . 1 1 109 109 ALA C C 109 177.889 177.889 178.211 -0.322 18112 3615 1 5 . 1 1 109 109 ALA CA C 109 52.299 52.299 54.636 -2.337 18112 3616 1 5 . 1 1 109 109 ALA CB C 109 17.787 17.787 19.019 -1.232 18112 3617 1 5 . 1 1 109 109 ALA H H 109 8.307 8.307 8.324 -0.017 18112 3618 1 5 . 1 1 110 110 ASN N N 110 115.542 115.542 115.054 0.488 18112 3619 1 5 . 1 1 110 110 ASN HA H 110 4.480 4.480 4.866 -0.386 18112 3620 1 5 . 1 1 110 110 ASN C C 110 174.277 174.277 174.041 0.236 18112 3621 1 5 . 1 1 110 110 ASN CA C 110 53.504 53.504 52.771 0.733 18112 3622 1 5 . 1 1 110 110 ASN CB C 110 37.283 37.283 37.209 0.074 18112 3623 1 5 . 1 1 110 110 ASN H H 110 8.353 8.353 8.434 -0.081 18112 3624 1 5 . 1 1 111 111 ASP N N 111 114.692 114.692 120.237 -5.545 18112 3625 1 5 . 1 1 111 111 ASP HA H 111 4.485 4.485 4.484 0.001 18112 3626 1 5 . 1 1 111 111 ASP C C 111 174.868 174.868 176.053 -1.185 18112 3627 1 5 . 1 1 111 111 ASP CA C 111 53.227 53.227 54.840 -1.613 18112 3628 1 5 . 1 1 111 111 ASP CB C 111 39.228 39.228 41.146 -1.918 18112 3629 1 5 . 1 1 111 111 ASP H H 111 8.297 8.297 7.642 0.655 18112 3630 1 5 . 1 1 112 112 PHE N N 112 120.927 120.927 119.027 1.900 18112 3631 1 5 . 1 1 112 112 PHE HA H 112 4.752 4.752 4.479 0.273 18112 3632 1 5 . 1 1 112 112 PHE C C 112 174.633 174.633 176.751 -2.118 18112 3633 1 5 . 1 1 112 112 PHE CA C 112 56.346 56.346 58.404 -2.058 18112 3634 1 5 . 1 1 112 112 PHE H H 112 7.784 7.784 7.566 0.218 18112 3635 1 5 . 1 1 113 113 GLU N N 113 128.111 128.111 121.991 6.120 18112 3636 1 5 . 1 1 113 113 GLU HA H 113 4.011 4.011 4.349 -0.338 18112 3637 1 5 . 1 1 113 113 GLU C C 113 173.502 173.502 175.408 -1.906 18112 3638 1 5 . 1 1 113 113 GLU CA C 113 55.100 55.100 56.405 -1.305 18112 3639 1 5 . 1 1 113 113 GLU H H 113 7.752 7.752 8.821 -1.069 18112 3640 1 5 . 1 1 114 114 VAL N N 114 129.326 129.326 111.777 17.549 18112 3641 1 5 . 1 1 114 114 VAL HA H 114 3.241 3.241 3.700 -0.459 18112 3642 1 5 . 1 1 114 114 VAL CA C 114 60.838 60.838 60.459 0.379 18112 3643 1 5 . 1 1 114 114 VAL CB C 114 32.609 32.609 29.487 3.122 18112 3644 1 5 . 1 1 114 114 VAL H H 114 8.008 8.008 7.687 0.321 18112 3645 1 5 . 1 1 115 115 PRO HA H 115 4.429 4.429 4.514 -0.085 18112 3646 1 5 . 1 1 115 115 PRO C C 115 177.421 177.421 177.791 -0.370 18112 3647 1 5 . 1 1 115 115 PRO CA C 115 61.882 61.882 62.496 -0.614 18112 3648 1 5 . 1 1 115 115 PRO CB C 115 30.974 30.974 32.758 -1.784 18112 3649 1 5 . 1 1 116 116 GLU N N 116 123.936 123.936 120.889 3.047 18112 3650 1 5 . 1 1 116 116 GLU C C 116 179.034 179.034 178.831 0.203 18112 3651 1 5 . 1 1 116 116 GLU CA C 116 58.913 58.913 59.991 -1.078 18112 3652 1 5 . 1 1 116 116 GLU CB C 116 28.378 28.378 29.664 -1.286 18112 3653 1 5 . 1 1 116 116 GLU H H 116 8.757 8.757 8.798 -0.041 18112 3654 1 5 . 1 1 117 117 ARG N N 117 116.943 116.943 117.953 -1.010 18112 3655 1 5 . 1 1 117 117 ARG C C 117 177.570 177.570 178.790 -1.220 18112 3656 1 5 . 1 1 117 117 ARG CA C 117 57.033 57.033 59.038 -2.005 18112 3657 1 5 . 1 1 117 117 ARG CB C 117 28.172 28.172 29.747 -1.575 18112 3658 1 5 . 1 1 117 117 ARG H H 117 8.733 8.733 8.225 0.508 18112 3659 1 5 . 1 1 118 118 PHE N N 118 117.528 117.528 120.859 -3.331 18112 3660 1 5 . 1 1 118 118 PHE HA H 118 4.137 4.137 4.203 -0.066 18112 3661 1 5 . 1 1 118 118 PHE C C 118 176.992 176.992 177.453 -0.461 18112 3662 1 5 . 1 1 118 118 PHE CA C 118 61.627 61.627 61.177 0.450 18112 3663 1 5 . 1 1 118 118 PHE CB C 118 37.386 37.386 39.107 -1.721 18112 3664 1 5 . 1 1 118 118 PHE H H 118 7.606 7.606 7.752 -0.146 18112 3665 1 5 . 1 1 119 119 LEU N N 119 118.483 118.483 118.692 -0.209 18112 3666 1 5 . 1 1 119 119 LEU HA H 119 3.684 3.684 4.192 -0.508 18112 3667 1 5 . 1 1 119 119 LEU C C 119 178.802 178.802 179.098 -0.296 18112 3668 1 5 . 1 1 119 119 LEU CA C 119 59.875 59.875 56.863 3.012 18112 3669 1 5 . 1 1 119 119 LEU CB C 119 39.453 39.453 40.278 -0.825 18112 3670 1 5 . 1 1 119 119 LEU H H 119 7.248 7.248 7.927 -0.679 18112 3671 1 5 . 1 1 120 120 GLU N N 120 117.870 117.870 121.711 -3.841 18112 3672 1 5 . 1 1 120 120 GLU C C 120 179.932 179.932 179.183 0.749 18112 3673 1 5 . 1 1 120 120 GLU CA C 120 59.150 59.150 60.071 -0.921 18112 3674 1 5 . 1 1 120 120 GLU CB C 120 28.878 28.878 29.917 -1.039 18112 3675 1 5 . 1 1 120 120 GLU H H 120 7.423 7.423 8.474 -1.051 18112 3676 1 5 . 1 1 121 121 VAL N N 121 120.777 120.777 120.377 0.400 18112 3677 1 5 . 1 1 121 121 VAL HA H 121 3.545 3.545 3.812 -0.267 18112 3678 1 5 . 1 1 121 121 VAL C C 121 179.302 179.302 178.051 1.251 18112 3679 1 5 . 1 1 121 121 VAL CA C 121 66.875 66.875 66.422 0.453 18112 3680 1 5 . 1 1 121 121 VAL CB C 121 30.823 30.823 31.565 -0.742 18112 3681 1 5 . 1 1 121 121 VAL H H 121 8.313 8.313 8.211 0.102 18112 3682 1 5 . 1 1 122 122 ALA N N 122 127.029 127.029 122.949 4.080 18112 3683 1 5 . 1 1 122 122 ALA HA H 122 4.251 4.251 4.270 -0.019 18112 3684 1 5 . 1 1 122 122 ALA C C 122 178.366 178.366 179.669 -1.303 18112 3685 1 5 . 1 1 122 122 ALA CA C 122 54.748 54.748 55.490 -0.742 18112 3686 1 5 . 1 1 122 122 ALA CB C 122 16.565 16.565 18.689 -2.124 18112 3687 1 5 . 1 1 122 122 ALA H H 122 8.896 8.896 8.191 0.705 18112 3688 1 5 . 1 1 123 123 GLN N N 123 119.887 119.887 118.257 1.630 18112 3689 1 5 . 1 1 123 123 GLN C C 123 177.908 177.908 178.630 -0.722 18112 3690 1 5 . 1 1 123 123 GLN CA C 123 60.671 60.671 58.573 2.098 18112 3691 1 5 . 1 1 123 123 GLN H H 123 8.349 8.349 8.133 0.216 18112 3692 1 5 . 1 1 124 124 ILE N N 124 120.632 120.632 120.907 -0.275 18112 3693 1 5 . 1 1 124 124 ILE HA H 124 3.651 3.651 3.824 -0.173 18112 3694 1 5 . 1 1 124 124 ILE C C 124 178.703 178.703 178.429 0.274 18112 3695 1 5 . 1 1 124 124 ILE CA C 124 65.945 65.945 64.969 0.976 18112 3696 1 5 . 1 1 124 124 ILE H H 124 8.204 8.204 8.231 -0.027 18112 3697 1 5 . 1 1 125 125 THR N N 125 115.084 115.084 115.924 -0.840 18112 3698 1 5 . 1 1 125 125 THR C C 125 175.568 175.568 176.503 -0.935 18112 3699 1 5 . 1 1 125 125 THR CA C 125 67.872 67.872 66.790 1.082 18112 3700 1 5 . 1 1 125 125 THR H H 125 8.399 8.399 8.342 0.057 18112 3701 1 5 . 1 1 126 126 LEU N N 126 125.011 125.011 122.281 2.730 18112 3702 1 5 . 1 1 126 126 LEU HA H 126 4.085 4.085 4.465 -0.380 18112 3703 1 5 . 1 1 126 126 LEU C C 126 178.559 178.559 178.254 0.305 18112 3704 1 5 . 1 1 126 126 LEU CA C 126 58.843 58.843 57.695 1.148 18112 3705 1 5 . 1 1 126 126 LEU CB C 126 41.421 41.421 41.877 -0.456 18112 3706 1 5 . 1 1 126 126 LEU H H 126 8.728 8.728 8.290 0.438 18112 3707 1 5 . 1 1 127 127 ARG N N 127 117.076 117.076 120.204 -3.128 18112 3708 1 5 . 1 1 127 127 ARG HA H 127 3.929 3.929 3.999 -0.070 18112 3709 1 5 . 1 1 127 127 ARG C C 127 177.984 177.984 178.460 -0.476 18112 3710 1 5 . 1 1 127 127 ARG CA C 127 60.685 60.685 59.886 0.799 18112 3711 1 5 . 1 1 127 127 ARG CB C 127 28.079 28.079 29.976 -1.897 18112 3712 1 5 . 1 1 127 127 ARG H H 127 8.213 8.213 8.322 -0.109 18112 3713 1 5 . 1 1 128 128 GLU N N 128 118.617 118.617 119.342 -0.725 18112 3714 1 5 . 1 1 128 128 GLU HA H 128 4.147 4.147 4.132 0.015 18112 3715 1 5 . 1 1 128 128 GLU C C 128 181.150 181.150 179.309 1.841 18112 3716 1 5 . 1 1 128 128 GLU CA C 128 59.508 59.508 59.212 0.297 18112 3717 1 5 . 1 1 128 128 GLU H H 128 8.478 8.478 8.095 0.383 18112 3718 1 5 . 1 1 129 129 PHE N N 129 119.267 119.267 119.854 -0.587 18112 3719 1 5 . 1 1 129 129 PHE HA H 129 4.104 4.104 4.310 -0.206 18112 3720 1 5 . 1 1 129 129 PHE C C 129 177.170 177.170 177.781 -0.611 18112 3721 1 5 . 1 1 129 129 PHE CA C 129 63.694 63.694 62.047 1.647 18112 3722 1 5 . 1 1 129 129 PHE H H 129 8.570 8.570 8.578 -0.008 18112 3723 1 5 . 1 1 130 130 PHE N N 130 118.739 118.739 120.130 -1.391 18112 3724 1 5 . 1 1 130 130 PHE HA H 130 3.884 3.884 4.064 -0.180 18112 3725 1 5 . 1 1 130 130 PHE C C 130 175.860 175.860 177.275 -1.415 18112 3726 1 5 . 1 1 130 130 PHE CA C 130 62.819 62.819 62.010 0.809 18112 3727 1 5 . 1 1 130 130 PHE H H 130 8.740 8.740 8.689 0.051 18112 3728 1 5 . 1 1 131 131 ASN N N 131 116.028 116.028 117.891 -1.863 18112 3729 1 5 . 1 1 131 131 ASN HA H 131 4.373 4.373 4.501 -0.128 18112 3730 1 5 . 1 1 131 131 ASN C C 131 178.228 178.228 177.690 0.538 18112 3731 1 5 . 1 1 131 131 ASN CA C 131 55.150 55.150 56.404 -1.254 18112 3732 1 5 . 1 1 131 131 ASN H H 131 8.864 8.864 8.521 0.343 18112 3733 1 5 . 1 1 132 132 ALA N N 132 120.922 120.922 123.958 -3.036 18112 3734 1 5 . 1 1 132 132 ALA HA H 132 4.020 4.020 4.161 -0.141 18112 3735 1 5 . 1 1 132 132 ALA C C 132 178.515 178.515 179.862 -1.347 18112 3736 1 5 . 1 1 132 132 ALA CA C 132 54.924 54.924 55.153 -0.229 18112 3737 1 5 . 1 1 132 132 ALA CB C 132 18.441 18.441 18.633 -0.192 18112 3738 1 5 . 1 1 132 132 ALA H H 132 7.745 7.745 7.928 -0.183 18112 3739 1 5 . 1 1 133 133 ILE N N 133 118.200 118.200 120.273 -2.073 18112 3740 1 5 . 1 1 133 133 ILE HA H 133 3.235 3.235 3.866 -0.631 18112 3741 1 5 . 1 1 133 133 ILE C C 133 180.606 180.606 178.203 2.403 18112 3742 1 5 . 1 1 133 133 ILE CA C 133 65.215 65.215 64.543 0.672 18112 3743 1 5 . 1 1 133 133 ILE CB C 133 38.291 38.291 37.621 0.670 18112 3744 1 5 . 1 1 133 133 ILE H H 133 7.999 7.999 8.260 -0.261 18112 3745 1 5 . 1 1 134 134 ILE N N 134 122.564 122.564 119.775 2.789 18112 3746 1 5 . 1 1 134 134 ILE HA H 134 3.788 3.788 3.687 0.101 18112 3747 1 5 . 1 1 134 134 ILE C C 134 177.215 177.215 176.987 0.228 18112 3748 1 5 . 1 1 134 134 ILE CA C 134 63.584 63.584 63.530 0.054 18112 3749 1 5 . 1 1 134 134 ILE CB C 134 35.636 35.636 37.503 -1.867 18112 3750 1 5 . 1 1 134 134 ILE H H 134 8.670 8.670 7.891 0.779 18112 3751 1 5 . 1 1 135 135 ALA N N 135 119.989 119.989 120.906 -0.917 18112 3752 1 5 . 1 1 135 135 ALA HA H 135 4.357 4.357 4.206 0.151 18112 3753 1 5 . 1 1 135 135 ALA C C 135 177.786 177.786 177.907 -0.121 18112 3754 1 5 . 1 1 135 135 ALA CA C 135 51.521 51.521 52.744 -1.223 18112 3755 1 5 . 1 1 135 135 ALA CB C 135 18.839 18.839 19.643 -0.804 18112 3756 1 5 . 1 1 135 135 ALA H H 135 6.898 6.898 7.731 -0.833 18112 3757 1 5 . 1 1 136 136 GLY N N 136 107.682 107.682 105.476 2.206 18112 3758 1 5 . 1 1 136 136 GLY C C 136 176.324 176.324 175.134 1.190 18112 3759 1 5 . 1 1 136 136 GLY CA C 136 45.469 45.469 44.828 0.641 18112 3760 1 5 . 1 1 136 136 GLY H H 136 7.913 7.913 7.745 0.168 18112 3761 1 5 . 1 1 137 137 LYS N N 137 117.213 117.213 119.510 -2.297 18112 3762 1 5 . 1 1 137 137 LYS HA H 137 4.004 4.004 4.268 -0.264 18112 3763 1 5 . 1 1 137 137 LYS C C 137 176.616 176.616 176.643 -0.027 18112 3764 1 5 . 1 1 137 137 LYS CA C 137 57.499 57.499 57.124 0.375 18112 3765 1 5 . 1 1 137 137 LYS CB C 137 30.927 30.927 32.591 -1.664 18112 3766 1 5 . 1 1 137 137 LYS H H 137 8.312 8.312 8.117 0.195 18112 3767 1 5 . 1 1 138 138 ASP N N 138 113.545 113.545 118.013 -4.468 18112 3768 1 5 . 1 1 138 138 ASP HA H 138 3.061 3.061 3.080 -0.019 18112 3769 1 5 . 1 1 138 138 ASP C C 138 174.698 174.698 176.697 -1.999 18112 3770 1 5 . 1 1 138 138 ASP CA C 138 53.694 53.694 54.553 -0.859 18112 3771 1 5 . 1 1 138 138 ASP CB C 138 36.008 36.008 39.280 -3.272 18112 3772 1 5 . 1 1 138 138 ASP H H 138 8.465 8.465 8.111 0.354 18112 3773 1 5 . 1 1 139 139 VAL N N 139 115.191 115.191 118.043 -2.852 18112 3774 1 5 . 1 1 139 139 VAL HA H 139 3.886 3.886 3.735 0.151 18112 3775 1 5 . 1 1 139 139 VAL C C 139 175.889 175.889 176.300 -0.411 18112 3776 1 5 . 1 1 139 139 VAL CA C 139 62.793 62.793 63.638 -0.845 18112 3777 1 5 . 1 1 139 139 VAL CB C 139 30.662 30.662 31.657 -0.995 18112 3778 1 5 . 1 1 139 139 VAL H H 139 6.610 6.610 7.379 -0.769 18112 3779 1 5 . 1 1 140 140 ASP N N 140 123.363 123.363 116.399 6.964 18112 3780 1 5 . 1 1 140 140 ASP C C 140 175.234 175.234 174.409 0.825 18112 3781 1 5 . 1 1 140 140 ASP CA C 140 50.221 50.221 54.148 -3.927 18112 3782 1 5 . 1 1 140 140 ASP CB C 140 42.254 42.254 40.486 1.768 18112 3783 1 5 . 1 1 140 140 ASP H H 140 7.553 7.553 7.412 0.141 18112 3784 1 5 . 1 1 141 141 PRO HA H 141 4.682 4.682 4.595 0.087 18112 3785 1 5 . 1 1 141 141 PRO C C 141 178.678 178.678 177.730 0.948 18112 3786 1 5 . 1 1 141 141 PRO CA C 141 64.532 64.532 63.032 1.500 18112 3787 1 5 . 1 1 141 141 PRO CB C 141 31.331 31.331 32.495 -1.164 18112 3788 1 5 . 1 1 142 142 SER N N 142 114.421 114.421 114.611 -0.190 18112 3789 1 5 . 1 1 142 142 SER HA H 142 4.565 4.565 4.552 0.013 18112 3790 1 5 . 1 1 142 142 SER C C 142 176.524 176.524 176.471 0.053 18112 3791 1 5 . 1 1 142 142 SER CA C 142 58.711 58.711 59.019 -0.308 18112 3792 1 5 . 1 1 142 142 SER CB C 142 62.783 62.783 62.817 -0.034 18112 3793 1 5 . 1 1 142 142 SER H H 142 8.703 8.703 8.531 0.172 18112 3794 1 5 . 1 1 143 143 TRP N N 143 123.598 123.598 122.035 1.563 18112 3795 1 5 . 1 1 143 143 TRP HA H 143 4.136 4.136 4.206 -0.070 18112 3796 1 5 . 1 1 143 143 TRP C C 143 177.113 177.113 176.586 0.527 18112 3797 1 5 . 1 1 143 143 TRP CA C 143 59.803 59.803 59.549 0.254 18112 3798 1 5 . 1 1 143 143 TRP CB C 143 26.364 26.364 27.741 -1.377 18112 3799 1 5 . 1 1 143 143 TRP H H 143 8.374 8.374 8.638 -0.264 18112 3800 1 5 . 1 1 144 144 LYS N N 144 119.293 119.293 118.489 0.804 18112 3801 1 5 . 1 1 144 144 LYS HA H 144 2.719 2.719 2.938 -0.219 18112 3802 1 5 . 1 1 144 144 LYS C C 144 177.243 177.243 177.743 -0.500 18112 3803 1 5 . 1 1 144 144 LYS CA C 144 58.851 58.851 58.548 0.303 18112 3804 1 5 . 1 1 144 144 LYS CB C 144 29.373 29.373 30.959 -1.586 18112 3805 1 5 . 1 1 144 144 LYS H H 144 7.196 7.196 7.564 -0.368 18112 3806 1 5 . 1 1 145 145 LYS N N 145 116.440 116.440 120.393 -3.953 18112 3807 1 5 . 1 1 145 145 LYS HA H 145 3.490 3.490 4.044 -0.554 18112 3808 1 5 . 1 1 145 145 LYS C C 145 179.149 179.149 178.512 0.637 18112 3809 1 5 . 1 1 145 145 LYS CA C 145 59.271 59.271 58.911 0.360 18112 3810 1 5 . 1 1 145 145 LYS CB C 145 30.521 30.521 32.157 -1.636 18112 3811 1 5 . 1 1 145 145 LYS H H 145 7.389 7.389 7.506 -0.117 18112 3812 1 5 . 1 1 146 146 ALA N N 146 118.582 118.582 123.295 -4.713 18112 3813 1 5 . 1 1 146 146 ALA HA H 146 3.932 3.932 3.962 -0.030 18112 3814 1 5 . 1 1 146 146 ALA C C 146 179.968 179.968 179.343 0.625 18112 3815 1 5 . 1 1 146 146 ALA CA C 146 54.241 54.241 55.186 -0.945 18112 3816 1 5 . 1 1 146 146 ALA CB C 146 17.689 17.689 18.269 -0.580 18112 3817 1 5 . 1 1 146 146 ALA H H 146 7.112 7.112 7.711 -0.599 18112 3818 1 5 . 1 1 147 147 ILE N N 147 118.537 118.537 119.287 -0.750 18112 3819 1 5 . 1 1 147 147 ILE HA H 147 3.642 3.642 3.473 0.169 18112 3820 1 5 . 1 1 147 147 ILE C C 147 178.919 178.919 177.751 1.168 18112 3821 1 5 . 1 1 147 147 ILE CA C 147 64.418 64.418 64.567 -0.149 18112 3822 1 5 . 1 1 147 147 ILE CB C 147 36.519 36.519 36.931 -0.412 18112 3823 1 5 . 1 1 147 147 ILE H H 147 6.734 6.734 7.606 -0.872 18112 3824 1 5 . 1 1 148 148 TYR N N 148 121.033 121.033 117.852 3.181 18112 3825 1 5 . 1 1 148 148 TYR HA H 148 4.489 4.489 3.736 0.753 18112 3826 1 5 . 1 1 148 148 TYR C C 148 178.348 178.348 178.259 0.089 18112 3827 1 5 . 1 1 148 148 TYR CA C 148 57.389 57.389 59.296 -1.907 18112 3828 1 5 . 1 1 148 148 TYR CB C 148 35.280 35.280 36.909 -1.629 18112 3829 1 5 . 1 1 148 148 TYR H H 148 8.126 8.126 7.806 0.320 18112 3830 1 5 . 1 1 149 149 LYS N N 149 114.484 114.484 119.812 -5.328 18112 3831 1 5 . 1 1 149 149 LYS C C 149 178.051 178.051 179.066 -1.015 18112 3832 1 5 . 1 1 149 149 LYS CA C 149 59.036 59.036 59.776 -0.740 18112 3833 1 5 . 1 1 149 149 LYS CB C 149 31.575 31.575 32.566 -0.991 18112 3834 1 5 . 1 1 149 149 LYS H H 149 7.364 7.364 7.995 -0.631 18112 3835 1 5 . 1 1 150 150 VAL N N 150 117.812 117.812 117.317 0.495 18112 3836 1 5 . 1 1 150 150 VAL HA H 150 3.770 3.770 3.806 -0.036 18112 3837 1 5 . 1 1 150 150 VAL C C 150 178.786 178.786 178.278 0.508 18112 3838 1 5 . 1 1 150 150 VAL CA C 150 65.070 65.070 65.963 -0.893 18112 3839 1 5 . 1 1 150 150 VAL CB C 150 29.515 29.515 31.150 -1.635 18112 3840 1 5 . 1 1 150 150 VAL H H 150 7.254 7.254 7.966 -0.712 18112 3841 1 5 . 1 1 151 151 ILE N N 151 117.884 117.884 117.763 0.121 18112 3842 1 5 . 1 1 151 151 ILE C C 151 180.539 180.539 177.104 3.435 18112 3843 1 5 . 1 1 151 151 ILE CA C 151 61.490 61.490 63.483 -1.993 18112 3844 1 5 . 1 1 151 151 ILE CB C 151 33.994 33.994 36.949 -2.955 18112 3845 1 5 . 1 1 151 151 ILE H H 151 8.154 8.154 7.990 0.164 18112 3846 1 5 . 1 1 152 152 CYS N N 152 118.649 118.649 121.417 -2.768 18112 3847 1 5 . 1 1 152 152 CYS HA H 152 4.153 4.153 4.439 -0.286 18112 3848 1 5 . 1 1 152 152 CYS C C 152 174.888 174.888 176.621 -1.733 18112 3849 1 5 . 1 1 152 152 CYS CA C 152 61.052 61.052 62.550 -1.498 18112 3850 1 5 . 1 1 152 152 CYS CB C 152 36.364 36.364 27.113 9.251 18112 3851 1 5 . 1 1 152 152 CYS H H 152 8.711 8.711 8.368 0.343 18112 3852 1 5 . 1 1 153 153 LYS N N 153 118.498 118.498 120.923 -2.425 18112 3853 1 5 . 1 1 153 153 LYS C C 153 177.389 177.389 178.881 -1.492 18112 3854 1 5 . 1 1 153 153 LYS CA C 153 56.243 56.243 58.309 -2.066 18112 3855 1 5 . 1 1 153 153 LYS CB C 153 31.343 31.343 31.906 -0.563 18112 3856 1 5 . 1 1 153 153 LYS H H 153 6.782 6.782 7.891 -1.109 18112 3857 1 5 . 1 1 154 154 LEU N N 154 117.318 117.318 119.054 -1.736 18112 3858 1 5 . 1 1 154 154 LEU HA H 154 4.576 4.576 4.091 0.485 18112 3859 1 5 . 1 1 154 154 LEU C C 154 177.161 177.161 177.979 -0.818 18112 3860 1 5 . 1 1 154 154 LEU CA C 154 53.782 53.782 57.078 -3.296 18112 3861 1 5 . 1 1 154 154 LEU CB C 154 40.881 40.881 41.981 -1.100 18112 3862 1 5 . 1 1 154 154 LEU H H 154 7.616 7.616 7.590 0.026 18112 3863 1 5 . 1 1 155 155 ASP N N 155 121.564 121.564 116.259 5.305 18112 3864 1 5 . 1 1 155 155 ASP C C 155 177.094 177.094 175.805 1.289 18112 3865 1 5 . 1 1 155 155 ASP CA C 155 55.732 55.732 54.454 1.278 18112 3866 1 5 . 1 1 155 155 ASP CB C 155 40.139 40.139 43.366 -3.227 18112 3867 1 5 . 1 1 155 155 ASP H H 155 7.582 7.582 7.560 0.022 18112 3868 1 5 . 1 1 156 156 SER N N 156 117.352 117.352 114.619 2.733 18112 3869 1 5 . 1 1 156 156 SER HA H 156 4.818 4.818 4.547 0.271 18112 3870 1 5 . 1 1 156 156 SER C C 156 173.409 173.409 173.295 0.114 18112 3871 1 5 . 1 1 156 156 SER CA C 156 57.073 57.073 59.263 -2.190 18112 3872 1 5 . 1 1 156 156 SER CB C 156 65.150 65.150 65.400 -0.250 18112 3873 1 5 . 1 1 156 156 SER H H 156 8.846 8.846 8.357 0.489 18112 3874 1 5 . 1 1 157 157 GLU N N 157 120.688 120.688 119.676 1.012 18112 3875 1 5 . 1 1 157 157 GLU HA H 157 4.038 4.038 4.596 -0.558 18112 3876 1 5 . 1 1 157 157 GLU C C 157 176.332 176.332 176.333 -0.001 18112 3877 1 5 . 1 1 157 157 GLU CA C 157 56.464 56.464 54.495 1.969 18112 3878 1 5 . 1 1 157 157 GLU CB C 157 29.206 29.206 32.304 -3.098 18112 3879 1 5 . 1 1 157 157 GLU H H 157 8.356 8.356 7.947 0.409 18112 3880 1 5 . 1 1 158 158 VAL N N 158 126.906 126.906 116.491 10.415 18112 3881 1 5 . 1 1 158 158 VAL HA H 158 3.449 3.449 4.014 -0.565 18112 3882 1 5 . 1 1 158 158 VAL C C 158 176.382 176.382 175.591 0.791 18112 3883 1 5 . 1 1 158 158 VAL CA C 158 59.584 59.584 61.474 -1.890 18112 3884 1 5 . 1 1 158 158 VAL CB C 158 31.160 31.160 30.523 0.637 18112 3885 1 5 . 1 1 158 158 VAL H H 158 8.561 8.561 7.940 0.621 18112 3886 1 5 . 1 1 159 159 PRO HA H 159 4.403 4.403 4.597 -0.194 18112 3887 1 5 . 1 1 159 159 PRO C C 159 176.757 176.757 175.547 1.210 18112 3888 1 5 . 1 1 159 159 PRO CA C 159 63.845 63.845 62.976 0.869 18112 3889 1 5 . 1 1 159 159 PRO CB C 159 32.106 32.106 32.060 0.046 18112 3890 1 5 . 1 1 160 160 GLU N N 160 122.904 122.904 119.525 3.379 18112 3891 1 5 . 1 1 160 160 GLU HA H 160 4.008 4.008 4.359 -0.351 18112 3892 1 5 . 1 1 160 160 GLU C C 160 179.132 179.132 174.555 4.577 18112 3893 1 5 . 1 1 160 160 GLU CA C 160 59.407 59.407 55.149 4.258 18112 3894 1 5 . 1 1 160 160 GLU CB C 160 28.991 28.991 31.651 -2.660 18112 3895 1 5 . 1 1 160 160 GLU H H 160 8.650 8.650 7.550 1.100 18112 3896 1 5 . 1 1 161 161 ILE N N 161 119.782 119.782 123.523 -3.741 18112 3897 1 5 . 1 1 161 161 ILE HA H 161 4.146 4.146 4.094 0.052 18112 3898 1 5 . 1 1 161 161 ILE C C 161 176.176 176.176 175.143 1.033 18112 3899 1 5 . 1 1 161 161 ILE CA C 161 62.034 62.034 59.541 2.493 18112 3900 1 5 . 1 1 161 161 ILE CB C 161 37.113 37.113 39.940 -2.827 18112 3901 1 5 . 1 1 161 161 ILE H H 161 8.448 8.448 8.196 0.252 18112 3902 1 5 . 1 1 162 162 PHE N N 162 117.594 117.594 123.006 -5.412 18112 3903 1 5 . 1 1 162 162 PHE C C 162 176.115 176.115 176.922 -0.807 18112 3904 1 5 . 1 1 162 162 PHE CA C 162 61.009 61.009 59.595 1.414 18112 3905 1 5 . 1 1 162 162 PHE CB C 162 38.394 38.394 38.837 -0.443 18112 3906 1 5 . 1 1 162 162 PHE H H 162 8.145 8.145 8.477 -0.332 18112 3907 1 5 . 1 1 163 163 LYS N N 163 116.083 116.083 119.782 -3.699 18112 3908 1 5 . 1 1 163 163 LYS C C 163 178.196 178.196 176.781 1.415 18112 3909 1 5 . 1 1 163 163 LYS CA C 163 58.136 58.136 57.801 0.335 18112 3910 1 5 . 1 1 163 163 LYS CB C 163 31.694 31.694 32.662 -0.968 18112 3911 1 5 . 1 1 163 163 LYS H H 163 8.232 8.232 8.118 0.114 18112 3912 1 5 . 1 1 164 164 SER N N 164 113.680 113.680 112.381 1.299 18112 3913 1 5 . 1 1 164 164 SER CA C 164 55.205 55.205 56.388 -1.183 18112 3914 1 5 . 1 1 164 164 SER CB C 164 63.265 63.265 63.913 -0.648 18112 3915 1 5 . 1 1 164 164 SER H H 164 7.708 7.708 7.671 0.037 18112 3916 1 5 . 1 1 165 165 PRO HA H 165 4.580 4.580 4.126 0.454 18112 3917 1 5 . 1 1 165 165 PRO C C 165 177.541 177.541 177.797 -0.256 18112 3918 1 5 . 1 1 165 165 PRO CA C 165 63.950 63.950 65.579 -1.629 18112 3919 1 5 . 1 1 165 165 PRO CB C 165 30.686 30.686 32.003 -1.317 18112 3920 1 5 . 1 1 166 166 ASN N N 166 116.304 116.304 115.738 0.566 18112 3921 1 5 . 1 1 166 166 ASN HA H 166 5.029 5.029 4.534 0.495 18112 3922 1 5 . 1 1 166 166 ASN C C 166 175.811 175.811 177.164 -1.353 18112 3923 1 5 . 1 1 166 166 ASN CA C 166 51.962 51.962 54.314 -2.352 18112 3924 1 5 . 1 1 166 166 ASN CB C 166 37.915 37.915 37.317 0.598 18112 3925 1 5 . 1 1 166 166 ASN H H 166 8.216 8.216 8.642 -0.426 18112 3926 1 5 . 1 1 167 167 CYS N N 167 116.078 116.078 120.092 -4.014 18112 3927 1 5 . 1 1 167 167 CYS HA H 167 4.011 4.011 4.271 -0.260 18112 3928 1 5 . 1 1 167 167 CYS C C 167 175.057 175.057 176.006 -0.949 18112 3929 1 5 . 1 1 167 167 CYS CA C 167 59.816 59.816 61.547 -1.731 18112 3930 1 5 . 1 1 167 167 CYS CB C 167 27.446 27.446 27.930 -0.484 18112 3931 1 5 . 1 1 167 167 CYS H H 167 7.246 7.246 7.933 -0.687 18112 3932 1 5 . 1 1 168 168 LEU N N 168 120.082 120.082 120.526 -0.444 18112 3933 1 5 . 1 1 168 168 LEU HA H 168 3.880 3.880 4.232 -0.352 18112 3934 1 5 . 1 1 168 168 LEU C C 168 178.541 178.541 177.840 0.701 18112 3935 1 5 . 1 1 168 168 LEU CA C 168 57.734 57.734 56.434 1.300 18112 3936 1 5 . 1 1 168 168 LEU CB C 168 38.825 38.825 40.393 -1.568 18112 3937 1 5 . 1 1 168 168 LEU H H 168 8.451 8.451 7.615 0.836 18112 3938 1 5 . 1 1 169 169 GLN N N 169 116.700 116.700 119.549 -2.849 18112 3939 1 5 . 1 1 169 169 GLN HA H 169 4.064 4.064 4.013 0.051 18112 3940 1 5 . 1 1 169 169 GLN C C 169 177.378 177.378 177.491 -0.113 18112 3941 1 5 . 1 1 169 169 GLN CA C 169 57.675 57.675 58.338 -0.663 18112 3942 1 5 . 1 1 169 169 GLN CB C 169 27.710 27.710 28.435 -0.725 18112 3943 1 5 . 1 1 169 169 GLN H H 169 7.665 7.665 7.816 -0.151 18112 3944 1 5 . 1 1 170 170 GLU N N 170 116.701 116.701 117.914 -1.213 18112 3945 1 5 . 1 1 170 170 GLU HA H 170 4.214 4.214 4.147 0.067 18112 3946 1 5 . 1 1 170 170 GLU C C 170 177.730 177.730 177.788 -0.058 18112 3947 1 5 . 1 1 170 170 GLU CA C 170 56.899 56.899 57.859 -0.961 18112 3948 1 5 . 1 1 170 170 GLU H H 170 7.405 7.405 7.708 -0.303 18112 3949 1 5 . 1 1 171 171 LEU N N 171 118.021 118.021 118.023 -0.002 18112 3950 1 5 . 1 1 171 171 LEU HA H 171 4.209 4.209 4.121 0.088 18112 3951 1 5 . 1 1 171 171 LEU C C 171 177.005 177.005 178.708 -1.703 18112 3952 1 5 . 1 1 171 171 LEU CA C 171 55.870 55.870 57.066 -1.196 18112 3953 1 5 . 1 1 171 171 LEU CB C 171 43.680 43.680 42.291 1.389 18112 3954 1 5 . 1 1 171 171 LEU H H 171 7.823 7.823 7.519 0.304 18112 3955 1 5 . 1 1 172 172 LEU N N 172 117.580 117.580 113.668 3.912 18112 3956 1 5 . 1 1 172 172 LEU HA H 172 4.571 4.571 4.416 0.155 18112 3957 1 5 . 1 1 172 172 LEU C C 172 176.411 176.411 175.627 0.784 18112 3958 1 5 . 1 1 172 172 LEU CA C 172 53.972 53.972 54.958 -0.986 18112 3959 1 5 . 1 1 172 172 LEU CB C 172 40.483 40.483 39.908 0.575 18112 3960 1 5 . 1 1 172 172 LEU H H 172 7.306 7.306 7.453 -0.147 18112 3961 1 5 . 1 1 173 173 HIS N N 173 123.310 123.310 121.124 2.186 18112 3962 1 5 . 1 1 173 173 HIS C C 173 179.022 179.022 173.336 5.686 18112 3963 1 5 . 1 1 173 173 HIS CA C 173 56.693 56.693 56.513 0.180 18112 3964 1 5 . 1 1 173 173 HIS CB C 173 29.371 29.371 31.372 -2.001 18112 3965 1 5 . 1 1 173 173 HIS H H 173 8.028 8.028 7.915 0.113 18112 3966 1 6 . 1 1 12 12 ALA N N 12 125.167 125.167 129.564 -4.397 18112 3967 1 6 . 1 1 12 12 ALA C C 12 177.566 177.566 177.999 -0.433 18112 3968 1 6 . 1 1 12 12 ALA CA C 12 52.067 52.067 51.746 0.321 18112 3969 1 6 . 1 1 12 12 ALA CB C 12 18.456 18.456 20.687 -2.231 18112 3970 1 6 . 1 1 12 12 ALA H H 12 8.311 8.311 8.383 -0.072 18112 3971 1 6 . 1 1 13 13 MET N N 13 119.278 119.278 119.698 -0.420 18112 3972 1 6 . 1 1 13 13 MET C C 13 176.325 176.325 175.886 0.439 18112 3973 1 6 . 1 1 13 13 MET CA C 13 54.992 54.992 55.861 -0.869 18112 3974 1 6 . 1 1 13 13 MET CB C 13 32.308 32.308 31.997 0.311 18112 3975 1 6 . 1 1 13 13 MET H H 13 8.269 8.269 8.395 -0.126 18112 3976 1 6 . 1 1 14 14 GLN N N 14 120.869 120.869 120.620 0.249 18112 3977 1 6 . 1 1 14 14 GLN HA H 14 4.399 4.399 4.268 0.131 18112 3978 1 6 . 1 1 14 14 GLN C C 14 175.644 175.644 174.538 1.106 18112 3979 1 6 . 1 1 14 14 GLN CA C 14 55.139 55.139 55.848 -0.709 18112 3980 1 6 . 1 1 14 14 GLN CB C 14 29.051 29.051 29.646 -0.595 18112 3981 1 6 . 1 1 14 14 GLN H H 14 8.501 8.501 7.886 0.615 18112 3982 1 6 . 1 1 15 15 GLU N N 15 122.042 122.042 121.965 0.077 18112 3983 1 6 . 1 1 15 15 GLU C C 15 176.242 176.242 176.079 0.163 18112 3984 1 6 . 1 1 15 15 GLU CA C 15 56.064 56.064 55.229 0.835 18112 3985 1 6 . 1 1 15 15 GLU CB C 15 29.302 29.302 30.670 -1.368 18112 3986 1 6 . 1 1 15 15 GLU H H 15 8.547 8.547 8.403 0.144 18112 3987 1 6 . 1 1 16 16 GLY N N 16 108.821 108.821 111.793 -2.972 18112 3988 1 6 . 1 1 16 16 GLY C C 16 172.949 172.949 174.783 -1.834 18112 3989 1 6 . 1 1 16 16 GLY CA C 16 44.227 44.227 45.364 -1.137 18112 3990 1 6 . 1 1 16 16 GLY H H 16 8.100 8.100 8.386 -0.286 18112 3991 1 6 . 1 1 17 17 LEU N N 17 120.315 120.315 116.412 3.903 18112 3992 1 6 . 1 1 17 17 LEU C C 17 177.334 177.334 177.668 -0.334 18112 3993 1 6 . 1 1 17 17 LEU CA C 17 53.544 53.544 56.535 -2.991 18112 3994 1 6 . 1 1 17 17 LEU CB C 17 42.140 42.140 40.139 2.002 18112 3995 1 6 . 1 1 17 17 LEU H H 17 8.222 8.222 7.745 0.477 18112 3996 1 6 . 1 1 18 18 SER N N 18 126.547 126.547 115.768 10.779 18112 3997 1 6 . 1 1 18 18 SER CA C 18 56.851 56.851 60.537 -3.686 18112 3998 1 6 . 1 1 18 18 SER CB C 18 64.636 64.636 63.260 1.376 18112 3999 1 6 . 1 1 18 18 SER H H 18 11.627 11.627 7.840 3.787 18112 4000 1 6 . 1 1 19 19 PRO C C 19 175.118 175.118 175.931 -0.813 18112 4001 1 6 . 1 1 20 20 ASN N N 20 121.372 121.372 117.232 4.140 18112 4002 1 6 . 1 1 20 20 ASN H H 20 8.172 8.172 8.625 -0.453 18112 4003 1 6 . 1 1 25 25 ALA CB C 25 18.020 18.020 18.514 -0.493 18112 4004 1 6 . 1 1 26 26 LYS N N 26 118.490 118.490 118.435 0.055 18112 4005 1 6 . 1 1 26 26 LYS CA C 26 56.146 56.146 59.176 -3.030 18112 4006 1 6 . 1 1 26 26 LYS H H 26 6.794 6.794 7.940 -1.146 18112 4007 1 6 . 1 1 31 31 TYR HA H 31 4.398 4.398 3.425 0.973 18112 4008 1 6 . 1 1 31 31 TYR C C 31 173.714 173.714 174.402 -0.688 18112 4009 1 6 . 1 1 31 31 TYR CA C 31 59.757 59.757 56.796 2.961 18112 4010 1 6 . 1 1 32 32 THR N N 32 111.928 111.928 117.117 -5.189 18112 4011 1 6 . 1 1 32 32 THR HA H 32 4.209 4.209 3.835 0.374 18112 4012 1 6 . 1 1 32 32 THR C C 32 171.061 171.061 174.976 -3.915 18112 4013 1 6 . 1 1 32 32 THR CA C 32 56.905 56.905 65.748 -8.843 18112 4014 1 6 . 1 1 32 32 THR CB C 32 69.707 69.707 69.325 0.382 18112 4015 1 6 . 1 1 32 32 THR H H 32 8.237 8.237 7.992 0.245 18112 4016 1 6 . 1 1 33 33 ARG N N 33 124.856 124.856 115.928 8.928 18112 4017 1 6 . 1 1 33 33 ARG C C 33 176.451 176.451 175.507 0.944 18112 4018 1 6 . 1 1 33 33 ARG CA C 33 55.627 55.627 56.973 -1.346 18112 4019 1 6 . 1 1 33 33 ARG CB C 33 29.861 29.861 32.166 -2.305 18112 4020 1 6 . 1 1 33 33 ARG H H 33 9.159 9.159 8.167 0.992 18112 4021 1 6 . 1 1 34 34 TYR N N 34 117.908 117.908 116.477 1.431 18112 4022 1 6 . 1 1 34 34 TYR CA C 34 55.320 55.320 58.711 -3.391 18112 4023 1 6 . 1 1 34 34 TYR H H 34 8.995 8.995 8.042 0.953 18112 4024 1 6 . 1 1 35 35 PRO C C 35 177.280 177.280 176.526 0.754 18112 4025 1 6 . 1 1 36 36 SER N N 36 116.410 116.410 119.922 -3.512 18112 4026 1 6 . 1 1 36 36 SER C C 36 178.938 178.938 176.554 2.384 18112 4027 1 6 . 1 1 36 36 SER CA C 36 64.815 64.815 60.831 3.984 18112 4028 1 6 . 1 1 36 36 SER H H 36 8.106 8.106 8.634 -0.528 18112 4029 1 6 . 1 1 37 37 SER N N 37 117.488 117.488 116.694 0.794 18112 4030 1 6 . 1 1 37 37 SER C C 37 177.698 177.698 176.821 0.877 18112 4031 1 6 . 1 1 37 37 SER CA C 37 61.357 61.357 61.846 -0.490 18112 4032 1 6 . 1 1 37 37 SER CB C 37 68.118 68.118 62.500 5.618 18112 4033 1 6 . 1 1 37 37 SER H H 37 8.169 8.169 8.577 -0.408 18112 4034 1 6 . 1 1 38 38 ASN N N 38 115.638 115.638 119.832 -4.194 18112 4035 1 6 . 1 1 38 38 ASN HA H 38 4.259 4.259 4.410 -0.151 18112 4036 1 6 . 1 1 38 38 ASN C C 38 177.868 177.868 177.577 0.291 18112 4037 1 6 . 1 1 38 38 ASN CA C 38 55.907 55.907 55.980 -0.073 18112 4038 1 6 . 1 1 38 38 ASN CB C 38 37.230 37.230 37.963 -0.733 18112 4039 1 6 . 1 1 38 38 ASN H H 38 8.284 8.284 7.610 0.674 18112 4040 1 6 . 1 1 39 39 MET N N 39 121.352 121.352 118.310 3.042 18112 4041 1 6 . 1 1 39 39 MET HA H 39 4.170 4.170 3.563 0.607 18112 4042 1 6 . 1 1 39 39 MET C C 39 179.068 179.068 178.335 0.733 18112 4043 1 6 . 1 1 39 39 MET CA C 39 58.751 58.751 58.266 0.485 18112 4044 1 6 . 1 1 39 39 MET CB C 39 31.850 31.850 32.358 -0.507 18112 4045 1 6 . 1 1 39 39 MET H H 39 7.857 7.857 7.380 0.477 18112 4046 1 6 . 1 1 40 40 LEU N N 40 118.936 118.936 122.815 -3.879 18112 4047 1 6 . 1 1 40 40 LEU HA H 40 4.139 4.139 4.571 -0.432 18112 4048 1 6 . 1 1 40 40 LEU C C 40 178.700 178.700 178.661 0.039 18112 4049 1 6 . 1 1 40 40 LEU CA C 40 58.455 58.455 58.961 -0.506 18112 4050 1 6 . 1 1 40 40 LEU CB C 40 40.304 40.304 41.887 -1.583 18112 4051 1 6 . 1 1 40 40 LEU H H 40 8.167 8.167 8.448 -0.281 18112 4052 1 6 . 1 1 41 41 LYS N N 41 116.791 116.791 117.358 -0.567 18112 4053 1 6 . 1 1 41 41 LYS HA H 41 3.475 3.475 3.881 -0.406 18112 4054 1 6 . 1 1 41 41 LYS C C 41 178.793 178.793 178.552 0.241 18112 4055 1 6 . 1 1 41 41 LYS CA C 41 59.161 59.161 59.236 -0.075 18112 4056 1 6 . 1 1 41 41 LYS CB C 41 30.992 30.992 32.347 -1.355 18112 4057 1 6 . 1 1 41 41 LYS H H 41 7.632 7.632 7.905 -0.273 18112 4058 1 6 . 1 1 42 42 THR N N 42 112.819 112.819 113.604 -0.785 18112 4059 1 6 . 1 1 42 42 THR HA H 42 4.230 4.230 4.295 -0.065 18112 4060 1 6 . 1 1 42 42 THR C C 42 176.142 176.142 176.942 -0.800 18112 4061 1 6 . 1 1 42 42 THR CA C 42 65.107 65.107 65.341 -0.234 18112 4062 1 6 . 1 1 42 42 THR CB C 42 68.306 68.306 69.229 -0.923 18112 4063 1 6 . 1 1 42 42 THR H H 42 7.469 7.469 7.833 -0.364 18112 4064 1 6 . 1 1 43 43 TYR N N 43 118.565 118.565 120.429 -1.864 18112 4065 1 6 . 1 1 43 43 TYR HA H 43 4.204 4.204 4.435 -0.231 18112 4066 1 6 . 1 1 43 43 TYR C C 43 174.240 174.240 176.651 -2.411 18112 4067 1 6 . 1 1 43 43 TYR CA C 43 60.886 60.886 57.644 3.242 18112 4068 1 6 . 1 1 43 43 TYR CB C 43 38.165 38.165 38.395 -0.230 18112 4069 1 6 . 1 1 43 43 TYR H H 43 7.978 7.978 7.627 0.351 18112 4070 1 6 . 1 1 44 44 PHE N N 44 120.980 120.980 118.597 2.383 18112 4071 1 6 . 1 1 44 44 PHE HA H 44 4.920 4.920 4.795 0.125 18112 4072 1 6 . 1 1 44 44 PHE C C 44 176.436 176.436 177.018 -0.582 18112 4073 1 6 . 1 1 44 44 PHE CA C 44 56.672 56.672 58.240 -1.568 18112 4074 1 6 . 1 1 44 44 PHE CB C 44 36.570 36.570 37.931 -1.361 18112 4075 1 6 . 1 1 44 44 PHE H H 44 7.955 7.955 7.943 0.012 18112 4076 1 6 . 1 1 45 45 SER N N 45 113.407 113.407 117.866 -4.459 18112 4077 1 6 . 1 1 45 45 SER HA H 45 4.373 4.373 4.576 -0.203 18112 4078 1 6 . 1 1 45 45 SER C C 45 174.424 174.424 174.065 0.359 18112 4079 1 6 . 1 1 45 45 SER CA C 45 61.037 61.037 58.136 2.901 18112 4080 1 6 . 1 1 45 45 SER CB C 45 62.711 62.711 63.830 -1.119 18112 4081 1 6 . 1 1 45 45 SER H H 45 7.932 7.932 8.466 -0.534 18112 4082 1 6 . 1 1 46 46 ASP N N 46 118.099 118.099 117.188 0.911 18112 4083 1 6 . 1 1 46 46 ASP HA H 46 4.572 4.572 4.498 0.074 18112 4084 1 6 . 1 1 46 46 ASP C C 46 174.866 174.866 175.023 -0.157 18112 4085 1 6 . 1 1 46 46 ASP CA C 46 53.602 53.602 54.320 -0.718 18112 4086 1 6 . 1 1 46 46 ASP CB C 46 38.992 38.992 40.829 -1.837 18112 4087 1 6 . 1 1 46 46 ASP H H 46 9.889 9.889 8.362 1.527 18112 4088 1 6 . 1 1 47 47 VAL N N 47 121.496 121.496 120.806 0.690 18112 4089 1 6 . 1 1 47 47 VAL HA H 47 4.058 4.058 3.877 0.181 18112 4090 1 6 . 1 1 47 47 VAL C C 47 174.676 174.676 175.397 -0.721 18112 4091 1 6 . 1 1 47 47 VAL CA C 47 61.006 61.006 61.170 -0.164 18112 4092 1 6 . 1 1 47 47 VAL CB C 47 32.110 32.110 31.911 0.199 18112 4093 1 6 . 1 1 47 47 VAL H H 47 7.781 7.781 7.113 0.668 18112 4094 1 6 . 1 1 48 48 LYS N N 48 126.100 126.100 128.000 -1.900 18112 4095 1 6 . 1 1 48 48 LYS HA H 48 4.402 4.402 4.163 0.239 18112 4096 1 6 . 1 1 48 48 LYS C C 48 175.564 175.564 176.254 -0.690 18112 4097 1 6 . 1 1 48 48 LYS CA C 48 54.874 54.874 57.141 -2.267 18112 4098 1 6 . 1 1 48 48 LYS CB C 48 30.189 30.189 32.757 -2.568 18112 4099 1 6 . 1 1 48 48 LYS H H 48 8.245 8.245 8.547 -0.302 18112 4100 1 6 . 1 1 49 49 PHE N N 49 125.341 125.341 114.130 11.211 18112 4101 1 6 . 1 1 49 49 PHE HA H 49 3.813 3.813 4.312 -0.499 18112 4102 1 6 . 1 1 49 49 PHE C C 49 175.708 175.708 174.617 1.091 18112 4103 1 6 . 1 1 49 49 PHE CA C 49 60.861 60.861 57.672 3.189 18112 4104 1 6 . 1 1 49 49 PHE CB C 49 38.616 38.616 36.057 2.559 18112 4105 1 6 . 1 1 49 49 PHE H H 49 8.626 8.626 7.663 0.963 18112 4106 1 6 . 1 1 50 50 ASN N N 50 115.408 115.408 118.809 -3.401 18112 4107 1 6 . 1 1 50 50 ASN C C 50 176.072 176.072 175.522 0.550 18112 4108 1 6 . 1 1 50 50 ASN CA C 50 51.730 51.730 51.141 0.589 18112 4109 1 6 . 1 1 50 50 ASN H H 50 7.030 7.030 7.839 -0.809 18112 4110 1 6 . 1 1 51 51 ARG N N 51 122.706 122.706 122.167 0.539 18112 4111 1 6 . 1 1 51 51 ARG CA C 51 59.534 59.534 59.094 0.440 18112 4112 1 6 . 1 1 51 51 ARG H H 51 7.790 7.790 8.992 -1.202 18112 4113 1 6 . 1 1 52 52 CYS N N 52 117.340 117.340 116.420 0.920 18112 4114 1 6 . 1 1 52 52 CYS HA H 52 4.108 4.108 4.157 -0.049 18112 4115 1 6 . 1 1 52 52 CYS C C 52 178.200 178.200 177.188 1.012 18112 4116 1 6 . 1 1 52 52 CYS CA C 52 61.143 61.143 62.138 -0.995 18112 4117 1 6 . 1 1 52 52 CYS H H 52 7.681 7.681 8.055 -0.374 18112 4118 1 6 . 1 1 53 53 ILE N N 53 122.321 122.321 117.299 5.022 18112 4119 1 6 . 1 1 53 53 ILE HA H 53 3.588 3.588 3.584 0.003 18112 4120 1 6 . 1 1 53 53 ILE C C 53 177.492 177.492 177.267 0.225 18112 4121 1 6 . 1 1 53 53 ILE CA C 53 64.109 64.109 64.584 -0.475 18112 4122 1 6 . 1 1 53 53 ILE CB C 53 37.603 37.603 37.434 0.169 18112 4123 1 6 . 1 1 53 53 ILE H H 53 8.035 8.035 8.092 -0.057 18112 4124 1 6 . 1 1 54 54 THR C C 54 175.903 175.903 176.408 -0.505 18112 4125 1 6 . 1 1 54 54 THR CA C 54 67.308 67.308 66.752 0.555 18112 4126 1 6 . 1 1 55 55 SER N N 55 113.819 113.819 117.607 -3.788 18112 4127 1 6 . 1 1 55 55 SER H H 55 7.844 7.844 7.942 -0.098 18112 4128 1 6 . 1 1 56 56 GLN C C 56 179.792 179.792 177.839 1.953 18112 4129 1 6 . 1 1 57 57 LEU N N 57 116.701 116.701 120.417 -3.716 18112 4130 1 6 . 1 1 57 57 LEU HA H 57 4.519 4.519 2.757 1.762 18112 4131 1 6 . 1 1 57 57 LEU C C 57 178.775 178.775 178.015 0.760 18112 4132 1 6 . 1 1 57 57 LEU CA C 57 55.232 55.232 57.118 -1.886 18112 4133 1 6 . 1 1 57 57 LEU CB C 57 37.131 37.131 41.482 -4.351 18112 4134 1 6 . 1 1 57 57 LEU H H 57 8.267 8.267 7.487 0.780 18112 4135 1 6 . 1 1 58 58 ILE N N 58 122.522 122.522 118.715 3.807 18112 4136 1 6 . 1 1 58 58 ILE HA H 58 4.640 4.640 3.541 1.099 18112 4137 1 6 . 1 1 58 58 ILE C C 58 177.380 177.380 177.905 -0.525 18112 4138 1 6 . 1 1 58 58 ILE CA C 58 62.163 62.163 64.801 -2.638 18112 4139 1 6 . 1 1 58 58 ILE CB C 58 30.657 30.657 37.585 -6.928 18112 4140 1 6 . 1 1 58 58 ILE H H 58 8.111 8.111 8.002 0.109 18112 4141 1 6 . 1 1 59 59 LYS N N 59 121.002 121.002 120.199 0.803 18112 4142 1 6 . 1 1 59 59 LYS C C 59 177.600 177.600 179.234 -1.634 18112 4143 1 6 . 1 1 59 59 LYS CA C 59 57.570 57.570 58.727 -1.157 18112 4144 1 6 . 1 1 59 59 LYS CB C 59 39.101 39.101 31.459 7.642 18112 4145 1 6 . 1 1 59 59 LYS H H 59 7.432 7.432 7.867 -0.435 18112 4146 1 6 . 1 1 60 60 TRP N N 60 118.679 118.679 120.739 -2.060 18112 4147 1 6 . 1 1 60 60 TRP HA H 60 3.739 3.739 4.125 -0.386 18112 4148 1 6 . 1 1 60 60 TRP C C 60 178.246 178.246 178.893 -0.647 18112 4149 1 6 . 1 1 60 60 TRP CA C 60 59.818 59.818 58.920 0.898 18112 4150 1 6 . 1 1 60 60 TRP CB C 60 31.851 31.851 28.370 3.481 18112 4151 1 6 . 1 1 60 60 TRP H H 60 7.565 7.565 8.072 -0.507 18112 4152 1 6 . 1 1 61 61 PHE N N 61 118.005 118.005 116.281 1.724 18112 4153 1 6 . 1 1 61 61 PHE HA H 61 3.882 3.882 4.066 -0.184 18112 4154 1 6 . 1 1 61 61 PHE CA C 61 60.054 60.054 59.427 0.627 18112 4155 1 6 . 1 1 61 61 PHE H H 61 7.819 7.819 8.403 -0.584 18112 4156 1 6 . 1 1 62 62 SER N N 62 121.144 121.144 115.108 6.036 18112 4157 1 6 . 1 1 62 62 SER C C 62 177.840 177.840 176.857 0.983 18112 4158 1 6 . 1 1 62 62 SER CA C 62 55.892 55.892 61.387 -5.495 18112 4159 1 6 . 1 1 62 62 SER H H 62 8.878 8.878 8.494 0.384 18112 4160 1 6 . 1 1 63 63 ASN N N 63 115.303 115.303 121.570 -6.267 18112 4161 1 6 . 1 1 63 63 ASN C C 63 177.222 177.222 177.815 -0.593 18112 4162 1 6 . 1 1 63 63 ASN CA C 63 60.467 60.467 55.987 4.480 18112 4163 1 6 . 1 1 63 63 ASN H H 63 8.001 8.001 7.963 0.038 18112 4164 1 6 . 1 1 64 64 PHE N N 64 112.571 112.571 119.368 -6.797 18112 4165 1 6 . 1 1 64 64 PHE CA C 64 56.453 56.453 61.240 -4.787 18112 4166 1 6 . 1 1 64 64 PHE H H 64 7.082 7.082 8.273 -1.191 18112 4167 1 6 . 1 1 65 65 ARG N N 65 116.695 116.695 121.391 -4.696 18112 4168 1 6 . 1 1 65 65 ARG CA C 65 59.590 59.590 59.799 -0.209 18112 4169 1 6 . 1 1 65 65 ARG H H 65 8.091 8.091 8.628 -0.537 18112 4170 1 6 . 1 1 66 66 GLU N N 66 121.653 121.653 118.929 2.724 18112 4171 1 6 . 1 1 66 66 GLU HA H 66 4.739 4.739 4.206 0.533 18112 4172 1 6 . 1 1 66 66 GLU C C 66 174.621 174.621 178.989 -4.368 18112 4173 1 6 . 1 1 66 66 GLU CA C 66 59.583 59.583 59.609 -0.026 18112 4174 1 6 . 1 1 66 66 GLU H H 66 7.597 7.597 8.347 -0.750 18112 4175 1 6 . 1 1 67 67 PHE N N 67 111.578 111.578 120.840 -9.262 18112 4176 1 6 . 1 1 67 67 PHE C C 67 176.164 176.164 177.860 -1.696 18112 4177 1 6 . 1 1 67 67 PHE CA C 67 61.156 61.156 61.419 -0.263 18112 4178 1 6 . 1 1 67 67 PHE H H 67 7.067 7.067 8.230 -1.163 18112 4179 1 6 . 1 1 68 68 TYR N N 68 119.370 119.370 119.692 -0.322 18112 4180 1 6 . 1 1 68 68 TYR C C 68 176.844 176.844 178.211 -1.367 18112 4181 1 6 . 1 1 68 68 TYR CA C 68 61.758 61.758 61.883 -0.125 18112 4182 1 6 . 1 1 68 68 TYR H H 68 7.442 7.442 9.138 -1.696 18112 4183 1 6 . 1 1 69 69 TYR N N 69 116.047 116.047 120.854 -4.807 18112 4184 1 6 . 1 1 69 69 TYR HA H 69 4.086 4.086 4.048 0.038 18112 4185 1 6 . 1 1 69 69 TYR C C 69 180.328 180.328 177.363 2.965 18112 4186 1 6 . 1 1 69 69 TYR CA C 69 61.528 61.528 62.112 -0.584 18112 4187 1 6 . 1 1 69 69 TYR H H 69 9.127 9.127 8.305 0.822 18112 4188 1 6 . 1 1 70 70 ILE N N 70 124.738 124.738 118.469 6.269 18112 4189 1 6 . 1 1 70 70 ILE HA H 70 3.828 3.828 3.417 0.411 18112 4190 1 6 . 1 1 70 70 ILE C C 70 179.585 179.585 178.019 1.566 18112 4191 1 6 . 1 1 70 70 ILE CA C 70 65.787 65.787 64.576 1.211 18112 4192 1 6 . 1 1 70 70 ILE CB C 70 36.435 36.435 37.314 -0.879 18112 4193 1 6 . 1 1 70 70 ILE H H 70 8.631 8.631 8.168 0.463 18112 4194 1 6 . 1 1 71 71 GLN N N 71 117.940 117.940 119.236 -1.296 18112 4195 1 6 . 1 1 71 71 GLN HA H 71 3.826 3.826 3.527 0.299 18112 4196 1 6 . 1 1 71 71 GLN C C 71 178.192 178.192 178.094 0.098 18112 4197 1 6 . 1 1 71 71 GLN CA C 71 57.779 57.779 58.140 -0.361 18112 4198 1 6 . 1 1 71 71 GLN H H 71 7.738 7.738 7.869 -0.131 18112 4199 1 6 . 1 1 72 72 MET N N 72 117.353 117.353 117.682 -0.329 18112 4200 1 6 . 1 1 72 72 MET HA H 72 4.112 4.112 4.218 -0.106 18112 4201 1 6 . 1 1 72 72 MET C C 72 177.203 177.203 178.296 -1.093 18112 4202 1 6 . 1 1 72 72 MET CA C 72 57.272 57.272 56.489 0.783 18112 4203 1 6 . 1 1 72 72 MET H H 72 7.844 7.844 8.020 -0.176 18112 4204 1 6 . 1 1 73 73 GLU N N 73 117.858 117.858 120.567 -2.709 18112 4205 1 6 . 1 1 73 73 GLU HA H 73 3.572 3.572 3.722 -0.150 18112 4206 1 6 . 1 1 73 73 GLU C C 73 177.344 177.344 178.368 -1.024 18112 4207 1 6 . 1 1 73 73 GLU CA C 73 60.324 60.324 59.492 0.832 18112 4208 1 6 . 1 1 73 73 GLU H H 73 7.503 7.503 7.924 -0.421 18112 4209 1 6 . 1 1 74 74 LYS N N 74 118.716 118.716 119.951 -1.235 18112 4210 1 6 . 1 1 74 74 LYS HA H 74 3.867 3.867 3.907 -0.040 18112 4211 1 6 . 1 1 74 74 LYS C C 74 180.077 180.077 179.190 0.887 18112 4212 1 6 . 1 1 74 74 LYS CA C 74 59.754 59.754 58.712 1.042 18112 4213 1 6 . 1 1 74 74 LYS H H 74 7.912 7.912 7.478 0.434 18112 4214 1 6 . 1 1 75 75 TYR N N 75 117.309 117.309 118.078 -0.769 18112 4215 1 6 . 1 1 75 75 TYR HA H 75 4.085 4.085 4.209 -0.124 18112 4216 1 6 . 1 1 75 75 TYR C C 75 178.874 178.874 178.333 0.541 18112 4217 1 6 . 1 1 75 75 TYR CA C 75 63.306 63.306 59.787 3.519 18112 4218 1 6 . 1 1 75 75 TYR H H 75 8.421 8.421 7.848 0.573 18112 4219 1 6 . 1 1 76 76 ALA N N 76 125.392 125.392 120.786 4.606 18112 4220 1 6 . 1 1 76 76 ALA HA H 76 4.221 4.221 4.086 0.135 18112 4221 1 6 . 1 1 76 76 ALA C C 76 178.850 178.850 179.301 -0.451 18112 4222 1 6 . 1 1 76 76 ALA CA C 76 56.280 56.280 55.258 1.022 18112 4223 1 6 . 1 1 76 76 ALA CB C 76 18.687 18.687 18.480 0.207 18112 4224 1 6 . 1 1 76 76 ALA H H 76 8.553 8.553 8.335 0.218 18112 4225 1 6 . 1 1 77 77 ARG N N 77 115.067 115.067 118.783 -3.716 18112 4226 1 6 . 1 1 77 77 ARG HA H 77 3.935 3.935 3.908 0.027 18112 4227 1 6 . 1 1 77 77 ARG C C 77 179.341 179.341 178.611 0.730 18112 4228 1 6 . 1 1 77 77 ARG CA C 77 60.499 60.499 59.656 0.843 18112 4229 1 6 . 1 1 77 77 ARG H H 77 8.471 8.471 7.979 0.492 18112 4230 1 6 . 1 1 78 78 GLN N N 78 120.107 120.107 117.317 2.790 18112 4231 1 6 . 1 1 78 78 GLN HA H 78 3.921 3.921 4.158 -0.237 18112 4232 1 6 . 1 1 78 78 GLN C C 78 177.289 177.289 178.443 -1.154 18112 4233 1 6 . 1 1 78 78 GLN CA C 78 58.619 58.619 57.957 0.662 18112 4234 1 6 . 1 1 78 78 GLN CB C 78 27.752 27.752 28.200 -0.448 18112 4235 1 6 . 1 1 78 78 GLN H H 78 8.142 8.142 8.034 0.108 18112 4236 1 6 . 1 1 79 79 ALA N N 79 120.809 120.809 123.991 -3.182 18112 4237 1 6 . 1 1 79 79 ALA HA H 79 4.308 4.308 4.028 0.280 18112 4238 1 6 . 1 1 79 79 ALA C C 79 179.924 179.924 179.509 0.415 18112 4239 1 6 . 1 1 79 79 ALA CA C 79 54.970 54.970 55.294 -0.324 18112 4240 1 6 . 1 1 79 79 ALA CB C 79 17.064 17.064 18.422 -1.358 18112 4241 1 6 . 1 1 79 79 ALA H H 79 7.811 7.811 8.052 -0.241 18112 4242 1 6 . 1 1 80 80 ILE N N 80 118.524 118.524 118.305 0.219 18112 4243 1 6 . 1 1 80 80 ILE HA H 80 3.894 3.894 3.704 0.190 18112 4244 1 6 . 1 1 80 80 ILE C C 80 181.268 181.268 178.189 3.079 18112 4245 1 6 . 1 1 80 80 ILE CA C 80 64.841 64.841 64.131 0.710 18112 4246 1 6 . 1 1 80 80 ILE CB C 80 37.125 37.125 37.658 -0.533 18112 4247 1 6 . 1 1 80 80 ILE H H 80 7.837 7.837 8.054 -0.217 18112 4248 1 6 . 1 1 81 81 ASN N N 81 121.233 121.233 117.927 3.306 18112 4249 1 6 . 1 1 81 81 ASN HA H 81 4.398 4.398 4.430 -0.032 18112 4250 1 6 . 1 1 81 81 ASN C C 81 176.546 176.546 176.946 -0.400 18112 4251 1 6 . 1 1 81 81 ASN CA C 81 55.892 55.892 55.941 -0.049 18112 4252 1 6 . 1 1 81 81 ASN CB C 81 37.603 37.603 38.656 -1.053 18112 4253 1 6 . 1 1 81 81 ASN H H 81 8.262 8.262 8.211 0.051 18112 4254 1 6 . 1 1 82 82 ASP N N 82 119.240 119.240 117.180 2.060 18112 4255 1 6 . 1 1 82 82 ASP HA H 82 4.666 4.666 4.634 0.032 18112 4256 1 6 . 1 1 82 82 ASP C C 82 176.767 176.767 177.235 -0.468 18112 4257 1 6 . 1 1 82 82 ASP CA C 82 54.771 54.771 54.469 0.302 18112 4258 1 6 . 1 1 82 82 ASP CB C 82 40.121 40.121 41.630 -1.509 18112 4259 1 6 . 1 1 82 82 ASP H H 82 8.316 8.316 7.950 0.366 18112 4260 1 6 . 1 1 83 83 GLY N N 83 106.913 106.913 106.538 0.375 18112 4261 1 6 . 1 1 83 83 GLY C C 83 174.601 174.601 175.399 -0.798 18112 4262 1 6 . 1 1 83 83 GLY CA C 83 45.214 45.214 45.316 -0.102 18112 4263 1 6 . 1 1 83 83 GLY H H 83 7.810 7.810 7.917 -0.107 18112 4264 1 6 . 1 1 84 84 VAL N N 84 122.981 122.981 120.558 2.423 18112 4265 1 6 . 1 1 84 84 VAL HA H 84 3.850 3.850 3.690 0.160 18112 4266 1 6 . 1 1 84 84 VAL C C 84 177.265 177.265 176.858 0.407 18112 4267 1 6 . 1 1 84 84 VAL CA C 84 64.270 64.270 65.145 -0.875 18112 4268 1 6 . 1 1 84 84 VAL CB C 84 30.471 30.471 31.871 -1.400 18112 4269 1 6 . 1 1 84 84 VAL H H 84 8.157 8.157 7.765 0.392 18112 4270 1 6 . 1 1 85 85 THR N N 85 115.232 115.232 109.224 6.008 18112 4271 1 6 . 1 1 85 85 THR HA H 85 4.716 4.716 3.889 0.827 18112 4272 1 6 . 1 1 85 85 THR C C 85 174.489 174.489 172.668 1.821 18112 4273 1 6 . 1 1 85 85 THR CA C 85 61.618 61.618 64.190 -2.572 18112 4274 1 6 . 1 1 85 85 THR CB C 85 70.081 70.081 68.693 1.388 18112 4275 1 6 . 1 1 85 85 THR H H 85 8.890 8.890 7.736 1.154 18112 4276 1 6 . 1 1 86 86 SER N N 86 117.009 117.009 115.774 1.235 18112 4277 1 6 . 1 1 86 86 SER HA H 86 5.046 5.046 4.248 0.798 18112 4278 1 6 . 1 1 86 86 SER C C 86 174.473 174.473 175.196 -0.723 18112 4279 1 6 . 1 1 86 86 SER CA C 86 55.922 55.922 57.024 -1.102 18112 4280 1 6 . 1 1 86 86 SER CB C 86 64.385 64.385 64.147 0.238 18112 4281 1 6 . 1 1 86 86 SER H H 86 7.704 7.704 7.673 0.031 18112 4282 1 6 . 1 1 87 87 THR N N 87 118.634 118.634 119.421 -0.787 18112 4283 1 6 . 1 1 87 87 THR HA H 87 4.065 4.065 4.104 -0.039 18112 4284 1 6 . 1 1 87 87 THR C C 87 176.047 176.047 175.506 0.541 18112 4285 1 6 . 1 1 87 87 THR CA C 87 64.983 64.983 65.032 -0.049 18112 4286 1 6 . 1 1 87 87 THR CB C 87 68.045 68.045 69.029 -0.984 18112 4287 1 6 . 1 1 87 87 THR H H 87 8.711 8.711 8.515 0.196 18112 4288 1 6 . 1 1 88 88 GLU N N 88 117.889 117.889 120.078 -2.189 18112 4289 1 6 . 1 1 88 88 GLU HA H 88 3.881 3.881 4.156 -0.275 18112 4290 1 6 . 1 1 88 88 GLU C C 88 177.146 177.146 176.904 0.242 18112 4291 1 6 . 1 1 88 88 GLU CA C 88 57.814 57.814 57.993 -0.179 18112 4292 1 6 . 1 1 88 88 GLU CB C 88 28.050 28.050 29.399 -1.349 18112 4293 1 6 . 1 1 88 88 GLU H H 88 8.152 8.152 8.232 -0.080 18112 4294 1 6 . 1 1 89 89 GLU N N 89 115.617 115.617 118.774 -3.157 18112 4295 1 6 . 1 1 89 89 GLU HA H 89 4.149 4.149 4.125 0.024 18112 4296 1 6 . 1 1 89 89 GLU C C 89 176.192 176.192 177.666 -1.474 18112 4297 1 6 . 1 1 89 89 GLU CA C 89 56.133 56.133 58.320 -2.187 18112 4298 1 6 . 1 1 89 89 GLU CB C 89 29.415 29.415 30.053 -0.638 18112 4299 1 6 . 1 1 89 89 GLU H H 89 7.311 7.311 7.614 -0.303 18112 4300 1 6 . 1 1 90 90 LEU N N 90 120.870 120.870 114.921 5.949 18112 4301 1 6 . 1 1 90 90 LEU HA H 90 4.439 4.439 4.595 -0.156 18112 4302 1 6 . 1 1 90 90 LEU C C 90 175.267 175.267 176.733 -1.466 18112 4303 1 6 . 1 1 90 90 LEU CA C 90 53.504 53.504 55.291 -1.786 18112 4304 1 6 . 1 1 90 90 LEU CB C 90 40.479 40.479 42.118 -1.639 18112 4305 1 6 . 1 1 90 90 LEU H H 90 7.311 7.311 7.138 0.173 18112 4306 1 6 . 1 1 91 91 SER N N 91 118.376 118.376 116.111 2.265 18112 4307 1 6 . 1 1 91 91 SER HA H 91 4.747 4.747 4.674 0.073 18112 4308 1 6 . 1 1 91 91 SER C C 91 173.332 173.332 173.204 0.128 18112 4309 1 6 . 1 1 91 91 SER CA C 91 56.314 56.314 58.646 -2.332 18112 4310 1 6 . 1 1 91 91 SER CB C 91 64.615 64.615 62.528 2.087 18112 4311 1 6 . 1 1 91 91 SER H H 91 8.221 8.221 7.898 0.323 18112 4312 1 6 . 1 1 92 92 ILE N N 92 122.247 122.247 124.056 -1.809 18112 4313 1 6 . 1 1 92 92 ILE HA H 92 4.537 4.537 4.441 0.096 18112 4314 1 6 . 1 1 92 92 ILE C C 92 174.059 174.059 174.318 -0.259 18112 4315 1 6 . 1 1 92 92 ILE CA C 92 59.881 59.881 59.242 0.639 18112 4316 1 6 . 1 1 92 92 ILE CB C 92 37.820 37.820 42.694 -4.874 18112 4317 1 6 . 1 1 92 92 ILE H H 92 8.570 8.570 7.594 0.976 18112 4318 1 6 . 1 1 93 93 THR N N 93 116.069 116.069 117.602 -1.533 18112 4319 1 6 . 1 1 93 93 THR HA H 93 4.580 4.580 4.546 0.034 18112 4320 1 6 . 1 1 93 93 THR C C 93 175.049 175.049 174.257 0.792 18112 4321 1 6 . 1 1 93 93 THR CA C 93 58.988 58.988 64.335 -5.347 18112 4322 1 6 . 1 1 93 93 THR CB C 93 71.362 71.362 69.172 2.190 18112 4323 1 6 . 1 1 93 93 THR H H 93 7.224 7.224 8.640 -1.416 18112 4324 1 6 . 1 1 94 94 ARG N N 94 116.595 116.595 122.684 -6.089 18112 4325 1 6 . 1 1 94 94 ARG HA H 94 3.077 3.077 3.642 -0.565 18112 4326 1 6 . 1 1 94 94 ARG C C 94 175.076 175.076 174.413 0.663 18112 4327 1 6 . 1 1 94 94 ARG CA C 94 57.119 57.119 56.526 0.593 18112 4328 1 6 . 1 1 94 94 ARG CB C 94 27.838 27.838 29.433 -1.595 18112 4329 1 6 . 1 1 94 94 ARG H H 94 8.596 8.596 8.443 0.153 18112 4330 1 6 . 1 1 95 95 ASP N N 95 113.735 113.735 115.532 -1.797 18112 4331 1 6 . 1 1 95 95 ASP HA H 95 4.765 4.765 3.670 1.095 18112 4332 1 6 . 1 1 95 95 ASP C C 95 175.876 175.876 175.037 0.839 18112 4333 1 6 . 1 1 95 95 ASP CA C 95 53.156 53.156 55.316 -2.160 18112 4334 1 6 . 1 1 95 95 ASP CB C 95 41.166 41.166 39.535 1.631 18112 4335 1 6 . 1 1 95 95 ASP H H 95 7.607 7.607 7.194 0.413 18112 4336 1 6 . 1 1 96 96 CYS N N 96 116.012 116.012 116.531 -0.519 18112 4337 1 6 . 1 1 96 96 CYS C C 96 174.361 174.361 175.602 -1.241 18112 4338 1 6 . 1 1 96 96 CYS CA C 96 56.562 56.562 59.647 -3.085 18112 4339 1 6 . 1 1 96 96 CYS CB C 96 29.416 29.416 29.396 0.020 18112 4340 1 6 . 1 1 96 96 CYS H H 96 7.094 7.094 7.127 -0.033 18112 4341 1 6 . 1 1 97 97 GLU N N 97 123.087 123.087 120.983 2.104 18112 4342 1 6 . 1 1 97 97 GLU C C 97 178.748 178.748 178.366 0.382 18112 4343 1 6 . 1 1 97 97 GLU CA C 97 59.912 59.912 59.068 0.844 18112 4344 1 6 . 1 1 97 97 GLU CB C 97 29.195 29.195 29.027 0.168 18112 4345 1 6 . 1 1 97 97 GLU H H 97 9.003 9.003 8.624 0.379 18112 4346 1 6 . 1 1 98 98 LEU N N 98 120.942 120.942 120.819 0.123 18112 4347 1 6 . 1 1 98 98 LEU HA H 98 3.614 3.614 4.103 -0.489 18112 4348 1 6 . 1 1 98 98 LEU C C 98 177.796 177.796 178.425 -0.629 18112 4349 1 6 . 1 1 98 98 LEU CA C 98 58.090 58.090 58.399 -0.309 18112 4350 1 6 . 1 1 98 98 LEU CB C 98 39.778 39.778 41.684 -1.906 18112 4351 1 6 . 1 1 98 98 LEU H H 98 8.656 8.656 7.751 0.905 18112 4352 1 6 . 1 1 99 99 TYR N N 99 118.313 118.313 117.872 0.441 18112 4353 1 6 . 1 1 99 99 TYR C C 99 177.077 177.077 178.752 -1.675 18112 4354 1 6 . 1 1 99 99 TYR CA C 99 62.622 62.622 61.145 1.477 18112 4355 1 6 . 1 1 99 99 TYR CB C 99 38.742 38.742 37.430 1.312 18112 4356 1 6 . 1 1 99 99 TYR H H 99 7.522 7.522 7.906 -0.384 18112 4357 1 6 . 1 1 100 100 ARG N N 100 118.101 118.101 118.716 -0.615 18112 4358 1 6 . 1 1 100 100 ARG C C 100 178.616 178.616 178.720 -0.104 18112 4359 1 6 . 1 1 100 100 ARG CA C 100 59.915 59.915 59.749 0.166 18112 4360 1 6 . 1 1 100 100 ARG CB C 100 29.100 29.100 29.965 -0.865 18112 4361 1 6 . 1 1 100 100 ARG H H 100 8.243 8.243 8.330 -0.087 18112 4362 1 6 . 1 1 101 101 ALA N N 101 120.972 120.972 122.596 -1.624 18112 4363 1 6 . 1 1 101 101 ALA HA H 101 4.145 4.145 4.015 0.130 18112 4364 1 6 . 1 1 101 101 ALA C C 101 181.359 181.359 179.685 1.674 18112 4365 1 6 . 1 1 101 101 ALA CA C 101 55.057 55.057 55.141 -0.084 18112 4366 1 6 . 1 1 101 101 ALA CB C 101 17.543 17.543 18.743 -1.200 18112 4367 1 6 . 1 1 101 101 ALA H H 101 8.352 8.352 8.041 0.311 18112 4368 1 6 . 1 1 102 102 LEU N N 102 115.683 115.683 118.890 -3.207 18112 4369 1 6 . 1 1 102 102 LEU HA H 102 4.333 4.333 4.425 -0.092 18112 4370 1 6 . 1 1 102 102 LEU C C 102 178.583 178.583 179.827 -1.244 18112 4371 1 6 . 1 1 102 102 LEU CA C 102 57.634 57.634 58.240 -0.606 18112 4372 1 6 . 1 1 102 102 LEU CB C 102 41.716 41.716 41.461 0.255 18112 4373 1 6 . 1 1 102 102 LEU H H 102 7.960 7.960 8.549 -0.589 18112 4374 1 6 . 1 1 103 103 ASN N N 103 118.957 118.957 118.263 0.694 18112 4375 1 6 . 1 1 103 103 ASN C C 103 177.470 177.470 177.885 -0.415 18112 4376 1 6 . 1 1 103 103 ASN CA C 103 56.974 56.974 56.022 0.952 18112 4377 1 6 . 1 1 103 103 ASN CB C 103 38.140 38.140 38.119 0.021 18112 4378 1 6 . 1 1 103 103 ASN H H 103 9.301 9.301 8.350 0.951 18112 4379 1 6 . 1 1 104 104 MET N N 104 113.763 113.763 118.970 -5.207 18112 4380 1 6 . 1 1 104 104 MET CA C 104 57.362 57.362 58.587 -1.225 18112 4381 1 6 . 1 1 104 104 MET CB C 104 31.895 31.895 32.694 -0.799 18112 4382 1 6 . 1 1 104 104 MET H H 104 8.332 8.332 8.101 0.231 18112 4383 1 6 . 1 1 105 105 HIS N N 105 116.024 116.024 115.570 0.454 18112 4384 1 6 . 1 1 105 105 HIS HA H 105 3.764 3.764 4.360 -0.596 18112 4385 1 6 . 1 1 105 105 HIS C C 105 176.939 176.939 176.705 0.234 18112 4386 1 6 . 1 1 105 105 HIS CA C 105 59.069 59.069 57.749 1.319 18112 4387 1 6 . 1 1 105 105 HIS H H 105 7.156 7.156 8.122 -0.966 18112 4388 1 6 . 1 1 106 106 TYR N N 106 113.161 113.161 115.589 -2.428 18112 4389 1 6 . 1 1 106 106 TYR C C 106 173.767 173.767 174.577 -0.810 18112 4390 1 6 . 1 1 106 106 TYR CA C 106 58.488 58.488 59.284 -0.796 18112 4391 1 6 . 1 1 106 106 TYR CB C 106 38.225 38.225 39.318 -1.093 18112 4392 1 6 . 1 1 106 106 TYR H H 106 7.204 7.204 8.010 -0.806 18112 4393 1 6 . 1 1 107 107 ASN N N 107 118.875 118.875 116.889 1.986 18112 4394 1 6 . 1 1 107 107 ASN HA H 107 3.922 3.922 4.510 -0.588 18112 4395 1 6 . 1 1 107 107 ASN C C 107 175.815 175.815 175.732 0.083 18112 4396 1 6 . 1 1 107 107 ASN CA C 107 51.233 51.233 53.482 -2.249 18112 4397 1 6 . 1 1 107 107 ASN CB C 107 38.142 38.142 38.289 -0.147 18112 4398 1 6 . 1 1 107 107 ASN H H 107 8.127 8.127 8.036 0.091 18112 4399 1 6 . 1 1 108 108 LYS N N 108 122.850 122.850 125.466 -2.616 18112 4400 1 6 . 1 1 108 108 LYS HA H 108 3.954 3.954 4.006 -0.052 18112 4401 1 6 . 1 1 108 108 LYS C C 108 177.586 177.586 176.686 0.900 18112 4402 1 6 . 1 1 108 108 LYS CA C 108 59.749 59.749 58.920 0.829 18112 4403 1 6 . 1 1 108 108 LYS CB C 108 31.498 31.498 32.582 -1.084 18112 4404 1 6 . 1 1 108 108 LYS H H 108 7.772 7.772 8.600 -0.828 18112 4405 1 6 . 1 1 109 109 ALA N N 109 118.054 118.054 118.872 -0.818 18112 4406 1 6 . 1 1 109 109 ALA HA H 109 4.137 4.137 3.973 0.164 18112 4407 1 6 . 1 1 109 109 ALA C C 109 177.889 177.889 178.099 -0.210 18112 4408 1 6 . 1 1 109 109 ALA CA C 109 52.299 52.299 53.818 -1.518 18112 4409 1 6 . 1 1 109 109 ALA CB C 109 17.787 17.787 17.563 0.224 18112 4410 1 6 . 1 1 109 109 ALA H H 109 8.307 8.307 7.978 0.329 18112 4411 1 6 . 1 1 110 110 ASN N N 110 115.542 115.542 115.501 0.041 18112 4412 1 6 . 1 1 110 110 ASN HA H 110 4.480 4.480 4.340 0.140 18112 4413 1 6 . 1 1 110 110 ASN C C 110 174.277 174.277 175.614 -1.337 18112 4414 1 6 . 1 1 110 110 ASN CA C 110 53.504 53.504 56.475 -2.971 18112 4415 1 6 . 1 1 110 110 ASN CB C 110 37.283 37.283 36.743 0.540 18112 4416 1 6 . 1 1 110 110 ASN H H 110 8.353 8.353 8.552 -0.199 18112 4417 1 6 . 1 1 111 111 ASP N N 111 114.692 114.692 120.725 -6.033 18112 4418 1 6 . 1 1 111 111 ASP HA H 111 4.485 4.485 4.363 0.122 18112 4419 1 6 . 1 1 111 111 ASP C C 111 174.868 174.868 176.783 -1.915 18112 4420 1 6 . 1 1 111 111 ASP CA C 111 53.227 53.227 56.347 -3.120 18112 4421 1 6 . 1 1 111 111 ASP CB C 111 39.228 39.228 41.190 -1.962 18112 4422 1 6 . 1 1 111 111 ASP H H 111 8.297 8.297 8.111 0.186 18112 4423 1 6 . 1 1 112 112 PHE N N 112 120.927 120.927 118.935 1.992 18112 4424 1 6 . 1 1 112 112 PHE HA H 112 4.752 4.752 4.461 0.291 18112 4425 1 6 . 1 1 112 112 PHE C C 112 174.633 174.633 176.427 -1.794 18112 4426 1 6 . 1 1 112 112 PHE CA C 112 56.346 56.346 58.467 -2.121 18112 4427 1 6 . 1 1 112 112 PHE H H 112 7.784 7.784 8.177 -0.393 18112 4428 1 6 . 1 1 113 113 GLU N N 113 128.111 128.111 126.893 1.218 18112 4429 1 6 . 1 1 113 113 GLU HA H 113 4.011 4.011 4.358 -0.347 18112 4430 1 6 . 1 1 113 113 GLU C C 113 173.502 173.502 175.787 -2.285 18112 4431 1 6 . 1 1 113 113 GLU CA C 113 55.100 55.100 55.898 -0.798 18112 4432 1 6 . 1 1 113 113 GLU H H 113 7.752 7.752 8.888 -1.136 18112 4433 1 6 . 1 1 114 114 VAL N N 114 129.326 129.326 115.752 13.574 18112 4434 1 6 . 1 1 114 114 VAL HA H 114 3.241 3.241 3.395 -0.154 18112 4435 1 6 . 1 1 114 114 VAL CA C 114 60.838 60.838 60.897 -0.059 18112 4436 1 6 . 1 1 114 114 VAL CB C 114 32.609 32.609 30.275 2.334 18112 4437 1 6 . 1 1 114 114 VAL H H 114 8.008 8.008 7.236 0.772 18112 4438 1 6 . 1 1 115 115 PRO HA H 115 4.429 4.429 4.478 -0.049 18112 4439 1 6 . 1 1 115 115 PRO C C 115 177.421 177.421 178.311 -0.890 18112 4440 1 6 . 1 1 115 115 PRO CA C 115 61.882 61.882 62.621 -0.739 18112 4441 1 6 . 1 1 115 115 PRO CB C 115 30.974 30.974 32.692 -1.718 18112 4442 1 6 . 1 1 116 116 GLU N N 116 123.936 123.936 121.926 2.010 18112 4443 1 6 . 1 1 116 116 GLU C C 116 179.034 179.034 178.822 0.212 18112 4444 1 6 . 1 1 116 116 GLU CA C 116 58.913 58.913 60.106 -1.193 18112 4445 1 6 . 1 1 116 116 GLU CB C 116 28.378 28.378 29.303 -0.925 18112 4446 1 6 . 1 1 116 116 GLU H H 116 8.757 8.757 8.896 -0.139 18112 4447 1 6 . 1 1 117 117 ARG N N 117 116.943 116.943 118.247 -1.304 18112 4448 1 6 . 1 1 117 117 ARG C C 117 177.570 177.570 178.468 -0.898 18112 4449 1 6 . 1 1 117 117 ARG CA C 117 57.033 57.033 59.106 -2.073 18112 4450 1 6 . 1 1 117 117 ARG CB C 117 28.172 28.172 29.267 -1.095 18112 4451 1 6 . 1 1 117 117 ARG H H 117 8.733 8.733 8.439 0.294 18112 4452 1 6 . 1 1 118 118 PHE N N 118 117.528 117.528 118.852 -1.324 18112 4453 1 6 . 1 1 118 118 PHE HA H 118 4.137 4.137 3.625 0.512 18112 4454 1 6 . 1 1 118 118 PHE C C 118 176.992 176.992 177.559 -0.567 18112 4455 1 6 . 1 1 118 118 PHE CA C 118 61.627 61.627 61.231 0.396 18112 4456 1 6 . 1 1 118 118 PHE CB C 118 37.386 37.386 38.148 -0.761 18112 4457 1 6 . 1 1 118 118 PHE H H 118 7.606 7.606 8.236 -0.630 18112 4458 1 6 . 1 1 119 119 LEU N N 119 118.483 118.483 117.805 0.678 18112 4459 1 6 . 1 1 119 119 LEU HA H 119 3.684 3.684 4.185 -0.501 18112 4460 1 6 . 1 1 119 119 LEU C C 119 178.802 178.802 179.498 -0.696 18112 4461 1 6 . 1 1 119 119 LEU CA C 119 59.875 59.875 56.273 3.602 18112 4462 1 6 . 1 1 119 119 LEU CB C 119 39.453 39.453 40.241 -0.788 18112 4463 1 6 . 1 1 119 119 LEU H H 119 7.248 7.248 7.589 -0.341 18112 4464 1 6 . 1 1 120 120 GLU N N 120 117.870 117.870 121.589 -3.719 18112 4465 1 6 . 1 1 120 120 GLU C C 120 179.932 179.932 178.980 0.952 18112 4466 1 6 . 1 1 120 120 GLU CA C 120 59.150 59.150 59.012 0.138 18112 4467 1 6 . 1 1 120 120 GLU CB C 120 28.878 28.878 29.180 -0.302 18112 4468 1 6 . 1 1 120 120 GLU H H 120 7.423 7.423 8.223 -0.800 18112 4469 1 6 . 1 1 121 121 VAL N N 121 120.777 120.777 120.352 0.425 18112 4470 1 6 . 1 1 121 121 VAL HA H 121 3.545 3.545 3.693 -0.148 18112 4471 1 6 . 1 1 121 121 VAL C C 121 179.302 179.302 178.106 1.196 18112 4472 1 6 . 1 1 121 121 VAL CA C 121 66.875 66.875 66.774 0.101 18112 4473 1 6 . 1 1 121 121 VAL CB C 121 30.823 30.823 31.511 -0.688 18112 4474 1 6 . 1 1 121 121 VAL H H 121 8.313 8.313 7.952 0.361 18112 4475 1 6 . 1 1 122 122 ALA N N 122 127.029 127.029 121.206 5.823 18112 4476 1 6 . 1 1 122 122 ALA HA H 122 4.251 4.251 4.178 0.073 18112 4477 1 6 . 1 1 122 122 ALA C C 122 178.366 178.366 179.557 -1.191 18112 4478 1 6 . 1 1 122 122 ALA CA C 122 54.748 54.748 55.561 -0.813 18112 4479 1 6 . 1 1 122 122 ALA CB C 122 16.565 16.565 18.303 -1.738 18112 4480 1 6 . 1 1 122 122 ALA H H 122 8.896 8.896 8.145 0.751 18112 4481 1 6 . 1 1 123 123 GLN N N 123 119.887 119.887 119.794 0.093 18112 4482 1 6 . 1 1 123 123 GLN C C 123 177.908 177.908 178.547 -0.639 18112 4483 1 6 . 1 1 123 123 GLN CA C 123 60.671 60.671 59.105 1.566 18112 4484 1 6 . 1 1 123 123 GLN H H 123 8.349 8.349 7.929 0.420 18112 4485 1 6 . 1 1 124 124 ILE N N 124 120.632 120.632 118.235 2.397 18112 4486 1 6 . 1 1 124 124 ILE HA H 124 3.651 3.651 3.892 -0.241 18112 4487 1 6 . 1 1 124 124 ILE C C 124 178.703 178.703 178.325 0.378 18112 4488 1 6 . 1 1 124 124 ILE CA C 124 65.945 65.945 64.890 1.055 18112 4489 1 6 . 1 1 124 124 ILE H H 124 8.204 8.204 8.227 -0.023 18112 4490 1 6 . 1 1 125 125 THR N N 125 115.084 115.084 116.433 -1.349 18112 4491 1 6 . 1 1 125 125 THR C C 125 175.568 175.568 176.413 -0.845 18112 4492 1 6 . 1 1 125 125 THR CA C 125 67.872 67.872 66.878 0.994 18112 4493 1 6 . 1 1 125 125 THR H H 125 8.399 8.399 8.236 0.163 18112 4494 1 6 . 1 1 126 126 LEU N N 126 125.011 125.011 121.774 3.237 18112 4495 1 6 . 1 1 126 126 LEU HA H 126 4.085 4.085 4.652 -0.567 18112 4496 1 6 . 1 1 126 126 LEU C C 126 178.559 178.559 178.092 0.467 18112 4497 1 6 . 1 1 126 126 LEU CA C 126 58.843 58.843 57.352 1.491 18112 4498 1 6 . 1 1 126 126 LEU CB C 126 41.421 41.421 41.867 -0.446 18112 4499 1 6 . 1 1 126 126 LEU H H 126 8.728 8.728 8.216 0.512 18112 4500 1 6 . 1 1 127 127 ARG N N 127 117.076 117.076 120.966 -3.890 18112 4501 1 6 . 1 1 127 127 ARG HA H 127 3.929 3.929 4.350 -0.421 18112 4502 1 6 . 1 1 127 127 ARG C C 127 177.984 177.984 178.368 -0.384 18112 4503 1 6 . 1 1 127 127 ARG CA C 127 60.685 60.685 59.972 0.713 18112 4504 1 6 . 1 1 127 127 ARG CB C 127 28.079 28.079 30.176 -2.097 18112 4505 1 6 . 1 1 127 127 ARG H H 127 8.213 8.213 8.380 -0.167 18112 4506 1 6 . 1 1 128 128 GLU N N 128 118.617 118.617 118.034 0.583 18112 4507 1 6 . 1 1 128 128 GLU HA H 128 4.147 4.147 4.007 0.140 18112 4508 1 6 . 1 1 128 128 GLU C C 128 181.150 181.150 179.222 1.928 18112 4509 1 6 . 1 1 128 128 GLU CA C 128 59.508 59.508 58.411 1.097 18112 4510 1 6 . 1 1 128 128 GLU H H 128 8.478 8.478 8.069 0.409 18112 4511 1 6 . 1 1 129 129 PHE N N 129 119.267 119.267 120.305 -1.038 18112 4512 1 6 . 1 1 129 129 PHE HA H 129 4.104 4.104 4.249 -0.145 18112 4513 1 6 . 1 1 129 129 PHE C C 129 177.170 177.170 177.550 -0.380 18112 4514 1 6 . 1 1 129 129 PHE CA C 129 63.694 63.694 61.698 1.996 18112 4515 1 6 . 1 1 129 129 PHE H H 129 8.570 8.570 8.218 0.352 18112 4516 1 6 . 1 1 130 130 PHE N N 130 118.739 118.739 119.120 -0.381 18112 4517 1 6 . 1 1 130 130 PHE HA H 130 3.884 3.884 4.095 -0.211 18112 4518 1 6 . 1 1 130 130 PHE C C 130 175.860 175.860 177.159 -1.299 18112 4519 1 6 . 1 1 130 130 PHE CA C 130 62.819 62.819 61.290 1.529 18112 4520 1 6 . 1 1 130 130 PHE H H 130 8.740 8.740 8.872 -0.132 18112 4521 1 6 . 1 1 131 131 ASN N N 131 116.028 116.028 118.436 -2.408 18112 4522 1 6 . 1 1 131 131 ASN HA H 131 4.373 4.373 3.692 0.681 18112 4523 1 6 . 1 1 131 131 ASN C C 131 178.228 178.228 176.965 1.263 18112 4524 1 6 . 1 1 131 131 ASN CA C 131 55.150 55.150 56.396 -1.246 18112 4525 1 6 . 1 1 131 131 ASN H H 131 8.864 8.864 7.599 1.265 18112 4526 1 6 . 1 1 132 132 ALA N N 132 120.922 120.922 122.915 -1.993 18112 4527 1 6 . 1 1 132 132 ALA HA H 132 4.020 4.020 4.066 -0.046 18112 4528 1 6 . 1 1 132 132 ALA C C 132 178.515 178.515 179.845 -1.330 18112 4529 1 6 . 1 1 132 132 ALA CA C 132 54.924 54.924 55.121 -0.197 18112 4530 1 6 . 1 1 132 132 ALA CB C 132 18.441 18.441 18.570 -0.129 18112 4531 1 6 . 1 1 132 132 ALA H H 132 7.745 7.745 7.771 -0.026 18112 4532 1 6 . 1 1 133 133 ILE N N 133 118.200 118.200 119.971 -1.771 18112 4533 1 6 . 1 1 133 133 ILE HA H 133 3.235 3.235 3.930 -0.695 18112 4534 1 6 . 1 1 133 133 ILE C C 133 180.606 180.606 178.394 2.212 18112 4535 1 6 . 1 1 133 133 ILE CA C 133 65.215 65.215 64.211 1.004 18112 4536 1 6 . 1 1 133 133 ILE CB C 133 38.291 38.291 37.684 0.607 18112 4537 1 6 . 1 1 133 133 ILE H H 133 7.999 7.999 7.987 0.012 18112 4538 1 6 . 1 1 134 134 ILE N N 134 122.564 122.564 120.139 2.425 18112 4539 1 6 . 1 1 134 134 ILE HA H 134 3.788 3.788 3.719 0.069 18112 4540 1 6 . 1 1 134 134 ILE C C 134 177.215 177.215 177.141 0.074 18112 4541 1 6 . 1 1 134 134 ILE CA C 134 63.584 63.584 64.286 -0.702 18112 4542 1 6 . 1 1 134 134 ILE CB C 134 35.636 35.636 38.199 -2.563 18112 4543 1 6 . 1 1 134 134 ILE H H 134 8.670 8.670 8.245 0.425 18112 4544 1 6 . 1 1 135 135 ALA N N 135 119.989 119.989 120.575 -0.586 18112 4545 1 6 . 1 1 135 135 ALA HA H 135 4.357 4.357 4.174 0.183 18112 4546 1 6 . 1 1 135 135 ALA C C 135 177.786 177.786 178.068 -0.282 18112 4547 1 6 . 1 1 135 135 ALA CA C 135 51.521 51.521 53.072 -1.551 18112 4548 1 6 . 1 1 135 135 ALA CB C 135 18.839 18.839 19.627 -0.788 18112 4549 1 6 . 1 1 135 135 ALA H H 135 6.898 6.898 7.975 -1.077 18112 4550 1 6 . 1 1 136 136 GLY N N 136 107.682 107.682 104.610 3.072 18112 4551 1 6 . 1 1 136 136 GLY C C 136 176.324 176.324 175.823 0.501 18112 4552 1 6 . 1 1 136 136 GLY CA C 136 45.469 45.469 44.865 0.604 18112 4553 1 6 . 1 1 136 136 GLY H H 136 7.913 7.913 7.870 0.043 18112 4554 1 6 . 1 1 137 137 LYS N N 137 117.213 117.213 120.768 -3.555 18112 4555 1 6 . 1 1 137 137 LYS HA H 137 4.004 4.004 4.228 -0.224 18112 4556 1 6 . 1 1 137 137 LYS C C 137 176.616 176.616 176.661 -0.045 18112 4557 1 6 . 1 1 137 137 LYS CA C 137 57.499 57.499 56.938 0.561 18112 4558 1 6 . 1 1 137 137 LYS CB C 137 30.927 30.927 31.856 -0.929 18112 4559 1 6 . 1 1 137 137 LYS H H 137 8.312 8.312 8.344 -0.032 18112 4560 1 6 . 1 1 138 138 ASP N N 138 113.545 113.545 115.896 -2.351 18112 4561 1 6 . 1 1 138 138 ASP HA H 138 3.061 3.061 3.374 -0.313 18112 4562 1 6 . 1 1 138 138 ASP C C 138 174.698 174.698 176.665 -1.967 18112 4563 1 6 . 1 1 138 138 ASP CA C 138 53.694 53.694 55.517 -1.823 18112 4564 1 6 . 1 1 138 138 ASP CB C 138 36.008 36.008 39.787 -3.779 18112 4565 1 6 . 1 1 138 138 ASP H H 138 8.465 8.465 7.851 0.614 18112 4566 1 6 . 1 1 139 139 VAL N N 139 115.191 115.191 111.217 3.974 18112 4567 1 6 . 1 1 139 139 VAL HA H 139 3.886 3.886 4.256 -0.370 18112 4568 1 6 . 1 1 139 139 VAL C C 139 175.889 175.889 176.101 -0.212 18112 4569 1 6 . 1 1 139 139 VAL CA C 139 62.793 62.793 61.429 1.363 18112 4570 1 6 . 1 1 139 139 VAL CB C 139 30.662 30.662 32.424 -1.762 18112 4571 1 6 . 1 1 139 139 VAL H H 139 6.610 6.610 7.147 -0.537 18112 4572 1 6 . 1 1 140 140 ASP N N 140 123.363 123.363 123.096 0.267 18112 4573 1 6 . 1 1 140 140 ASP C C 140 175.234 175.234 175.842 -0.608 18112 4574 1 6 . 1 1 140 140 ASP CA C 140 50.221 50.221 51.019 -0.798 18112 4575 1 6 . 1 1 140 140 ASP CB C 140 42.254 42.254 42.904 -0.650 18112 4576 1 6 . 1 1 140 140 ASP H H 140 7.553 7.553 7.472 0.081 18112 4577 1 6 . 1 1 141 141 PRO HA H 141 4.682 4.682 4.464 0.218 18112 4578 1 6 . 1 1 141 141 PRO C C 141 178.678 178.678 178.158 0.520 18112 4579 1 6 . 1 1 141 141 PRO CA C 141 64.532 64.532 65.022 -0.490 18112 4580 1 6 . 1 1 141 141 PRO CB C 141 31.331 31.331 32.156 -0.825 18112 4581 1 6 . 1 1 142 142 SER N N 142 114.421 114.421 114.154 0.267 18112 4582 1 6 . 1 1 142 142 SER HA H 142 4.565 4.565 4.383 0.182 18112 4583 1 6 . 1 1 142 142 SER C C 142 176.524 176.524 176.302 0.222 18112 4584 1 6 . 1 1 142 142 SER CA C 142 58.711 58.711 60.856 -2.145 18112 4585 1 6 . 1 1 142 142 SER CB C 142 62.783 62.783 62.809 -0.025 18112 4586 1 6 . 1 1 142 142 SER H H 142 8.703 8.703 8.096 0.607 18112 4587 1 6 . 1 1 143 143 TRP N N 143 123.598 123.598 122.015 1.583 18112 4588 1 6 . 1 1 143 143 TRP HA H 143 4.136 4.136 4.173 -0.037 18112 4589 1 6 . 1 1 143 143 TRP C C 143 177.113 177.113 176.923 0.190 18112 4590 1 6 . 1 1 143 143 TRP CA C 143 59.803 59.803 59.875 -0.072 18112 4591 1 6 . 1 1 143 143 TRP CB C 143 26.364 26.364 27.954 -1.590 18112 4592 1 6 . 1 1 143 143 TRP H H 143 8.374 8.374 7.900 0.474 18112 4593 1 6 . 1 1 144 144 LYS N N 144 119.293 119.293 119.050 0.243 18112 4594 1 6 . 1 1 144 144 LYS HA H 144 2.719 2.719 3.159 -0.440 18112 4595 1 6 . 1 1 144 144 LYS C C 144 177.243 177.243 177.992 -0.749 18112 4596 1 6 . 1 1 144 144 LYS CA C 144 58.851 58.851 58.247 0.604 18112 4597 1 6 . 1 1 144 144 LYS CB C 144 29.373 29.373 30.951 -1.578 18112 4598 1 6 . 1 1 144 144 LYS H H 144 7.196 7.196 7.155 0.041 18112 4599 1 6 . 1 1 145 145 LYS N N 145 116.440 116.440 119.356 -2.916 18112 4600 1 6 . 1 1 145 145 LYS HA H 145 3.490 3.490 3.893 -0.403 18112 4601 1 6 . 1 1 145 145 LYS C C 145 179.149 179.149 178.521 0.628 18112 4602 1 6 . 1 1 145 145 LYS CA C 145 59.271 59.271 59.077 0.194 18112 4603 1 6 . 1 1 145 145 LYS CB C 145 30.521 30.521 32.031 -1.510 18112 4604 1 6 . 1 1 145 145 LYS H H 145 7.389 7.389 7.786 -0.397 18112 4605 1 6 . 1 1 146 146 ALA N N 146 118.582 118.582 123.300 -4.718 18112 4606 1 6 . 1 1 146 146 ALA HA H 146 3.932 3.932 4.048 -0.116 18112 4607 1 6 . 1 1 146 146 ALA C C 146 179.968 179.968 179.463 0.505 18112 4608 1 6 . 1 1 146 146 ALA CA C 146 54.241 54.241 54.896 -0.655 18112 4609 1 6 . 1 1 146 146 ALA CB C 146 17.689 17.689 18.161 -0.472 18112 4610 1 6 . 1 1 146 146 ALA H H 146 7.112 7.112 7.809 -0.697 18112 4611 1 6 . 1 1 147 147 ILE N N 147 118.537 118.537 119.748 -1.211 18112 4612 1 6 . 1 1 147 147 ILE HA H 147 3.642 3.642 3.431 0.211 18112 4613 1 6 . 1 1 147 147 ILE C C 147 178.919 178.919 177.727 1.192 18112 4614 1 6 . 1 1 147 147 ILE CA C 147 64.418 64.418 64.910 -0.492 18112 4615 1 6 . 1 1 147 147 ILE CB C 147 36.519 36.519 37.073 -0.554 18112 4616 1 6 . 1 1 147 147 ILE H H 147 6.734 6.734 7.720 -0.986 18112 4617 1 6 . 1 1 148 148 TYR N N 148 121.033 121.033 117.231 3.802 18112 4618 1 6 . 1 1 148 148 TYR HA H 148 4.489 4.489 4.201 0.288 18112 4619 1 6 . 1 1 148 148 TYR C C 148 178.348 178.348 178.419 -0.071 18112 4620 1 6 . 1 1 148 148 TYR CA C 148 57.389 57.389 58.430 -1.041 18112 4621 1 6 . 1 1 148 148 TYR CB C 148 35.280 35.280 37.132 -1.852 18112 4622 1 6 . 1 1 148 148 TYR H H 148 8.126 8.126 7.935 0.191 18112 4623 1 6 . 1 1 149 149 LYS N N 149 114.484 114.484 120.879 -6.395 18112 4624 1 6 . 1 1 149 149 LYS C C 149 178.051 178.051 178.830 -0.779 18112 4625 1 6 . 1 1 149 149 LYS CA C 149 59.036 59.036 59.154 -0.118 18112 4626 1 6 . 1 1 149 149 LYS CB C 149 31.575 31.575 32.253 -0.678 18112 4627 1 6 . 1 1 149 149 LYS H H 149 7.364 7.364 7.801 -0.437 18112 4628 1 6 . 1 1 150 150 VAL N N 150 117.812 117.812 115.468 2.344 18112 4629 1 6 . 1 1 150 150 VAL HA H 150 3.770 3.770 3.745 0.025 18112 4630 1 6 . 1 1 150 150 VAL C C 150 178.786 178.786 178.407 0.379 18112 4631 1 6 . 1 1 150 150 VAL CA C 150 65.070 65.070 65.792 -0.722 18112 4632 1 6 . 1 1 150 150 VAL CB C 150 29.515 29.515 31.726 -2.211 18112 4633 1 6 . 1 1 150 150 VAL H H 150 7.254 7.254 7.693 -0.439 18112 4634 1 6 . 1 1 151 151 ILE N N 151 117.884 117.884 115.095 2.789 18112 4635 1 6 . 1 1 151 151 ILE C C 151 180.539 180.539 177.023 3.516 18112 4636 1 6 . 1 1 151 151 ILE CA C 151 61.490 61.490 63.456 -1.966 18112 4637 1 6 . 1 1 151 151 ILE CB C 151 33.994 33.994 38.066 -4.072 18112 4638 1 6 . 1 1 151 151 ILE H H 151 8.154 8.154 8.168 -0.014 18112 4639 1 6 . 1 1 152 152 CYS N N 152 118.649 118.649 120.029 -1.380 18112 4640 1 6 . 1 1 152 152 CYS HA H 152 4.153 4.153 4.574 -0.421 18112 4641 1 6 . 1 1 152 152 CYS C C 152 174.888 174.888 175.313 -0.425 18112 4642 1 6 . 1 1 152 152 CYS CA C 152 61.052 61.052 58.089 2.963 18112 4643 1 6 . 1 1 152 152 CYS CB C 152 36.364 36.364 27.038 9.326 18112 4644 1 6 . 1 1 152 152 CYS H H 152 8.711 8.711 8.111 0.600 18112 4645 1 6 . 1 1 153 153 LYS N N 153 118.498 118.498 119.843 -1.345 18112 4646 1 6 . 1 1 153 153 LYS C C 153 177.389 177.389 177.394 -0.005 18112 4647 1 6 . 1 1 153 153 LYS CA C 153 56.243 56.243 56.693 -0.450 18112 4648 1 6 . 1 1 153 153 LYS CB C 153 31.343 31.343 32.551 -1.208 18112 4649 1 6 . 1 1 153 153 LYS H H 153 6.782 6.782 7.811 -1.029 18112 4650 1 6 . 1 1 154 154 LEU N N 154 117.318 117.318 118.942 -1.624 18112 4651 1 6 . 1 1 154 154 LEU HA H 154 4.576 4.576 4.198 0.378 18112 4652 1 6 . 1 1 154 154 LEU C C 154 177.161 177.161 176.559 0.602 18112 4653 1 6 . 1 1 154 154 LEU CA C 154 53.782 53.782 54.959 -1.177 18112 4654 1 6 . 1 1 154 154 LEU CB C 154 40.881 40.881 41.242 -0.360 18112 4655 1 6 . 1 1 154 154 LEU H H 154 7.616 7.616 7.380 0.236 18112 4656 1 6 . 1 1 155 155 ASP N N 155 121.564 121.564 120.481 1.083 18112 4657 1 6 . 1 1 155 155 ASP C C 155 177.094 177.094 176.072 1.022 18112 4658 1 6 . 1 1 155 155 ASP CA C 155 55.732 55.732 55.195 0.537 18112 4659 1 6 . 1 1 155 155 ASP CB C 155 40.139 40.139 40.586 -0.447 18112 4660 1 6 . 1 1 155 155 ASP H H 155 7.582 7.582 7.435 0.147 18112 4661 1 6 . 1 1 156 156 SER N N 156 117.352 117.352 120.020 -2.668 18112 4662 1 6 . 1 1 156 156 SER HA H 156 4.818 4.818 4.580 0.238 18112 4663 1 6 . 1 1 156 156 SER C C 156 173.409 173.409 174.058 -0.649 18112 4664 1 6 . 1 1 156 156 SER CA C 156 57.073 57.073 56.904 0.169 18112 4665 1 6 . 1 1 156 156 SER CB C 156 65.150 65.150 65.900 -0.750 18112 4666 1 6 . 1 1 156 156 SER H H 156 8.846 8.846 8.197 0.649 18112 4667 1 6 . 1 1 157 157 GLU N N 157 120.688 120.688 123.349 -2.661 18112 4668 1 6 . 1 1 157 157 GLU HA H 157 4.038 4.038 4.560 -0.522 18112 4669 1 6 . 1 1 157 157 GLU C C 157 176.332 176.332 176.858 -0.526 18112 4670 1 6 . 1 1 157 157 GLU CA C 157 56.464 56.464 55.170 1.294 18112 4671 1 6 . 1 1 157 157 GLU CB C 157 29.206 29.206 29.836 -0.630 18112 4672 1 6 . 1 1 157 157 GLU H H 157 8.356 8.356 8.435 -0.080 18112 4673 1 6 . 1 1 158 158 VAL N N 158 126.906 126.906 122.850 4.056 18112 4674 1 6 . 1 1 158 158 VAL HA H 158 3.449 3.449 4.062 -0.613 18112 4675 1 6 . 1 1 158 158 VAL C C 158 176.382 176.382 174.447 1.935 18112 4676 1 6 . 1 1 158 158 VAL CA C 158 59.584 59.584 59.491 0.093 18112 4677 1 6 . 1 1 158 158 VAL CB C 158 31.160 31.160 31.403 -0.243 18112 4678 1 6 . 1 1 158 158 VAL H H 158 8.561 8.561 7.959 0.602 18112 4679 1 6 . 1 1 159 159 PRO HA H 159 4.403 4.403 4.275 0.128 18112 4680 1 6 . 1 1 159 159 PRO C C 159 176.757 176.757 177.111 -0.354 18112 4681 1 6 . 1 1 159 159 PRO CA C 159 63.845 63.845 62.886 0.959 18112 4682 1 6 . 1 1 159 159 PRO CB C 159 32.106 32.106 32.370 -0.264 18112 4683 1 6 . 1 1 160 160 GLU N N 160 122.904 122.904 118.699 4.205 18112 4684 1 6 . 1 1 160 160 GLU HA H 160 4.008 4.008 4.030 -0.022 18112 4685 1 6 . 1 1 160 160 GLU C C 160 179.132 179.132 176.475 2.657 18112 4686 1 6 . 1 1 160 160 GLU CA C 160 59.407 59.407 58.879 0.528 18112 4687 1 6 . 1 1 160 160 GLU CB C 160 28.991 28.991 29.772 -0.781 18112 4688 1 6 . 1 1 160 160 GLU H H 160 8.650 8.650 8.629 0.021 18112 4689 1 6 . 1 1 161 161 ILE N N 161 119.782 119.782 115.468 4.314 18112 4690 1 6 . 1 1 161 161 ILE HA H 161 4.146 4.146 4.395 -0.249 18112 4691 1 6 . 1 1 161 161 ILE C C 161 176.176 176.176 175.203 0.973 18112 4692 1 6 . 1 1 161 161 ILE CA C 161 62.034 62.034 60.076 1.958 18112 4693 1 6 . 1 1 161 161 ILE CB C 161 37.113 37.113 40.418 -3.305 18112 4694 1 6 . 1 1 161 161 ILE H H 161 8.448 8.448 7.470 0.978 18112 4695 1 6 . 1 1 162 162 PHE N N 162 117.594 117.594 123.898 -6.304 18112 4696 1 6 . 1 1 162 162 PHE C C 162 176.115 176.115 176.804 -0.689 18112 4697 1 6 . 1 1 162 162 PHE CA C 162 61.009 61.009 60.165 0.844 18112 4698 1 6 . 1 1 162 162 PHE CB C 162 38.394 38.394 39.013 -0.619 18112 4699 1 6 . 1 1 162 162 PHE H H 162 8.145 8.145 8.872 -0.727 18112 4700 1 6 . 1 1 163 163 LYS N N 163 116.083 116.083 118.968 -2.885 18112 4701 1 6 . 1 1 163 163 LYS C C 163 178.196 178.196 176.726 1.470 18112 4702 1 6 . 1 1 163 163 LYS CA C 163 58.136 58.136 58.150 -0.014 18112 4703 1 6 . 1 1 163 163 LYS CB C 163 31.694 31.694 33.005 -1.311 18112 4704 1 6 . 1 1 163 163 LYS H H 163 8.232 8.232 8.292 -0.060 18112 4705 1 6 . 1 1 164 164 SER N N 164 113.680 113.680 110.383 3.297 18112 4706 1 6 . 1 1 164 164 SER CA C 164 55.205 55.205 56.761 -1.556 18112 4707 1 6 . 1 1 164 164 SER CB C 164 63.265 63.265 64.659 -1.394 18112 4708 1 6 . 1 1 164 164 SER H H 164 7.708 7.708 7.533 0.175 18112 4709 1 6 . 1 1 165 165 PRO HA H 165 4.580 4.580 4.480 0.100 18112 4710 1 6 . 1 1 165 165 PRO C C 165 177.541 177.541 176.743 0.798 18112 4711 1 6 . 1 1 165 165 PRO CA C 165 63.950 63.950 63.804 0.146 18112 4712 1 6 . 1 1 165 165 PRO CB C 165 30.686 30.686 31.220 -0.534 18112 4713 1 6 . 1 1 166 166 ASN N N 166 116.304 116.304 120.308 -4.004 18112 4714 1 6 . 1 1 166 166 ASN HA H 166 5.029 5.029 4.426 0.603 18112 4715 1 6 . 1 1 166 166 ASN C C 166 175.811 175.811 176.944 -1.133 18112 4716 1 6 . 1 1 166 166 ASN CA C 166 51.962 51.962 54.450 -2.488 18112 4717 1 6 . 1 1 166 166 ASN CB C 166 37.915 37.915 37.983 -0.069 18112 4718 1 6 . 1 1 166 166 ASN H H 166 8.216 8.216 8.617 -0.401 18112 4719 1 6 . 1 1 167 167 CYS N N 167 116.078 116.078 118.932 -2.854 18112 4720 1 6 . 1 1 167 167 CYS HA H 167 4.011 4.011 4.330 -0.319 18112 4721 1 6 . 1 1 167 167 CYS C C 167 175.057 175.057 176.032 -0.975 18112 4722 1 6 . 1 1 167 167 CYS CA C 167 59.816 59.816 60.456 -0.640 18112 4723 1 6 . 1 1 167 167 CYS CB C 167 27.446 27.446 26.557 0.889 18112 4724 1 6 . 1 1 167 167 CYS H H 167 7.246 7.246 7.807 -0.561 18112 4725 1 6 . 1 1 168 168 LEU N N 168 120.082 120.082 120.465 -0.383 18112 4726 1 6 . 1 1 168 168 LEU HA H 168 3.880 3.880 4.219 -0.339 18112 4727 1 6 . 1 1 168 168 LEU C C 168 178.541 178.541 178.196 0.345 18112 4728 1 6 . 1 1 168 168 LEU CA C 168 57.734 57.734 56.921 0.813 18112 4729 1 6 . 1 1 168 168 LEU CB C 168 38.825 38.825 40.211 -1.386 18112 4730 1 6 . 1 1 168 168 LEU H H 168 8.451 8.451 8.284 0.167 18112 4731 1 6 . 1 1 169 169 GLN N N 169 116.700 116.700 119.488 -2.788 18112 4732 1 6 . 1 1 169 169 GLN HA H 169 4.064 4.064 4.127 -0.063 18112 4733 1 6 . 1 1 169 169 GLN C C 169 177.378 177.378 177.544 -0.166 18112 4734 1 6 . 1 1 169 169 GLN CA C 169 57.675 57.675 58.289 -0.614 18112 4735 1 6 . 1 1 169 169 GLN CB C 169 27.710 27.710 28.551 -0.841 18112 4736 1 6 . 1 1 169 169 GLN H H 169 7.665 7.665 7.603 0.062 18112 4737 1 6 . 1 1 170 170 GLU N N 170 116.701 116.701 118.394 -1.693 18112 4738 1 6 . 1 1 170 170 GLU HA H 170 4.214 4.214 4.205 0.009 18112 4739 1 6 . 1 1 170 170 GLU C C 170 177.730 177.730 177.798 -0.068 18112 4740 1 6 . 1 1 170 170 GLU CA C 170 56.899 56.899 58.505 -1.605 18112 4741 1 6 . 1 1 170 170 GLU H H 170 7.405 7.405 7.881 -0.476 18112 4742 1 6 . 1 1 171 171 LEU N N 171 118.021 118.021 113.023 4.998 18112 4743 1 6 . 1 1 171 171 LEU HA H 171 4.209 4.209 4.870 -0.661 18112 4744 1 6 . 1 1 171 171 LEU C C 171 177.005 177.005 177.256 -0.251 18112 4745 1 6 . 1 1 171 171 LEU CA C 171 55.870 55.870 54.462 1.408 18112 4746 1 6 . 1 1 171 171 LEU CB C 171 43.680 43.680 42.700 0.980 18112 4747 1 6 . 1 1 171 171 LEU H H 171 7.823 7.823 7.520 0.303 18112 4748 1 6 . 1 1 172 172 LEU N N 172 117.580 117.580 123.525 -5.945 18112 4749 1 6 . 1 1 172 172 LEU HA H 172 4.571 4.571 4.323 0.248 18112 4750 1 6 . 1 1 172 172 LEU C C 172 176.411 176.411 175.663 0.748 18112 4751 1 6 . 1 1 172 172 LEU CA C 172 53.972 53.972 55.171 -1.199 18112 4752 1 6 . 1 1 172 172 LEU CB C 172 40.483 40.483 40.460 0.023 18112 4753 1 6 . 1 1 172 172 LEU H H 172 7.306 7.306 7.532 -0.226 18112 4754 1 6 . 1 1 173 173 HIS N N 173 123.310 123.310 121.962 1.348 18112 4755 1 6 . 1 1 173 173 HIS C C 173 179.022 179.022 173.052 5.970 18112 4756 1 6 . 1 1 173 173 HIS CA C 173 56.693 56.693 54.771 1.922 18112 4757 1 6 . 1 1 173 173 HIS CB C 173 29.371 29.371 30.888 -1.517 18112 4758 1 6 . 1 1 173 173 HIS H H 173 8.028 8.028 7.848 0.180 18112 4759 1 7 . 1 1 12 12 ALA N N 12 125.167 125.167 131.213 -6.046 18112 4760 1 7 . 1 1 12 12 ALA C C 12 177.566 177.566 177.208 0.358 18112 4761 1 7 . 1 1 12 12 ALA CA C 12 52.067 52.067 51.126 0.941 18112 4762 1 7 . 1 1 12 12 ALA CB C 12 18.456 18.456 18.737 -0.281 18112 4763 1 7 . 1 1 12 12 ALA H H 12 8.311 8.311 8.615 -0.304 18112 4764 1 7 . 1 1 13 13 MET N N 13 119.278 119.278 120.227 -0.949 18112 4765 1 7 . 1 1 13 13 MET C C 13 176.325 176.325 176.662 -0.337 18112 4766 1 7 . 1 1 13 13 MET CA C 13 54.992 54.992 56.447 -1.455 18112 4767 1 7 . 1 1 13 13 MET CB C 13 32.308 32.308 32.093 0.215 18112 4768 1 7 . 1 1 13 13 MET H H 13 8.269 8.269 8.418 -0.149 18112 4769 1 7 . 1 1 14 14 GLN N N 14 120.869 120.869 120.846 0.023 18112 4770 1 7 . 1 1 14 14 GLN HA H 14 4.399 4.399 4.498 -0.099 18112 4771 1 7 . 1 1 14 14 GLN C C 14 175.644 175.644 175.021 0.623 18112 4772 1 7 . 1 1 14 14 GLN CA C 14 55.139 55.139 55.143 -0.004 18112 4773 1 7 . 1 1 14 14 GLN CB C 14 29.051 29.051 27.471 1.581 18112 4774 1 7 . 1 1 14 14 GLN H H 14 8.501 8.501 8.338 0.163 18112 4775 1 7 . 1 1 15 15 GLU N N 15 122.042 122.042 118.986 3.056 18112 4776 1 7 . 1 1 15 15 GLU C C 15 176.242 176.242 176.927 -0.685 18112 4777 1 7 . 1 1 15 15 GLU CA C 15 56.064 56.064 56.137 -0.073 18112 4778 1 7 . 1 1 15 15 GLU CB C 15 29.302 29.302 28.434 0.868 18112 4779 1 7 . 1 1 15 15 GLU H H 15 8.547 8.547 7.468 1.079 18112 4780 1 7 . 1 1 16 16 GLY N N 16 108.821 108.821 110.952 -2.131 18112 4781 1 7 . 1 1 16 16 GLY C C 16 172.949 172.949 174.314 -1.365 18112 4782 1 7 . 1 1 16 16 GLY CA C 16 44.227 44.227 45.397 -1.170 18112 4783 1 7 . 1 1 16 16 GLY H H 16 8.100 8.100 7.940 0.160 18112 4784 1 7 . 1 1 17 17 LEU N N 17 120.315 120.315 118.829 1.486 18112 4785 1 7 . 1 1 17 17 LEU C C 17 177.334 177.334 176.538 0.796 18112 4786 1 7 . 1 1 17 17 LEU CA C 17 53.544 53.544 54.219 -0.675 18112 4787 1 7 . 1 1 17 17 LEU CB C 17 42.140 42.140 42.897 -0.757 18112 4788 1 7 . 1 1 17 17 LEU H H 17 8.222 8.222 7.524 0.698 18112 4789 1 7 . 1 1 18 18 SER N N 18 126.547 126.547 117.338 9.209 18112 4790 1 7 . 1 1 18 18 SER CA C 18 56.851 56.851 57.038 -0.187 18112 4791 1 7 . 1 1 18 18 SER CB C 18 64.636 64.636 63.376 1.260 18112 4792 1 7 . 1 1 18 18 SER H H 18 11.627 11.627 8.510 3.117 18112 4793 1 7 . 1 1 19 19 PRO C C 19 175.118 175.118 178.692 -3.574 18112 4794 1 7 . 1 1 20 20 ASN N N 20 121.372 121.372 115.821 5.551 18112 4795 1 7 . 1 1 20 20 ASN H H 20 8.172 8.172 8.864 -0.692 18112 4796 1 7 . 1 1 25 25 ALA CB C 25 18.020 18.020 17.716 0.304 18112 4797 1 7 . 1 1 26 26 LYS N N 26 118.490 118.490 119.238 -0.748 18112 4798 1 7 . 1 1 26 26 LYS CA C 26 56.146 56.146 59.207 -3.061 18112 4799 1 7 . 1 1 26 26 LYS H H 26 6.794 6.794 7.417 -0.623 18112 4800 1 7 . 1 1 31 31 TYR HA H 31 4.398 4.398 4.176 0.222 18112 4801 1 7 . 1 1 31 31 TYR C C 31 173.714 173.714 176.580 -2.866 18112 4802 1 7 . 1 1 31 31 TYR CA C 31 59.757 59.757 59.195 0.562 18112 4803 1 7 . 1 1 32 32 THR N N 32 111.928 111.928 113.908 -1.980 18112 4804 1 7 . 1 1 32 32 THR HA H 32 4.209 4.209 4.724 -0.515 18112 4805 1 7 . 1 1 32 32 THR C C 32 171.061 171.061 174.096 -3.035 18112 4806 1 7 . 1 1 32 32 THR CA C 32 56.905 56.905 61.737 -4.832 18112 4807 1 7 . 1 1 32 32 THR CB C 32 69.707 69.707 68.849 0.858 18112 4808 1 7 . 1 1 32 32 THR H H 32 8.237 8.237 7.682 0.555 18112 4809 1 7 . 1 1 33 33 ARG N N 33 124.856 124.856 128.101 -3.245 18112 4810 1 7 . 1 1 33 33 ARG C C 33 176.451 176.451 174.684 1.767 18112 4811 1 7 . 1 1 33 33 ARG CA C 33 55.627 55.627 55.860 -0.233 18112 4812 1 7 . 1 1 33 33 ARG CB C 33 29.861 29.861 31.053 -1.192 18112 4813 1 7 . 1 1 33 33 ARG H H 33 9.159 9.159 8.861 0.298 18112 4814 1 7 . 1 1 34 34 TYR N N 34 117.908 117.908 120.325 -2.417 18112 4815 1 7 . 1 1 34 34 TYR CA C 34 55.320 55.320 58.994 -3.674 18112 4816 1 7 . 1 1 34 34 TYR H H 34 8.995 8.995 7.665 1.330 18112 4817 1 7 . 1 1 35 35 PRO C C 35 177.280 177.280 176.667 0.613 18112 4818 1 7 . 1 1 36 36 SER N N 36 116.410 116.410 116.899 -0.489 18112 4819 1 7 . 1 1 36 36 SER C C 36 178.938 178.938 175.738 3.200 18112 4820 1 7 . 1 1 36 36 SER CA C 36 64.815 64.815 62.023 2.792 18112 4821 1 7 . 1 1 36 36 SER H H 36 8.106 8.106 8.033 0.073 18112 4822 1 7 . 1 1 37 37 SER N N 37 117.488 117.488 117.658 -0.170 18112 4823 1 7 . 1 1 37 37 SER C C 37 177.698 177.698 176.293 1.405 18112 4824 1 7 . 1 1 37 37 SER CA C 37 61.357 61.357 61.663 -0.305 18112 4825 1 7 . 1 1 37 37 SER CB C 37 68.118 68.118 62.389 5.729 18112 4826 1 7 . 1 1 37 37 SER H H 37 8.169 8.169 8.360 -0.191 18112 4827 1 7 . 1 1 38 38 ASN N N 38 115.638 115.638 120.527 -4.889 18112 4828 1 7 . 1 1 38 38 ASN HA H 38 4.259 4.259 4.356 -0.097 18112 4829 1 7 . 1 1 38 38 ASN C C 38 177.868 177.868 177.493 0.375 18112 4830 1 7 . 1 1 38 38 ASN CA C 38 55.907 55.907 55.860 0.047 18112 4831 1 7 . 1 1 38 38 ASN CB C 38 37.230 37.230 38.105 -0.875 18112 4832 1 7 . 1 1 38 38 ASN H H 38 8.284 8.284 7.689 0.595 18112 4833 1 7 . 1 1 39 39 MET N N 39 121.352 121.352 120.027 1.325 18112 4834 1 7 . 1 1 39 39 MET HA H 39 4.170 4.170 3.526 0.644 18112 4835 1 7 . 1 1 39 39 MET C C 39 179.068 179.068 178.053 1.015 18112 4836 1 7 . 1 1 39 39 MET CA C 39 58.751 58.751 57.666 1.085 18112 4837 1 7 . 1 1 39 39 MET CB C 39 31.850 31.850 31.599 0.251 18112 4838 1 7 . 1 1 39 39 MET H H 39 7.857 7.857 8.042 -0.185 18112 4839 1 7 . 1 1 40 40 LEU N N 40 118.936 118.936 120.211 -1.275 18112 4840 1 7 . 1 1 40 40 LEU HA H 40 4.139 4.139 4.302 -0.163 18112 4841 1 7 . 1 1 40 40 LEU C C 40 178.700 178.700 178.965 -0.265 18112 4842 1 7 . 1 1 40 40 LEU CA C 40 58.455 58.455 58.465 -0.010 18112 4843 1 7 . 1 1 40 40 LEU CB C 40 40.304 40.304 41.325 -1.021 18112 4844 1 7 . 1 1 40 40 LEU H H 40 8.167 8.167 7.755 0.412 18112 4845 1 7 . 1 1 41 41 LYS N N 41 116.791 116.791 118.597 -1.806 18112 4846 1 7 . 1 1 41 41 LYS HA H 41 3.475 3.475 4.256 -0.781 18112 4847 1 7 . 1 1 41 41 LYS C C 41 178.793 178.793 179.039 -0.246 18112 4848 1 7 . 1 1 41 41 LYS CA C 41 59.161 59.161 59.185 -0.024 18112 4849 1 7 . 1 1 41 41 LYS CB C 41 30.992 30.992 31.915 -0.922 18112 4850 1 7 . 1 1 41 41 LYS H H 41 7.632 7.632 8.010 -0.378 18112 4851 1 7 . 1 1 42 42 THR N N 42 112.819 112.819 115.321 -2.502 18112 4852 1 7 . 1 1 42 42 THR HA H 42 4.230 4.230 4.321 -0.091 18112 4853 1 7 . 1 1 42 42 THR C C 42 176.142 176.142 177.016 -0.874 18112 4854 1 7 . 1 1 42 42 THR CA C 42 65.107 65.107 66.405 -1.298 18112 4855 1 7 . 1 1 42 42 THR CB C 42 68.306 68.306 69.218 -0.912 18112 4856 1 7 . 1 1 42 42 THR H H 42 7.469 7.469 8.126 -0.657 18112 4857 1 7 . 1 1 43 43 TYR N N 43 118.565 118.565 119.454 -0.889 18112 4858 1 7 . 1 1 43 43 TYR HA H 43 4.204 4.204 4.356 -0.152 18112 4859 1 7 . 1 1 43 43 TYR C C 43 174.240 174.240 176.381 -2.141 18112 4860 1 7 . 1 1 43 43 TYR CA C 43 60.886 60.886 58.353 2.533 18112 4861 1 7 . 1 1 43 43 TYR CB C 43 38.165 38.165 38.586 -0.421 18112 4862 1 7 . 1 1 43 43 TYR H H 43 7.978 7.978 8.165 -0.187 18112 4863 1 7 . 1 1 44 44 PHE N N 44 120.980 120.980 118.274 2.706 18112 4864 1 7 . 1 1 44 44 PHE HA H 44 4.920 4.920 5.176 -0.256 18112 4865 1 7 . 1 1 44 44 PHE C C 44 176.436 176.436 176.120 0.316 18112 4866 1 7 . 1 1 44 44 PHE CA C 44 56.672 56.672 55.334 1.338 18112 4867 1 7 . 1 1 44 44 PHE CB C 44 36.570 36.570 38.002 -1.432 18112 4868 1 7 . 1 1 44 44 PHE H H 44 7.955 7.955 7.929 0.026 18112 4869 1 7 . 1 1 45 45 SER N N 45 113.407 113.407 116.590 -3.183 18112 4870 1 7 . 1 1 45 45 SER HA H 45 4.373 4.373 4.391 -0.018 18112 4871 1 7 . 1 1 45 45 SER C C 45 174.424 174.424 175.478 -1.054 18112 4872 1 7 . 1 1 45 45 SER CA C 45 61.037 61.037 60.473 0.564 18112 4873 1 7 . 1 1 45 45 SER CB C 45 62.711 62.711 63.197 -0.486 18112 4874 1 7 . 1 1 45 45 SER H H 45 7.932 7.932 8.332 -0.400 18112 4875 1 7 . 1 1 46 46 ASP N N 46 118.099 118.099 118.385 -0.286 18112 4876 1 7 . 1 1 46 46 ASP HA H 46 4.572 4.572 4.519 0.053 18112 4877 1 7 . 1 1 46 46 ASP C C 46 174.866 174.866 175.982 -1.116 18112 4878 1 7 . 1 1 46 46 ASP CA C 46 53.602 53.602 54.468 -0.866 18112 4879 1 7 . 1 1 46 46 ASP CB C 46 38.992 38.992 40.910 -1.918 18112 4880 1 7 . 1 1 46 46 ASP H H 46 9.889 9.889 8.695 1.194 18112 4881 1 7 . 1 1 47 47 VAL N N 47 121.496 121.496 121.670 -0.174 18112 4882 1 7 . 1 1 47 47 VAL HA H 47 4.058 4.058 3.865 0.193 18112 4883 1 7 . 1 1 47 47 VAL C C 47 174.676 174.676 175.031 -0.355 18112 4884 1 7 . 1 1 47 47 VAL CA C 47 61.006 61.006 61.622 -0.616 18112 4885 1 7 . 1 1 47 47 VAL CB C 47 32.110 32.110 31.692 0.418 18112 4886 1 7 . 1 1 47 47 VAL H H 47 7.781 7.781 7.209 0.572 18112 4887 1 7 . 1 1 48 48 LYS N N 48 126.100 126.100 127.414 -1.314 18112 4888 1 7 . 1 1 48 48 LYS HA H 48 4.402 4.402 4.010 0.392 18112 4889 1 7 . 1 1 48 48 LYS C C 48 175.564 175.564 175.804 -0.240 18112 4890 1 7 . 1 1 48 48 LYS CA C 48 54.874 54.874 57.167 -2.293 18112 4891 1 7 . 1 1 48 48 LYS CB C 48 30.189 30.189 32.776 -2.587 18112 4892 1 7 . 1 1 48 48 LYS H H 48 8.245 8.245 8.434 -0.189 18112 4893 1 7 . 1 1 49 49 PHE N N 49 125.341 125.341 112.929 12.412 18112 4894 1 7 . 1 1 49 49 PHE HA H 49 3.813 3.813 4.363 -0.550 18112 4895 1 7 . 1 1 49 49 PHE C C 49 175.708 175.708 174.533 1.175 18112 4896 1 7 . 1 1 49 49 PHE CA C 49 60.861 60.861 57.803 3.058 18112 4897 1 7 . 1 1 49 49 PHE CB C 49 38.616 38.616 37.850 0.766 18112 4898 1 7 . 1 1 49 49 PHE H H 49 8.626 8.626 7.341 1.285 18112 4899 1 7 . 1 1 50 50 ASN N N 50 115.408 115.408 121.025 -5.617 18112 4900 1 7 . 1 1 50 50 ASN C C 50 176.072 176.072 175.096 0.976 18112 4901 1 7 . 1 1 50 50 ASN CA C 50 51.730 51.730 52.084 -0.354 18112 4902 1 7 . 1 1 50 50 ASN H H 50 7.030 7.030 8.614 -1.584 18112 4903 1 7 . 1 1 51 51 ARG N N 51 122.706 122.706 122.009 0.697 18112 4904 1 7 . 1 1 51 51 ARG CA C 51 59.534 59.534 59.285 0.249 18112 4905 1 7 . 1 1 51 51 ARG H H 51 7.790 7.790 8.883 -1.093 18112 4906 1 7 . 1 1 52 52 CYS N N 52 117.340 117.340 116.091 1.249 18112 4907 1 7 . 1 1 52 52 CYS HA H 52 4.108 4.108 4.091 0.017 18112 4908 1 7 . 1 1 52 52 CYS C C 52 178.200 178.200 176.958 1.242 18112 4909 1 7 . 1 1 52 52 CYS CA C 52 61.143 61.143 63.249 -2.106 18112 4910 1 7 . 1 1 52 52 CYS H H 52 7.681 7.681 7.936 -0.255 18112 4911 1 7 . 1 1 53 53 ILE N N 53 122.321 122.321 117.231 5.090 18112 4912 1 7 . 1 1 53 53 ILE HA H 53 3.588 3.588 3.804 -0.216 18112 4913 1 7 . 1 1 53 53 ILE C C 53 177.492 177.492 177.396 0.096 18112 4914 1 7 . 1 1 53 53 ILE CA C 53 64.109 64.109 64.307 -0.198 18112 4915 1 7 . 1 1 53 53 ILE CB C 53 37.603 37.603 37.358 0.244 18112 4916 1 7 . 1 1 53 53 ILE H H 53 8.035 8.035 7.607 0.428 18112 4917 1 7 . 1 1 54 54 THR C C 54 175.903 175.903 176.850 -0.947 18112 4918 1 7 . 1 1 54 54 THR CA C 54 67.308 67.308 66.792 0.516 18112 4919 1 7 . 1 1 55 55 SER N N 55 113.819 113.819 118.284 -4.465 18112 4920 1 7 . 1 1 55 55 SER H H 55 7.844 7.844 8.191 -0.347 18112 4921 1 7 . 1 1 56 56 GLN C C 56 179.792 179.792 177.541 2.251 18112 4922 1 7 . 1 1 57 57 LEU N N 57 116.701 116.701 120.498 -3.797 18112 4923 1 7 . 1 1 57 57 LEU HA H 57 4.519 4.519 2.994 1.525 18112 4924 1 7 . 1 1 57 57 LEU C C 57 178.775 178.775 178.853 -0.078 18112 4925 1 7 . 1 1 57 57 LEU CA C 57 55.232 55.232 57.570 -2.338 18112 4926 1 7 . 1 1 57 57 LEU CB C 57 37.131 37.131 41.973 -4.842 18112 4927 1 7 . 1 1 57 57 LEU H H 57 8.267 8.267 7.551 0.716 18112 4928 1 7 . 1 1 58 58 ILE N N 58 122.522 122.522 117.822 4.700 18112 4929 1 7 . 1 1 58 58 ILE HA H 58 4.640 4.640 3.825 0.815 18112 4930 1 7 . 1 1 58 58 ILE C C 58 177.380 177.380 177.757 -0.377 18112 4931 1 7 . 1 1 58 58 ILE CA C 58 62.163 62.163 64.881 -2.718 18112 4932 1 7 . 1 1 58 58 ILE CB C 58 30.657 30.657 37.486 -6.829 18112 4933 1 7 . 1 1 58 58 ILE H H 58 8.111 8.111 8.274 -0.163 18112 4934 1 7 . 1 1 59 59 LYS N N 59 121.002 121.002 121.756 -0.754 18112 4935 1 7 . 1 1 59 59 LYS C C 59 177.600 177.600 179.091 -1.491 18112 4936 1 7 . 1 1 59 59 LYS CA C 59 57.570 57.570 60.083 -2.513 18112 4937 1 7 . 1 1 59 59 LYS CB C 59 39.101 39.101 32.287 6.814 18112 4938 1 7 . 1 1 59 59 LYS H H 59 7.432 7.432 7.735 -0.303 18112 4939 1 7 . 1 1 60 60 TRP N N 60 118.679 118.679 119.099 -0.420 18112 4940 1 7 . 1 1 60 60 TRP HA H 60 3.739 3.739 4.557 -0.818 18112 4941 1 7 . 1 1 60 60 TRP C C 60 178.246 178.246 179.211 -0.965 18112 4942 1 7 . 1 1 60 60 TRP CA C 60 59.818 59.818 59.022 0.796 18112 4943 1 7 . 1 1 60 60 TRP CB C 60 31.851 31.851 28.616 3.235 18112 4944 1 7 . 1 1 60 60 TRP H H 60 7.565 7.565 7.985 -0.420 18112 4945 1 7 . 1 1 61 61 PHE N N 61 118.005 118.005 117.986 0.019 18112 4946 1 7 . 1 1 61 61 PHE HA H 61 3.882 3.882 3.362 0.520 18112 4947 1 7 . 1 1 61 61 PHE CA C 61 60.054 60.054 62.509 -2.455 18112 4948 1 7 . 1 1 61 61 PHE H H 61 7.819 7.819 8.679 -0.860 18112 4949 1 7 . 1 1 62 62 SER N N 62 121.144 121.144 113.588 7.556 18112 4950 1 7 . 1 1 62 62 SER C C 62 177.840 177.840 176.845 0.995 18112 4951 1 7 . 1 1 62 62 SER CA C 62 55.892 55.892 60.438 -4.546 18112 4952 1 7 . 1 1 62 62 SER H H 62 8.878 8.878 8.292 0.586 18112 4953 1 7 . 1 1 63 63 ASN N N 63 115.303 115.303 121.798 -6.495 18112 4954 1 7 . 1 1 63 63 ASN C C 63 177.222 177.222 177.244 -0.022 18112 4955 1 7 . 1 1 63 63 ASN CA C 63 60.467 60.467 56.642 3.825 18112 4956 1 7 . 1 1 63 63 ASN H H 63 8.001 8.001 8.335 -0.334 18112 4957 1 7 . 1 1 64 64 PHE N N 64 112.571 112.571 121.088 -8.517 18112 4958 1 7 . 1 1 64 64 PHE CA C 64 56.453 56.453 61.717 -5.264 18112 4959 1 7 . 1 1 64 64 PHE H H 64 7.082 7.082 8.552 -1.470 18112 4960 1 7 . 1 1 65 65 ARG N N 65 116.695 116.695 119.851 -3.156 18112 4961 1 7 . 1 1 65 65 ARG CA C 65 59.590 59.590 60.182 -0.592 18112 4962 1 7 . 1 1 65 65 ARG H H 65 8.091 8.091 8.562 -0.471 18112 4963 1 7 . 1 1 66 66 GLU N N 66 121.653 121.653 118.727 2.926 18112 4964 1 7 . 1 1 66 66 GLU HA H 66 4.739 4.739 4.351 0.388 18112 4965 1 7 . 1 1 66 66 GLU C C 66 174.621 174.621 179.261 -4.640 18112 4966 1 7 . 1 1 66 66 GLU CA C 66 59.583 59.583 58.208 1.375 18112 4967 1 7 . 1 1 66 66 GLU H H 66 7.597 7.597 8.095 -0.498 18112 4968 1 7 . 1 1 67 67 PHE N N 67 111.578 111.578 121.316 -9.738 18112 4969 1 7 . 1 1 67 67 PHE C C 67 176.164 176.164 177.701 -1.537 18112 4970 1 7 . 1 1 67 67 PHE CA C 67 61.156 61.156 60.841 0.315 18112 4971 1 7 . 1 1 67 67 PHE H H 67 7.067 7.067 8.338 -1.271 18112 4972 1 7 . 1 1 68 68 TYR N N 68 119.370 119.370 121.450 -2.080 18112 4973 1 7 . 1 1 68 68 TYR C C 68 176.844 176.844 177.928 -1.084 18112 4974 1 7 . 1 1 68 68 TYR CA C 68 61.758 61.758 61.660 0.098 18112 4975 1 7 . 1 1 68 68 TYR H H 68 7.442 7.442 8.482 -1.040 18112 4976 1 7 . 1 1 69 69 TYR N N 69 116.047 116.047 120.032 -3.985 18112 4977 1 7 . 1 1 69 69 TYR HA H 69 4.086 4.086 4.128 -0.042 18112 4978 1 7 . 1 1 69 69 TYR C C 69 180.328 180.328 177.256 3.072 18112 4979 1 7 . 1 1 69 69 TYR CA C 69 61.528 61.528 61.996 -0.468 18112 4980 1 7 . 1 1 69 69 TYR H H 69 9.127 9.127 8.806 0.321 18112 4981 1 7 . 1 1 70 70 ILE N N 70 124.738 124.738 118.802 5.936 18112 4982 1 7 . 1 1 70 70 ILE HA H 70 3.828 3.828 3.470 0.358 18112 4983 1 7 . 1 1 70 70 ILE C C 70 179.585 179.585 177.778 1.807 18112 4984 1 7 . 1 1 70 70 ILE CA C 70 65.787 65.787 63.539 2.248 18112 4985 1 7 . 1 1 70 70 ILE CB C 70 36.435 36.435 37.862 -1.427 18112 4986 1 7 . 1 1 70 70 ILE H H 70 8.631 8.631 7.971 0.660 18112 4987 1 7 . 1 1 71 71 GLN N N 71 117.940 117.940 118.888 -0.948 18112 4988 1 7 . 1 1 71 71 GLN HA H 71 3.826 3.826 3.498 0.328 18112 4989 1 7 . 1 1 71 71 GLN C C 71 178.192 178.192 178.041 0.151 18112 4990 1 7 . 1 1 71 71 GLN CA C 71 57.779 57.779 58.243 -0.465 18112 4991 1 7 . 1 1 71 71 GLN H H 71 7.738 7.738 7.987 -0.249 18112 4992 1 7 . 1 1 72 72 MET N N 72 117.353 117.353 118.398 -1.045 18112 4993 1 7 . 1 1 72 72 MET HA H 72 4.112 4.112 3.991 0.121 18112 4994 1 7 . 1 1 72 72 MET C C 72 177.203 177.203 178.280 -1.077 18112 4995 1 7 . 1 1 72 72 MET CA C 72 57.272 57.272 57.919 -0.647 18112 4996 1 7 . 1 1 72 72 MET H H 72 7.844 7.844 7.777 0.067 18112 4997 1 7 . 1 1 73 73 GLU N N 73 117.858 117.858 119.026 -1.168 18112 4998 1 7 . 1 1 73 73 GLU HA H 73 3.572 3.572 3.154 0.418 18112 4999 1 7 . 1 1 73 73 GLU C C 73 177.344 177.344 178.529 -1.185 18112 5000 1 7 . 1 1 73 73 GLU CA C 73 60.324 60.324 59.375 0.949 18112 5001 1 7 . 1 1 73 73 GLU H H 73 7.503 7.503 7.646 -0.143 18112 5002 1 7 . 1 1 74 74 LYS N N 74 118.716 118.716 118.279 0.437 18112 5003 1 7 . 1 1 74 74 LYS HA H 74 3.867 3.867 4.081 -0.214 18112 5004 1 7 . 1 1 74 74 LYS C C 74 180.077 180.077 179.734 0.343 18112 5005 1 7 . 1 1 74 74 LYS CA C 74 59.754 59.754 57.406 2.348 18112 5006 1 7 . 1 1 74 74 LYS H H 74 7.912 7.912 7.470 0.442 18112 5007 1 7 . 1 1 75 75 TYR N N 75 117.309 117.309 120.240 -2.931 18112 5008 1 7 . 1 1 75 75 TYR HA H 75 4.085 4.085 4.282 -0.197 18112 5009 1 7 . 1 1 75 75 TYR C C 75 178.874 178.874 178.155 0.719 18112 5010 1 7 . 1 1 75 75 TYR CA C 75 63.306 63.306 58.968 4.338 18112 5011 1 7 . 1 1 75 75 TYR H H 75 8.421 8.421 8.120 0.301 18112 5012 1 7 . 1 1 76 76 ALA N N 76 125.392 125.392 121.522 3.870 18112 5013 1 7 . 1 1 76 76 ALA HA H 76 4.221 4.221 4.165 0.056 18112 5014 1 7 . 1 1 76 76 ALA C C 76 178.850 178.850 179.681 -0.831 18112 5015 1 7 . 1 1 76 76 ALA CA C 76 56.280 56.280 55.361 0.919 18112 5016 1 7 . 1 1 76 76 ALA CB C 76 18.687 18.687 18.283 0.404 18112 5017 1 7 . 1 1 76 76 ALA H H 76 8.553 8.553 8.324 0.229 18112 5018 1 7 . 1 1 77 77 ARG N N 77 115.067 115.067 118.476 -3.409 18112 5019 1 7 . 1 1 77 77 ARG HA H 77 3.935 3.935 3.931 0.004 18112 5020 1 7 . 1 1 77 77 ARG C C 77 179.341 179.341 178.145 1.196 18112 5021 1 7 . 1 1 77 77 ARG CA C 77 60.499 60.499 59.429 1.070 18112 5022 1 7 . 1 1 77 77 ARG H H 77 8.471 8.471 8.226 0.245 18112 5023 1 7 . 1 1 78 78 GLN N N 78 120.107 120.107 119.505 0.602 18112 5024 1 7 . 1 1 78 78 GLN HA H 78 3.921 3.921 4.109 -0.188 18112 5025 1 7 . 1 1 78 78 GLN C C 78 177.289 177.289 178.130 -0.841 18112 5026 1 7 . 1 1 78 78 GLN CA C 78 58.619 58.619 58.874 -0.255 18112 5027 1 7 . 1 1 78 78 GLN CB C 78 27.752 27.752 28.615 -0.863 18112 5028 1 7 . 1 1 78 78 GLN H H 78 8.142 8.142 7.995 0.147 18112 5029 1 7 . 1 1 79 79 ALA N N 79 120.809 120.809 122.944 -2.135 18112 5030 1 7 . 1 1 79 79 ALA HA H 79 4.308 4.308 4.106 0.202 18112 5031 1 7 . 1 1 79 79 ALA C C 79 179.924 179.924 180.208 -0.284 18112 5032 1 7 . 1 1 79 79 ALA CA C 79 54.970 54.970 55.303 -0.333 18112 5033 1 7 . 1 1 79 79 ALA CB C 79 17.064 17.064 18.514 -1.450 18112 5034 1 7 . 1 1 79 79 ALA H H 79 7.811 7.811 7.991 -0.180 18112 5035 1 7 . 1 1 80 80 ILE N N 80 118.524 118.524 119.120 -0.596 18112 5036 1 7 . 1 1 80 80 ILE HA H 80 3.894 3.894 3.643 0.251 18112 5037 1 7 . 1 1 80 80 ILE C C 80 181.268 181.268 178.260 3.008 18112 5038 1 7 . 1 1 80 80 ILE CA C 80 64.841 64.841 63.672 1.169 18112 5039 1 7 . 1 1 80 80 ILE CB C 80 37.125 37.125 36.471 0.654 18112 5040 1 7 . 1 1 80 80 ILE H H 80 7.837 7.837 8.138 -0.301 18112 5041 1 7 . 1 1 81 81 ASN N N 81 121.233 121.233 117.964 3.269 18112 5042 1 7 . 1 1 81 81 ASN HA H 81 4.398 4.398 4.449 -0.051 18112 5043 1 7 . 1 1 81 81 ASN C C 81 176.546 176.546 177.098 -0.552 18112 5044 1 7 . 1 1 81 81 ASN CA C 81 55.892 55.892 55.785 0.107 18112 5045 1 7 . 1 1 81 81 ASN CB C 81 37.603 37.603 38.819 -1.216 18112 5046 1 7 . 1 1 81 81 ASN H H 81 8.262 8.262 8.174 0.088 18112 5047 1 7 . 1 1 82 82 ASP N N 82 119.240 119.240 117.481 1.759 18112 5048 1 7 . 1 1 82 82 ASP HA H 82 4.666 4.666 4.645 0.021 18112 5049 1 7 . 1 1 82 82 ASP C C 82 176.767 176.767 177.181 -0.414 18112 5050 1 7 . 1 1 82 82 ASP CA C 82 54.771 54.771 54.524 0.247 18112 5051 1 7 . 1 1 82 82 ASP CB C 82 40.121 40.121 41.631 -1.510 18112 5052 1 7 . 1 1 82 82 ASP H H 82 8.316 8.316 8.106 0.210 18112 5053 1 7 . 1 1 83 83 GLY N N 83 106.913 106.913 105.826 1.087 18112 5054 1 7 . 1 1 83 83 GLY C C 83 174.601 174.601 175.284 -0.683 18112 5055 1 7 . 1 1 83 83 GLY CA C 83 45.214 45.214 45.456 -0.242 18112 5056 1 7 . 1 1 83 83 GLY H H 83 7.810 7.810 8.025 -0.215 18112 5057 1 7 . 1 1 84 84 VAL N N 84 122.981 122.981 121.129 1.852 18112 5058 1 7 . 1 1 84 84 VAL HA H 84 3.850 3.850 3.879 -0.029 18112 5059 1 7 . 1 1 84 84 VAL C C 84 177.265 177.265 177.511 -0.246 18112 5060 1 7 . 1 1 84 84 VAL CA C 84 64.270 64.270 65.353 -1.083 18112 5061 1 7 . 1 1 84 84 VAL CB C 84 30.471 30.471 32.011 -1.540 18112 5062 1 7 . 1 1 84 84 VAL H H 84 8.157 8.157 7.896 0.261 18112 5063 1 7 . 1 1 85 85 THR N N 85 115.232 115.232 108.142 7.090 18112 5064 1 7 . 1 1 85 85 THR HA H 85 4.716 4.716 4.238 0.478 18112 5065 1 7 . 1 1 85 85 THR C C 85 174.489 174.489 173.703 0.786 18112 5066 1 7 . 1 1 85 85 THR CA C 85 61.618 61.618 64.257 -2.639 18112 5067 1 7 . 1 1 85 85 THR CB C 85 70.081 70.081 68.319 1.762 18112 5068 1 7 . 1 1 85 85 THR H H 85 8.890 8.890 7.854 1.036 18112 5069 1 7 . 1 1 86 86 SER N N 86 117.009 117.009 115.747 1.262 18112 5070 1 7 . 1 1 86 86 SER HA H 86 5.046 5.046 4.466 0.580 18112 5071 1 7 . 1 1 86 86 SER C C 86 174.473 174.473 175.147 -0.674 18112 5072 1 7 . 1 1 86 86 SER CA C 86 55.922 55.922 56.253 -0.331 18112 5073 1 7 . 1 1 86 86 SER CB C 86 64.385 64.385 64.642 -0.257 18112 5074 1 7 . 1 1 86 86 SER H H 86 7.704 7.704 7.816 -0.112 18112 5075 1 7 . 1 1 87 87 THR N N 87 118.634 118.634 118.717 -0.083 18112 5076 1 7 . 1 1 87 87 THR HA H 87 4.065 4.065 4.125 -0.060 18112 5077 1 7 . 1 1 87 87 THR C C 87 176.047 176.047 175.604 0.443 18112 5078 1 7 . 1 1 87 87 THR CA C 87 64.983 64.983 63.952 1.031 18112 5079 1 7 . 1 1 87 87 THR CB C 87 68.045 68.045 68.770 -0.725 18112 5080 1 7 . 1 1 87 87 THR H H 87 8.711 8.711 8.597 0.114 18112 5081 1 7 . 1 1 88 88 GLU N N 88 117.889 117.889 119.902 -2.013 18112 5082 1 7 . 1 1 88 88 GLU HA H 88 3.881 3.881 4.100 -0.219 18112 5083 1 7 . 1 1 88 88 GLU C C 88 177.146 177.146 177.667 -0.521 18112 5084 1 7 . 1 1 88 88 GLU CA C 88 57.814 57.814 58.540 -0.726 18112 5085 1 7 . 1 1 88 88 GLU CB C 88 28.050 28.050 28.805 -0.755 18112 5086 1 7 . 1 1 88 88 GLU H H 88 8.152 8.152 8.141 0.011 18112 5087 1 7 . 1 1 89 89 GLU N N 89 115.617 115.617 117.679 -2.062 18112 5088 1 7 . 1 1 89 89 GLU HA H 89 4.149 4.149 4.326 -0.177 18112 5089 1 7 . 1 1 89 89 GLU C C 89 176.192 176.192 176.910 -0.718 18112 5090 1 7 . 1 1 89 89 GLU CA C 89 56.133 56.133 56.764 -0.631 18112 5091 1 7 . 1 1 89 89 GLU CB C 89 29.415 29.415 30.501 -1.086 18112 5092 1 7 . 1 1 89 89 GLU H H 89 7.311 7.311 7.877 -0.566 18112 5093 1 7 . 1 1 90 90 LEU N N 90 120.870 120.870 119.075 1.795 18112 5094 1 7 . 1 1 90 90 LEU HA H 90 4.439 4.439 4.211 0.228 18112 5095 1 7 . 1 1 90 90 LEU C C 90 175.267 175.267 177.326 -2.059 18112 5096 1 7 . 1 1 90 90 LEU CA C 90 53.504 53.504 56.096 -2.592 18112 5097 1 7 . 1 1 90 90 LEU CB C 90 40.479 40.479 43.302 -2.823 18112 5098 1 7 . 1 1 90 90 LEU H H 90 7.311 7.311 7.426 -0.115 18112 5099 1 7 . 1 1 91 91 SER N N 91 118.376 118.376 112.400 5.976 18112 5100 1 7 . 1 1 91 91 SER HA H 91 4.747 4.747 4.559 0.188 18112 5101 1 7 . 1 1 91 91 SER C C 91 173.332 173.332 172.751 0.581 18112 5102 1 7 . 1 1 91 91 SER CA C 91 56.314 56.314 58.674 -2.360 18112 5103 1 7 . 1 1 91 91 SER CB C 91 64.615 64.615 63.884 0.731 18112 5104 1 7 . 1 1 91 91 SER H H 91 8.221 8.221 7.555 0.666 18112 5105 1 7 . 1 1 92 92 ILE N N 92 122.247 122.247 120.446 1.801 18112 5106 1 7 . 1 1 92 92 ILE HA H 92 4.537 4.537 4.377 0.160 18112 5107 1 7 . 1 1 92 92 ILE C C 92 174.059 174.059 175.501 -1.442 18112 5108 1 7 . 1 1 92 92 ILE CA C 92 59.881 59.881 59.195 0.686 18112 5109 1 7 . 1 1 92 92 ILE CB C 92 37.820 37.820 42.310 -4.490 18112 5110 1 7 . 1 1 92 92 ILE H H 92 8.570 8.570 7.820 0.750 18112 5111 1 7 . 1 1 93 93 THR N N 93 116.069 116.069 120.859 -4.790 18112 5112 1 7 . 1 1 93 93 THR HA H 93 4.580 4.580 4.350 0.230 18112 5113 1 7 . 1 1 93 93 THR C C 93 175.049 175.049 174.588 0.461 18112 5114 1 7 . 1 1 93 93 THR CA C 93 58.988 58.988 64.710 -5.722 18112 5115 1 7 . 1 1 93 93 THR CB C 93 71.362 71.362 67.869 3.493 18112 5116 1 7 . 1 1 93 93 THR H H 93 7.224 7.224 8.799 -1.575 18112 5117 1 7 . 1 1 94 94 ARG N N 94 116.595 116.595 125.449 -8.854 18112 5118 1 7 . 1 1 94 94 ARG HA H 94 3.077 3.077 4.465 -1.388 18112 5119 1 7 . 1 1 94 94 ARG C C 94 175.076 175.076 175.283 -0.207 18112 5120 1 7 . 1 1 94 94 ARG CA C 94 57.119 57.119 54.544 2.575 18112 5121 1 7 . 1 1 94 94 ARG CB C 94 27.838 27.838 31.721 -3.883 18112 5122 1 7 . 1 1 94 94 ARG H H 94 8.596 8.596 8.181 0.415 18112 5123 1 7 . 1 1 95 95 ASP N N 95 113.735 113.735 116.817 -3.082 18112 5124 1 7 . 1 1 95 95 ASP HA H 95 4.765 4.765 2.758 2.007 18112 5125 1 7 . 1 1 95 95 ASP C C 95 175.876 175.876 175.612 0.264 18112 5126 1 7 . 1 1 95 95 ASP CA C 95 53.156 53.156 55.020 -1.864 18112 5127 1 7 . 1 1 95 95 ASP CB C 95 41.166 41.166 41.065 0.102 18112 5128 1 7 . 1 1 95 95 ASP H H 95 7.607 7.607 7.755 -0.148 18112 5129 1 7 . 1 1 96 96 CYS N N 96 116.012 116.012 114.681 1.331 18112 5130 1 7 . 1 1 96 96 CYS C C 96 174.361 174.361 175.686 -1.325 18112 5131 1 7 . 1 1 96 96 CYS CA C 96 56.562 56.562 61.976 -5.414 18112 5132 1 7 . 1 1 96 96 CYS CB C 96 29.416 29.416 26.729 2.687 18112 5133 1 7 . 1 1 96 96 CYS H H 96 7.094 7.094 8.314 -1.220 18112 5134 1 7 . 1 1 97 97 GLU N N 97 123.087 123.087 120.566 2.521 18112 5135 1 7 . 1 1 97 97 GLU C C 97 178.748 178.748 178.564 0.184 18112 5136 1 7 . 1 1 97 97 GLU CA C 97 59.912 59.912 59.138 0.774 18112 5137 1 7 . 1 1 97 97 GLU CB C 97 29.195 29.195 29.361 -0.166 18112 5138 1 7 . 1 1 97 97 GLU H H 97 9.003 9.003 7.936 1.067 18112 5139 1 7 . 1 1 98 98 LEU N N 98 120.942 120.942 120.752 0.190 18112 5140 1 7 . 1 1 98 98 LEU HA H 98 3.614 3.614 4.161 -0.547 18112 5141 1 7 . 1 1 98 98 LEU C C 98 177.796 177.796 178.805 -1.009 18112 5142 1 7 . 1 1 98 98 LEU CA C 98 58.090 58.090 58.844 -0.754 18112 5143 1 7 . 1 1 98 98 LEU CB C 98 39.778 39.778 41.754 -1.976 18112 5144 1 7 . 1 1 98 98 LEU H H 98 8.656 8.656 7.871 0.785 18112 5145 1 7 . 1 1 99 99 TYR N N 99 118.313 118.313 117.214 1.099 18112 5146 1 7 . 1 1 99 99 TYR C C 99 177.077 177.077 178.629 -1.552 18112 5147 1 7 . 1 1 99 99 TYR CA C 99 62.622 62.622 59.249 3.373 18112 5148 1 7 . 1 1 99 99 TYR CB C 99 38.742 38.742 37.376 1.366 18112 5149 1 7 . 1 1 99 99 TYR H H 99 7.522 7.522 8.330 -0.808 18112 5150 1 7 . 1 1 100 100 ARG N N 100 118.101 118.101 120.399 -2.298 18112 5151 1 7 . 1 1 100 100 ARG C C 100 178.616 178.616 178.399 0.217 18112 5152 1 7 . 1 1 100 100 ARG CA C 100 59.915 59.915 59.367 0.548 18112 5153 1 7 . 1 1 100 100 ARG CB C 100 29.100 29.100 30.260 -1.160 18112 5154 1 7 . 1 1 100 100 ARG H H 100 8.243 8.243 8.430 -0.187 18112 5155 1 7 . 1 1 101 101 ALA N N 101 120.972 120.972 123.008 -2.036 18112 5156 1 7 . 1 1 101 101 ALA HA H 101 4.145 4.145 4.129 0.016 18112 5157 1 7 . 1 1 101 101 ALA C C 101 181.359 181.359 179.848 1.511 18112 5158 1 7 . 1 1 101 101 ALA CA C 101 55.057 55.057 55.105 -0.048 18112 5159 1 7 . 1 1 101 101 ALA CB C 101 17.543 17.543 18.245 -0.702 18112 5160 1 7 . 1 1 101 101 ALA H H 101 8.352 8.352 8.017 0.335 18112 5161 1 7 . 1 1 102 102 LEU N N 102 115.683 115.683 118.879 -3.196 18112 5162 1 7 . 1 1 102 102 LEU HA H 102 4.333 4.333 3.775 0.558 18112 5163 1 7 . 1 1 102 102 LEU C C 102 178.583 178.583 179.185 -0.602 18112 5164 1 7 . 1 1 102 102 LEU CA C 102 57.634 57.634 57.947 -0.313 18112 5165 1 7 . 1 1 102 102 LEU CB C 102 41.716 41.716 41.616 0.100 18112 5166 1 7 . 1 1 102 102 LEU H H 102 7.960 7.960 8.382 -0.422 18112 5167 1 7 . 1 1 103 103 ASN N N 103 118.957 118.957 117.450 1.507 18112 5168 1 7 . 1 1 103 103 ASN C C 103 177.470 177.470 177.526 -0.056 18112 5169 1 7 . 1 1 103 103 ASN CA C 103 56.974 56.974 55.993 0.981 18112 5170 1 7 . 1 1 103 103 ASN CB C 103 38.140 38.140 38.415 -0.275 18112 5171 1 7 . 1 1 103 103 ASN H H 103 9.301 9.301 8.183 1.118 18112 5172 1 7 . 1 1 104 104 MET N N 104 113.763 113.763 119.139 -5.376 18112 5173 1 7 . 1 1 104 104 MET CA C 104 57.362 57.362 57.698 -0.336 18112 5174 1 7 . 1 1 104 104 MET CB C 104 31.895 31.895 32.396 -0.501 18112 5175 1 7 . 1 1 104 104 MET H H 104 8.332 8.332 8.056 0.276 18112 5176 1 7 . 1 1 105 105 HIS N N 105 116.024 116.024 117.737 -1.713 18112 5177 1 7 . 1 1 105 105 HIS HA H 105 3.764 3.764 4.062 -0.298 18112 5178 1 7 . 1 1 105 105 HIS C C 105 176.939 176.939 176.871 0.068 18112 5179 1 7 . 1 1 105 105 HIS CA C 105 59.069 59.069 58.634 0.435 18112 5180 1 7 . 1 1 105 105 HIS H H 105 7.156 7.156 8.025 -0.869 18112 5181 1 7 . 1 1 106 106 TYR N N 106 113.161 113.161 114.780 -1.619 18112 5182 1 7 . 1 1 106 106 TYR C C 106 173.767 173.767 174.499 -0.732 18112 5183 1 7 . 1 1 106 106 TYR CA C 106 58.488 58.488 59.277 -0.789 18112 5184 1 7 . 1 1 106 106 TYR CB C 106 38.225 38.225 38.728 -0.503 18112 5185 1 7 . 1 1 106 106 TYR H H 106 7.204 7.204 7.876 -0.672 18112 5186 1 7 . 1 1 107 107 ASN N N 107 118.875 118.875 115.587 3.288 18112 5187 1 7 . 1 1 107 107 ASN HA H 107 3.922 3.922 4.515 -0.593 18112 5188 1 7 . 1 1 107 107 ASN C C 107 175.815 175.815 175.649 0.166 18112 5189 1 7 . 1 1 107 107 ASN CA C 107 51.233 51.233 53.120 -1.887 18112 5190 1 7 . 1 1 107 107 ASN CB C 107 38.142 38.142 38.080 0.062 18112 5191 1 7 . 1 1 107 107 ASN H H 107 8.127 8.127 7.950 0.177 18112 5192 1 7 . 1 1 108 108 LYS N N 108 122.850 122.850 123.602 -0.752 18112 5193 1 7 . 1 1 108 108 LYS HA H 108 3.954 3.954 4.063 -0.109 18112 5194 1 7 . 1 1 108 108 LYS C C 108 177.586 177.586 177.314 0.272 18112 5195 1 7 . 1 1 108 108 LYS CA C 108 59.749 59.749 59.170 0.579 18112 5196 1 7 . 1 1 108 108 LYS CB C 108 31.498 31.498 32.138 -0.640 18112 5197 1 7 . 1 1 108 108 LYS H H 108 7.772 7.772 8.882 -1.110 18112 5198 1 7 . 1 1 109 109 ALA N N 109 118.054 118.054 119.287 -1.233 18112 5199 1 7 . 1 1 109 109 ALA HA H 109 4.137 4.137 4.148 -0.011 18112 5200 1 7 . 1 1 109 109 ALA C C 109 177.889 177.889 177.638 0.251 18112 5201 1 7 . 1 1 109 109 ALA CA C 109 52.299 52.299 52.608 -0.309 18112 5202 1 7 . 1 1 109 109 ALA CB C 109 17.787 17.787 18.320 -0.533 18112 5203 1 7 . 1 1 109 109 ALA H H 109 8.307 8.307 7.821 0.486 18112 5204 1 7 . 1 1 110 110 ASN N N 110 115.542 115.542 117.419 -1.877 18112 5205 1 7 . 1 1 110 110 ASN HA H 110 4.480 4.480 4.345 0.135 18112 5206 1 7 . 1 1 110 110 ASN C C 110 174.277 174.277 175.016 -0.739 18112 5207 1 7 . 1 1 110 110 ASN CA C 110 53.504 53.504 53.294 0.210 18112 5208 1 7 . 1 1 110 110 ASN CB C 110 37.283 37.283 37.612 -0.329 18112 5209 1 7 . 1 1 110 110 ASN H H 110 8.353 8.353 7.713 0.640 18112 5210 1 7 . 1 1 111 111 ASP N N 111 114.692 114.692 125.983 -11.291 18112 5211 1 7 . 1 1 111 111 ASP HA H 111 4.485 4.485 4.354 0.131 18112 5212 1 7 . 1 1 111 111 ASP C C 111 174.868 174.868 176.975 -2.107 18112 5213 1 7 . 1 1 111 111 ASP CA C 111 53.227 53.227 56.276 -3.049 18112 5214 1 7 . 1 1 111 111 ASP CB C 111 39.228 39.228 40.807 -1.579 18112 5215 1 7 . 1 1 111 111 ASP H H 111 8.297 8.297 8.019 0.278 18112 5216 1 7 . 1 1 112 112 PHE N N 112 120.927 120.927 117.574 3.353 18112 5217 1 7 . 1 1 112 112 PHE HA H 112 4.752 4.752 4.415 0.337 18112 5218 1 7 . 1 1 112 112 PHE C C 112 174.633 174.633 176.267 -1.634 18112 5219 1 7 . 1 1 112 112 PHE CA C 112 56.346 56.346 59.827 -3.481 18112 5220 1 7 . 1 1 112 112 PHE H H 112 7.784 7.784 8.043 -0.259 18112 5221 1 7 . 1 1 113 113 GLU N N 113 128.111 128.111 114.661 13.450 18112 5222 1 7 . 1 1 113 113 GLU HA H 113 4.011 4.011 4.029 -0.018 18112 5223 1 7 . 1 1 113 113 GLU C C 113 173.502 173.502 175.523 -2.021 18112 5224 1 7 . 1 1 113 113 GLU CA C 113 55.100 55.100 58.741 -3.641 18112 5225 1 7 . 1 1 113 113 GLU H H 113 7.752 7.752 8.419 -0.667 18112 5226 1 7 . 1 1 114 114 VAL N N 114 129.326 129.326 114.897 14.429 18112 5227 1 7 . 1 1 114 114 VAL HA H 114 3.241 3.241 4.251 -1.010 18112 5228 1 7 . 1 1 114 114 VAL CA C 114 60.838 60.838 59.603 1.235 18112 5229 1 7 . 1 1 114 114 VAL CB C 114 32.609 32.609 31.706 0.903 18112 5230 1 7 . 1 1 114 114 VAL H H 114 8.008 8.008 7.676 0.332 18112 5231 1 7 . 1 1 115 115 PRO HA H 115 4.429 4.429 4.587 -0.158 18112 5232 1 7 . 1 1 115 115 PRO C C 115 177.421 177.421 178.101 -0.680 18112 5233 1 7 . 1 1 115 115 PRO CA C 115 61.882 61.882 62.688 -0.806 18112 5234 1 7 . 1 1 115 115 PRO CB C 115 30.974 30.974 32.791 -1.817 18112 5235 1 7 . 1 1 116 116 GLU N N 116 123.936 123.936 121.533 2.403 18112 5236 1 7 . 1 1 116 116 GLU C C 116 179.034 179.034 178.823 0.211 18112 5237 1 7 . 1 1 116 116 GLU CA C 116 58.913 58.913 60.380 -1.467 18112 5238 1 7 . 1 1 116 116 GLU CB C 116 28.378 28.378 29.124 -0.746 18112 5239 1 7 . 1 1 116 116 GLU H H 116 8.757 8.757 8.816 -0.059 18112 5240 1 7 . 1 1 117 117 ARG N N 117 116.943 116.943 119.179 -2.236 18112 5241 1 7 . 1 1 117 117 ARG C C 117 177.570 177.570 178.271 -0.701 18112 5242 1 7 . 1 1 117 117 ARG CA C 117 57.033 57.033 58.233 -1.200 18112 5243 1 7 . 1 1 117 117 ARG CB C 117 28.172 28.172 29.198 -1.026 18112 5244 1 7 . 1 1 117 117 ARG H H 117 8.733 8.733 8.570 0.163 18112 5245 1 7 . 1 1 118 118 PHE N N 118 117.528 117.528 116.665 0.863 18112 5246 1 7 . 1 1 118 118 PHE HA H 118 4.137 4.137 4.283 -0.146 18112 5247 1 7 . 1 1 118 118 PHE C C 118 176.992 176.992 177.418 -0.426 18112 5248 1 7 . 1 1 118 118 PHE CA C 118 61.627 61.627 60.650 0.977 18112 5249 1 7 . 1 1 118 118 PHE CB C 118 37.386 37.386 38.476 -1.090 18112 5250 1 7 . 1 1 118 118 PHE H H 118 7.606 7.606 7.999 -0.393 18112 5251 1 7 . 1 1 119 119 LEU N N 119 118.483 118.483 120.363 -1.880 18112 5252 1 7 . 1 1 119 119 LEU HA H 119 3.684 3.684 4.175 -0.491 18112 5253 1 7 . 1 1 119 119 LEU C C 119 178.802 178.802 178.896 -0.094 18112 5254 1 7 . 1 1 119 119 LEU CA C 119 59.875 59.875 56.981 2.894 18112 5255 1 7 . 1 1 119 119 LEU CB C 119 39.453 39.453 40.582 -1.129 18112 5256 1 7 . 1 1 119 119 LEU H H 119 7.248 7.248 7.631 -0.383 18112 5257 1 7 . 1 1 120 120 GLU N N 120 117.870 117.870 120.625 -2.755 18112 5258 1 7 . 1 1 120 120 GLU C C 120 179.932 179.932 179.443 0.489 18112 5259 1 7 . 1 1 120 120 GLU CA C 120 59.150 59.150 59.426 -0.276 18112 5260 1 7 . 1 1 120 120 GLU CB C 120 28.878 28.878 29.230 -0.352 18112 5261 1 7 . 1 1 120 120 GLU H H 120 7.423 7.423 8.234 -0.811 18112 5262 1 7 . 1 1 121 121 VAL N N 121 120.777 120.777 120.015 0.762 18112 5263 1 7 . 1 1 121 121 VAL HA H 121 3.545 3.545 3.654 -0.109 18112 5264 1 7 . 1 1 121 121 VAL C C 121 179.302 179.302 177.877 1.425 18112 5265 1 7 . 1 1 121 121 VAL CA C 121 66.875 66.875 66.738 0.137 18112 5266 1 7 . 1 1 121 121 VAL CB C 121 30.823 30.823 31.343 -0.520 18112 5267 1 7 . 1 1 121 121 VAL H H 121 8.313 8.313 8.096 0.217 18112 5268 1 7 . 1 1 122 122 ALA N N 122 127.029 127.029 122.218 4.811 18112 5269 1 7 . 1 1 122 122 ALA HA H 122 4.251 4.251 4.167 0.084 18112 5270 1 7 . 1 1 122 122 ALA C C 122 178.366 178.366 179.778 -1.412 18112 5271 1 7 . 1 1 122 122 ALA CA C 122 54.748 54.748 55.250 -0.502 18112 5272 1 7 . 1 1 122 122 ALA CB C 122 16.565 16.565 18.383 -1.818 18112 5273 1 7 . 1 1 122 122 ALA H H 122 8.896 8.896 7.973 0.923 18112 5274 1 7 . 1 1 123 123 GLN N N 123 119.887 119.887 119.520 0.367 18112 5275 1 7 . 1 1 123 123 GLN C C 123 177.908 177.908 178.639 -0.731 18112 5276 1 7 . 1 1 123 123 GLN CA C 123 60.671 60.671 58.948 1.723 18112 5277 1 7 . 1 1 123 123 GLN H H 123 8.349 8.349 7.963 0.386 18112 5278 1 7 . 1 1 124 124 ILE N N 124 120.632 120.632 119.540 1.092 18112 5279 1 7 . 1 1 124 124 ILE HA H 124 3.651 3.651 3.792 -0.141 18112 5280 1 7 . 1 1 124 124 ILE C C 124 178.703 178.703 178.317 0.386 18112 5281 1 7 . 1 1 124 124 ILE CA C 124 65.945 65.945 64.978 0.967 18112 5282 1 7 . 1 1 124 124 ILE H H 124 8.204 8.204 8.238 -0.034 18112 5283 1 7 . 1 1 125 125 THR N N 125 115.084 115.084 116.171 -1.087 18112 5284 1 7 . 1 1 125 125 THR C C 125 175.568 175.568 176.614 -1.046 18112 5285 1 7 . 1 1 125 125 THR CA C 125 67.872 67.872 66.271 1.601 18112 5286 1 7 . 1 1 125 125 THR H H 125 8.399 8.399 8.432 -0.033 18112 5287 1 7 . 1 1 126 126 LEU N N 126 125.011 125.011 123.232 1.779 18112 5288 1 7 . 1 1 126 126 LEU HA H 126 4.085 4.085 4.379 -0.294 18112 5289 1 7 . 1 1 126 126 LEU C C 126 178.559 178.559 178.397 0.162 18112 5290 1 7 . 1 1 126 126 LEU CA C 126 58.843 58.843 58.205 0.638 18112 5291 1 7 . 1 1 126 126 LEU CB C 126 41.421 41.421 41.939 -0.518 18112 5292 1 7 . 1 1 126 126 LEU H H 126 8.728 8.728 8.199 0.529 18112 5293 1 7 . 1 1 127 127 ARG N N 127 117.076 117.076 118.890 -1.814 18112 5294 1 7 . 1 1 127 127 ARG HA H 127 3.929 3.929 4.083 -0.154 18112 5295 1 7 . 1 1 127 127 ARG C C 127 177.984 177.984 178.542 -0.558 18112 5296 1 7 . 1 1 127 127 ARG CA C 127 60.685 60.685 59.663 1.022 18112 5297 1 7 . 1 1 127 127 ARG CB C 127 28.079 28.079 30.088 -2.009 18112 5298 1 7 . 1 1 127 127 ARG H H 127 8.213 8.213 8.235 -0.022 18112 5299 1 7 . 1 1 128 128 GLU N N 128 118.617 118.617 120.808 -2.191 18112 5300 1 7 . 1 1 128 128 GLU HA H 128 4.147 4.147 4.154 -0.007 18112 5301 1 7 . 1 1 128 128 GLU C C 128 181.150 181.150 179.045 2.105 18112 5302 1 7 . 1 1 128 128 GLU CA C 128 59.508 59.508 59.245 0.263 18112 5303 1 7 . 1 1 128 128 GLU H H 128 8.478 8.478 8.120 0.358 18112 5304 1 7 . 1 1 129 129 PHE N N 129 119.267 119.267 119.454 -0.187 18112 5305 1 7 . 1 1 129 129 PHE HA H 129 4.104 4.104 4.270 -0.166 18112 5306 1 7 . 1 1 129 129 PHE C C 129 177.170 177.170 177.573 -0.403 18112 5307 1 7 . 1 1 129 129 PHE CA C 129 63.694 63.694 61.980 1.714 18112 5308 1 7 . 1 1 129 129 PHE H H 129 8.570 8.570 8.339 0.231 18112 5309 1 7 . 1 1 130 130 PHE N N 130 118.739 118.739 119.938 -1.199 18112 5310 1 7 . 1 1 130 130 PHE HA H 130 3.884 3.884 3.988 -0.104 18112 5311 1 7 . 1 1 130 130 PHE C C 130 175.860 175.860 177.279 -1.419 18112 5312 1 7 . 1 1 130 130 PHE CA C 130 62.819 62.819 62.188 0.631 18112 5313 1 7 . 1 1 130 130 PHE H H 130 8.740 8.740 8.778 -0.038 18112 5314 1 7 . 1 1 131 131 ASN N N 131 116.028 116.028 118.091 -2.063 18112 5315 1 7 . 1 1 131 131 ASN HA H 131 4.373 4.373 4.391 -0.018 18112 5316 1 7 . 1 1 131 131 ASN C C 131 178.228 178.228 177.743 0.485 18112 5317 1 7 . 1 1 131 131 ASN CA C 131 55.150 55.150 56.241 -1.091 18112 5318 1 7 . 1 1 131 131 ASN H H 131 8.864 8.864 8.384 0.480 18112 5319 1 7 . 1 1 132 132 ALA N N 132 120.922 120.922 123.272 -2.350 18112 5320 1 7 . 1 1 132 132 ALA HA H 132 4.020 4.020 4.007 0.013 18112 5321 1 7 . 1 1 132 132 ALA C C 132 178.515 178.515 179.507 -0.992 18112 5322 1 7 . 1 1 132 132 ALA CA C 132 54.924 54.924 55.253 -0.329 18112 5323 1 7 . 1 1 132 132 ALA CB C 132 18.441 18.441 18.841 -0.400 18112 5324 1 7 . 1 1 132 132 ALA H H 132 7.745 7.745 7.873 -0.128 18112 5325 1 7 . 1 1 133 133 ILE N N 133 118.200 118.200 119.514 -1.314 18112 5326 1 7 . 1 1 133 133 ILE HA H 133 3.235 3.235 3.722 -0.487 18112 5327 1 7 . 1 1 133 133 ILE C C 133 180.606 180.606 178.299 2.307 18112 5328 1 7 . 1 1 133 133 ILE CA C 133 65.215 65.215 64.660 0.555 18112 5329 1 7 . 1 1 133 133 ILE CB C 133 38.291 38.291 37.818 0.473 18112 5330 1 7 . 1 1 133 133 ILE H H 133 7.999 7.999 8.033 -0.034 18112 5331 1 7 . 1 1 134 134 ILE N N 134 122.564 122.564 120.102 2.462 18112 5332 1 7 . 1 1 134 134 ILE HA H 134 3.788 3.788 3.625 0.163 18112 5333 1 7 . 1 1 134 134 ILE C C 134 177.215 177.215 176.957 0.258 18112 5334 1 7 . 1 1 134 134 ILE CA C 134 63.584 63.584 63.704 -0.120 18112 5335 1 7 . 1 1 134 134 ILE CB C 134 35.636 35.636 37.445 -1.809 18112 5336 1 7 . 1 1 134 134 ILE H H 134 8.670 8.670 7.954 0.716 18112 5337 1 7 . 1 1 135 135 ALA N N 135 119.989 119.989 120.855 -0.866 18112 5338 1 7 . 1 1 135 135 ALA HA H 135 4.357 4.357 4.149 0.208 18112 5339 1 7 . 1 1 135 135 ALA C C 135 177.786 177.786 178.491 -0.705 18112 5340 1 7 . 1 1 135 135 ALA CA C 135 51.521 51.521 53.811 -2.290 18112 5341 1 7 . 1 1 135 135 ALA CB C 135 18.839 18.839 19.828 -0.989 18112 5342 1 7 . 1 1 135 135 ALA H H 135 6.898 6.898 7.864 -0.966 18112 5343 1 7 . 1 1 136 136 GLY N N 136 107.682 107.682 105.059 2.623 18112 5344 1 7 . 1 1 136 136 GLY C C 136 176.324 176.324 173.990 2.334 18112 5345 1 7 . 1 1 136 136 GLY CA C 136 45.469 45.469 44.775 0.694 18112 5346 1 7 . 1 1 136 136 GLY H H 136 7.913 7.913 7.954 -0.041 18112 5347 1 7 . 1 1 137 137 LYS N N 137 117.213 117.213 118.372 -1.159 18112 5348 1 7 . 1 1 137 137 LYS HA H 137 4.004 4.004 3.362 0.642 18112 5349 1 7 . 1 1 137 137 LYS C C 137 176.616 176.616 175.529 1.087 18112 5350 1 7 . 1 1 137 137 LYS CA C 137 57.499 57.499 58.449 -0.950 18112 5351 1 7 . 1 1 137 137 LYS CB C 137 30.927 30.927 29.898 1.028 18112 5352 1 7 . 1 1 137 137 LYS H H 137 8.312 8.312 8.058 0.254 18112 5353 1 7 . 1 1 138 138 ASP N N 138 113.545 113.545 120.205 -6.660 18112 5354 1 7 . 1 1 138 138 ASP HA H 138 3.061 3.061 4.188 -1.127 18112 5355 1 7 . 1 1 138 138 ASP C C 138 174.698 174.698 177.008 -2.310 18112 5356 1 7 . 1 1 138 138 ASP CA C 138 53.694 53.694 53.292 0.402 18112 5357 1 7 . 1 1 138 138 ASP CB C 138 36.008 36.008 40.183 -4.175 18112 5358 1 7 . 1 1 138 138 ASP H H 138 8.465 8.465 7.854 0.611 18112 5359 1 7 . 1 1 139 139 VAL N N 139 115.191 115.191 114.093 1.098 18112 5360 1 7 . 1 1 139 139 VAL HA H 139 3.886 3.886 3.794 0.092 18112 5361 1 7 . 1 1 139 139 VAL C C 139 175.889 175.889 176.013 -0.124 18112 5362 1 7 . 1 1 139 139 VAL CA C 139 62.793 62.793 64.381 -1.588 18112 5363 1 7 . 1 1 139 139 VAL CB C 139 30.662 30.662 31.963 -1.301 18112 5364 1 7 . 1 1 139 139 VAL H H 139 6.610 6.610 7.570 -0.960 18112 5365 1 7 . 1 1 140 140 ASP N N 140 123.363 123.363 118.672 4.691 18112 5366 1 7 . 1 1 140 140 ASP C C 140 175.234 175.234 175.058 0.176 18112 5367 1 7 . 1 1 140 140 ASP CA C 140 50.221 50.221 51.683 -1.462 18112 5368 1 7 . 1 1 140 140 ASP CB C 140 42.254 42.254 42.506 -0.252 18112 5369 1 7 . 1 1 140 140 ASP H H 140 7.553 7.553 7.907 -0.354 18112 5370 1 7 . 1 1 141 141 PRO HA H 141 4.682 4.682 4.559 0.123 18112 5371 1 7 . 1 1 141 141 PRO C C 141 178.678 178.678 177.672 1.006 18112 5372 1 7 . 1 1 141 141 PRO CA C 141 64.532 64.532 64.634 -0.102 18112 5373 1 7 . 1 1 141 141 PRO CB C 141 31.331 31.331 32.142 -0.812 18112 5374 1 7 . 1 1 142 142 SER N N 142 114.421 114.421 113.578 0.843 18112 5375 1 7 . 1 1 142 142 SER HA H 142 4.565 4.565 4.619 -0.054 18112 5376 1 7 . 1 1 142 142 SER C C 142 176.524 176.524 175.664 0.860 18112 5377 1 7 . 1 1 142 142 SER CA C 142 58.711 58.711 59.008 -0.297 18112 5378 1 7 . 1 1 142 142 SER CB C 142 62.783 62.783 62.137 0.646 18112 5379 1 7 . 1 1 142 142 SER H H 142 8.703 8.703 8.693 0.010 18112 5380 1 7 . 1 1 143 143 TRP N N 143 123.598 123.598 121.776 1.822 18112 5381 1 7 . 1 1 143 143 TRP HA H 143 4.136 4.136 4.304 -0.168 18112 5382 1 7 . 1 1 143 143 TRP C C 143 177.113 177.113 176.701 0.412 18112 5383 1 7 . 1 1 143 143 TRP CA C 143 59.803 59.803 59.841 -0.038 18112 5384 1 7 . 1 1 143 143 TRP CB C 143 26.364 26.364 27.715 -1.351 18112 5385 1 7 . 1 1 143 143 TRP H H 143 8.374 8.374 7.743 0.631 18112 5386 1 7 . 1 1 144 144 LYS N N 144 119.293 119.293 120.171 -0.878 18112 5387 1 7 . 1 1 144 144 LYS HA H 144 2.719 2.719 3.349 -0.630 18112 5388 1 7 . 1 1 144 144 LYS C C 144 177.243 177.243 178.373 -1.130 18112 5389 1 7 . 1 1 144 144 LYS CA C 144 58.851 58.851 59.106 -0.255 18112 5390 1 7 . 1 1 144 144 LYS CB C 144 29.373 29.373 31.310 -1.937 18112 5391 1 7 . 1 1 144 144 LYS H H 144 7.196 7.196 7.638 -0.442 18112 5392 1 7 . 1 1 145 145 LYS N N 145 116.440 116.440 118.509 -2.069 18112 5393 1 7 . 1 1 145 145 LYS HA H 145 3.490 3.490 4.275 -0.785 18112 5394 1 7 . 1 1 145 145 LYS C C 145 179.149 179.149 179.018 0.131 18112 5395 1 7 . 1 1 145 145 LYS CA C 145 59.271 59.271 59.487 -0.216 18112 5396 1 7 . 1 1 145 145 LYS CB C 145 30.521 30.521 31.971 -1.450 18112 5397 1 7 . 1 1 145 145 LYS H H 145 7.389 7.389 7.880 -0.491 18112 5398 1 7 . 1 1 146 146 ALA N N 146 118.582 118.582 123.012 -4.430 18112 5399 1 7 . 1 1 146 146 ALA HA H 146 3.932 3.932 4.016 -0.084 18112 5400 1 7 . 1 1 146 146 ALA C C 146 179.968 179.968 179.403 0.565 18112 5401 1 7 . 1 1 146 146 ALA CA C 146 54.241 54.241 55.023 -0.782 18112 5402 1 7 . 1 1 146 146 ALA CB C 146 17.689 17.689 18.173 -0.484 18112 5403 1 7 . 1 1 146 146 ALA H H 146 7.112 7.112 7.905 -0.793 18112 5404 1 7 . 1 1 147 147 ILE N N 147 118.537 118.537 118.738 -0.201 18112 5405 1 7 . 1 1 147 147 ILE HA H 147 3.642 3.642 3.447 0.195 18112 5406 1 7 . 1 1 147 147 ILE C C 147 178.919 178.919 178.048 0.871 18112 5407 1 7 . 1 1 147 147 ILE CA C 147 64.418 64.418 63.594 0.824 18112 5408 1 7 . 1 1 147 147 ILE CB C 147 36.519 36.519 35.920 0.599 18112 5409 1 7 . 1 1 147 147 ILE H H 147 6.734 6.734 7.643 -0.909 18112 5410 1 7 . 1 1 148 148 TYR N N 148 121.033 121.033 118.133 2.900 18112 5411 1 7 . 1 1 148 148 TYR HA H 148 4.489 4.489 4.132 0.357 18112 5412 1 7 . 1 1 148 148 TYR C C 148 178.348 178.348 178.292 0.056 18112 5413 1 7 . 1 1 148 148 TYR CA C 148 57.389 57.389 60.171 -2.782 18112 5414 1 7 . 1 1 148 148 TYR CB C 148 35.280 35.280 36.972 -1.692 18112 5415 1 7 . 1 1 148 148 TYR H H 148 8.126 8.126 8.011 0.115 18112 5416 1 7 . 1 1 149 149 LYS N N 149 114.484 114.484 119.827 -5.343 18112 5417 1 7 . 1 1 149 149 LYS C C 149 178.051 178.051 178.790 -0.739 18112 5418 1 7 . 1 1 149 149 LYS CA C 149 59.036 59.036 58.600 0.436 18112 5419 1 7 . 1 1 149 149 LYS CB C 149 31.575 31.575 31.757 -0.182 18112 5420 1 7 . 1 1 149 149 LYS H H 149 7.364 7.364 7.640 -0.276 18112 5421 1 7 . 1 1 150 150 VAL N N 150 117.812 117.812 116.857 0.955 18112 5422 1 7 . 1 1 150 150 VAL HA H 150 3.770 3.770 3.844 -0.074 18112 5423 1 7 . 1 1 150 150 VAL C C 150 178.786 178.786 177.190 1.596 18112 5424 1 7 . 1 1 150 150 VAL CA C 150 65.070 65.070 65.517 -0.447 18112 5425 1 7 . 1 1 150 150 VAL CB C 150 29.515 29.515 31.266 -1.751 18112 5426 1 7 . 1 1 150 150 VAL H H 150 7.254 7.254 7.785 -0.531 18112 5427 1 7 . 1 1 151 151 ILE N N 151 117.884 117.884 113.060 4.824 18112 5428 1 7 . 1 1 151 151 ILE C C 151 180.539 180.539 177.231 3.308 18112 5429 1 7 . 1 1 151 151 ILE CA C 151 61.490 61.490 62.633 -1.143 18112 5430 1 7 . 1 1 151 151 ILE CB C 151 33.994 33.994 38.262 -4.268 18112 5431 1 7 . 1 1 151 151 ILE H H 151 8.154 8.154 7.851 0.303 18112 5432 1 7 . 1 1 152 152 CYS N N 152 118.649 118.649 120.491 -1.842 18112 5433 1 7 . 1 1 152 152 CYS HA H 152 4.153 4.153 4.417 -0.264 18112 5434 1 7 . 1 1 152 152 CYS C C 152 174.888 174.888 176.352 -1.464 18112 5435 1 7 . 1 1 152 152 CYS CA C 152 61.052 61.052 59.946 1.106 18112 5436 1 7 . 1 1 152 152 CYS CB C 152 36.364 36.364 27.663 8.701 18112 5437 1 7 . 1 1 152 152 CYS H H 152 8.711 8.711 8.034 0.677 18112 5438 1 7 . 1 1 153 153 LYS N N 153 118.498 118.498 119.900 -1.402 18112 5439 1 7 . 1 1 153 153 LYS C C 153 177.389 177.389 177.529 -0.140 18112 5440 1 7 . 1 1 153 153 LYS CA C 153 56.243 56.243 58.710 -2.467 18112 5441 1 7 . 1 1 153 153 LYS CB C 153 31.343 31.343 32.075 -0.732 18112 5442 1 7 . 1 1 153 153 LYS H H 153 6.782 6.782 7.948 -1.166 18112 5443 1 7 . 1 1 154 154 LEU N N 154 117.318 117.318 118.083 -0.765 18112 5444 1 7 . 1 1 154 154 LEU HA H 154 4.576 4.576 4.331 0.245 18112 5445 1 7 . 1 1 154 154 LEU C C 154 177.161 177.161 177.129 0.032 18112 5446 1 7 . 1 1 154 154 LEU CA C 154 53.782 53.782 54.827 -1.045 18112 5447 1 7 . 1 1 154 154 LEU CB C 154 40.881 40.881 41.670 -0.789 18112 5448 1 7 . 1 1 154 154 LEU H H 154 7.616 7.616 7.439 0.177 18112 5449 1 7 . 1 1 155 155 ASP N N 155 121.564 121.564 119.654 1.910 18112 5450 1 7 . 1 1 155 155 ASP C C 155 177.094 177.094 175.333 1.761 18112 5451 1 7 . 1 1 155 155 ASP CA C 155 55.732 55.732 55.524 0.208 18112 5452 1 7 . 1 1 155 155 ASP CB C 155 40.139 40.139 41.848 -1.709 18112 5453 1 7 . 1 1 155 155 ASP H H 155 7.582 7.582 7.498 0.084 18112 5454 1 7 . 1 1 156 156 SER N N 156 117.352 117.352 119.193 -1.841 18112 5455 1 7 . 1 1 156 156 SER HA H 156 4.818 4.818 4.603 0.215 18112 5456 1 7 . 1 1 156 156 SER C C 156 173.409 173.409 173.874 -0.465 18112 5457 1 7 . 1 1 156 156 SER CA C 156 57.073 57.073 57.030 0.043 18112 5458 1 7 . 1 1 156 156 SER CB C 156 65.150 65.150 65.604 -0.454 18112 5459 1 7 . 1 1 156 156 SER H H 156 8.846 8.846 8.014 0.832 18112 5460 1 7 . 1 1 157 157 GLU N N 157 120.688 120.688 120.762 -0.074 18112 5461 1 7 . 1 1 157 157 GLU HA H 157 4.038 4.038 4.304 -0.266 18112 5462 1 7 . 1 1 157 157 GLU C C 157 176.332 176.332 176.048 0.284 18112 5463 1 7 . 1 1 157 157 GLU CA C 157 56.464 56.464 55.609 0.855 18112 5464 1 7 . 1 1 157 157 GLU CB C 157 29.206 29.206 29.708 -0.502 18112 5465 1 7 . 1 1 157 157 GLU H H 157 8.356 8.356 8.338 0.018 18112 5466 1 7 . 1 1 158 158 VAL N N 158 126.906 126.906 120.018 6.888 18112 5467 1 7 . 1 1 158 158 VAL HA H 158 3.449 3.449 3.749 -0.300 18112 5468 1 7 . 1 1 158 158 VAL C C 158 176.382 176.382 173.772 2.610 18112 5469 1 7 . 1 1 158 158 VAL CA C 158 59.584 59.584 58.775 0.809 18112 5470 1 7 . 1 1 158 158 VAL CB C 158 31.160 31.160 31.131 0.028 18112 5471 1 7 . 1 1 158 158 VAL H H 158 8.561 8.561 7.902 0.659 18112 5472 1 7 . 1 1 159 159 PRO HA H 159 4.403 4.403 4.218 0.185 18112 5473 1 7 . 1 1 159 159 PRO C C 159 176.757 176.757 175.651 1.106 18112 5474 1 7 . 1 1 159 159 PRO CA C 159 63.845 63.845 62.979 0.866 18112 5475 1 7 . 1 1 159 159 PRO CB C 159 32.106 32.106 31.530 0.576 18112 5476 1 7 . 1 1 160 160 GLU N N 160 122.904 122.904 122.299 0.605 18112 5477 1 7 . 1 1 160 160 GLU HA H 160 4.008 4.008 3.751 0.257 18112 5478 1 7 . 1 1 160 160 GLU C C 160 179.132 179.132 175.285 3.847 18112 5479 1 7 . 1 1 160 160 GLU CA C 160 59.407 59.407 58.089 1.318 18112 5480 1 7 . 1 1 160 160 GLU CB C 160 28.991 28.991 29.915 -0.924 18112 5481 1 7 . 1 1 160 160 GLU H H 160 8.650 8.650 8.439 0.211 18112 5482 1 7 . 1 1 161 161 ILE N N 161 119.782 119.782 115.138 4.644 18112 5483 1 7 . 1 1 161 161 ILE HA H 161 4.146 4.146 4.086 0.060 18112 5484 1 7 . 1 1 161 161 ILE C C 161 176.176 176.176 174.227 1.949 18112 5485 1 7 . 1 1 161 161 ILE CA C 161 62.034 62.034 60.319 1.715 18112 5486 1 7 . 1 1 161 161 ILE CB C 161 37.113 37.113 40.369 -3.256 18112 5487 1 7 . 1 1 161 161 ILE H H 161 8.448 8.448 7.144 1.304 18112 5488 1 7 . 1 1 162 162 PHE N N 162 117.594 117.594 126.601 -9.007 18112 5489 1 7 . 1 1 162 162 PHE C C 162 176.115 176.115 176.749 -0.634 18112 5490 1 7 . 1 1 162 162 PHE CA C 162 61.009 61.009 59.252 1.757 18112 5491 1 7 . 1 1 162 162 PHE CB C 162 38.394 38.394 39.137 -0.743 18112 5492 1 7 . 1 1 162 162 PHE H H 162 8.145 8.145 8.524 -0.379 18112 5493 1 7 . 1 1 163 163 LYS N N 163 116.083 116.083 120.169 -4.086 18112 5494 1 7 . 1 1 163 163 LYS C C 163 178.196 178.196 176.726 1.470 18112 5495 1 7 . 1 1 163 163 LYS CA C 163 58.136 58.136 58.310 -0.174 18112 5496 1 7 . 1 1 163 163 LYS CB C 163 31.694 31.694 32.910 -1.216 18112 5497 1 7 . 1 1 163 163 LYS H H 163 8.232 8.232 7.901 0.331 18112 5498 1 7 . 1 1 164 164 SER N N 164 113.680 113.680 111.998 1.682 18112 5499 1 7 . 1 1 164 164 SER CA C 164 55.205 55.205 55.824 -0.619 18112 5500 1 7 . 1 1 164 164 SER CB C 164 63.265 63.265 64.643 -1.378 18112 5501 1 7 . 1 1 164 164 SER H H 164 7.708 7.708 7.706 0.002 18112 5502 1 7 . 1 1 165 165 PRO HA H 165 4.580 4.580 4.431 0.149 18112 5503 1 7 . 1 1 165 165 PRO C C 165 177.541 177.541 176.233 1.308 18112 5504 1 7 . 1 1 165 165 PRO CA C 165 63.950 63.950 63.930 0.020 18112 5505 1 7 . 1 1 165 165 PRO CB C 165 30.686 30.686 30.774 -0.088 18112 5506 1 7 . 1 1 166 166 ASN N N 166 116.304 116.304 116.641 -0.337 18112 5507 1 7 . 1 1 166 166 ASN HA H 166 5.029 5.029 4.243 0.786 18112 5508 1 7 . 1 1 166 166 ASN C C 166 175.811 175.811 176.020 -0.209 18112 5509 1 7 . 1 1 166 166 ASN CA C 166 51.962 51.962 54.483 -2.521 18112 5510 1 7 . 1 1 166 166 ASN CB C 166 37.915 37.915 37.047 0.868 18112 5511 1 7 . 1 1 166 166 ASN H H 166 8.216 8.216 8.432 -0.216 18112 5512 1 7 . 1 1 167 167 CYS N N 167 116.078 116.078 119.414 -3.336 18112 5513 1 7 . 1 1 167 167 CYS HA H 167 4.011 4.011 4.278 -0.267 18112 5514 1 7 . 1 1 167 167 CYS C C 167 175.057 175.057 175.912 -0.855 18112 5515 1 7 . 1 1 167 167 CYS CA C 167 59.816 59.816 60.739 -0.923 18112 5516 1 7 . 1 1 167 167 CYS CB C 167 27.446 27.446 27.126 0.320 18112 5517 1 7 . 1 1 167 167 CYS H H 167 7.246 7.246 7.951 -0.705 18112 5518 1 7 . 1 1 168 168 LEU N N 168 120.082 120.082 119.616 0.466 18112 5519 1 7 . 1 1 168 168 LEU HA H 168 3.880 3.880 4.279 -0.399 18112 5520 1 7 . 1 1 168 168 LEU C C 168 178.541 178.541 178.316 0.225 18112 5521 1 7 . 1 1 168 168 LEU CA C 168 57.734 57.734 56.114 1.620 18112 5522 1 7 . 1 1 168 168 LEU CB C 168 38.825 38.825 40.054 -1.229 18112 5523 1 7 . 1 1 168 168 LEU H H 168 8.451 8.451 8.206 0.245 18112 5524 1 7 . 1 1 169 169 GLN N N 169 116.700 116.700 120.567 -3.867 18112 5525 1 7 . 1 1 169 169 GLN HA H 169 4.064 4.064 4.049 0.015 18112 5526 1 7 . 1 1 169 169 GLN C C 169 177.378 177.378 177.493 -0.115 18112 5527 1 7 . 1 1 169 169 GLN CA C 169 57.675 57.675 58.091 -0.416 18112 5528 1 7 . 1 1 169 169 GLN CB C 169 27.710 27.710 28.196 -0.486 18112 5529 1 7 . 1 1 169 169 GLN H H 169 7.665 7.665 7.676 -0.011 18112 5530 1 7 . 1 1 170 170 GLU N N 170 116.701 116.701 120.048 -3.347 18112 5531 1 7 . 1 1 170 170 GLU HA H 170 4.214 4.214 4.130 0.084 18112 5532 1 7 . 1 1 170 170 GLU C C 170 177.730 177.730 178.142 -0.412 18112 5533 1 7 . 1 1 170 170 GLU CA C 170 56.899 56.899 58.636 -1.737 18112 5534 1 7 . 1 1 170 170 GLU H H 170 7.405 7.405 7.930 -0.525 18112 5535 1 7 . 1 1 171 171 LEU N N 171 118.021 118.021 114.107 3.914 18112 5536 1 7 . 1 1 171 171 LEU HA H 171 4.209 4.209 4.600 -0.391 18112 5537 1 7 . 1 1 171 171 LEU C C 171 177.005 177.005 176.891 0.114 18112 5538 1 7 . 1 1 171 171 LEU CA C 171 55.870 55.870 55.248 0.622 18112 5539 1 7 . 1 1 171 171 LEU CB C 171 43.680 43.680 42.431 1.249 18112 5540 1 7 . 1 1 171 171 LEU H H 171 7.823 7.823 7.471 0.352 18112 5541 1 7 . 1 1 172 172 LEU N N 172 117.580 117.580 121.952 -4.372 18112 5542 1 7 . 1 1 172 172 LEU HA H 172 4.571 4.571 4.269 0.302 18112 5543 1 7 . 1 1 172 172 LEU C C 172 176.411 176.411 176.315 0.096 18112 5544 1 7 . 1 1 172 172 LEU CA C 172 53.972 53.972 55.439 -1.467 18112 5545 1 7 . 1 1 172 172 LEU CB C 172 40.483 40.483 39.495 0.988 18112 5546 1 7 . 1 1 172 172 LEU H H 172 7.306 7.306 7.343 -0.037 18112 5547 1 7 . 1 1 173 173 HIS N N 173 123.310 123.310 123.446 -0.136 18112 5548 1 7 . 1 1 173 173 HIS C C 173 179.022 179.022 173.736 5.286 18112 5549 1 7 . 1 1 173 173 HIS CA C 173 56.693 56.693 56.187 0.506 18112 5550 1 7 . 1 1 173 173 HIS CB C 173 29.371 29.371 32.425 -3.054 18112 5551 1 7 . 1 1 173 173 HIS H H 173 8.028 8.028 8.147 -0.119 18112 5552 1 8 . 1 1 12 12 ALA N N 12 125.167 125.167 128.166 -2.999 18112 5553 1 8 . 1 1 12 12 ALA C C 12 177.566 177.566 177.793 -0.227 18112 5554 1 8 . 1 1 12 12 ALA CA C 12 52.067 52.067 52.020 0.047 18112 5555 1 8 . 1 1 12 12 ALA CB C 12 18.456 18.456 18.953 -0.497 18112 5556 1 8 . 1 1 12 12 ALA H H 12 8.311 8.311 8.734 -0.423 18112 5557 1 8 . 1 1 13 13 MET N N 13 119.278 119.278 123.043 -3.765 18112 5558 1 8 . 1 1 13 13 MET C C 13 176.325 176.325 176.827 -0.502 18112 5559 1 8 . 1 1 13 13 MET CA C 13 54.992 54.992 56.507 -1.515 18112 5560 1 8 . 1 1 13 13 MET CB C 13 32.308 32.308 32.494 -0.186 18112 5561 1 8 . 1 1 13 13 MET H H 13 8.269 8.269 8.485 -0.216 18112 5562 1 8 . 1 1 14 14 GLN N N 14 120.869 120.869 115.273 5.596 18112 5563 1 8 . 1 1 14 14 GLN HA H 14 4.399 4.399 3.991 0.408 18112 5564 1 8 . 1 1 14 14 GLN C C 14 175.644 175.644 175.122 0.522 18112 5565 1 8 . 1 1 14 14 GLN CA C 14 55.139 55.139 57.163 -2.024 18112 5566 1 8 . 1 1 14 14 GLN CB C 14 29.051 29.051 26.533 2.518 18112 5567 1 8 . 1 1 14 14 GLN H H 14 8.501 8.501 8.060 0.441 18112 5568 1 8 . 1 1 15 15 GLU N N 15 122.042 122.042 118.409 3.633 18112 5569 1 8 . 1 1 15 15 GLU C C 15 176.242 176.242 178.059 -1.817 18112 5570 1 8 . 1 1 15 15 GLU CA C 15 56.064 56.064 58.555 -2.491 18112 5571 1 8 . 1 1 15 15 GLU CB C 15 29.302 29.302 29.370 -0.068 18112 5572 1 8 . 1 1 15 15 GLU H H 15 8.547 8.547 8.286 0.261 18112 5573 1 8 . 1 1 16 16 GLY N N 16 108.821 108.821 105.601 3.220 18112 5574 1 8 . 1 1 16 16 GLY C C 16 172.949 172.949 173.930 -0.981 18112 5575 1 8 . 1 1 16 16 GLY CA C 16 44.227 44.227 44.944 -0.716 18112 5576 1 8 . 1 1 16 16 GLY H H 16 8.100 8.100 8.433 -0.333 18112 5577 1 8 . 1 1 17 17 LEU N N 17 120.315 120.315 120.702 -0.387 18112 5578 1 8 . 1 1 17 17 LEU C C 17 177.334 177.334 175.105 2.229 18112 5579 1 8 . 1 1 17 17 LEU CA C 17 53.544 53.544 54.217 -0.673 18112 5580 1 8 . 1 1 17 17 LEU CB C 17 42.140 42.140 42.416 -0.276 18112 5581 1 8 . 1 1 17 17 LEU H H 17 8.222 8.222 7.577 0.645 18112 5582 1 8 . 1 1 18 18 SER N N 18 126.547 126.547 118.024 8.523 18112 5583 1 8 . 1 1 18 18 SER CA C 18 56.851 56.851 58.700 -1.849 18112 5584 1 8 . 1 1 18 18 SER CB C 18 64.636 64.636 63.475 1.161 18112 5585 1 8 . 1 1 18 18 SER H H 18 11.627 11.627 8.683 2.944 18112 5586 1 8 . 1 1 19 19 PRO C C 19 175.118 175.118 177.124 -2.006 18112 5587 1 8 . 1 1 20 20 ASN N N 20 121.372 121.372 116.836 4.536 18112 5588 1 8 . 1 1 20 20 ASN H H 20 8.172 8.172 8.678 -0.506 18112 5589 1 8 . 1 1 25 25 ALA CB C 25 18.020 18.020 18.478 -0.458 18112 5590 1 8 . 1 1 26 26 LYS N N 26 118.490 118.490 118.087 0.403 18112 5591 1 8 . 1 1 26 26 LYS CA C 26 56.146 56.146 58.777 -2.631 18112 5592 1 8 . 1 1 26 26 LYS H H 26 6.794 6.794 7.978 -1.183 18112 5593 1 8 . 1 1 31 31 TYR HA H 31 4.398 4.398 4.297 0.101 18112 5594 1 8 . 1 1 31 31 TYR C C 31 173.714 173.714 174.928 -1.214 18112 5595 1 8 . 1 1 31 31 TYR CA C 31 59.757 59.757 56.501 3.256 18112 5596 1 8 . 1 1 32 32 THR N N 32 111.928 111.928 117.680 -5.752 18112 5597 1 8 . 1 1 32 32 THR HA H 32 4.209 4.209 4.436 -0.227 18112 5598 1 8 . 1 1 32 32 THR C C 32 171.061 171.061 174.407 -3.346 18112 5599 1 8 . 1 1 32 32 THR CA C 32 56.905 56.905 62.980 -6.075 18112 5600 1 8 . 1 1 32 32 THR CB C 32 69.707 69.707 69.950 -0.243 18112 5601 1 8 . 1 1 32 32 THR H H 32 8.237 8.237 7.649 0.588 18112 5602 1 8 . 1 1 33 33 ARG N N 33 124.856 124.856 117.113 7.743 18112 5603 1 8 . 1 1 33 33 ARG C C 33 176.451 176.451 175.218 1.233 18112 5604 1 8 . 1 1 33 33 ARG CA C 33 55.627 55.627 54.937 0.690 18112 5605 1 8 . 1 1 33 33 ARG CB C 33 29.861 29.861 32.644 -2.783 18112 5606 1 8 . 1 1 33 33 ARG H H 33 9.159 9.159 7.200 1.959 18112 5607 1 8 . 1 1 34 34 TYR N N 34 117.908 117.908 118.378 -0.470 18112 5608 1 8 . 1 1 34 34 TYR CA C 34 55.320 55.320 57.886 -2.566 18112 5609 1 8 . 1 1 34 34 TYR H H 34 8.995 8.995 8.309 0.686 18112 5610 1 8 . 1 1 35 35 PRO C C 35 177.280 177.280 177.233 0.047 18112 5611 1 8 . 1 1 36 36 SER N N 36 116.410 116.410 120.970 -4.560 18112 5612 1 8 . 1 1 36 36 SER C C 36 178.938 178.938 176.562 2.376 18112 5613 1 8 . 1 1 36 36 SER CA C 36 64.815 64.815 61.950 2.865 18112 5614 1 8 . 1 1 36 36 SER H H 36 8.106 8.106 8.429 -0.323 18112 5615 1 8 . 1 1 37 37 SER N N 37 117.488 117.488 115.601 1.887 18112 5616 1 8 . 1 1 37 37 SER C C 37 177.698 177.698 176.503 1.195 18112 5617 1 8 . 1 1 37 37 SER CA C 37 61.357 61.357 61.006 0.351 18112 5618 1 8 . 1 1 37 37 SER CB C 37 68.118 68.118 62.749 5.369 18112 5619 1 8 . 1 1 37 37 SER H H 37 8.169 8.169 8.408 -0.239 18112 5620 1 8 . 1 1 38 38 ASN N N 38 115.638 115.638 122.270 -6.632 18112 5621 1 8 . 1 1 38 38 ASN HA H 38 4.259 4.259 4.400 -0.141 18112 5622 1 8 . 1 1 38 38 ASN C C 38 177.868 177.868 177.194 0.674 18112 5623 1 8 . 1 1 38 38 ASN CA C 38 55.907 55.907 55.997 -0.090 18112 5624 1 8 . 1 1 38 38 ASN CB C 38 37.230 37.230 38.689 -1.459 18112 5625 1 8 . 1 1 38 38 ASN H H 38 8.284 8.284 7.598 0.686 18112 5626 1 8 . 1 1 39 39 MET N N 39 121.352 121.352 118.120 3.232 18112 5627 1 8 . 1 1 39 39 MET HA H 39 4.170 4.170 3.699 0.471 18112 5628 1 8 . 1 1 39 39 MET C C 39 179.068 179.068 178.660 0.408 18112 5629 1 8 . 1 1 39 39 MET CA C 39 58.751 58.751 58.114 0.637 18112 5630 1 8 . 1 1 39 39 MET CB C 39 31.850 31.850 32.196 -0.346 18112 5631 1 8 . 1 1 39 39 MET H H 39 7.857 7.857 7.474 0.383 18112 5632 1 8 . 1 1 40 40 LEU N N 40 118.936 118.936 123.398 -4.462 18112 5633 1 8 . 1 1 40 40 LEU HA H 40 4.139 4.139 4.466 -0.327 18112 5634 1 8 . 1 1 40 40 LEU C C 40 178.700 178.700 178.529 0.171 18112 5635 1 8 . 1 1 40 40 LEU CA C 40 58.455 58.455 58.902 -0.447 18112 5636 1 8 . 1 1 40 40 LEU CB C 40 40.304 40.304 41.774 -1.470 18112 5637 1 8 . 1 1 40 40 LEU H H 40 8.167 8.167 8.252 -0.085 18112 5638 1 8 . 1 1 41 41 LYS N N 41 116.791 116.791 117.282 -0.491 18112 5639 1 8 . 1 1 41 41 LYS HA H 41 3.475 3.475 4.181 -0.706 18112 5640 1 8 . 1 1 41 41 LYS C C 41 178.793 178.793 178.856 -0.063 18112 5641 1 8 . 1 1 41 41 LYS CA C 41 59.161 59.161 59.267 -0.106 18112 5642 1 8 . 1 1 41 41 LYS CB C 41 30.992 30.992 32.463 -1.471 18112 5643 1 8 . 1 1 41 41 LYS H H 41 7.632 7.632 7.899 -0.267 18112 5644 1 8 . 1 1 42 42 THR N N 42 112.819 112.819 115.039 -2.220 18112 5645 1 8 . 1 1 42 42 THR HA H 42 4.230 4.230 4.150 0.080 18112 5646 1 8 . 1 1 42 42 THR C C 42 176.142 176.142 177.253 -1.111 18112 5647 1 8 . 1 1 42 42 THR CA C 42 65.107 65.107 66.116 -1.009 18112 5648 1 8 . 1 1 42 42 THR CB C 42 68.306 68.306 69.081 -0.775 18112 5649 1 8 . 1 1 42 42 THR H H 42 7.469 7.469 7.975 -0.506 18112 5650 1 8 . 1 1 43 43 TYR N N 43 118.565 118.565 119.602 -1.037 18112 5651 1 8 . 1 1 43 43 TYR HA H 43 4.204 4.204 4.371 -0.167 18112 5652 1 8 . 1 1 43 43 TYR C C 43 174.240 174.240 176.695 -2.455 18112 5653 1 8 . 1 1 43 43 TYR CA C 43 60.886 60.886 57.365 3.521 18112 5654 1 8 . 1 1 43 43 TYR CB C 43 38.165 38.165 38.507 -0.342 18112 5655 1 8 . 1 1 43 43 TYR H H 43 7.978 7.978 7.556 0.422 18112 5656 1 8 . 1 1 44 44 PHE N N 44 120.980 120.980 117.924 3.056 18112 5657 1 8 . 1 1 44 44 PHE HA H 44 4.920 4.920 4.769 0.151 18112 5658 1 8 . 1 1 44 44 PHE C C 44 176.436 176.436 175.915 0.521 18112 5659 1 8 . 1 1 44 44 PHE CA C 44 56.672 56.672 56.750 -0.078 18112 5660 1 8 . 1 1 44 44 PHE CB C 44 36.570 36.570 37.298 -0.728 18112 5661 1 8 . 1 1 44 44 PHE H H 44 7.955 7.955 7.940 0.015 18112 5662 1 8 . 1 1 45 45 SER N N 45 113.407 113.407 115.208 -1.801 18112 5663 1 8 . 1 1 45 45 SER HA H 45 4.373 4.373 4.321 0.052 18112 5664 1 8 . 1 1 45 45 SER C C 45 174.424 174.424 175.478 -1.054 18112 5665 1 8 . 1 1 45 45 SER CA C 45 61.037 61.037 60.227 0.810 18112 5666 1 8 . 1 1 45 45 SER CB C 45 62.711 62.711 63.674 -0.963 18112 5667 1 8 . 1 1 45 45 SER H H 45 7.932 7.932 7.907 0.025 18112 5668 1 8 . 1 1 46 46 ASP N N 46 118.099 118.099 121.475 -3.376 18112 5669 1 8 . 1 1 46 46 ASP HA H 46 4.572 4.572 4.578 -0.006 18112 5670 1 8 . 1 1 46 46 ASP C C 46 174.866 174.866 175.943 -1.077 18112 5671 1 8 . 1 1 46 46 ASP CA C 46 53.602 53.602 55.572 -1.970 18112 5672 1 8 . 1 1 46 46 ASP CB C 46 38.992 38.992 41.241 -2.249 18112 5673 1 8 . 1 1 46 46 ASP H H 46 9.889 9.889 8.495 1.394 18112 5674 1 8 . 1 1 47 47 VAL N N 47 121.496 121.496 120.598 0.898 18112 5675 1 8 . 1 1 47 47 VAL HA H 47 4.058 4.058 3.796 0.262 18112 5676 1 8 . 1 1 47 47 VAL C C 47 174.676 174.676 174.952 -0.276 18112 5677 1 8 . 1 1 47 47 VAL CA C 47 61.006 61.006 62.488 -1.482 18112 5678 1 8 . 1 1 47 47 VAL CB C 47 32.110 32.110 31.302 0.808 18112 5679 1 8 . 1 1 47 47 VAL H H 47 7.781 7.781 7.744 0.037 18112 5680 1 8 . 1 1 48 48 LYS N N 48 126.100 126.100 128.284 -2.184 18112 5681 1 8 . 1 1 48 48 LYS HA H 48 4.402 4.402 4.084 0.318 18112 5682 1 8 . 1 1 48 48 LYS C C 48 175.564 175.564 175.983 -0.419 18112 5683 1 8 . 1 1 48 48 LYS CA C 48 54.874 54.874 55.321 -0.447 18112 5684 1 8 . 1 1 48 48 LYS CB C 48 30.189 30.189 30.018 0.171 18112 5685 1 8 . 1 1 48 48 LYS H H 48 8.245 8.245 7.975 0.270 18112 5686 1 8 . 1 1 49 49 PHE N N 49 125.341 125.341 123.058 2.283 18112 5687 1 8 . 1 1 49 49 PHE HA H 49 3.813 3.813 4.186 -0.373 18112 5688 1 8 . 1 1 49 49 PHE C C 49 175.708 175.708 176.100 -0.392 18112 5689 1 8 . 1 1 49 49 PHE CA C 49 60.861 60.861 59.206 1.655 18112 5690 1 8 . 1 1 49 49 PHE CB C 49 38.616 38.616 38.811 -0.195 18112 5691 1 8 . 1 1 49 49 PHE H H 49 8.626 8.626 7.558 1.068 18112 5692 1 8 . 1 1 50 50 ASN N N 50 115.408 115.408 120.724 -5.316 18112 5693 1 8 . 1 1 50 50 ASN C C 50 176.072 176.072 174.995 1.077 18112 5694 1 8 . 1 1 50 50 ASN CA C 50 51.730 51.730 51.800 -0.070 18112 5695 1 8 . 1 1 50 50 ASN H H 50 7.030 7.030 8.007 -0.977 18112 5696 1 8 . 1 1 51 51 ARG N N 51 122.706 122.706 124.706 -2.000 18112 5697 1 8 . 1 1 51 51 ARG CA C 51 59.534 59.534 59.615 -0.081 18112 5698 1 8 . 1 1 51 51 ARG H H 51 7.790 7.790 8.772 -0.982 18112 5699 1 8 . 1 1 52 52 CYS N N 52 117.340 117.340 116.807 0.533 18112 5700 1 8 . 1 1 52 52 CYS HA H 52 4.108 4.108 4.142 -0.034 18112 5701 1 8 . 1 1 52 52 CYS C C 52 178.200 178.200 177.170 1.030 18112 5702 1 8 . 1 1 52 52 CYS CA C 52 61.143 61.143 61.692 -0.549 18112 5703 1 8 . 1 1 52 52 CYS H H 52 7.681 7.681 8.211 -0.530 18112 5704 1 8 . 1 1 53 53 ILE N N 53 122.321 122.321 116.919 5.402 18112 5705 1 8 . 1 1 53 53 ILE HA H 53 3.588 3.588 3.743 -0.155 18112 5706 1 8 . 1 1 53 53 ILE C C 53 177.492 177.492 177.196 0.296 18112 5707 1 8 . 1 1 53 53 ILE CA C 53 64.109 64.109 64.244 -0.135 18112 5708 1 8 . 1 1 53 53 ILE CB C 53 37.603 37.603 37.165 0.438 18112 5709 1 8 . 1 1 53 53 ILE H H 53 8.035 8.035 7.594 0.441 18112 5710 1 8 . 1 1 54 54 THR C C 54 175.903 175.903 176.473 -0.570 18112 5711 1 8 . 1 1 54 54 THR CA C 54 67.308 67.308 67.147 0.161 18112 5712 1 8 . 1 1 55 55 SER N N 55 113.819 113.819 116.136 -2.317 18112 5713 1 8 . 1 1 55 55 SER H H 55 7.844 7.844 7.992 -0.148 18112 5714 1 8 . 1 1 56 56 GLN C C 56 179.792 179.792 177.653 2.139 18112 5715 1 8 . 1 1 57 57 LEU N N 57 116.701 116.701 120.558 -3.857 18112 5716 1 8 . 1 1 57 57 LEU HA H 57 4.519 4.519 2.832 1.687 18112 5717 1 8 . 1 1 57 57 LEU C C 57 178.775 178.775 178.278 0.497 18112 5718 1 8 . 1 1 57 57 LEU CA C 57 55.232 55.232 57.194 -1.962 18112 5719 1 8 . 1 1 57 57 LEU CB C 57 37.131 37.131 41.596 -4.465 18112 5720 1 8 . 1 1 57 57 LEU H H 57 8.267 8.267 7.645 0.622 18112 5721 1 8 . 1 1 58 58 ILE N N 58 122.522 122.522 118.023 4.499 18112 5722 1 8 . 1 1 58 58 ILE HA H 58 4.640 4.640 3.380 1.260 18112 5723 1 8 . 1 1 58 58 ILE C C 58 177.380 177.380 177.811 -0.431 18112 5724 1 8 . 1 1 58 58 ILE CA C 58 62.163 62.163 64.850 -2.687 18112 5725 1 8 . 1 1 58 58 ILE CB C 58 30.657 30.657 37.282 -6.625 18112 5726 1 8 . 1 1 58 58 ILE H H 58 8.111 8.111 7.809 0.302 18112 5727 1 8 . 1 1 59 59 LYS N N 59 121.002 121.002 121.202 -0.200 18112 5728 1 8 . 1 1 59 59 LYS C C 59 177.600 177.600 178.582 -0.982 18112 5729 1 8 . 1 1 59 59 LYS CA C 59 57.570 57.570 59.139 -1.569 18112 5730 1 8 . 1 1 59 59 LYS CB C 59 39.101 39.101 31.689 7.412 18112 5731 1 8 . 1 1 59 59 LYS H H 59 7.432 7.432 7.708 -0.276 18112 5732 1 8 . 1 1 60 60 TRP N N 60 118.679 118.679 119.461 -0.782 18112 5733 1 8 . 1 1 60 60 TRP HA H 60 3.739 3.739 4.470 -0.731 18112 5734 1 8 . 1 1 60 60 TRP C C 60 178.246 178.246 179.407 -1.161 18112 5735 1 8 . 1 1 60 60 TRP CA C 60 59.818 59.818 59.189 0.629 18112 5736 1 8 . 1 1 60 60 TRP CB C 60 31.851 31.851 28.555 3.296 18112 5737 1 8 . 1 1 60 60 TRP H H 60 7.565 7.565 7.810 -0.245 18112 5738 1 8 . 1 1 61 61 PHE N N 61 118.005 118.005 116.717 1.288 18112 5739 1 8 . 1 1 61 61 PHE HA H 61 3.882 3.882 3.808 0.074 18112 5740 1 8 . 1 1 61 61 PHE CA C 61 60.054 60.054 59.041 1.014 18112 5741 1 8 . 1 1 61 61 PHE H H 61 7.819 7.819 8.526 -0.707 18112 5742 1 8 . 1 1 62 62 SER N N 62 121.144 121.144 115.735 5.409 18112 5743 1 8 . 1 1 62 62 SER C C 62 177.840 177.840 176.637 1.203 18112 5744 1 8 . 1 1 62 62 SER CA C 62 55.892 55.892 62.017 -6.125 18112 5745 1 8 . 1 1 62 62 SER H H 62 8.878 8.878 8.542 0.336 18112 5746 1 8 . 1 1 63 63 ASN N N 63 115.303 115.303 121.056 -5.753 18112 5747 1 8 . 1 1 63 63 ASN C C 63 177.222 177.222 177.800 -0.578 18112 5748 1 8 . 1 1 63 63 ASN CA C 63 60.467 60.467 56.631 3.836 18112 5749 1 8 . 1 1 63 63 ASN H H 63 8.001 8.001 8.224 -0.223 18112 5750 1 8 . 1 1 64 64 PHE N N 64 112.571 112.571 121.399 -8.828 18112 5751 1 8 . 1 1 64 64 PHE CA C 64 56.453 56.453 61.872 -5.419 18112 5752 1 8 . 1 1 64 64 PHE H H 64 7.082 7.082 8.482 -1.400 18112 5753 1 8 . 1 1 65 65 ARG N N 65 116.695 116.695 118.823 -2.128 18112 5754 1 8 . 1 1 65 65 ARG CA C 65 59.590 59.590 58.959 0.631 18112 5755 1 8 . 1 1 65 65 ARG H H 65 8.091 8.091 8.562 -0.471 18112 5756 1 8 . 1 1 66 66 GLU N N 66 121.653 121.653 119.284 2.369 18112 5757 1 8 . 1 1 66 66 GLU HA H 66 4.739 4.739 4.306 0.433 18112 5758 1 8 . 1 1 66 66 GLU C C 66 174.621 174.621 178.950 -4.329 18112 5759 1 8 . 1 1 66 66 GLU CA C 66 59.583 59.583 58.821 0.763 18112 5760 1 8 . 1 1 66 66 GLU H H 66 7.597 7.597 8.689 -1.092 18112 5761 1 8 . 1 1 67 67 PHE N N 67 111.578 111.578 121.698 -10.120 18112 5762 1 8 . 1 1 67 67 PHE C C 67 176.164 176.164 177.562 -1.398 18112 5763 1 8 . 1 1 67 67 PHE CA C 67 61.156 61.156 61.481 -0.325 18112 5764 1 8 . 1 1 67 67 PHE H H 67 7.067 7.067 8.371 -1.304 18112 5765 1 8 . 1 1 68 68 TYR N N 68 119.370 119.370 120.909 -1.539 18112 5766 1 8 . 1 1 68 68 TYR C C 68 176.844 176.844 177.324 -0.480 18112 5767 1 8 . 1 1 68 68 TYR CA C 68 61.758 61.758 61.718 0.040 18112 5768 1 8 . 1 1 68 68 TYR H H 68 7.442 7.442 8.606 -1.164 18112 5769 1 8 . 1 1 69 69 TYR N N 69 116.047 116.047 119.940 -3.893 18112 5770 1 8 . 1 1 69 69 TYR HA H 69 4.086 4.086 3.999 0.087 18112 5771 1 8 . 1 1 69 69 TYR C C 69 180.328 180.328 177.446 2.882 18112 5772 1 8 . 1 1 69 69 TYR CA C 69 61.528 61.528 61.639 -0.111 18112 5773 1 8 . 1 1 69 69 TYR H H 69 9.127 9.127 8.372 0.755 18112 5774 1 8 . 1 1 70 70 ILE N N 70 124.738 124.738 117.226 7.512 18112 5775 1 8 . 1 1 70 70 ILE HA H 70 3.828 3.828 3.458 0.370 18112 5776 1 8 . 1 1 70 70 ILE C C 70 179.585 179.585 178.041 1.544 18112 5777 1 8 . 1 1 70 70 ILE CA C 70 65.787 65.787 62.968 2.819 18112 5778 1 8 . 1 1 70 70 ILE CB C 70 36.435 36.435 36.153 0.283 18112 5779 1 8 . 1 1 70 70 ILE H H 70 8.631 8.631 8.244 0.387 18112 5780 1 8 . 1 1 71 71 GLN N N 71 117.940 117.940 120.601 -2.661 18112 5781 1 8 . 1 1 71 71 GLN HA H 71 3.826 3.826 3.470 0.356 18112 5782 1 8 . 1 1 71 71 GLN C C 71 178.192 178.192 177.780 0.412 18112 5783 1 8 . 1 1 71 71 GLN CA C 71 57.779 57.779 58.209 -0.430 18112 5784 1 8 . 1 1 71 71 GLN H H 71 7.738 7.738 7.612 0.126 18112 5785 1 8 . 1 1 72 72 MET N N 72 117.353 117.353 118.244 -0.891 18112 5786 1 8 . 1 1 72 72 MET HA H 72 4.112 4.112 4.133 -0.021 18112 5787 1 8 . 1 1 72 72 MET C C 72 177.203 177.203 178.365 -1.162 18112 5788 1 8 . 1 1 72 72 MET CA C 72 57.272 57.272 57.355 -0.083 18112 5789 1 8 . 1 1 72 72 MET H H 72 7.844 7.844 7.705 0.139 18112 5790 1 8 . 1 1 73 73 GLU N N 73 117.858 117.858 119.864 -2.006 18112 5791 1 8 . 1 1 73 73 GLU HA H 73 3.572 3.572 3.618 -0.046 18112 5792 1 8 . 1 1 73 73 GLU C C 73 177.344 177.344 178.568 -1.224 18112 5793 1 8 . 1 1 73 73 GLU CA C 73 60.324 60.324 59.346 0.978 18112 5794 1 8 . 1 1 73 73 GLU H H 73 7.503 7.503 7.862 -0.359 18112 5795 1 8 . 1 1 74 74 LYS N N 74 118.716 118.716 120.444 -1.728 18112 5796 1 8 . 1 1 74 74 LYS HA H 74 3.867 3.867 3.899 -0.032 18112 5797 1 8 . 1 1 74 74 LYS C C 74 180.077 180.077 179.224 0.853 18112 5798 1 8 . 1 1 74 74 LYS CA C 74 59.754 59.754 58.649 1.105 18112 5799 1 8 . 1 1 74 74 LYS H H 74 7.912 7.912 7.476 0.436 18112 5800 1 8 . 1 1 75 75 TYR N N 75 117.309 117.309 118.689 -1.380 18112 5801 1 8 . 1 1 75 75 TYR HA H 75 4.085 4.085 4.332 -0.247 18112 5802 1 8 . 1 1 75 75 TYR C C 75 178.874 178.874 178.544 0.330 18112 5803 1 8 . 1 1 75 75 TYR CA C 75 63.306 63.306 59.128 4.178 18112 5804 1 8 . 1 1 75 75 TYR H H 75 8.421 8.421 7.784 0.637 18112 5805 1 8 . 1 1 76 76 ALA N N 76 125.392 125.392 121.064 4.328 18112 5806 1 8 . 1 1 76 76 ALA HA H 76 4.221 4.221 4.055 0.166 18112 5807 1 8 . 1 1 76 76 ALA C C 76 178.850 178.850 179.191 -0.341 18112 5808 1 8 . 1 1 76 76 ALA CA C 76 56.280 56.280 55.247 1.033 18112 5809 1 8 . 1 1 76 76 ALA CB C 76 18.687 18.687 18.297 0.390 18112 5810 1 8 . 1 1 76 76 ALA H H 76 8.553 8.553 8.303 0.250 18112 5811 1 8 . 1 1 77 77 ARG N N 77 115.067 115.067 118.974 -3.907 18112 5812 1 8 . 1 1 77 77 ARG HA H 77 3.935 3.935 3.815 0.120 18112 5813 1 8 . 1 1 77 77 ARG C C 77 179.341 179.341 178.231 1.110 18112 5814 1 8 . 1 1 77 77 ARG CA C 77 60.499 60.499 59.834 0.665 18112 5815 1 8 . 1 1 77 77 ARG H H 77 8.471 8.471 8.150 0.321 18112 5816 1 8 . 1 1 78 78 GLN N N 78 120.107 120.107 118.461 1.646 18112 5817 1 8 . 1 1 78 78 GLN HA H 78 3.921 3.921 4.070 -0.149 18112 5818 1 8 . 1 1 78 78 GLN C C 78 177.289 177.289 178.200 -0.911 18112 5819 1 8 . 1 1 78 78 GLN CA C 78 58.619 58.619 58.821 -0.202 18112 5820 1 8 . 1 1 78 78 GLN CB C 78 27.752 27.752 28.593 -0.841 18112 5821 1 8 . 1 1 78 78 GLN H H 78 8.142 8.142 8.014 0.128 18112 5822 1 8 . 1 1 79 79 ALA N N 79 120.809 120.809 123.268 -2.459 18112 5823 1 8 . 1 1 79 79 ALA HA H 79 4.308 4.308 4.058 0.250 18112 5824 1 8 . 1 1 79 79 ALA C C 79 179.924 179.924 179.583 0.341 18112 5825 1 8 . 1 1 79 79 ALA CA C 79 54.970 54.970 55.324 -0.354 18112 5826 1 8 . 1 1 79 79 ALA CB C 79 17.064 17.064 18.621 -1.557 18112 5827 1 8 . 1 1 79 79 ALA H H 79 7.811 7.811 7.965 -0.154 18112 5828 1 8 . 1 1 80 80 ILE N N 80 118.524 118.524 118.963 -0.439 18112 5829 1 8 . 1 1 80 80 ILE HA H 80 3.894 3.894 3.516 0.378 18112 5830 1 8 . 1 1 80 80 ILE C C 80 181.268 181.268 178.100 3.168 18112 5831 1 8 . 1 1 80 80 ILE CA C 80 64.841 64.841 64.995 -0.154 18112 5832 1 8 . 1 1 80 80 ILE CB C 80 37.125 37.125 37.574 -0.449 18112 5833 1 8 . 1 1 80 80 ILE H H 80 7.837 7.837 7.980 -0.143 18112 5834 1 8 . 1 1 81 81 ASN N N 81 121.233 121.233 117.724 3.509 18112 5835 1 8 . 1 1 81 81 ASN HA H 81 4.398 4.398 4.366 0.032 18112 5836 1 8 . 1 1 81 81 ASN C C 81 176.546 176.546 177.051 -0.505 18112 5837 1 8 . 1 1 81 81 ASN CA C 81 55.892 55.892 56.024 -0.132 18112 5838 1 8 . 1 1 81 81 ASN CB C 81 37.603 37.603 38.609 -1.006 18112 5839 1 8 . 1 1 81 81 ASN H H 81 8.262 8.262 8.058 0.204 18112 5840 1 8 . 1 1 82 82 ASP N N 82 119.240 119.240 117.865 1.375 18112 5841 1 8 . 1 1 82 82 ASP HA H 82 4.666 4.666 4.551 0.115 18112 5842 1 8 . 1 1 82 82 ASP C C 82 176.767 176.767 177.181 -0.414 18112 5843 1 8 . 1 1 82 82 ASP CA C 82 54.771 54.771 54.870 -0.099 18112 5844 1 8 . 1 1 82 82 ASP CB C 82 40.121 40.121 41.679 -1.558 18112 5845 1 8 . 1 1 82 82 ASP H H 82 8.316 8.316 8.038 0.278 18112 5846 1 8 . 1 1 83 83 GLY N N 83 106.913 106.913 105.851 1.062 18112 5847 1 8 . 1 1 83 83 GLY C C 83 174.601 174.601 174.715 -0.114 18112 5848 1 8 . 1 1 83 83 GLY CA C 83 45.214 45.214 44.957 0.257 18112 5849 1 8 . 1 1 83 83 GLY H H 83 7.810 7.810 7.962 -0.152 18112 5850 1 8 . 1 1 84 84 VAL N N 84 122.981 122.981 121.248 1.733 18112 5851 1 8 . 1 1 84 84 VAL HA H 84 3.850 3.850 4.057 -0.207 18112 5852 1 8 . 1 1 84 84 VAL C C 84 177.265 177.265 176.086 1.179 18112 5853 1 8 . 1 1 84 84 VAL CA C 84 64.270 64.270 63.403 0.867 18112 5854 1 8 . 1 1 84 84 VAL CB C 84 30.471 30.471 32.540 -2.069 18112 5855 1 8 . 1 1 84 84 VAL H H 84 8.157 8.157 7.551 0.606 18112 5856 1 8 . 1 1 85 85 THR N N 85 115.232 115.232 115.536 -0.304 18112 5857 1 8 . 1 1 85 85 THR HA H 85 4.716 4.716 4.685 0.031 18112 5858 1 8 . 1 1 85 85 THR C C 85 174.489 174.489 174.813 -0.324 18112 5859 1 8 . 1 1 85 85 THR CA C 85 61.618 61.618 62.277 -0.659 18112 5860 1 8 . 1 1 85 85 THR CB C 85 70.081 70.081 69.598 0.483 18112 5861 1 8 . 1 1 85 85 THR H H 85 8.890 8.890 8.290 0.600 18112 5862 1 8 . 1 1 86 86 SER N N 86 117.009 117.009 119.906 -2.897 18112 5863 1 8 . 1 1 86 86 SER HA H 86 5.046 5.046 4.556 0.490 18112 5864 1 8 . 1 1 86 86 SER C C 86 174.473 174.473 175.089 -0.616 18112 5865 1 8 . 1 1 86 86 SER CA C 86 55.922 55.922 57.406 -1.484 18112 5866 1 8 . 1 1 86 86 SER CB C 86 64.385 64.385 64.202 0.183 18112 5867 1 8 . 1 1 86 86 SER H H 86 7.704 7.704 7.779 -0.075 18112 5868 1 8 . 1 1 87 87 THR N N 87 118.634 118.634 118.208 0.426 18112 5869 1 8 . 1 1 87 87 THR HA H 87 4.065 4.065 3.972 0.093 18112 5870 1 8 . 1 1 87 87 THR C C 87 176.047 176.047 175.239 0.808 18112 5871 1 8 . 1 1 87 87 THR CA C 87 64.983 64.983 64.273 0.710 18112 5872 1 8 . 1 1 87 87 THR CB C 87 68.045 68.045 68.757 -0.712 18112 5873 1 8 . 1 1 87 87 THR H H 87 8.711 8.711 8.543 0.169 18112 5874 1 8 . 1 1 88 88 GLU N N 88 117.889 117.889 118.977 -1.088 18112 5875 1 8 . 1 1 88 88 GLU HA H 88 3.881 3.881 4.167 -0.286 18112 5876 1 8 . 1 1 88 88 GLU C C 88 177.146 177.146 177.218 -0.072 18112 5877 1 8 . 1 1 88 88 GLU CA C 88 57.814 57.814 58.227 -0.413 18112 5878 1 8 . 1 1 88 88 GLU CB C 88 28.050 28.050 28.447 -0.397 18112 5879 1 8 . 1 1 88 88 GLU H H 88 8.152 8.152 8.531 -0.379 18112 5880 1 8 . 1 1 89 89 GLU N N 89 115.617 115.617 117.642 -2.025 18112 5881 1 8 . 1 1 89 89 GLU HA H 89 4.149 4.149 4.377 -0.228 18112 5882 1 8 . 1 1 89 89 GLU C C 89 176.192 176.192 176.404 -0.212 18112 5883 1 8 . 1 1 89 89 GLU CA C 89 56.133 56.133 56.777 -0.644 18112 5884 1 8 . 1 1 89 89 GLU CB C 89 29.415 29.415 30.458 -1.043 18112 5885 1 8 . 1 1 89 89 GLU H H 89 7.311 7.311 7.830 -0.519 18112 5886 1 8 . 1 1 90 90 LEU N N 90 120.870 120.870 113.945 6.925 18112 5887 1 8 . 1 1 90 90 LEU HA H 90 4.439 4.439 4.532 -0.093 18112 5888 1 8 . 1 1 90 90 LEU C C 90 175.267 175.267 175.707 -0.440 18112 5889 1 8 . 1 1 90 90 LEU CA C 90 53.504 53.504 55.000 -1.496 18112 5890 1 8 . 1 1 90 90 LEU CB C 90 40.479 40.479 43.658 -3.179 18112 5891 1 8 . 1 1 90 90 LEU H H 90 7.311 7.311 7.374 -0.063 18112 5892 1 8 . 1 1 91 91 SER N N 91 118.376 118.376 114.763 3.613 18112 5893 1 8 . 1 1 91 91 SER HA H 91 4.747 4.747 4.518 0.229 18112 5894 1 8 . 1 1 91 91 SER C C 91 173.332 173.332 172.210 1.122 18112 5895 1 8 . 1 1 91 91 SER CA C 91 56.314 56.314 58.704 -2.390 18112 5896 1 8 . 1 1 91 91 SER CB C 91 64.615 64.615 63.905 0.710 18112 5897 1 8 . 1 1 91 91 SER H H 91 8.221 8.221 7.795 0.426 18112 5898 1 8 . 1 1 92 92 ILE N N 92 122.247 122.247 124.138 -1.891 18112 5899 1 8 . 1 1 92 92 ILE HA H 92 4.537 4.537 4.448 0.089 18112 5900 1 8 . 1 1 92 92 ILE C C 92 174.059 174.059 175.777 -1.718 18112 5901 1 8 . 1 1 92 92 ILE CA C 92 59.881 59.881 58.873 1.008 18112 5902 1 8 . 1 1 92 92 ILE CB C 92 37.820 37.820 42.619 -4.799 18112 5903 1 8 . 1 1 92 92 ILE H H 92 8.570 8.570 8.067 0.503 18112 5904 1 8 . 1 1 93 93 THR N N 93 116.069 116.069 120.594 -4.525 18112 5905 1 8 . 1 1 93 93 THR HA H 93 4.580 4.580 4.093 0.487 18112 5906 1 8 . 1 1 93 93 THR C C 93 175.049 175.049 175.050 -0.001 18112 5907 1 8 . 1 1 93 93 THR CA C 93 58.988 58.988 64.651 -5.663 18112 5908 1 8 . 1 1 93 93 THR CB C 93 71.362 71.362 69.025 2.337 18112 5909 1 8 . 1 1 93 93 THR H H 93 7.224 7.224 8.670 -1.446 18112 5910 1 8 . 1 1 94 94 ARG N N 94 116.595 116.595 119.481 -2.886 18112 5911 1 8 . 1 1 94 94 ARG HA H 94 3.077 3.077 4.114 -1.037 18112 5912 1 8 . 1 1 94 94 ARG C C 94 175.076 175.076 175.211 -0.135 18112 5913 1 8 . 1 1 94 94 ARG CA C 94 57.119 57.119 57.197 -0.078 18112 5914 1 8 . 1 1 94 94 ARG CB C 94 27.838 27.838 28.268 -0.430 18112 5915 1 8 . 1 1 94 94 ARG H H 94 8.596 8.596 9.278 -0.682 18112 5916 1 8 . 1 1 95 95 ASP N N 95 113.735 113.735 120.062 -6.327 18112 5917 1 8 . 1 1 95 95 ASP HA H 95 4.765 4.765 4.835 -0.070 18112 5918 1 8 . 1 1 95 95 ASP C C 95 175.876 175.876 176.721 -0.845 18112 5919 1 8 . 1 1 95 95 ASP CA C 95 53.156 53.156 52.867 0.289 18112 5920 1 8 . 1 1 95 95 ASP CB C 95 41.166 41.166 41.458 -0.292 18112 5921 1 8 . 1 1 95 95 ASP H H 95 7.607 7.607 7.889 -0.282 18112 5922 1 8 . 1 1 96 96 CYS N N 96 116.012 116.012 125.344 -9.332 18112 5923 1 8 . 1 1 96 96 CYS C C 96 174.361 174.361 176.573 -2.212 18112 5924 1 8 . 1 1 96 96 CYS CA C 96 56.562 56.562 62.575 -6.013 18112 5925 1 8 . 1 1 96 96 CYS CB C 96 29.416 29.416 28.009 1.407 18112 5926 1 8 . 1 1 96 96 CYS H H 96 7.094 7.094 8.931 -1.837 18112 5927 1 8 . 1 1 97 97 GLU N N 97 123.087 123.087 119.694 3.393 18112 5928 1 8 . 1 1 97 97 GLU C C 97 178.748 178.748 178.622 0.126 18112 5929 1 8 . 1 1 97 97 GLU CA C 97 59.912 59.912 59.207 0.705 18112 5930 1 8 . 1 1 97 97 GLU CB C 97 29.195 29.195 29.084 0.111 18112 5931 1 8 . 1 1 97 97 GLU H H 97 9.003 9.003 8.159 0.844 18112 5932 1 8 . 1 1 98 98 LEU N N 98 120.942 120.942 121.485 -0.543 18112 5933 1 8 . 1 1 98 98 LEU HA H 98 3.614 3.614 4.117 -0.503 18112 5934 1 8 . 1 1 98 98 LEU C C 98 177.796 177.796 178.759 -0.963 18112 5935 1 8 . 1 1 98 98 LEU CA C 98 58.090 58.090 57.371 0.719 18112 5936 1 8 . 1 1 98 98 LEU CB C 98 39.778 39.778 41.597 -1.819 18112 5937 1 8 . 1 1 98 98 LEU H H 98 8.656 8.656 7.881 0.775 18112 5938 1 8 . 1 1 99 99 TYR N N 99 118.313 118.313 118.234 0.079 18112 5939 1 8 . 1 1 99 99 TYR C C 99 177.077 177.077 178.233 -1.156 18112 5940 1 8 . 1 1 99 99 TYR CA C 99 62.622 62.622 62.777 -0.155 18112 5941 1 8 . 1 1 99 99 TYR CB C 99 38.742 38.742 37.745 0.997 18112 5942 1 8 . 1 1 99 99 TYR H H 99 7.522 7.522 8.203 -0.681 18112 5943 1 8 . 1 1 100 100 ARG N N 100 118.101 118.101 119.341 -1.240 18112 5944 1 8 . 1 1 100 100 ARG C C 100 178.616 178.616 178.337 0.279 18112 5945 1 8 . 1 1 100 100 ARG CA C 100 59.915 59.915 59.398 0.517 18112 5946 1 8 . 1 1 100 100 ARG CB C 100 29.100 29.100 30.226 -1.126 18112 5947 1 8 . 1 1 100 100 ARG H H 100 8.243 8.243 8.443 -0.200 18112 5948 1 8 . 1 1 101 101 ALA N N 101 120.972 120.972 123.687 -2.715 18112 5949 1 8 . 1 1 101 101 ALA HA H 101 4.145 4.145 4.226 -0.081 18112 5950 1 8 . 1 1 101 101 ALA C C 101 181.359 181.359 179.630 1.729 18112 5951 1 8 . 1 1 101 101 ALA CA C 101 55.057 55.057 54.978 0.079 18112 5952 1 8 . 1 1 101 101 ALA CB C 101 17.543 17.543 18.399 -0.856 18112 5953 1 8 . 1 1 101 101 ALA H H 101 8.352 8.352 7.825 0.527 18112 5954 1 8 . 1 1 102 102 LEU N N 102 115.683 115.683 118.900 -3.217 18112 5955 1 8 . 1 1 102 102 LEU HA H 102 4.333 4.333 3.493 0.840 18112 5956 1 8 . 1 1 102 102 LEU C C 102 178.583 178.583 179.503 -0.920 18112 5957 1 8 . 1 1 102 102 LEU CA C 102 57.634 57.634 58.353 -0.719 18112 5958 1 8 . 1 1 102 102 LEU CB C 102 41.716 41.716 41.506 0.210 18112 5959 1 8 . 1 1 102 102 LEU H H 102 7.960 7.960 8.276 -0.316 18112 5960 1 8 . 1 1 103 103 ASN N N 103 118.957 118.957 117.121 1.836 18112 5961 1 8 . 1 1 103 103 ASN C C 103 177.470 177.470 177.863 -0.393 18112 5962 1 8 . 1 1 103 103 ASN CA C 103 56.974 56.974 56.381 0.593 18112 5963 1 8 . 1 1 103 103 ASN CB C 103 38.140 38.140 38.483 -0.343 18112 5964 1 8 . 1 1 103 103 ASN H H 103 9.301 9.301 8.335 0.966 18112 5965 1 8 . 1 1 104 104 MET N N 104 113.763 113.763 119.509 -5.746 18112 5966 1 8 . 1 1 104 104 MET CA C 104 57.362 57.362 57.637 -0.275 18112 5967 1 8 . 1 1 104 104 MET CB C 104 31.895 31.895 32.528 -0.633 18112 5968 1 8 . 1 1 104 104 MET H H 104 8.332 8.332 8.115 0.217 18112 5969 1 8 . 1 1 105 105 HIS N N 105 116.024 116.024 115.885 0.139 18112 5970 1 8 . 1 1 105 105 HIS HA H 105 3.764 3.764 4.286 -0.522 18112 5971 1 8 . 1 1 105 105 HIS C C 105 176.939 176.939 177.371 -0.432 18112 5972 1 8 . 1 1 105 105 HIS CA C 105 59.069 59.069 58.627 0.442 18112 5973 1 8 . 1 1 105 105 HIS H H 105 7.156 7.156 8.175 -1.019 18112 5974 1 8 . 1 1 106 106 TYR N N 106 113.161 113.161 118.314 -5.153 18112 5975 1 8 . 1 1 106 106 TYR C C 106 173.767 173.767 175.771 -2.004 18112 5976 1 8 . 1 1 106 106 TYR CA C 106 58.488 58.488 59.822 -1.334 18112 5977 1 8 . 1 1 106 106 TYR CB C 106 38.225 38.225 39.481 -1.256 18112 5978 1 8 . 1 1 106 106 TYR H H 106 7.204 7.204 8.121 -0.917 18112 5979 1 8 . 1 1 107 107 ASN N N 107 118.875 118.875 113.499 5.376 18112 5980 1 8 . 1 1 107 107 ASN HA H 107 3.922 3.922 4.728 -0.806 18112 5981 1 8 . 1 1 107 107 ASN C C 107 175.815 175.815 173.328 2.487 18112 5982 1 8 . 1 1 107 107 ASN CA C 107 51.233 51.233 52.955 -1.722 18112 5983 1 8 . 1 1 107 107 ASN CB C 107 38.142 38.142 39.582 -1.440 18112 5984 1 8 . 1 1 107 107 ASN H H 107 8.127 8.127 8.361 -0.234 18112 5985 1 8 . 1 1 108 108 LYS N N 108 122.850 122.850 126.620 -3.770 18112 5986 1 8 . 1 1 108 108 LYS HA H 108 3.954 3.954 4.224 -0.270 18112 5987 1 8 . 1 1 108 108 LYS C C 108 177.586 177.586 176.066 1.520 18112 5988 1 8 . 1 1 108 108 LYS CA C 108 59.749 59.749 56.828 2.921 18112 5989 1 8 . 1 1 108 108 LYS CB C 108 31.498 31.498 30.655 0.843 18112 5990 1 8 . 1 1 108 108 LYS H H 108 7.772 7.772 8.798 -1.026 18112 5991 1 8 . 1 1 109 109 ALA N N 109 118.054 118.054 126.125 -8.071 18112 5992 1 8 . 1 1 109 109 ALA HA H 109 4.137 4.137 4.233 -0.096 18112 5993 1 8 . 1 1 109 109 ALA C C 109 177.889 177.889 176.639 1.250 18112 5994 1 8 . 1 1 109 109 ALA CA C 109 52.299 52.299 52.205 0.095 18112 5995 1 8 . 1 1 109 109 ALA CB C 109 17.787 17.787 19.023 -1.236 18112 5996 1 8 . 1 1 109 109 ALA H H 109 8.307 8.307 8.097 0.210 18112 5997 1 8 . 1 1 110 110 ASN N N 110 115.542 115.542 120.209 -4.667 18112 5998 1 8 . 1 1 110 110 ASN HA H 110 4.480 4.480 4.660 -0.180 18112 5999 1 8 . 1 1 110 110 ASN C C 110 174.277 174.277 176.413 -2.136 18112 6000 1 8 . 1 1 110 110 ASN CA C 110 53.504 53.504 53.691 -0.187 18112 6001 1 8 . 1 1 110 110 ASN CB C 110 37.283 37.283 38.692 -1.409 18112 6002 1 8 . 1 1 110 110 ASN H H 110 8.353 8.353 8.296 0.057 18112 6003 1 8 . 1 1 111 111 ASP N N 111 114.692 114.692 126.792 -12.100 18112 6004 1 8 . 1 1 111 111 ASP HA H 111 4.485 4.485 4.449 0.036 18112 6005 1 8 . 1 1 111 111 ASP C C 111 174.868 174.868 177.125 -2.257 18112 6006 1 8 . 1 1 111 111 ASP CA C 111 53.227 53.227 57.128 -3.901 18112 6007 1 8 . 1 1 111 111 ASP CB C 111 39.228 39.228 40.977 -1.749 18112 6008 1 8 . 1 1 111 111 ASP H H 111 8.297 8.297 8.407 -0.110 18112 6009 1 8 . 1 1 112 112 PHE N N 112 120.927 120.927 116.685 4.242 18112 6010 1 8 . 1 1 112 112 PHE HA H 112 4.752 4.752 4.549 0.203 18112 6011 1 8 . 1 1 112 112 PHE C C 112 174.633 174.633 175.669 -1.036 18112 6012 1 8 . 1 1 112 112 PHE CA C 112 56.346 56.346 58.933 -2.587 18112 6013 1 8 . 1 1 112 112 PHE H H 112 7.784 7.784 8.237 -0.453 18112 6014 1 8 . 1 1 113 113 GLU N N 113 128.111 128.111 114.939 13.172 18112 6015 1 8 . 1 1 113 113 GLU HA H 113 4.011 4.011 4.368 -0.357 18112 6016 1 8 . 1 1 113 113 GLU C C 113 173.502 173.502 176.220 -2.718 18112 6017 1 8 . 1 1 113 113 GLU CA C 113 55.100 55.100 57.123 -2.023 18112 6018 1 8 . 1 1 113 113 GLU H H 113 7.752 7.752 8.124 -0.372 18112 6019 1 8 . 1 1 114 114 VAL N N 114 129.326 129.326 112.737 16.589 18112 6020 1 8 . 1 1 114 114 VAL HA H 114 3.241 3.241 4.198 -0.957 18112 6021 1 8 . 1 1 114 114 VAL CA C 114 60.838 60.838 62.401 -1.563 18112 6022 1 8 . 1 1 114 114 VAL CB C 114 32.609 32.609 31.310 1.299 18112 6023 1 8 . 1 1 114 114 VAL H H 114 8.008 8.008 8.253 -0.245 18112 6024 1 8 . 1 1 115 115 PRO HA H 115 4.429 4.429 4.603 -0.174 18112 6025 1 8 . 1 1 115 115 PRO C C 115 177.421 177.421 177.838 -0.417 18112 6026 1 8 . 1 1 115 115 PRO CA C 115 61.882 61.882 62.027 -0.145 18112 6027 1 8 . 1 1 115 115 PRO CB C 115 30.974 30.974 32.616 -1.642 18112 6028 1 8 . 1 1 116 116 GLU N N 116 123.936 123.936 121.005 2.931 18112 6029 1 8 . 1 1 116 116 GLU C C 116 179.034 179.034 178.952 0.082 18112 6030 1 8 . 1 1 116 116 GLU CA C 116 58.913 58.913 60.367 -1.454 18112 6031 1 8 . 1 1 116 116 GLU CB C 116 28.378 28.378 29.113 -0.735 18112 6032 1 8 . 1 1 116 116 GLU H H 116 8.757 8.757 8.680 0.077 18112 6033 1 8 . 1 1 117 117 ARG N N 117 116.943 116.943 119.073 -2.130 18112 6034 1 8 . 1 1 117 117 ARG C C 117 177.570 177.570 178.468 -0.898 18112 6035 1 8 . 1 1 117 117 ARG CA C 117 57.033 57.033 59.223 -2.190 18112 6036 1 8 . 1 1 117 117 ARG CB C 117 28.172 28.172 29.394 -1.222 18112 6037 1 8 . 1 1 117 117 ARG H H 117 8.733 8.733 8.263 0.470 18112 6038 1 8 . 1 1 118 118 PHE N N 118 117.528 117.528 116.872 0.656 18112 6039 1 8 . 1 1 118 118 PHE HA H 118 4.137 4.137 4.311 -0.174 18112 6040 1 8 . 1 1 118 118 PHE C C 118 176.992 176.992 178.367 -1.375 18112 6041 1 8 . 1 1 118 118 PHE CA C 118 61.627 61.627 60.050 1.577 18112 6042 1 8 . 1 1 118 118 PHE CB C 118 37.386 37.386 38.084 -0.698 18112 6043 1 8 . 1 1 118 118 PHE H H 118 7.606 7.606 7.505 0.101 18112 6044 1 8 . 1 1 119 119 LEU N N 119 118.483 118.483 119.885 -1.402 18112 6045 1 8 . 1 1 119 119 LEU HA H 119 3.684 3.684 4.078 -0.394 18112 6046 1 8 . 1 1 119 119 LEU C C 119 178.802 178.802 178.956 -0.154 18112 6047 1 8 . 1 1 119 119 LEU CA C 119 59.875 59.875 56.974 2.901 18112 6048 1 8 . 1 1 119 119 LEU CB C 119 39.453 39.453 40.498 -1.045 18112 6049 1 8 . 1 1 119 119 LEU H H 119 7.248 7.248 7.626 -0.378 18112 6050 1 8 . 1 1 120 120 GLU N N 120 117.870 117.870 121.257 -3.387 18112 6051 1 8 . 1 1 120 120 GLU C C 120 179.932 179.932 179.402 0.530 18112 6052 1 8 . 1 1 120 120 GLU CA C 120 59.150 59.150 59.538 -0.388 18112 6053 1 8 . 1 1 120 120 GLU CB C 120 28.878 28.878 29.748 -0.870 18112 6054 1 8 . 1 1 120 120 GLU H H 120 7.423 7.423 8.261 -0.838 18112 6055 1 8 . 1 1 121 121 VAL N N 121 120.777 120.777 120.306 0.471 18112 6056 1 8 . 1 1 121 121 VAL HA H 121 3.545 3.545 3.655 -0.110 18112 6057 1 8 . 1 1 121 121 VAL C C 121 179.302 179.302 177.783 1.519 18112 6058 1 8 . 1 1 121 121 VAL CA C 121 66.875 66.875 67.176 -0.301 18112 6059 1 8 . 1 1 121 121 VAL CB C 121 30.823 30.823 31.721 -0.898 18112 6060 1 8 . 1 1 121 121 VAL H H 121 8.313 8.313 8.209 0.104 18112 6061 1 8 . 1 1 122 122 ALA N N 122 127.029 127.029 121.576 5.453 18112 6062 1 8 . 1 1 122 122 ALA HA H 122 4.251 4.251 4.094 0.157 18112 6063 1 8 . 1 1 122 122 ALA C C 122 178.366 178.366 179.543 -1.177 18112 6064 1 8 . 1 1 122 122 ALA CA C 122 54.748 54.748 55.611 -0.863 18112 6065 1 8 . 1 1 122 122 ALA CB C 122 16.565 16.565 18.114 -1.549 18112 6066 1 8 . 1 1 122 122 ALA H H 122 8.896 8.896 8.031 0.865 18112 6067 1 8 . 1 1 123 123 GLN N N 123 119.887 119.887 119.824 0.063 18112 6068 1 8 . 1 1 123 123 GLN C C 123 177.908 177.908 178.531 -0.623 18112 6069 1 8 . 1 1 123 123 GLN CA C 123 60.671 60.671 58.825 1.846 18112 6070 1 8 . 1 1 123 123 GLN H H 123 8.349 8.349 7.927 0.422 18112 6071 1 8 . 1 1 124 124 ILE N N 124 120.632 120.632 118.282 2.350 18112 6072 1 8 . 1 1 124 124 ILE HA H 124 3.651 3.651 3.890 -0.239 18112 6073 1 8 . 1 1 124 124 ILE C C 124 178.703 178.703 178.488 0.215 18112 6074 1 8 . 1 1 124 124 ILE CA C 124 65.945 65.945 64.857 1.088 18112 6075 1 8 . 1 1 124 124 ILE H H 124 8.204 8.204 8.277 -0.073 18112 6076 1 8 . 1 1 125 125 THR N N 125 115.084 115.084 116.722 -1.638 18112 6077 1 8 . 1 1 125 125 THR C C 125 175.568 175.568 176.185 -0.617 18112 6078 1 8 . 1 1 125 125 THR CA C 125 67.872 67.872 66.822 1.050 18112 6079 1 8 . 1 1 125 125 THR H H 125 8.399 8.399 8.302 0.097 18112 6080 1 8 . 1 1 126 126 LEU N N 126 125.011 125.011 122.149 2.862 18112 6081 1 8 . 1 1 126 126 LEU HA H 126 4.085 4.085 4.447 -0.362 18112 6082 1 8 . 1 1 126 126 LEU C C 126 178.559 178.559 178.201 0.358 18112 6083 1 8 . 1 1 126 126 LEU CA C 126 58.843 58.843 57.748 1.095 18112 6084 1 8 . 1 1 126 126 LEU CB C 126 41.421 41.421 41.831 -0.410 18112 6085 1 8 . 1 1 126 126 LEU H H 126 8.728 8.728 8.083 0.645 18112 6086 1 8 . 1 1 127 127 ARG N N 127 117.076 117.076 119.978 -2.902 18112 6087 1 8 . 1 1 127 127 ARG HA H 127 3.929 3.929 3.883 0.046 18112 6088 1 8 . 1 1 127 127 ARG C C 127 177.984 177.984 178.335 -0.351 18112 6089 1 8 . 1 1 127 127 ARG CA C 127 60.685 60.685 60.206 0.478 18112 6090 1 8 . 1 1 127 127 ARG CB C 127 28.079 28.079 30.084 -2.005 18112 6091 1 8 . 1 1 127 127 ARG H H 127 8.213 8.213 8.353 -0.140 18112 6092 1 8 . 1 1 128 128 GLU N N 128 118.617 118.617 118.804 -0.187 18112 6093 1 8 . 1 1 128 128 GLU HA H 128 4.147 4.147 4.191 -0.044 18112 6094 1 8 . 1 1 128 128 GLU C C 128 181.150 181.150 179.420 1.730 18112 6095 1 8 . 1 1 128 128 GLU CA C 128 59.508 59.508 59.183 0.325 18112 6096 1 8 . 1 1 128 128 GLU H H 128 8.478 8.478 7.983 0.495 18112 6097 1 8 . 1 1 129 129 PHE N N 129 119.267 119.267 120.516 -1.249 18112 6098 1 8 . 1 1 129 129 PHE HA H 129 4.104 4.104 4.351 -0.247 18112 6099 1 8 . 1 1 129 129 PHE C C 129 177.170 177.170 177.660 -0.490 18112 6100 1 8 . 1 1 129 129 PHE CA C 129 63.694 63.694 61.333 2.361 18112 6101 1 8 . 1 1 129 129 PHE H H 129 8.570 8.570 8.366 0.204 18112 6102 1 8 . 1 1 130 130 PHE N N 130 118.739 118.739 119.913 -1.174 18112 6103 1 8 . 1 1 130 130 PHE HA H 130 3.884 3.884 4.000 -0.116 18112 6104 1 8 . 1 1 130 130 PHE C C 130 175.860 175.860 177.222 -1.362 18112 6105 1 8 . 1 1 130 130 PHE CA C 130 62.819 62.819 62.109 0.710 18112 6106 1 8 . 1 1 130 130 PHE H H 130 8.740 8.740 8.676 0.064 18112 6107 1 8 . 1 1 131 131 ASN N N 131 116.028 116.028 117.980 -1.952 18112 6108 1 8 . 1 1 131 131 ASN HA H 131 4.373 4.373 4.405 -0.032 18112 6109 1 8 . 1 1 131 131 ASN C C 131 178.228 178.228 177.720 0.508 18112 6110 1 8 . 1 1 131 131 ASN CA C 131 55.150 55.150 56.214 -1.064 18112 6111 1 8 . 1 1 131 131 ASN H H 131 8.864 8.864 8.453 0.411 18112 6112 1 8 . 1 1 132 132 ALA N N 132 120.922 120.922 122.920 -1.998 18112 6113 1 8 . 1 1 132 132 ALA HA H 132 4.020 4.020 4.070 -0.050 18112 6114 1 8 . 1 1 132 132 ALA C C 132 178.515 178.515 179.884 -1.369 18112 6115 1 8 . 1 1 132 132 ALA CA C 132 54.924 54.924 55.132 -0.208 18112 6116 1 8 . 1 1 132 132 ALA CB C 132 18.441 18.441 18.576 -0.135 18112 6117 1 8 . 1 1 132 132 ALA H H 132 7.745 7.745 7.931 -0.186 18112 6118 1 8 . 1 1 133 133 ILE N N 133 118.200 118.200 119.182 -0.982 18112 6119 1 8 . 1 1 133 133 ILE HA H 133 3.235 3.235 3.699 -0.464 18112 6120 1 8 . 1 1 133 133 ILE C C 133 180.606 180.606 177.854 2.752 18112 6121 1 8 . 1 1 133 133 ILE CA C 133 65.215 65.215 64.551 0.664 18112 6122 1 8 . 1 1 133 133 ILE CB C 133 38.291 38.291 37.784 0.507 18112 6123 1 8 . 1 1 133 133 ILE H H 133 7.999 7.999 7.851 0.148 18112 6124 1 8 . 1 1 134 134 ILE N N 134 122.564 122.564 119.671 2.893 18112 6125 1 8 . 1 1 134 134 ILE HA H 134 3.788 3.788 3.600 0.188 18112 6126 1 8 . 1 1 134 134 ILE C C 134 177.215 177.215 176.860 0.355 18112 6127 1 8 . 1 1 134 134 ILE CA C 134 63.584 63.584 63.364 0.220 18112 6128 1 8 . 1 1 134 134 ILE CB C 134 35.636 35.636 37.131 -1.495 18112 6129 1 8 . 1 1 134 134 ILE H H 134 8.670 8.670 8.017 0.653 18112 6130 1 8 . 1 1 135 135 ALA N N 135 119.989 119.989 121.462 -1.473 18112 6131 1 8 . 1 1 135 135 ALA HA H 135 4.357 4.357 4.131 0.226 18112 6132 1 8 . 1 1 135 135 ALA C C 135 177.786 177.786 177.858 -0.072 18112 6133 1 8 . 1 1 135 135 ALA CA C 135 51.521 51.521 53.686 -2.165 18112 6134 1 8 . 1 1 135 135 ALA CB C 135 18.839 18.839 19.914 -1.075 18112 6135 1 8 . 1 1 135 135 ALA H H 135 6.898 6.898 7.956 -1.058 18112 6136 1 8 . 1 1 136 136 GLY N N 136 107.682 107.682 103.314 4.368 18112 6137 1 8 . 1 1 136 136 GLY C C 136 176.324 176.324 173.958 2.366 18112 6138 1 8 . 1 1 136 136 GLY CA C 136 45.469 45.469 44.411 1.058 18112 6139 1 8 . 1 1 136 136 GLY H H 136 7.913 7.913 7.551 0.362 18112 6140 1 8 . 1 1 137 137 LYS N N 137 117.213 117.213 119.479 -2.266 18112 6141 1 8 . 1 1 137 137 LYS HA H 137 4.004 4.004 3.590 0.414 18112 6142 1 8 . 1 1 137 137 LYS C C 137 176.616 176.616 176.171 0.445 18112 6143 1 8 . 1 1 137 137 LYS CA C 137 57.499 57.499 57.439 0.060 18112 6144 1 8 . 1 1 137 137 LYS CB C 137 30.927 30.927 31.447 -0.520 18112 6145 1 8 . 1 1 137 137 LYS H H 137 8.312 8.312 8.140 0.172 18112 6146 1 8 . 1 1 138 138 ASP N N 138 113.545 113.545 117.889 -4.344 18112 6147 1 8 . 1 1 138 138 ASP HA H 138 3.061 3.061 4.383 -1.322 18112 6148 1 8 . 1 1 138 138 ASP C C 138 174.698 174.698 177.022 -2.324 18112 6149 1 8 . 1 1 138 138 ASP CA C 138 53.694 53.694 56.748 -3.054 18112 6150 1 8 . 1 1 138 138 ASP CB C 138 36.008 36.008 40.837 -4.829 18112 6151 1 8 . 1 1 138 138 ASP H H 138 8.465 8.465 8.687 -0.222 18112 6152 1 8 . 1 1 139 139 VAL N N 139 115.191 115.191 112.683 2.508 18112 6153 1 8 . 1 1 139 139 VAL HA H 139 3.886 3.886 4.316 -0.430 18112 6154 1 8 . 1 1 139 139 VAL C C 139 175.889 175.889 176.147 -0.258 18112 6155 1 8 . 1 1 139 139 VAL CA C 139 62.793 62.793 60.538 2.256 18112 6156 1 8 . 1 1 139 139 VAL CB C 139 30.662 30.662 30.900 -0.238 18112 6157 1 8 . 1 1 139 139 VAL H H 139 6.610 6.610 7.273 -0.663 18112 6158 1 8 . 1 1 140 140 ASP N N 140 123.363 123.363 123.045 0.318 18112 6159 1 8 . 1 1 140 140 ASP C C 140 175.234 175.234 176.048 -0.814 18112 6160 1 8 . 1 1 140 140 ASP CA C 140 50.221 50.221 59.190 -8.969 18112 6161 1 8 . 1 1 140 140 ASP CB C 140 42.254 42.254 39.677 2.577 18112 6162 1 8 . 1 1 140 140 ASP H H 140 7.553 7.553 7.952 -0.399 18112 6163 1 8 . 1 1 141 141 PRO HA H 141 4.682 4.682 4.376 0.306 18112 6164 1 8 . 1 1 141 141 PRO C C 141 178.678 178.678 178.316 0.362 18112 6165 1 8 . 1 1 141 141 PRO CA C 141 64.532 64.532 65.344 -0.812 18112 6166 1 8 . 1 1 141 141 PRO CB C 141 31.331 31.331 31.531 -0.200 18112 6167 1 8 . 1 1 142 142 SER N N 142 114.421 114.421 112.411 2.010 18112 6168 1 8 . 1 1 142 142 SER HA H 142 4.565 4.565 4.626 -0.061 18112 6169 1 8 . 1 1 142 142 SER C C 142 176.524 176.524 176.882 -0.358 18112 6170 1 8 . 1 1 142 142 SER CA C 142 58.711 58.711 59.739 -1.028 18112 6171 1 8 . 1 1 142 142 SER CB C 142 62.783 62.783 63.485 -0.702 18112 6172 1 8 . 1 1 142 142 SER H H 142 8.703 8.703 7.978 0.725 18112 6173 1 8 . 1 1 143 143 TRP N N 143 123.598 123.598 122.672 0.926 18112 6174 1 8 . 1 1 143 143 TRP HA H 143 4.136 4.136 4.295 -0.159 18112 6175 1 8 . 1 1 143 143 TRP C C 143 177.113 177.113 176.947 0.166 18112 6176 1 8 . 1 1 143 143 TRP CA C 143 59.803 59.803 59.997 -0.194 18112 6177 1 8 . 1 1 143 143 TRP CB C 143 26.364 26.364 28.151 -1.787 18112 6178 1 8 . 1 1 143 143 TRP H H 143 8.374 8.374 8.807 -0.433 18112 6179 1 8 . 1 1 144 144 LYS N N 144 119.293 119.293 119.396 -0.103 18112 6180 1 8 . 1 1 144 144 LYS HA H 144 2.719 2.719 3.056 -0.337 18112 6181 1 8 . 1 1 144 144 LYS C C 144 177.243 177.243 177.942 -0.699 18112 6182 1 8 . 1 1 144 144 LYS CA C 144 58.851 58.851 58.889 -0.038 18112 6183 1 8 . 1 1 144 144 LYS CB C 144 29.373 29.373 30.901 -1.528 18112 6184 1 8 . 1 1 144 144 LYS H H 144 7.196 7.196 7.460 -0.264 18112 6185 1 8 . 1 1 145 145 LYS N N 145 116.440 116.440 120.218 -3.778 18112 6186 1 8 . 1 1 145 145 LYS HA H 145 3.490 3.490 3.898 -0.408 18112 6187 1 8 . 1 1 145 145 LYS C C 145 179.149 179.149 178.494 0.655 18112 6188 1 8 . 1 1 145 145 LYS CA C 145 59.271 59.271 59.218 0.053 18112 6189 1 8 . 1 1 145 145 LYS CB C 145 30.521 30.521 32.146 -1.625 18112 6190 1 8 . 1 1 145 145 LYS H H 145 7.389 7.389 7.873 -0.484 18112 6191 1 8 . 1 1 146 146 ALA N N 146 118.582 118.582 122.718 -4.136 18112 6192 1 8 . 1 1 146 146 ALA HA H 146 3.932 3.932 4.000 -0.068 18112 6193 1 8 . 1 1 146 146 ALA C C 146 179.968 179.968 179.472 0.496 18112 6194 1 8 . 1 1 146 146 ALA CA C 146 54.241 54.241 55.180 -0.939 18112 6195 1 8 . 1 1 146 146 ALA CB C 146 17.689 17.689 18.365 -0.676 18112 6196 1 8 . 1 1 146 146 ALA H H 146 7.112 7.112 7.809 -0.697 18112 6197 1 8 . 1 1 147 147 ILE N N 147 118.537 118.537 119.796 -1.259 18112 6198 1 8 . 1 1 147 147 ILE HA H 147 3.642 3.642 3.488 0.154 18112 6199 1 8 . 1 1 147 147 ILE C C 147 178.919 178.919 177.934 0.985 18112 6200 1 8 . 1 1 147 147 ILE CA C 147 64.418 64.418 64.828 -0.410 18112 6201 1 8 . 1 1 147 147 ILE CB C 147 36.519 36.519 37.091 -0.572 18112 6202 1 8 . 1 1 147 147 ILE H H 147 6.734 6.734 7.987 -1.253 18112 6203 1 8 . 1 1 148 148 TYR N N 148 121.033 121.033 118.134 2.899 18112 6204 1 8 . 1 1 148 148 TYR HA H 148 4.489 4.489 4.160 0.329 18112 6205 1 8 . 1 1 148 148 TYR C C 148 178.348 178.348 178.741 -0.393 18112 6206 1 8 . 1 1 148 148 TYR CA C 148 57.389 57.389 58.826 -1.437 18112 6207 1 8 . 1 1 148 148 TYR CB C 148 35.280 35.280 36.688 -1.408 18112 6208 1 8 . 1 1 148 148 TYR H H 148 8.126 8.126 7.822 0.304 18112 6209 1 8 . 1 1 149 149 LYS N N 149 114.484 114.484 120.780 -6.296 18112 6210 1 8 . 1 1 149 149 LYS C C 149 178.051 178.051 179.190 -1.139 18112 6211 1 8 . 1 1 149 149 LYS CA C 149 59.036 59.036 59.237 -0.201 18112 6212 1 8 . 1 1 149 149 LYS CB C 149 31.575 31.575 32.873 -1.298 18112 6213 1 8 . 1 1 149 149 LYS H H 149 7.364 7.364 7.960 -0.596 18112 6214 1 8 . 1 1 150 150 VAL N N 150 117.812 117.812 116.118 1.694 18112 6215 1 8 . 1 1 150 150 VAL HA H 150 3.770 3.770 3.848 -0.078 18112 6216 1 8 . 1 1 150 150 VAL C C 150 178.786 178.786 177.749 1.037 18112 6217 1 8 . 1 1 150 150 VAL CA C 150 65.070 65.070 65.884 -0.814 18112 6218 1 8 . 1 1 150 150 VAL CB C 150 29.515 29.515 31.878 -2.363 18112 6219 1 8 . 1 1 150 150 VAL H H 150 7.254 7.254 7.800 -0.546 18112 6220 1 8 . 1 1 151 151 ILE N N 151 117.884 117.884 115.063 2.821 18112 6221 1 8 . 1 1 151 151 ILE C C 151 180.539 180.539 177.362 3.177 18112 6222 1 8 . 1 1 151 151 ILE CA C 151 61.490 61.490 62.610 -1.120 18112 6223 1 8 . 1 1 151 151 ILE CB C 151 33.994 33.994 38.534 -4.540 18112 6224 1 8 . 1 1 151 151 ILE H H 151 8.154 8.154 8.142 0.012 18112 6225 1 8 . 1 1 152 152 CYS N N 152 118.649 118.649 119.805 -1.156 18112 6226 1 8 . 1 1 152 152 CYS HA H 152 4.153 4.153 5.049 -0.896 18112 6227 1 8 . 1 1 152 152 CYS C C 152 174.888 174.888 176.046 -1.158 18112 6228 1 8 . 1 1 152 152 CYS CA C 152 61.052 61.052 58.915 2.137 18112 6229 1 8 . 1 1 152 152 CYS CB C 152 36.364 36.364 27.761 8.603 18112 6230 1 8 . 1 1 152 152 CYS H H 152 8.711 8.711 8.073 0.638 18112 6231 1 8 . 1 1 153 153 LYS N N 153 118.498 118.498 119.836 -1.338 18112 6232 1 8 . 1 1 153 153 LYS C C 153 177.389 177.389 177.725 -0.336 18112 6233 1 8 . 1 1 153 153 LYS CA C 153 56.243 56.243 57.975 -1.732 18112 6234 1 8 . 1 1 153 153 LYS CB C 153 31.343 31.343 32.413 -1.070 18112 6235 1 8 . 1 1 153 153 LYS H H 153 6.782 6.782 7.857 -1.075 18112 6236 1 8 . 1 1 154 154 LEU N N 154 117.318 117.318 116.748 0.570 18112 6237 1 8 . 1 1 154 154 LEU HA H 154 4.576 4.576 4.289 0.287 18112 6238 1 8 . 1 1 154 154 LEU C C 154 177.161 177.161 177.465 -0.304 18112 6239 1 8 . 1 1 154 154 LEU CA C 154 53.782 53.782 55.578 -1.796 18112 6240 1 8 . 1 1 154 154 LEU CB C 154 40.881 40.881 42.956 -2.075 18112 6241 1 8 . 1 1 154 154 LEU H H 154 7.616 7.616 7.272 0.344 18112 6242 1 8 . 1 1 155 155 ASP N N 155 121.564 121.564 118.873 2.691 18112 6243 1 8 . 1 1 155 155 ASP C C 155 177.094 177.094 175.695 1.399 18112 6244 1 8 . 1 1 155 155 ASP CA C 155 55.732 55.732 54.073 1.659 18112 6245 1 8 . 1 1 155 155 ASP CB C 155 40.139 40.139 41.581 -1.442 18112 6246 1 8 . 1 1 155 155 ASP H H 155 7.582 7.582 7.760 -0.178 18112 6247 1 8 . 1 1 156 156 SER N N 156 117.352 117.352 112.496 4.856 18112 6248 1 8 . 1 1 156 156 SER HA H 156 4.818 4.818 4.641 0.177 18112 6249 1 8 . 1 1 156 156 SER C C 156 173.409 173.409 173.600 -0.191 18112 6250 1 8 . 1 1 156 156 SER CA C 156 57.073 57.073 57.117 -0.044 18112 6251 1 8 . 1 1 156 156 SER CB C 156 65.150 65.150 66.457 -1.307 18112 6252 1 8 . 1 1 156 156 SER H H 156 8.846 8.846 8.280 0.566 18112 6253 1 8 . 1 1 157 157 GLU N N 157 120.688 120.688 121.150 -0.462 18112 6254 1 8 . 1 1 157 157 GLU HA H 157 4.038 4.038 4.527 -0.489 18112 6255 1 8 . 1 1 157 157 GLU C C 157 176.332 176.332 176.823 -0.491 18112 6256 1 8 . 1 1 157 157 GLU CA C 157 56.464 56.464 55.142 1.322 18112 6257 1 8 . 1 1 157 157 GLU CB C 157 29.206 29.206 30.488 -1.282 18112 6258 1 8 . 1 1 157 157 GLU H H 157 8.356 8.356 8.408 -0.052 18112 6259 1 8 . 1 1 158 158 VAL N N 158 126.906 126.906 117.794 9.112 18112 6260 1 8 . 1 1 158 158 VAL HA H 158 3.449 3.449 4.313 -0.864 18112 6261 1 8 . 1 1 158 158 VAL C C 158 176.382 176.382 174.595 1.787 18112 6262 1 8 . 1 1 158 158 VAL CA C 158 59.584 59.584 60.531 -0.947 18112 6263 1 8 . 1 1 158 158 VAL CB C 158 31.160 31.160 31.583 -0.423 18112 6264 1 8 . 1 1 158 158 VAL H H 158 8.561 8.561 8.256 0.305 18112 6265 1 8 . 1 1 159 159 PRO HA H 159 4.403 4.403 4.256 0.147 18112 6266 1 8 . 1 1 159 159 PRO C C 159 176.757 176.757 176.403 0.354 18112 6267 1 8 . 1 1 159 159 PRO CA C 159 63.845 63.845 63.203 0.642 18112 6268 1 8 . 1 1 159 159 PRO CB C 159 32.106 32.106 31.898 0.208 18112 6269 1 8 . 1 1 160 160 GLU N N 160 122.904 122.904 120.711 2.193 18112 6270 1 8 . 1 1 160 160 GLU HA H 160 4.008 4.008 4.051 -0.043 18112 6271 1 8 . 1 1 160 160 GLU C C 160 179.132 179.132 176.299 2.833 18112 6272 1 8 . 1 1 160 160 GLU CA C 160 59.407 59.407 57.657 1.750 18112 6273 1 8 . 1 1 160 160 GLU CB C 160 28.991 28.991 29.805 -0.814 18112 6274 1 8 . 1 1 160 160 GLU H H 160 8.650 8.650 8.447 0.203 18112 6275 1 8 . 1 1 161 161 ILE N N 161 119.782 119.782 119.003 0.779 18112 6276 1 8 . 1 1 161 161 ILE HA H 161 4.146 4.146 4.260 -0.114 18112 6277 1 8 . 1 1 161 161 ILE C C 161 176.176 176.176 174.979 1.197 18112 6278 1 8 . 1 1 161 161 ILE CA C 161 62.034 62.034 60.151 1.883 18112 6279 1 8 . 1 1 161 161 ILE CB C 161 37.113 37.113 39.063 -1.950 18112 6280 1 8 . 1 1 161 161 ILE H H 161 8.448 8.448 7.532 0.916 18112 6281 1 8 . 1 1 162 162 PHE N N 162 117.594 117.594 125.633 -8.039 18112 6282 1 8 . 1 1 162 162 PHE C C 162 176.115 176.115 177.293 -1.178 18112 6283 1 8 . 1 1 162 162 PHE CA C 162 61.009 61.009 60.147 0.862 18112 6284 1 8 . 1 1 162 162 PHE CB C 162 38.394 38.394 39.188 -0.794 18112 6285 1 8 . 1 1 162 162 PHE H H 162 8.145 8.145 8.785 -0.640 18112 6286 1 8 . 1 1 163 163 LYS N N 163 116.083 116.083 119.724 -3.641 18112 6287 1 8 . 1 1 163 163 LYS C C 163 178.196 178.196 176.363 1.833 18112 6288 1 8 . 1 1 163 163 LYS CA C 163 58.136 58.136 58.264 -0.128 18112 6289 1 8 . 1 1 163 163 LYS CB C 163 31.694 31.694 32.678 -0.985 18112 6290 1 8 . 1 1 163 163 LYS H H 163 8.232 8.232 8.302 -0.070 18112 6291 1 8 . 1 1 164 164 SER N N 164 113.680 113.680 108.772 4.908 18112 6292 1 8 . 1 1 164 164 SER CA C 164 55.205 55.205 56.233 -1.028 18112 6293 1 8 . 1 1 164 164 SER CB C 164 63.265 63.265 65.047 -1.782 18112 6294 1 8 . 1 1 164 164 SER H H 164 7.708 7.708 7.607 0.101 18112 6295 1 8 . 1 1 165 165 PRO HA H 165 4.580 4.580 4.307 0.273 18112 6296 1 8 . 1 1 165 165 PRO C C 165 177.541 177.541 176.809 0.732 18112 6297 1 8 . 1 1 165 165 PRO CA C 165 63.950 63.950 64.316 -0.366 18112 6298 1 8 . 1 1 165 165 PRO CB C 165 30.686 30.686 31.756 -1.070 18112 6299 1 8 . 1 1 166 166 ASN N N 166 116.304 116.304 114.308 1.996 18112 6300 1 8 . 1 1 166 166 ASN HA H 166 5.029 5.029 4.612 0.417 18112 6301 1 8 . 1 1 166 166 ASN C C 166 175.811 175.811 176.897 -1.086 18112 6302 1 8 . 1 1 166 166 ASN CA C 166 51.962 51.962 54.249 -2.287 18112 6303 1 8 . 1 1 166 166 ASN CB C 166 37.915 37.915 37.661 0.254 18112 6304 1 8 . 1 1 166 166 ASN H H 166 8.216 8.216 8.518 -0.302 18112 6305 1 8 . 1 1 167 167 CYS N N 167 116.078 116.078 121.230 -5.152 18112 6306 1 8 . 1 1 167 167 CYS HA H 167 4.011 4.011 4.258 -0.247 18112 6307 1 8 . 1 1 167 167 CYS C C 167 175.057 175.057 176.580 -1.523 18112 6308 1 8 . 1 1 167 167 CYS CA C 167 59.816 59.816 61.627 -1.811 18112 6309 1 8 . 1 1 167 167 CYS CB C 167 27.446 27.446 26.995 0.451 18112 6310 1 8 . 1 1 167 167 CYS H H 167 7.246 7.246 7.850 -0.604 18112 6311 1 8 . 1 1 168 168 LEU N N 168 120.082 120.082 119.731 0.351 18112 6312 1 8 . 1 1 168 168 LEU HA H 168 3.880 3.880 4.247 -0.367 18112 6313 1 8 . 1 1 168 168 LEU C C 168 178.541 178.541 178.351 0.190 18112 6314 1 8 . 1 1 168 168 LEU CA C 168 57.734 57.734 57.004 0.730 18112 6315 1 8 . 1 1 168 168 LEU CB C 168 38.825 38.825 40.043 -1.218 18112 6316 1 8 . 1 1 168 168 LEU H H 168 8.451 8.451 7.922 0.529 18112 6317 1 8 . 1 1 169 169 GLN N N 169 116.700 116.700 120.072 -3.372 18112 6318 1 8 . 1 1 169 169 GLN HA H 169 4.064 4.064 3.866 0.198 18112 6319 1 8 . 1 1 169 169 GLN C C 169 177.378 177.378 177.596 -0.218 18112 6320 1 8 . 1 1 169 169 GLN CA C 169 57.675 57.675 58.653 -0.978 18112 6321 1 8 . 1 1 169 169 GLN CB C 169 27.710 27.710 28.060 -0.350 18112 6322 1 8 . 1 1 169 169 GLN H H 169 7.665 7.665 7.738 -0.073 18112 6323 1 8 . 1 1 170 170 GLU N N 170 116.701 116.701 118.412 -1.711 18112 6324 1 8 . 1 1 170 170 GLU HA H 170 4.214 4.214 4.183 0.031 18112 6325 1 8 . 1 1 170 170 GLU C C 170 177.730 177.730 178.260 -0.530 18112 6326 1 8 . 1 1 170 170 GLU CA C 170 56.899 56.899 58.865 -1.966 18112 6327 1 8 . 1 1 170 170 GLU H H 170 7.405 7.405 7.889 -0.484 18112 6328 1 8 . 1 1 171 171 LEU N N 171 118.021 118.021 115.430 2.591 18112 6329 1 8 . 1 1 171 171 LEU HA H 171 4.209 4.209 4.464 -0.255 18112 6330 1 8 . 1 1 171 171 LEU C C 171 177.005 177.005 177.578 -0.573 18112 6331 1 8 . 1 1 171 171 LEU CA C 171 55.870 55.870 56.327 -0.457 18112 6332 1 8 . 1 1 171 171 LEU CB C 171 43.680 43.680 42.103 1.577 18112 6333 1 8 . 1 1 171 171 LEU H H 171 7.823 7.823 7.415 0.408 18112 6334 1 8 . 1 1 172 172 LEU N N 172 117.580 117.580 120.226 -2.646 18112 6335 1 8 . 1 1 172 172 LEU HA H 172 4.571 4.571 4.272 0.299 18112 6336 1 8 . 1 1 172 172 LEU C C 172 176.411 176.411 175.167 1.244 18112 6337 1 8 . 1 1 172 172 LEU CA C 172 53.972 53.972 54.769 -0.797 18112 6338 1 8 . 1 1 172 172 LEU CB C 172 40.483 40.483 40.073 0.410 18112 6339 1 8 . 1 1 172 172 LEU H H 172 7.306 7.306 7.581 -0.275 18112 6340 1 8 . 1 1 173 173 HIS N N 173 123.310 123.310 121.016 2.294 18112 6341 1 8 . 1 1 173 173 HIS C C 173 179.022 179.022 174.985 4.037 18112 6342 1 8 . 1 1 173 173 HIS CA C 173 56.693 56.693 56.124 0.569 18112 6343 1 8 . 1 1 173 173 HIS CB C 173 29.371 29.371 31.312 -1.941 18112 6344 1 8 . 1 1 173 173 HIS H H 173 8.028 8.028 8.295 -0.267 18112 6345 1 9 . 1 1 12 12 ALA N N 12 125.167 125.167 124.000 1.167 18112 6346 1 9 . 1 1 12 12 ALA C C 12 177.566 177.566 178.365 -0.799 18112 6347 1 9 . 1 1 12 12 ALA CA C 12 52.067 52.067 54.462 -2.395 18112 6348 1 9 . 1 1 12 12 ALA CB C 12 18.456 18.456 18.762 -0.306 18112 6349 1 9 . 1 1 12 12 ALA H H 12 8.311 8.311 8.391 -0.080 18112 6350 1 9 . 1 1 13 13 MET N N 13 119.278 119.278 119.474 -0.196 18112 6351 1 9 . 1 1 13 13 MET C C 13 176.325 176.325 175.201 1.124 18112 6352 1 9 . 1 1 13 13 MET CA C 13 54.992 54.992 53.767 1.226 18112 6353 1 9 . 1 1 13 13 MET CB C 13 32.308 32.308 30.388 1.920 18112 6354 1 9 . 1 1 13 13 MET H H 13 8.269 8.269 7.936 0.333 18112 6355 1 9 . 1 1 14 14 GLN N N 14 120.869 120.869 121.521 -0.652 18112 6356 1 9 . 1 1 14 14 GLN HA H 14 4.399 4.399 3.921 0.478 18112 6357 1 9 . 1 1 14 14 GLN C C 14 175.644 175.644 176.248 -0.604 18112 6358 1 9 . 1 1 14 14 GLN CA C 14 55.139 55.139 55.627 -0.488 18112 6359 1 9 . 1 1 14 14 GLN CB C 14 29.051 29.051 28.491 0.560 18112 6360 1 9 . 1 1 14 14 GLN H H 14 8.501 8.501 7.722 0.779 18112 6361 1 9 . 1 1 15 15 GLU N N 15 122.042 122.042 125.324 -3.282 18112 6362 1 9 . 1 1 15 15 GLU C C 15 176.242 176.242 175.637 0.605 18112 6363 1 9 . 1 1 15 15 GLU CA C 15 56.064 56.064 57.165 -1.101 18112 6364 1 9 . 1 1 15 15 GLU CB C 15 29.302 29.302 29.399 -0.097 18112 6365 1 9 . 1 1 15 15 GLU H H 15 8.547 8.547 8.664 -0.117 18112 6366 1 9 . 1 1 16 16 GLY N N 16 108.821 108.821 111.080 -2.259 18112 6367 1 9 . 1 1 16 16 GLY C C 16 172.949 172.949 174.507 -1.558 18112 6368 1 9 . 1 1 16 16 GLY CA C 16 44.227 44.227 45.246 -1.020 18112 6369 1 9 . 1 1 16 16 GLY H H 16 8.100 8.100 8.477 -0.377 18112 6370 1 9 . 1 1 17 17 LEU N N 17 120.315 120.315 120.987 -0.672 18112 6371 1 9 . 1 1 17 17 LEU C C 17 177.334 177.334 176.133 1.201 18112 6372 1 9 . 1 1 17 17 LEU CA C 17 53.544 53.544 54.045 -0.502 18112 6373 1 9 . 1 1 17 17 LEU CB C 17 42.140 42.140 43.839 -1.699 18112 6374 1 9 . 1 1 17 17 LEU H H 17 8.222 8.222 7.784 0.438 18112 6375 1 9 . 1 1 18 18 SER N N 18 126.547 126.547 117.431 9.116 18112 6376 1 9 . 1 1 18 18 SER CA C 18 56.851 56.851 57.085 -0.234 18112 6377 1 9 . 1 1 18 18 SER CB C 18 64.636 64.636 63.087 1.549 18112 6378 1 9 . 1 1 18 18 SER H H 18 11.627 11.627 8.338 3.289 18112 6379 1 9 . 1 1 19 19 PRO C C 19 175.118 175.118 177.934 -2.816 18112 6380 1 9 . 1 1 20 20 ASN N N 20 121.372 121.372 115.347 6.025 18112 6381 1 9 . 1 1 20 20 ASN H H 20 8.172 8.172 8.804 -0.632 18112 6382 1 9 . 1 1 25 25 ALA CB C 25 18.020 18.020 18.691 -0.671 18112 6383 1 9 . 1 1 26 26 LYS N N 26 118.490 118.490 119.966 -1.476 18112 6384 1 9 . 1 1 26 26 LYS CA C 26 56.146 56.146 58.891 -2.745 18112 6385 1 9 . 1 1 26 26 LYS H H 26 6.794 6.794 7.914 -1.120 18112 6386 1 9 . 1 1 31 31 TYR HA H 31 4.398 4.398 4.762 -0.364 18112 6387 1 9 . 1 1 31 31 TYR C C 31 173.714 173.714 174.274 -0.560 18112 6388 1 9 . 1 1 31 31 TYR CA C 31 59.757 59.757 54.129 5.628 18112 6389 1 9 . 1 1 32 32 THR N N 32 111.928 111.928 116.389 -4.461 18112 6390 1 9 . 1 1 32 32 THR HA H 32 4.209 4.209 4.116 0.093 18112 6391 1 9 . 1 1 32 32 THR C C 32 171.061 171.061 174.464 -3.403 18112 6392 1 9 . 1 1 32 32 THR CA C 32 56.905 56.905 61.133 -4.228 18112 6393 1 9 . 1 1 32 32 THR CB C 32 69.707 69.707 69.628 0.079 18112 6394 1 9 . 1 1 32 32 THR H H 32 8.237 8.237 7.541 0.696 18112 6395 1 9 . 1 1 33 33 ARG N N 33 124.856 124.856 125.586 -0.730 18112 6396 1 9 . 1 1 33 33 ARG C C 33 176.451 176.451 175.287 1.164 18112 6397 1 9 . 1 1 33 33 ARG CA C 33 55.627 55.627 54.410 1.217 18112 6398 1 9 . 1 1 33 33 ARG CB C 33 29.861 29.861 30.370 -0.509 18112 6399 1 9 . 1 1 33 33 ARG H H 33 9.159 9.159 7.982 1.177 18112 6400 1 9 . 1 1 34 34 TYR N N 34 117.908 117.908 121.253 -3.345 18112 6401 1 9 . 1 1 34 34 TYR CA C 34 55.320 55.320 57.589 -2.268 18112 6402 1 9 . 1 1 34 34 TYR H H 34 8.995 8.995 7.489 1.506 18112 6403 1 9 . 1 1 35 35 PRO C C 35 177.280 177.280 177.087 0.193 18112 6404 1 9 . 1 1 36 36 SER N N 36 116.410 116.410 121.576 -5.166 18112 6405 1 9 . 1 1 36 36 SER C C 36 178.938 178.938 176.623 2.315 18112 6406 1 9 . 1 1 36 36 SER CA C 36 64.815 64.815 62.468 2.347 18112 6407 1 9 . 1 1 36 36 SER H H 36 8.106 8.106 8.776 -0.670 18112 6408 1 9 . 1 1 37 37 SER N N 37 117.488 117.488 117.002 0.486 18112 6409 1 9 . 1 1 37 37 SER C C 37 177.698 177.698 177.005 0.693 18112 6410 1 9 . 1 1 37 37 SER CA C 37 61.357 61.357 61.605 -0.248 18112 6411 1 9 . 1 1 37 37 SER CB C 37 68.118 68.118 62.539 5.579 18112 6412 1 9 . 1 1 37 37 SER H H 37 8.169 8.169 8.466 -0.297 18112 6413 1 9 . 1 1 38 38 ASN N N 38 115.638 115.638 120.841 -5.203 18112 6414 1 9 . 1 1 38 38 ASN HA H 38 4.259 4.259 4.400 -0.141 18112 6415 1 9 . 1 1 38 38 ASN C C 38 177.868 177.868 177.447 0.421 18112 6416 1 9 . 1 1 38 38 ASN CA C 38 55.907 55.907 56.056 -0.149 18112 6417 1 9 . 1 1 38 38 ASN CB C 38 37.230 37.230 37.991 -0.761 18112 6418 1 9 . 1 1 38 38 ASN H H 38 8.284 8.284 8.074 0.210 18112 6419 1 9 . 1 1 39 39 MET N N 39 121.352 121.352 118.375 2.977 18112 6420 1 9 . 1 1 39 39 MET HA H 39 4.170 4.170 3.706 0.464 18112 6421 1 9 . 1 1 39 39 MET C C 39 179.068 179.068 178.422 0.646 18112 6422 1 9 . 1 1 39 39 MET CA C 39 58.751 58.751 58.297 0.454 18112 6423 1 9 . 1 1 39 39 MET CB C 39 31.850 31.850 32.398 -0.548 18112 6424 1 9 . 1 1 39 39 MET H H 39 7.857 7.857 7.491 0.366 18112 6425 1 9 . 1 1 40 40 LEU N N 40 118.936 118.936 123.110 -4.174 18112 6426 1 9 . 1 1 40 40 LEU HA H 40 4.139 4.139 4.359 -0.220 18112 6427 1 9 . 1 1 40 40 LEU C C 40 178.700 178.700 178.626 0.074 18112 6428 1 9 . 1 1 40 40 LEU CA C 40 58.455 58.455 58.881 -0.426 18112 6429 1 9 . 1 1 40 40 LEU CB C 40 40.304 40.304 41.691 -1.387 18112 6430 1 9 . 1 1 40 40 LEU H H 40 8.167 8.167 8.394 -0.227 18112 6431 1 9 . 1 1 41 41 LYS N N 41 116.791 116.791 118.108 -1.317 18112 6432 1 9 . 1 1 41 41 LYS HA H 41 3.475 3.475 4.026 -0.551 18112 6433 1 9 . 1 1 41 41 LYS C C 41 178.793 178.793 178.650 0.143 18112 6434 1 9 . 1 1 41 41 LYS CA C 41 59.161 59.161 59.615 -0.454 18112 6435 1 9 . 1 1 41 41 LYS CB C 41 30.992 30.992 32.437 -1.445 18112 6436 1 9 . 1 1 41 41 LYS H H 41 7.632 7.632 7.890 -0.258 18112 6437 1 9 . 1 1 42 42 THR N N 42 112.819 112.819 114.083 -1.264 18112 6438 1 9 . 1 1 42 42 THR HA H 42 4.230 4.230 4.046 0.184 18112 6439 1 9 . 1 1 42 42 THR C C 42 176.142 176.142 177.138 -0.996 18112 6440 1 9 . 1 1 42 42 THR CA C 42 65.107 65.107 66.316 -1.209 18112 6441 1 9 . 1 1 42 42 THR CB C 42 68.306 68.306 68.935 -0.629 18112 6442 1 9 . 1 1 42 42 THR H H 42 7.469 7.469 7.918 -0.449 18112 6443 1 9 . 1 1 43 43 TYR N N 43 118.565 118.565 119.382 -0.817 18112 6444 1 9 . 1 1 43 43 TYR HA H 43 4.204 4.204 4.352 -0.148 18112 6445 1 9 . 1 1 43 43 TYR C C 43 174.240 174.240 177.554 -3.314 18112 6446 1 9 . 1 1 43 43 TYR CA C 43 60.886 60.886 57.758 3.128 18112 6447 1 9 . 1 1 43 43 TYR CB C 43 38.165 38.165 38.381 -0.216 18112 6448 1 9 . 1 1 43 43 TYR H H 43 7.978 7.978 7.598 0.380 18112 6449 1 9 . 1 1 44 44 PHE N N 44 120.980 120.980 116.835 4.145 18112 6450 1 9 . 1 1 44 44 PHE HA H 44 4.920 4.920 4.816 0.104 18112 6451 1 9 . 1 1 44 44 PHE C C 44 176.436 176.436 176.425 0.011 18112 6452 1 9 . 1 1 44 44 PHE CA C 44 56.672 56.672 55.972 0.700 18112 6453 1 9 . 1 1 44 44 PHE CB C 44 36.570 36.570 37.190 -0.620 18112 6454 1 9 . 1 1 44 44 PHE H H 44 7.955 7.955 7.970 -0.015 18112 6455 1 9 . 1 1 45 45 SER N N 45 113.407 113.407 116.451 -3.044 18112 6456 1 9 . 1 1 45 45 SER HA H 45 4.373 4.373 4.213 0.160 18112 6457 1 9 . 1 1 45 45 SER C C 45 174.424 174.424 175.505 -1.081 18112 6458 1 9 . 1 1 45 45 SER CA C 45 61.037 61.037 61.263 -0.226 18112 6459 1 9 . 1 1 45 45 SER CB C 45 62.711 62.711 63.414 -0.703 18112 6460 1 9 . 1 1 45 45 SER H H 45 7.932 7.932 7.923 0.009 18112 6461 1 9 . 1 1 46 46 ASP N N 46 118.099 118.099 122.060 -3.961 18112 6462 1 9 . 1 1 46 46 ASP HA H 46 4.572 4.572 4.484 0.088 18112 6463 1 9 . 1 1 46 46 ASP C C 46 174.866 174.866 176.542 -1.676 18112 6464 1 9 . 1 1 46 46 ASP CA C 46 53.602 53.602 55.937 -2.335 18112 6465 1 9 . 1 1 46 46 ASP CB C 46 38.992 38.992 41.404 -2.412 18112 6466 1 9 . 1 1 46 46 ASP H H 46 9.889 9.889 8.313 1.576 18112 6467 1 9 . 1 1 47 47 VAL N N 47 121.496 121.496 121.059 0.437 18112 6468 1 9 . 1 1 47 47 VAL HA H 47 4.058 4.058 3.748 0.310 18112 6469 1 9 . 1 1 47 47 VAL C C 47 174.676 174.676 174.932 -0.256 18112 6470 1 9 . 1 1 47 47 VAL CA C 47 61.006 61.006 62.203 -1.197 18112 6471 1 9 . 1 1 47 47 VAL CB C 47 32.110 32.110 31.173 0.937 18112 6472 1 9 . 1 1 47 47 VAL H H 47 7.781 7.781 7.146 0.635 18112 6473 1 9 . 1 1 48 48 LYS N N 48 126.100 126.100 129.127 -3.027 18112 6474 1 9 . 1 1 48 48 LYS HA H 48 4.402 4.402 4.152 0.250 18112 6475 1 9 . 1 1 48 48 LYS C C 48 175.564 175.564 175.888 -0.324 18112 6476 1 9 . 1 1 48 48 LYS CA C 48 54.874 54.874 55.546 -0.672 18112 6477 1 9 . 1 1 48 48 LYS CB C 48 30.189 30.189 31.270 -1.081 18112 6478 1 9 . 1 1 48 48 LYS H H 48 8.245 8.245 8.296 -0.051 18112 6479 1 9 . 1 1 49 49 PHE N N 49 125.341 125.341 123.964 1.377 18112 6480 1 9 . 1 1 49 49 PHE HA H 49 3.813 3.813 4.177 -0.364 18112 6481 1 9 . 1 1 49 49 PHE C C 49 175.708 175.708 176.350 -0.642 18112 6482 1 9 . 1 1 49 49 PHE CA C 49 60.861 60.861 58.824 2.037 18112 6483 1 9 . 1 1 49 49 PHE CB C 49 38.616 38.616 38.430 0.186 18112 6484 1 9 . 1 1 49 49 PHE H H 49 8.626 8.626 7.842 0.784 18112 6485 1 9 . 1 1 50 50 ASN N N 50 115.408 115.408 123.069 -7.661 18112 6486 1 9 . 1 1 50 50 ASN C C 50 176.072 176.072 175.787 0.285 18112 6487 1 9 . 1 1 50 50 ASN CA C 50 51.730 51.730 51.137 0.593 18112 6488 1 9 . 1 1 50 50 ASN H H 50 7.030 7.030 8.127 -1.097 18112 6489 1 9 . 1 1 51 51 ARG N N 51 122.706 122.706 123.039 -0.333 18112 6490 1 9 . 1 1 51 51 ARG CA C 51 59.534 59.534 60.021 -0.487 18112 6491 1 9 . 1 1 51 51 ARG H H 51 7.790 7.790 9.004 -1.214 18112 6492 1 9 . 1 1 52 52 CYS N N 52 117.340 117.340 115.592 1.748 18112 6493 1 9 . 1 1 52 52 CYS HA H 52 4.108 4.108 4.238 -0.130 18112 6494 1 9 . 1 1 52 52 CYS C C 52 178.200 178.200 177.169 1.031 18112 6495 1 9 . 1 1 52 52 CYS CA C 52 61.143 61.143 61.099 0.044 18112 6496 1 9 . 1 1 52 52 CYS H H 52 7.681 7.681 8.253 -0.572 18112 6497 1 9 . 1 1 53 53 ILE N N 53 122.321 122.321 120.360 1.961 18112 6498 1 9 . 1 1 53 53 ILE HA H 53 3.588 3.588 3.974 -0.386 18112 6499 1 9 . 1 1 53 53 ILE C C 53 177.492 177.492 177.308 0.184 18112 6500 1 9 . 1 1 53 53 ILE CA C 53 64.109 64.109 63.176 0.933 18112 6501 1 9 . 1 1 53 53 ILE CB C 53 37.603 37.603 36.747 0.856 18112 6502 1 9 . 1 1 53 53 ILE H H 53 8.035 8.035 7.685 0.350 18112 6503 1 9 . 1 1 54 54 THR C C 54 175.903 175.903 176.649 -0.746 18112 6504 1 9 . 1 1 54 54 THR CA C 54 67.308 67.308 67.294 0.014 18112 6505 1 9 . 1 1 55 55 SER N N 55 113.819 113.819 117.043 -3.224 18112 6506 1 9 . 1 1 55 55 SER H H 55 7.844 7.844 8.094 -0.250 18112 6507 1 9 . 1 1 56 56 GLN C C 56 179.792 179.792 177.588 2.204 18112 6508 1 9 . 1 1 57 57 LEU N N 57 116.701 116.701 120.736 -4.035 18112 6509 1 9 . 1 1 57 57 LEU HA H 57 4.519 4.519 2.056 2.463 18112 6510 1 9 . 1 1 57 57 LEU C C 57 178.775 178.775 178.291 0.484 18112 6511 1 9 . 1 1 57 57 LEU CA C 57 55.232 55.232 56.995 -1.763 18112 6512 1 9 . 1 1 57 57 LEU CB C 57 37.131 37.131 41.362 -4.231 18112 6513 1 9 . 1 1 57 57 LEU H H 57 8.267 8.267 7.387 0.880 18112 6514 1 9 . 1 1 58 58 ILE N N 58 122.522 122.522 117.718 4.804 18112 6515 1 9 . 1 1 58 58 ILE HA H 58 4.640 4.640 3.307 1.333 18112 6516 1 9 . 1 1 58 58 ILE C C 58 177.380 177.380 177.507 -0.127 18112 6517 1 9 . 1 1 58 58 ILE CA C 58 62.163 62.163 64.912 -2.749 18112 6518 1 9 . 1 1 58 58 ILE CB C 58 30.657 30.657 37.370 -6.713 18112 6519 1 9 . 1 1 58 58 ILE H H 58 8.111 8.111 7.915 0.196 18112 6520 1 9 . 1 1 59 59 LYS N N 59 121.002 121.002 121.512 -0.510 18112 6521 1 9 . 1 1 59 59 LYS C C 59 177.600 177.600 179.047 -1.447 18112 6522 1 9 . 1 1 59 59 LYS CA C 59 57.570 57.570 59.649 -2.079 18112 6523 1 9 . 1 1 59 59 LYS CB C 59 39.101 39.101 32.342 6.759 18112 6524 1 9 . 1 1 59 59 LYS H H 59 7.432 7.432 7.608 -0.176 18112 6525 1 9 . 1 1 60 60 TRP N N 60 118.679 118.679 119.334 -0.655 18112 6526 1 9 . 1 1 60 60 TRP HA H 60 3.739 3.739 4.012 -0.273 18112 6527 1 9 . 1 1 60 60 TRP C C 60 178.246 178.246 178.434 -0.188 18112 6528 1 9 . 1 1 60 60 TRP CA C 60 59.818 59.818 58.666 1.152 18112 6529 1 9 . 1 1 60 60 TRP CB C 60 31.851 31.851 28.011 3.840 18112 6530 1 9 . 1 1 60 60 TRP H H 60 7.565 7.565 7.849 -0.284 18112 6531 1 9 . 1 1 61 61 PHE N N 61 118.005 118.005 116.951 1.054 18112 6532 1 9 . 1 1 61 61 PHE HA H 61 3.882 3.882 3.759 0.123 18112 6533 1 9 . 1 1 61 61 PHE CA C 61 60.054 60.054 60.240 -0.186 18112 6534 1 9 . 1 1 61 61 PHE H H 61 7.819 7.819 8.334 -0.515 18112 6535 1 9 . 1 1 62 62 SER N N 62 121.144 121.144 114.176 6.968 18112 6536 1 9 . 1 1 62 62 SER C C 62 177.840 177.840 176.382 1.458 18112 6537 1 9 . 1 1 62 62 SER CA C 62 55.892 55.892 61.396 -5.504 18112 6538 1 9 . 1 1 62 62 SER H H 62 8.878 8.878 8.435 0.443 18112 6539 1 9 . 1 1 63 63 ASN N N 63 115.303 115.303 123.112 -7.809 18112 6540 1 9 . 1 1 63 63 ASN C C 63 177.222 177.222 178.029 -0.807 18112 6541 1 9 . 1 1 63 63 ASN CA C 63 60.467 60.467 56.382 4.085 18112 6542 1 9 . 1 1 63 63 ASN H H 63 8.001 8.001 7.952 0.049 18112 6543 1 9 . 1 1 64 64 PHE N N 64 112.571 112.571 118.548 -5.977 18112 6544 1 9 . 1 1 64 64 PHE CA C 64 56.453 56.453 59.678 -3.225 18112 6545 1 9 . 1 1 64 64 PHE H H 64 7.082 7.082 8.437 -1.355 18112 6546 1 9 . 1 1 65 65 ARG N N 65 116.695 116.695 121.244 -4.549 18112 6547 1 9 . 1 1 65 65 ARG CA C 65 59.590 59.590 60.367 -0.777 18112 6548 1 9 . 1 1 65 65 ARG H H 65 8.091 8.091 8.413 -0.322 18112 6549 1 9 . 1 1 66 66 GLU N N 66 121.653 121.653 118.753 2.900 18112 6550 1 9 . 1 1 66 66 GLU HA H 66 4.739 4.739 4.368 0.371 18112 6551 1 9 . 1 1 66 66 GLU C C 66 174.621 174.621 179.089 -4.468 18112 6552 1 9 . 1 1 66 66 GLU CA C 66 59.583 59.583 58.923 0.660 18112 6553 1 9 . 1 1 66 66 GLU H H 66 7.597 7.597 8.368 -0.771 18112 6554 1 9 . 1 1 67 67 PHE N N 67 111.578 111.578 122.061 -10.483 18112 6555 1 9 . 1 1 67 67 PHE C C 67 176.164 176.164 177.652 -1.488 18112 6556 1 9 . 1 1 67 67 PHE CA C 67 61.156 61.156 62.045 -0.889 18112 6557 1 9 . 1 1 67 67 PHE H H 67 7.067 7.067 8.513 -1.446 18112 6558 1 9 . 1 1 68 68 TYR N N 68 119.370 119.370 120.828 -1.458 18112 6559 1 9 . 1 1 68 68 TYR C C 68 176.844 176.844 178.100 -1.256 18112 6560 1 9 . 1 1 68 68 TYR CA C 68 61.758 61.758 62.043 -0.285 18112 6561 1 9 . 1 1 68 68 TYR H H 68 7.442 7.442 8.617 -1.175 18112 6562 1 9 . 1 1 69 69 TYR N N 69 116.047 116.047 119.861 -3.814 18112 6563 1 9 . 1 1 69 69 TYR HA H 69 4.086 4.086 4.234 -0.148 18112 6564 1 9 . 1 1 69 69 TYR C C 69 180.328 180.328 177.488 2.840 18112 6565 1 9 . 1 1 69 69 TYR CA C 69 61.528 61.528 60.984 0.543 18112 6566 1 9 . 1 1 69 69 TYR H H 69 9.127 9.127 8.562 0.565 18112 6567 1 9 . 1 1 70 70 ILE N N 70 124.738 124.738 118.880 5.858 18112 6568 1 9 . 1 1 70 70 ILE HA H 70 3.828 3.828 3.149 0.679 18112 6569 1 9 . 1 1 70 70 ILE C C 70 179.585 179.585 178.212 1.373 18112 6570 1 9 . 1 1 70 70 ILE CA C 70 65.787 65.787 64.612 1.175 18112 6571 1 9 . 1 1 70 70 ILE CB C 70 36.435 36.435 37.380 -0.945 18112 6572 1 9 . 1 1 70 70 ILE H H 70 8.631 8.631 8.125 0.506 18112 6573 1 9 . 1 1 71 71 GLN N N 71 117.940 117.940 117.890 0.050 18112 6574 1 9 . 1 1 71 71 GLN HA H 71 3.826 3.826 3.427 0.399 18112 6575 1 9 . 1 1 71 71 GLN C C 71 178.192 178.192 178.083 0.109 18112 6576 1 9 . 1 1 71 71 GLN CA C 71 57.779 57.779 57.988 -0.209 18112 6577 1 9 . 1 1 71 71 GLN H H 71 7.738 7.738 7.733 0.005 18112 6578 1 9 . 1 1 72 72 MET N N 72 117.353 117.353 119.730 -2.377 18112 6579 1 9 . 1 1 72 72 MET HA H 72 4.112 4.112 4.115 -0.003 18112 6580 1 9 . 1 1 72 72 MET C C 72 177.203 177.203 178.246 -1.043 18112 6581 1 9 . 1 1 72 72 MET CA C 72 57.272 57.272 58.652 -1.380 18112 6582 1 9 . 1 1 72 72 MET H H 72 7.844 7.844 8.027 -0.183 18112 6583 1 9 . 1 1 73 73 GLU N N 73 117.858 117.858 119.116 -1.258 18112 6584 1 9 . 1 1 73 73 GLU HA H 73 3.572 3.572 3.604 -0.032 18112 6585 1 9 . 1 1 73 73 GLU C C 73 177.344 177.344 178.468 -1.124 18112 6586 1 9 . 1 1 73 73 GLU CA C 73 60.324 60.324 59.208 1.116 18112 6587 1 9 . 1 1 73 73 GLU H H 73 7.503 7.503 8.130 -0.627 18112 6588 1 9 . 1 1 74 74 LYS N N 74 118.716 118.716 120.057 -1.341 18112 6589 1 9 . 1 1 74 74 LYS HA H 74 3.867 3.867 3.977 -0.110 18112 6590 1 9 . 1 1 74 74 LYS C C 74 180.077 180.077 179.359 0.718 18112 6591 1 9 . 1 1 74 74 LYS CA C 74 59.754 59.754 58.602 1.153 18112 6592 1 9 . 1 1 74 74 LYS H H 74 7.912 7.912 7.582 0.330 18112 6593 1 9 . 1 1 75 75 TYR N N 75 117.309 117.309 118.593 -1.284 18112 6594 1 9 . 1 1 75 75 TYR HA H 75 4.085 4.085 4.268 -0.183 18112 6595 1 9 . 1 1 75 75 TYR C C 75 178.874 178.874 178.238 0.636 18112 6596 1 9 . 1 1 75 75 TYR CA C 75 63.306 63.306 59.014 4.293 18112 6597 1 9 . 1 1 75 75 TYR H H 75 8.421 8.421 7.818 0.603 18112 6598 1 9 . 1 1 76 76 ALA N N 76 125.392 125.392 122.137 3.255 18112 6599 1 9 . 1 1 76 76 ALA HA H 76 4.221 4.221 4.176 0.045 18112 6600 1 9 . 1 1 76 76 ALA C C 76 178.850 178.850 179.298 -0.448 18112 6601 1 9 . 1 1 76 76 ALA CA C 76 56.280 56.280 55.569 0.711 18112 6602 1 9 . 1 1 76 76 ALA CB C 76 18.687 18.687 18.412 0.275 18112 6603 1 9 . 1 1 76 76 ALA H H 76 8.553 8.553 8.510 0.043 18112 6604 1 9 . 1 1 77 77 ARG N N 77 115.067 115.067 118.788 -3.721 18112 6605 1 9 . 1 1 77 77 ARG HA H 77 3.935 3.935 3.944 -0.009 18112 6606 1 9 . 1 1 77 77 ARG C C 77 179.341 179.341 178.213 1.128 18112 6607 1 9 . 1 1 77 77 ARG CA C 77 60.499 60.499 59.498 1.002 18112 6608 1 9 . 1 1 77 77 ARG H H 77 8.471 8.471 8.098 0.373 18112 6609 1 9 . 1 1 78 78 GLN N N 78 120.107 120.107 119.141 0.966 18112 6610 1 9 . 1 1 78 78 GLN HA H 78 3.921 3.921 4.136 -0.215 18112 6611 1 9 . 1 1 78 78 GLN C C 78 177.289 177.289 178.176 -0.887 18112 6612 1 9 . 1 1 78 78 GLN CA C 78 58.619 58.619 58.846 -0.227 18112 6613 1 9 . 1 1 78 78 GLN CB C 78 27.752 27.752 28.625 -0.873 18112 6614 1 9 . 1 1 78 78 GLN H H 78 8.142 8.142 8.056 0.086 18112 6615 1 9 . 1 1 79 79 ALA N N 79 120.809 120.809 123.075 -2.266 18112 6616 1 9 . 1 1 79 79 ALA HA H 79 4.308 4.308 4.115 0.193 18112 6617 1 9 . 1 1 79 79 ALA C C 79 179.924 179.924 179.833 0.091 18112 6618 1 9 . 1 1 79 79 ALA CA C 79 54.970 54.970 55.359 -0.389 18112 6619 1 9 . 1 1 79 79 ALA CB C 79 17.064 17.064 18.697 -1.633 18112 6620 1 9 . 1 1 79 79 ALA H H 79 7.811 7.811 8.154 -0.343 18112 6621 1 9 . 1 1 80 80 ILE N N 80 118.524 118.524 118.700 -0.176 18112 6622 1 9 . 1 1 80 80 ILE HA H 80 3.894 3.894 3.625 0.269 18112 6623 1 9 . 1 1 80 80 ILE C C 80 181.268 181.268 178.274 2.994 18112 6624 1 9 . 1 1 80 80 ILE CA C 80 64.841 64.841 64.678 0.163 18112 6625 1 9 . 1 1 80 80 ILE CB C 80 37.125 37.125 37.829 -0.704 18112 6626 1 9 . 1 1 80 80 ILE H H 80 7.837 7.837 8.041 -0.204 18112 6627 1 9 . 1 1 81 81 ASN N N 81 121.233 121.233 117.464 3.769 18112 6628 1 9 . 1 1 81 81 ASN HA H 81 4.398 4.398 4.423 -0.025 18112 6629 1 9 . 1 1 81 81 ASN C C 81 176.546 176.546 177.060 -0.514 18112 6630 1 9 . 1 1 81 81 ASN CA C 81 55.892 55.892 55.866 0.026 18112 6631 1 9 . 1 1 81 81 ASN CB C 81 37.603 37.603 38.649 -1.046 18112 6632 1 9 . 1 1 81 81 ASN H H 81 8.262 8.262 8.146 0.116 18112 6633 1 9 . 1 1 82 82 ASP N N 82 119.240 119.240 117.381 1.859 18112 6634 1 9 . 1 1 82 82 ASP HA H 82 4.666 4.666 4.646 0.020 18112 6635 1 9 . 1 1 82 82 ASP C C 82 176.767 176.767 177.252 -0.485 18112 6636 1 9 . 1 1 82 82 ASP CA C 82 54.771 54.771 54.639 0.132 18112 6637 1 9 . 1 1 82 82 ASP CB C 82 40.121 40.121 41.632 -1.511 18112 6638 1 9 . 1 1 82 82 ASP H H 82 8.316 8.316 8.115 0.201 18112 6639 1 9 . 1 1 83 83 GLY N N 83 106.913 106.913 107.066 -0.153 18112 6640 1 9 . 1 1 83 83 GLY C C 83 174.601 174.601 174.831 -0.230 18112 6641 1 9 . 1 1 83 83 GLY CA C 83 45.214 45.214 44.973 0.241 18112 6642 1 9 . 1 1 83 83 GLY H H 83 7.810 7.810 7.856 -0.046 18112 6643 1 9 . 1 1 84 84 VAL N N 84 122.981 122.981 120.068 2.913 18112 6644 1 9 . 1 1 84 84 VAL HA H 84 3.850 3.850 3.948 -0.098 18112 6645 1 9 . 1 1 84 84 VAL C C 84 177.265 177.265 176.165 1.100 18112 6646 1 9 . 1 1 84 84 VAL CA C 84 64.270 64.270 63.260 1.010 18112 6647 1 9 . 1 1 84 84 VAL CB C 84 30.471 30.471 31.331 -0.859 18112 6648 1 9 . 1 1 84 84 VAL H H 84 8.157 8.157 7.824 0.333 18112 6649 1 9 . 1 1 85 85 THR N N 85 115.232 115.232 121.236 -6.004 18112 6650 1 9 . 1 1 85 85 THR HA H 85 4.716 4.716 4.665 0.051 18112 6651 1 9 . 1 1 85 85 THR C C 85 174.489 174.489 174.600 -0.111 18112 6652 1 9 . 1 1 85 85 THR CA C 85 61.618 61.618 62.800 -1.183 18112 6653 1 9 . 1 1 85 85 THR CB C 85 70.081 70.081 69.819 0.262 18112 6654 1 9 . 1 1 85 85 THR H H 85 8.890 8.890 8.755 0.135 18112 6655 1 9 . 1 1 86 86 SER N N 86 117.009 117.009 116.508 0.501 18112 6656 1 9 . 1 1 86 86 SER HA H 86 5.046 5.046 4.736 0.310 18112 6657 1 9 . 1 1 86 86 SER C C 86 174.473 174.473 174.690 -0.217 18112 6658 1 9 . 1 1 86 86 SER CA C 86 55.922 55.922 57.077 -1.155 18112 6659 1 9 . 1 1 86 86 SER CB C 86 64.385 64.385 64.981 -0.596 18112 6660 1 9 . 1 1 86 86 SER H H 86 7.704 7.704 7.652 0.052 18112 6661 1 9 . 1 1 87 87 THR N N 87 118.634 118.634 117.388 1.246 18112 6662 1 9 . 1 1 87 87 THR HA H 87 4.065 4.065 3.846 0.219 18112 6663 1 9 . 1 1 87 87 THR C C 87 176.047 176.047 175.494 0.553 18112 6664 1 9 . 1 1 87 87 THR CA C 87 64.983 64.983 64.639 0.344 18112 6665 1 9 . 1 1 87 87 THR CB C 87 68.045 68.045 68.318 -0.273 18112 6666 1 9 . 1 1 87 87 THR H H 87 8.711 8.711 8.544 0.167 18112 6667 1 9 . 1 1 88 88 GLU N N 88 117.889 117.889 119.374 -1.485 18112 6668 1 9 . 1 1 88 88 GLU HA H 88 3.881 3.881 4.100 -0.219 18112 6669 1 9 . 1 1 88 88 GLU C C 88 177.146 177.146 177.522 -0.376 18112 6670 1 9 . 1 1 88 88 GLU CA C 88 57.814 57.814 58.352 -0.538 18112 6671 1 9 . 1 1 88 88 GLU CB C 88 28.050 28.050 28.474 -0.425 18112 6672 1 9 . 1 1 88 88 GLU H H 88 8.152 8.152 8.674 -0.522 18112 6673 1 9 . 1 1 89 89 GLU N N 89 115.617 115.617 117.633 -2.016 18112 6674 1 9 . 1 1 89 89 GLU HA H 89 4.149 4.149 4.283 -0.134 18112 6675 1 9 . 1 1 89 89 GLU C C 89 176.192 176.192 177.029 -0.837 18112 6676 1 9 . 1 1 89 89 GLU CA C 89 56.133 56.133 57.266 -1.133 18112 6677 1 9 . 1 1 89 89 GLU CB C 89 29.415 29.415 30.345 -0.930 18112 6678 1 9 . 1 1 89 89 GLU H H 89 7.311 7.311 7.659 -0.348 18112 6679 1 9 . 1 1 90 90 LEU N N 90 120.870 120.870 114.729 6.141 18112 6680 1 9 . 1 1 90 90 LEU HA H 90 4.439 4.439 4.600 -0.161 18112 6681 1 9 . 1 1 90 90 LEU C C 90 175.267 175.267 176.274 -1.007 18112 6682 1 9 . 1 1 90 90 LEU CA C 90 53.504 53.504 55.466 -1.962 18112 6683 1 9 . 1 1 90 90 LEU CB C 90 40.479 40.479 43.420 -2.942 18112 6684 1 9 . 1 1 90 90 LEU H H 90 7.311 7.311 7.387 -0.076 18112 6685 1 9 . 1 1 91 91 SER N N 91 118.376 118.376 114.995 3.381 18112 6686 1 9 . 1 1 91 91 SER HA H 91 4.747 4.747 4.534 0.213 18112 6687 1 9 . 1 1 91 91 SER C C 91 173.332 173.332 172.774 0.558 18112 6688 1 9 . 1 1 91 91 SER CA C 91 56.314 56.314 58.789 -2.475 18112 6689 1 9 . 1 1 91 91 SER CB C 91 64.615 64.615 63.928 0.687 18112 6690 1 9 . 1 1 91 91 SER H H 91 8.221 8.221 7.867 0.354 18112 6691 1 9 . 1 1 92 92 ILE N N 92 122.247 122.247 121.214 1.033 18112 6692 1 9 . 1 1 92 92 ILE HA H 92 4.537 4.537 4.380 0.157 18112 6693 1 9 . 1 1 92 92 ILE C C 92 174.059 174.059 175.956 -1.897 18112 6694 1 9 . 1 1 92 92 ILE CA C 92 59.881 59.881 58.507 1.374 18112 6695 1 9 . 1 1 92 92 ILE CB C 92 37.820 37.820 41.819 -3.999 18112 6696 1 9 . 1 1 92 92 ILE H H 92 8.570 8.570 7.856 0.714 18112 6697 1 9 . 1 1 93 93 THR N N 93 116.069 116.069 118.944 -2.875 18112 6698 1 9 . 1 1 93 93 THR HA H 93 4.580 4.580 4.290 0.290 18112 6699 1 9 . 1 1 93 93 THR C C 93 175.049 175.049 174.755 0.294 18112 6700 1 9 . 1 1 93 93 THR CA C 93 58.988 58.988 64.285 -5.298 18112 6701 1 9 . 1 1 93 93 THR CB C 93 71.362 71.362 67.978 3.384 18112 6702 1 9 . 1 1 93 93 THR H H 93 7.224 7.224 8.746 -1.522 18112 6703 1 9 . 1 1 94 94 ARG N N 94 116.595 116.595 127.229 -10.634 18112 6704 1 9 . 1 1 94 94 ARG HA H 94 3.077 3.077 4.410 -1.333 18112 6705 1 9 . 1 1 94 94 ARG C C 94 175.076 175.076 175.391 -0.315 18112 6706 1 9 . 1 1 94 94 ARG CA C 94 57.119 57.119 54.199 2.920 18112 6707 1 9 . 1 1 94 94 ARG CB C 94 27.838 27.838 30.439 -2.601 18112 6708 1 9 . 1 1 94 94 ARG H H 94 8.596 8.596 8.217 0.379 18112 6709 1 9 . 1 1 95 95 ASP N N 95 113.735 113.735 118.745 -5.010 18112 6710 1 9 . 1 1 95 95 ASP HA H 95 4.765 4.765 2.697 2.068 18112 6711 1 9 . 1 1 95 95 ASP C C 95 175.876 175.876 176.666 -0.790 18112 6712 1 9 . 1 1 95 95 ASP CA C 95 53.156 53.156 57.023 -3.868 18112 6713 1 9 . 1 1 95 95 ASP CB C 95 41.166 41.166 38.807 2.359 18112 6714 1 9 . 1 1 95 95 ASP H H 95 7.607 7.607 8.210 -0.603 18112 6715 1 9 . 1 1 96 96 CYS N N 96 116.012 116.012 122.097 -6.085 18112 6716 1 9 . 1 1 96 96 CYS C C 96 174.361 174.361 176.984 -2.623 18112 6717 1 9 . 1 1 96 96 CYS CA C 96 56.562 56.562 63.290 -6.728 18112 6718 1 9 . 1 1 96 96 CYS CB C 96 29.416 29.416 27.586 1.830 18112 6719 1 9 . 1 1 96 96 CYS H H 96 7.094 7.094 8.307 -1.213 18112 6720 1 9 . 1 1 97 97 GLU N N 97 123.087 123.087 119.356 3.731 18112 6721 1 9 . 1 1 97 97 GLU C C 97 178.748 178.748 179.319 -0.571 18112 6722 1 9 . 1 1 97 97 GLU CA C 97 59.912 59.912 59.451 0.461 18112 6723 1 9 . 1 1 97 97 GLU CB C 97 29.195 29.195 29.249 -0.054 18112 6724 1 9 . 1 1 97 97 GLU H H 97 9.003 9.003 7.726 1.277 18112 6725 1 9 . 1 1 98 98 LEU N N 98 120.942 120.942 120.383 0.559 18112 6726 1 9 . 1 1 98 98 LEU HA H 98 3.614 3.614 4.263 -0.649 18112 6727 1 9 . 1 1 98 98 LEU C C 98 177.796 177.796 179.041 -1.245 18112 6728 1 9 . 1 1 98 98 LEU CA C 98 58.090 58.090 57.597 0.493 18112 6729 1 9 . 1 1 98 98 LEU CB C 98 39.778 39.778 41.781 -2.003 18112 6730 1 9 . 1 1 98 98 LEU H H 98 8.656 8.656 7.993 0.663 18112 6731 1 9 . 1 1 99 99 TYR N N 99 118.313 118.313 119.219 -0.906 18112 6732 1 9 . 1 1 99 99 TYR C C 99 177.077 177.077 178.541 -1.464 18112 6733 1 9 . 1 1 99 99 TYR CA C 99 62.622 62.622 59.991 2.631 18112 6734 1 9 . 1 1 99 99 TYR CB C 99 38.742 38.742 37.281 1.462 18112 6735 1 9 . 1 1 99 99 TYR H H 99 7.522 7.522 8.621 -1.099 18112 6736 1 9 . 1 1 100 100 ARG N N 100 118.101 118.101 118.537 -0.436 18112 6737 1 9 . 1 1 100 100 ARG C C 100 178.616 178.616 178.794 -0.178 18112 6738 1 9 . 1 1 100 100 ARG CA C 100 59.915 59.915 58.191 1.724 18112 6739 1 9 . 1 1 100 100 ARG CB C 100 29.100 29.100 29.237 -0.137 18112 6740 1 9 . 1 1 100 100 ARG H H 100 8.243 8.243 8.280 -0.037 18112 6741 1 9 . 1 1 101 101 ALA N N 101 120.972 120.972 122.999 -2.027 18112 6742 1 9 . 1 1 101 101 ALA HA H 101 4.145 4.145 4.135 0.010 18112 6743 1 9 . 1 1 101 101 ALA C C 101 181.359 181.359 179.514 1.845 18112 6744 1 9 . 1 1 101 101 ALA CA C 101 55.057 55.057 55.121 -0.064 18112 6745 1 9 . 1 1 101 101 ALA CB C 101 17.543 17.543 18.646 -1.103 18112 6746 1 9 . 1 1 101 101 ALA H H 101 8.352 8.352 8.017 0.335 18112 6747 1 9 . 1 1 102 102 LEU N N 102 115.683 115.683 117.880 -2.197 18112 6748 1 9 . 1 1 102 102 LEU HA H 102 4.333 4.333 4.203 0.130 18112 6749 1 9 . 1 1 102 102 LEU C C 102 178.583 178.583 179.691 -1.108 18112 6750 1 9 . 1 1 102 102 LEU CA C 102 57.634 57.634 57.863 -0.229 18112 6751 1 9 . 1 1 102 102 LEU CB C 102 41.716 41.716 41.813 -0.097 18112 6752 1 9 . 1 1 102 102 LEU H H 102 7.960 7.960 8.324 -0.364 18112 6753 1 9 . 1 1 103 103 ASN N N 103 118.957 118.957 118.317 0.640 18112 6754 1 9 . 1 1 103 103 ASN C C 103 177.470 177.470 177.366 0.104 18112 6755 1 9 . 1 1 103 103 ASN CA C 103 56.974 56.974 56.810 0.164 18112 6756 1 9 . 1 1 103 103 ASN CB C 103 38.140 38.140 38.667 -0.527 18112 6757 1 9 . 1 1 103 103 ASN H H 103 9.301 9.301 8.488 0.813 18112 6758 1 9 . 1 1 104 104 MET N N 104 113.763 113.763 118.918 -5.155 18112 6759 1 9 . 1 1 104 104 MET CA C 104 57.362 57.362 58.086 -0.724 18112 6760 1 9 . 1 1 104 104 MET CB C 104 31.895 31.895 32.498 -0.603 18112 6761 1 9 . 1 1 104 104 MET H H 104 8.332 8.332 8.019 0.313 18112 6762 1 9 . 1 1 105 105 HIS N N 105 116.024 116.024 116.402 -0.378 18112 6763 1 9 . 1 1 105 105 HIS HA H 105 3.764 3.764 4.293 -0.529 18112 6764 1 9 . 1 1 105 105 HIS C C 105 176.939 176.939 176.981 -0.042 18112 6765 1 9 . 1 1 105 105 HIS CA C 105 59.069 59.069 59.271 -0.202 18112 6766 1 9 . 1 1 105 105 HIS H H 105 7.156 7.156 8.023 -0.867 18112 6767 1 9 . 1 1 106 106 TYR N N 106 113.161 113.161 116.727 -3.566 18112 6768 1 9 . 1 1 106 106 TYR C C 106 173.767 173.767 175.908 -2.141 18112 6769 1 9 . 1 1 106 106 TYR CA C 106 58.488 58.488 59.719 -1.231 18112 6770 1 9 . 1 1 106 106 TYR CB C 106 38.225 38.225 39.919 -1.694 18112 6771 1 9 . 1 1 106 106 TYR H H 106 7.204 7.204 7.986 -0.782 18112 6772 1 9 . 1 1 107 107 ASN N N 107 118.875 118.875 117.578 1.297 18112 6773 1 9 . 1 1 107 107 ASN HA H 107 3.922 3.922 4.779 -0.857 18112 6774 1 9 . 1 1 107 107 ASN C C 107 175.815 175.815 175.082 0.733 18112 6775 1 9 . 1 1 107 107 ASN CA C 107 51.233 51.233 52.172 -0.939 18112 6776 1 9 . 1 1 107 107 ASN CB C 107 38.142 38.142 38.572 -0.430 18112 6777 1 9 . 1 1 107 107 ASN H H 107 8.127 8.127 8.212 -0.085 18112 6778 1 9 . 1 1 108 108 LYS N N 108 122.850 122.850 124.245 -1.395 18112 6779 1 9 . 1 1 108 108 LYS HA H 108 3.954 3.954 4.006 -0.052 18112 6780 1 9 . 1 1 108 108 LYS C C 108 177.586 177.586 177.295 0.291 18112 6781 1 9 . 1 1 108 108 LYS CA C 108 59.749 59.749 58.900 0.849 18112 6782 1 9 . 1 1 108 108 LYS CB C 108 31.498 31.498 32.528 -1.030 18112 6783 1 9 . 1 1 108 108 LYS H H 108 7.772 7.772 8.468 -0.696 18112 6784 1 9 . 1 1 109 109 ALA N N 109 118.054 118.054 122.659 -4.605 18112 6785 1 9 . 1 1 109 109 ALA HA H 109 4.137 4.137 4.480 -0.343 18112 6786 1 9 . 1 1 109 109 ALA C C 109 177.889 177.889 176.351 1.538 18112 6787 1 9 . 1 1 109 109 ALA CA C 109 52.299 52.299 49.994 2.305 18112 6788 1 9 . 1 1 109 109 ALA CB C 109 17.787 17.787 17.395 0.392 18112 6789 1 9 . 1 1 109 109 ALA H H 109 8.307 8.307 8.033 0.274 18112 6790 1 9 . 1 1 110 110 ASN N N 110 115.542 115.542 119.668 -4.126 18112 6791 1 9 . 1 1 110 110 ASN HA H 110 4.480 4.480 4.441 0.039 18112 6792 1 9 . 1 1 110 110 ASN C C 110 174.277 174.277 175.225 -0.948 18112 6793 1 9 . 1 1 110 110 ASN CA C 110 53.504 53.504 53.102 0.402 18112 6794 1 9 . 1 1 110 110 ASN CB C 110 37.283 37.283 37.150 0.133 18112 6795 1 9 . 1 1 110 110 ASN H H 110 8.353 8.353 7.761 0.592 18112 6796 1 9 . 1 1 111 111 ASP N N 111 114.692 114.692 122.756 -8.064 18112 6797 1 9 . 1 1 111 111 ASP HA H 111 4.485 4.485 4.475 0.010 18112 6798 1 9 . 1 1 111 111 ASP C C 111 174.868 174.868 176.005 -1.137 18112 6799 1 9 . 1 1 111 111 ASP CA C 111 53.227 53.227 56.604 -3.377 18112 6800 1 9 . 1 1 111 111 ASP CB C 111 39.228 39.228 41.563 -2.335 18112 6801 1 9 . 1 1 111 111 ASP H H 111 8.297 8.297 8.562 -0.265 18112 6802 1 9 . 1 1 112 112 PHE N N 112 120.927 120.927 117.973 2.954 18112 6803 1 9 . 1 1 112 112 PHE HA H 112 4.752 4.752 4.585 0.167 18112 6804 1 9 . 1 1 112 112 PHE C C 112 174.633 174.633 176.757 -2.124 18112 6805 1 9 . 1 1 112 112 PHE CA C 112 56.346 56.346 56.713 -0.367 18112 6806 1 9 . 1 1 112 112 PHE H H 112 7.784 7.784 8.124 -0.340 18112 6807 1 9 . 1 1 113 113 GLU N N 113 128.111 128.111 123.911 4.200 18112 6808 1 9 . 1 1 113 113 GLU HA H 113 4.011 4.011 4.228 -0.217 18112 6809 1 9 . 1 1 113 113 GLU C C 113 173.502 173.502 175.731 -2.229 18112 6810 1 9 . 1 1 113 113 GLU CA C 113 55.100 55.100 55.639 -0.539 18112 6811 1 9 . 1 1 113 113 GLU H H 113 7.752 7.752 8.761 -1.009 18112 6812 1 9 . 1 1 114 114 VAL N N 114 129.326 129.326 114.887 14.439 18112 6813 1 9 . 1 1 114 114 VAL HA H 114 3.241 3.241 3.817 -0.576 18112 6814 1 9 . 1 1 114 114 VAL CA C 114 60.838 60.838 61.680 -0.842 18112 6815 1 9 . 1 1 114 114 VAL CB C 114 32.609 32.609 30.295 2.314 18112 6816 1 9 . 1 1 114 114 VAL H H 114 8.008 8.008 7.430 0.578 18112 6817 1 9 . 1 1 115 115 PRO HA H 115 4.429 4.429 4.523 -0.094 18112 6818 1 9 . 1 1 115 115 PRO C C 115 177.421 177.421 177.560 -0.139 18112 6819 1 9 . 1 1 115 115 PRO CA C 115 61.882 61.882 62.276 -0.394 18112 6820 1 9 . 1 1 115 115 PRO CB C 115 30.974 30.974 32.765 -1.791 18112 6821 1 9 . 1 1 116 116 GLU N N 116 123.936 123.936 120.898 3.038 18112 6822 1 9 . 1 1 116 116 GLU C C 116 179.034 179.034 178.704 0.330 18112 6823 1 9 . 1 1 116 116 GLU CA C 116 58.913 58.913 60.369 -1.456 18112 6824 1 9 . 1 1 116 116 GLU CB C 116 28.378 28.378 29.723 -1.345 18112 6825 1 9 . 1 1 116 116 GLU H H 116 8.757 8.757 8.888 -0.131 18112 6826 1 9 . 1 1 117 117 ARG N N 117 116.943 116.943 118.037 -1.094 18112 6827 1 9 . 1 1 117 117 ARG C C 117 177.570 177.570 178.715 -1.145 18112 6828 1 9 . 1 1 117 117 ARG CA C 117 57.033 57.033 58.338 -1.305 18112 6829 1 9 . 1 1 117 117 ARG CB C 117 28.172 28.172 29.657 -1.485 18112 6830 1 9 . 1 1 117 117 ARG H H 117 8.733 8.733 8.373 0.360 18112 6831 1 9 . 1 1 118 118 PHE N N 118 117.528 117.528 121.968 -4.440 18112 6832 1 9 . 1 1 118 118 PHE HA H 118 4.137 4.137 4.185 -0.048 18112 6833 1 9 . 1 1 118 118 PHE C C 118 176.992 176.992 177.002 -0.010 18112 6834 1 9 . 1 1 118 118 PHE CA C 118 61.627 61.627 61.804 -0.177 18112 6835 1 9 . 1 1 118 118 PHE CB C 118 37.386 37.386 39.106 -1.720 18112 6836 1 9 . 1 1 118 118 PHE H H 118 7.606 7.606 7.889 -0.283 18112 6837 1 9 . 1 1 119 119 LEU N N 119 118.483 118.483 118.601 -0.118 18112 6838 1 9 . 1 1 119 119 LEU HA H 119 3.684 3.684 4.070 -0.386 18112 6839 1 9 . 1 1 119 119 LEU C C 119 178.802 178.802 179.057 -0.255 18112 6840 1 9 . 1 1 119 119 LEU CA C 119 59.875 59.875 56.824 3.051 18112 6841 1 9 . 1 1 119 119 LEU CB C 119 39.453 39.453 40.426 -0.973 18112 6842 1 9 . 1 1 119 119 LEU H H 119 7.248 7.248 7.934 -0.686 18112 6843 1 9 . 1 1 120 120 GLU N N 120 117.870 117.870 121.297 -3.427 18112 6844 1 9 . 1 1 120 120 GLU C C 120 179.932 179.932 179.092 0.840 18112 6845 1 9 . 1 1 120 120 GLU CA C 120 59.150 59.150 59.867 -0.717 18112 6846 1 9 . 1 1 120 120 GLU CB C 120 28.878 28.878 29.779 -0.901 18112 6847 1 9 . 1 1 120 120 GLU H H 120 7.423 7.423 8.401 -0.978 18112 6848 1 9 . 1 1 121 121 VAL N N 121 120.777 120.777 120.384 0.393 18112 6849 1 9 . 1 1 121 121 VAL HA H 121 3.545 3.545 3.568 -0.023 18112 6850 1 9 . 1 1 121 121 VAL C C 121 179.302 179.302 177.674 1.628 18112 6851 1 9 . 1 1 121 121 VAL CA C 121 66.875 66.875 66.205 0.670 18112 6852 1 9 . 1 1 121 121 VAL CB C 121 30.823 30.823 31.263 -0.440 18112 6853 1 9 . 1 1 121 121 VAL H H 121 8.313 8.313 7.769 0.544 18112 6854 1 9 . 1 1 122 122 ALA N N 122 127.029 127.029 121.945 5.084 18112 6855 1 9 . 1 1 122 122 ALA HA H 122 4.251 4.251 3.927 0.324 18112 6856 1 9 . 1 1 122 122 ALA C C 122 178.366 178.366 179.714 -1.348 18112 6857 1 9 . 1 1 122 122 ALA CA C 122 54.748 54.748 55.065 -0.317 18112 6858 1 9 . 1 1 122 122 ALA CB C 122 16.565 16.565 18.135 -1.570 18112 6859 1 9 . 1 1 122 122 ALA H H 122 8.896 8.896 7.918 0.978 18112 6860 1 9 . 1 1 123 123 GLN N N 123 119.887 119.887 119.155 0.732 18112 6861 1 9 . 1 1 123 123 GLN C C 123 177.908 177.908 178.534 -0.626 18112 6862 1 9 . 1 1 123 123 GLN CA C 123 60.671 60.671 58.904 1.767 18112 6863 1 9 . 1 1 123 123 GLN H H 123 8.349 8.349 7.893 0.456 18112 6864 1 9 . 1 1 124 124 ILE N N 124 120.632 120.632 119.396 1.236 18112 6865 1 9 . 1 1 124 124 ILE HA H 124 3.651 3.651 3.662 -0.011 18112 6866 1 9 . 1 1 124 124 ILE C C 124 178.703 178.703 178.121 0.582 18112 6867 1 9 . 1 1 124 124 ILE CA C 124 65.945 65.945 65.323 0.622 18112 6868 1 9 . 1 1 124 124 ILE H H 124 8.204 8.204 7.955 0.249 18112 6869 1 9 . 1 1 125 125 THR N N 125 115.084 115.084 115.125 -0.041 18112 6870 1 9 . 1 1 125 125 THR C C 125 175.568 175.568 176.648 -1.080 18112 6871 1 9 . 1 1 125 125 THR CA C 125 67.872 67.872 66.621 1.251 18112 6872 1 9 . 1 1 125 125 THR H H 125 8.399 8.399 8.265 0.134 18112 6873 1 9 . 1 1 126 126 LEU N N 126 125.011 125.011 122.419 2.592 18112 6874 1 9 . 1 1 126 126 LEU HA H 126 4.085 4.085 4.362 -0.278 18112 6875 1 9 . 1 1 126 126 LEU C C 126 178.559 178.559 178.405 0.154 18112 6876 1 9 . 1 1 126 126 LEU CA C 126 58.843 58.843 58.225 0.618 18112 6877 1 9 . 1 1 126 126 LEU CB C 126 41.421 41.421 41.848 -0.427 18112 6878 1 9 . 1 1 126 126 LEU H H 126 8.728 8.728 7.955 0.773 18112 6879 1 9 . 1 1 127 127 ARG N N 127 117.076 117.076 119.324 -2.248 18112 6880 1 9 . 1 1 127 127 ARG HA H 127 3.929 3.929 4.061 -0.132 18112 6881 1 9 . 1 1 127 127 ARG C C 127 177.984 177.984 178.906 -0.922 18112 6882 1 9 . 1 1 127 127 ARG CA C 127 60.685 60.685 58.913 1.772 18112 6883 1 9 . 1 1 127 127 ARG CB C 127 28.079 28.079 29.520 -1.441 18112 6884 1 9 . 1 1 127 127 ARG H H 127 8.213 8.213 8.303 -0.090 18112 6885 1 9 . 1 1 128 128 GLU N N 128 118.617 118.617 120.112 -1.495 18112 6886 1 9 . 1 1 128 128 GLU HA H 128 4.147 4.147 4.208 -0.061 18112 6887 1 9 . 1 1 128 128 GLU C C 128 181.150 181.150 179.366 1.784 18112 6888 1 9 . 1 1 128 128 GLU CA C 128 59.508 59.508 59.088 0.420 18112 6889 1 9 . 1 1 128 128 GLU H H 128 8.478 8.478 8.187 0.291 18112 6890 1 9 . 1 1 129 129 PHE N N 129 119.267 119.267 120.263 -0.996 18112 6891 1 9 . 1 1 129 129 PHE HA H 129 4.104 4.104 4.551 -0.447 18112 6892 1 9 . 1 1 129 129 PHE C C 129 177.170 177.170 177.891 -0.721 18112 6893 1 9 . 1 1 129 129 PHE CA C 129 63.694 63.694 60.477 3.217 18112 6894 1 9 . 1 1 129 129 PHE H H 129 8.570 8.570 8.209 0.361 18112 6895 1 9 . 1 1 130 130 PHE N N 130 118.739 118.739 119.699 -0.960 18112 6896 1 9 . 1 1 130 130 PHE HA H 130 3.884 3.884 4.050 -0.166 18112 6897 1 9 . 1 1 130 130 PHE C C 130 175.860 175.860 177.369 -1.509 18112 6898 1 9 . 1 1 130 130 PHE CA C 130 62.819 62.819 61.986 0.833 18112 6899 1 9 . 1 1 130 130 PHE H H 130 8.740 8.740 9.021 -0.281 18112 6900 1 9 . 1 1 131 131 ASN N N 131 116.028 116.028 117.977 -1.949 18112 6901 1 9 . 1 1 131 131 ASN HA H 131 4.373 4.373 4.398 -0.025 18112 6902 1 9 . 1 1 131 131 ASN C C 131 178.228 178.228 177.658 0.570 18112 6903 1 9 . 1 1 131 131 ASN CA C 131 55.150 55.150 56.560 -1.411 18112 6904 1 9 . 1 1 131 131 ASN H H 131 8.864 8.864 8.389 0.475 18112 6905 1 9 . 1 1 132 132 ALA N N 132 120.922 120.922 123.383 -2.461 18112 6906 1 9 . 1 1 132 132 ALA HA H 132 4.020 4.020 4.076 -0.056 18112 6907 1 9 . 1 1 132 132 ALA C C 132 178.515 178.515 179.922 -1.407 18112 6908 1 9 . 1 1 132 132 ALA CA C 132 54.924 54.924 55.056 -0.132 18112 6909 1 9 . 1 1 132 132 ALA CB C 132 18.441 18.441 18.570 -0.129 18112 6910 1 9 . 1 1 132 132 ALA H H 132 7.745 7.745 7.937 -0.192 18112 6911 1 9 . 1 1 133 133 ILE N N 133 118.200 118.200 119.798 -1.598 18112 6912 1 9 . 1 1 133 133 ILE HA H 133 3.235 3.235 3.631 -0.396 18112 6913 1 9 . 1 1 133 133 ILE C C 133 180.606 180.606 177.911 2.695 18112 6914 1 9 . 1 1 133 133 ILE CA C 133 65.215 65.215 64.967 0.248 18112 6915 1 9 . 1 1 133 133 ILE CB C 133 38.291 38.291 37.778 0.513 18112 6916 1 9 . 1 1 133 133 ILE H H 133 7.999 7.999 7.987 0.012 18112 6917 1 9 . 1 1 134 134 ILE N N 134 122.564 122.564 119.100 3.464 18112 6918 1 9 . 1 1 134 134 ILE HA H 134 3.788 3.788 3.613 0.175 18112 6919 1 9 . 1 1 134 134 ILE C C 134 177.215 177.215 177.149 0.066 18112 6920 1 9 . 1 1 134 134 ILE CA C 134 63.584 63.584 63.510 0.074 18112 6921 1 9 . 1 1 134 134 ILE CB C 134 35.636 35.636 37.221 -1.585 18112 6922 1 9 . 1 1 134 134 ILE H H 134 8.670 8.670 7.972 0.698 18112 6923 1 9 . 1 1 135 135 ALA N N 135 119.989 119.989 120.616 -0.627 18112 6924 1 9 . 1 1 135 135 ALA HA H 135 4.357 4.357 4.142 0.215 18112 6925 1 9 . 1 1 135 135 ALA C C 135 177.786 177.786 178.014 -0.228 18112 6926 1 9 . 1 1 135 135 ALA CA C 135 51.521 51.521 53.676 -2.155 18112 6927 1 9 . 1 1 135 135 ALA CB C 135 18.839 18.839 19.940 -1.101 18112 6928 1 9 . 1 1 135 135 ALA H H 135 6.898 6.898 7.885 -0.987 18112 6929 1 9 . 1 1 136 136 GLY N N 136 107.682 107.682 104.486 3.196 18112 6930 1 9 . 1 1 136 136 GLY C C 136 176.324 176.324 174.313 2.011 18112 6931 1 9 . 1 1 136 136 GLY CA C 136 45.469 45.469 44.610 0.859 18112 6932 1 9 . 1 1 136 136 GLY H H 136 7.913 7.913 7.664 0.249 18112 6933 1 9 . 1 1 137 137 LYS N N 137 117.213 117.213 115.891 1.322 18112 6934 1 9 . 1 1 137 137 LYS HA H 137 4.004 4.004 3.558 0.446 18112 6935 1 9 . 1 1 137 137 LYS C C 137 176.616 176.616 175.080 1.536 18112 6936 1 9 . 1 1 137 137 LYS CA C 137 57.499 57.499 57.725 -0.226 18112 6937 1 9 . 1 1 137 137 LYS CB C 137 30.927 30.927 30.283 0.644 18112 6938 1 9 . 1 1 137 137 LYS H H 137 8.312 8.312 7.954 0.358 18112 6939 1 9 . 1 1 138 138 ASP N N 138 113.545 113.545 119.942 -6.397 18112 6940 1 9 . 1 1 138 138 ASP HA H 138 3.061 3.061 4.647 -1.586 18112 6941 1 9 . 1 1 138 138 ASP C C 138 174.698 174.698 175.840 -1.142 18112 6942 1 9 . 1 1 138 138 ASP CA C 138 53.694 53.694 53.661 0.033 18112 6943 1 9 . 1 1 138 138 ASP CB C 138 36.008 36.008 40.311 -4.303 18112 6944 1 9 . 1 1 138 138 ASP H H 138 8.465 8.465 8.247 0.218 18112 6945 1 9 . 1 1 139 139 VAL N N 139 115.191 115.191 118.473 -3.282 18112 6946 1 9 . 1 1 139 139 VAL HA H 139 3.886 3.886 4.338 -0.452 18112 6947 1 9 . 1 1 139 139 VAL C C 139 175.889 175.889 174.647 1.242 18112 6948 1 9 . 1 1 139 139 VAL CA C 139 62.793 62.793 61.335 1.458 18112 6949 1 9 . 1 1 139 139 VAL CB C 139 30.662 30.662 32.689 -2.027 18112 6950 1 9 . 1 1 139 139 VAL H H 139 6.610 6.610 7.506 -0.896 18112 6951 1 9 . 1 1 140 140 ASP N N 140 123.363 123.363 118.329 5.034 18112 6952 1 9 . 1 1 140 140 ASP C C 140 175.234 175.234 175.760 -0.526 18112 6953 1 9 . 1 1 140 140 ASP CA C 140 50.221 50.221 55.013 -4.792 18112 6954 1 9 . 1 1 140 140 ASP CB C 140 42.254 42.254 41.069 1.185 18112 6955 1 9 . 1 1 140 140 ASP H H 140 7.553 7.553 7.839 -0.286 18112 6956 1 9 . 1 1 141 141 PRO HA H 141 4.682 4.682 4.519 0.163 18112 6957 1 9 . 1 1 141 141 PRO C C 141 178.678 178.678 178.545 0.133 18112 6958 1 9 . 1 1 141 141 PRO CA C 141 64.532 64.532 65.283 -0.751 18112 6959 1 9 . 1 1 141 141 PRO CB C 141 31.331 31.331 31.940 -0.609 18112 6960 1 9 . 1 1 142 142 SER N N 142 114.421 114.421 115.425 -1.004 18112 6961 1 9 . 1 1 142 142 SER HA H 142 4.565 4.565 4.397 0.168 18112 6962 1 9 . 1 1 142 142 SER C C 142 176.524 176.524 176.205 0.319 18112 6963 1 9 . 1 1 142 142 SER CA C 142 58.711 58.711 60.493 -1.782 18112 6964 1 9 . 1 1 142 142 SER CB C 142 62.783 62.783 62.375 0.408 18112 6965 1 9 . 1 1 142 142 SER H H 142 8.703 8.703 8.636 0.067 18112 6966 1 9 . 1 1 143 143 TRP N N 143 123.598 123.598 121.934 1.664 18112 6967 1 9 . 1 1 143 143 TRP HA H 143 4.136 4.136 4.278 -0.142 18112 6968 1 9 . 1 1 143 143 TRP C C 143 177.113 177.113 177.116 -0.003 18112 6969 1 9 . 1 1 143 143 TRP CA C 143 59.803 59.803 59.365 0.438 18112 6970 1 9 . 1 1 143 143 TRP CB C 143 26.364 26.364 27.777 -1.413 18112 6971 1 9 . 1 1 143 143 TRP H H 143 8.374 8.374 7.976 0.398 18112 6972 1 9 . 1 1 144 144 LYS N N 144 119.293 119.293 119.770 -0.477 18112 6973 1 9 . 1 1 144 144 LYS HA H 144 2.719 2.719 3.274 -0.555 18112 6974 1 9 . 1 1 144 144 LYS C C 144 177.243 177.243 178.434 -1.191 18112 6975 1 9 . 1 1 144 144 LYS CA C 144 58.851 58.851 59.391 -0.540 18112 6976 1 9 . 1 1 144 144 LYS CB C 144 29.373 29.373 31.207 -1.834 18112 6977 1 9 . 1 1 144 144 LYS H H 144 7.196 7.196 6.887 0.309 18112 6978 1 9 . 1 1 145 145 LYS N N 145 116.440 116.440 118.555 -2.115 18112 6979 1 9 . 1 1 145 145 LYS HA H 145 3.490 3.490 3.963 -0.473 18112 6980 1 9 . 1 1 145 145 LYS C C 145 179.149 179.149 178.719 0.430 18112 6981 1 9 . 1 1 145 145 LYS CA C 145 59.271 59.271 58.662 0.609 18112 6982 1 9 . 1 1 145 145 LYS CB C 145 30.521 30.521 31.562 -1.041 18112 6983 1 9 . 1 1 145 145 LYS H H 145 7.389 7.389 7.362 0.027 18112 6984 1 9 . 1 1 146 146 ALA N N 146 118.582 118.582 122.861 -4.279 18112 6985 1 9 . 1 1 146 146 ALA HA H 146 3.932 3.932 3.915 0.017 18112 6986 1 9 . 1 1 146 146 ALA C C 146 179.968 179.968 179.212 0.756 18112 6987 1 9 . 1 1 146 146 ALA CA C 146 54.241 54.241 55.148 -0.907 18112 6988 1 9 . 1 1 146 146 ALA CB C 146 17.689 17.689 18.339 -0.650 18112 6989 1 9 . 1 1 146 146 ALA H H 146 7.112 7.112 7.930 -0.818 18112 6990 1 9 . 1 1 147 147 ILE N N 147 118.537 118.537 119.599 -1.062 18112 6991 1 9 . 1 1 147 147 ILE HA H 147 3.642 3.642 3.515 0.127 18112 6992 1 9 . 1 1 147 147 ILE C C 147 178.919 178.919 177.812 1.107 18112 6993 1 9 . 1 1 147 147 ILE CA C 147 64.418 64.418 64.963 -0.545 18112 6994 1 9 . 1 1 147 147 ILE CB C 147 36.519 36.519 37.257 -0.738 18112 6995 1 9 . 1 1 147 147 ILE H H 147 6.734 6.734 8.071 -1.337 18112 6996 1 9 . 1 1 148 148 TYR N N 148 121.033 121.033 117.953 3.080 18112 6997 1 9 . 1 1 148 148 TYR HA H 148 4.489 4.489 3.947 0.542 18112 6998 1 9 . 1 1 148 148 TYR C C 148 178.348 178.348 178.510 -0.162 18112 6999 1 9 . 1 1 148 148 TYR CA C 148 57.389 57.389 59.538 -2.149 18112 7000 1 9 . 1 1 148 148 TYR CB C 148 35.280 35.280 36.855 -1.575 18112 7001 1 9 . 1 1 148 148 TYR H H 148 8.126 8.126 7.658 0.468 18112 7002 1 9 . 1 1 149 149 LYS N N 149 114.484 114.484 119.508 -5.024 18112 7003 1 9 . 1 1 149 149 LYS C C 149 178.051 178.051 179.112 -1.061 18112 7004 1 9 . 1 1 149 149 LYS CA C 149 59.036 59.036 59.144 -0.108 18112 7005 1 9 . 1 1 149 149 LYS CB C 149 31.575 31.575 32.700 -1.125 18112 7006 1 9 . 1 1 149 149 LYS H H 149 7.364 7.364 7.923 -0.559 18112 7007 1 9 . 1 1 150 150 VAL N N 150 117.812 117.812 117.480 0.332 18112 7008 1 9 . 1 1 150 150 VAL HA H 150 3.770 3.770 3.821 -0.050 18112 7009 1 9 . 1 1 150 150 VAL C C 150 178.786 178.786 177.599 1.187 18112 7010 1 9 . 1 1 150 150 VAL CA C 150 65.070 65.070 65.780 -0.710 18112 7011 1 9 . 1 1 150 150 VAL CB C 150 29.515 29.515 31.640 -2.124 18112 7012 1 9 . 1 1 150 150 VAL H H 150 7.254 7.254 7.696 -0.442 18112 7013 1 9 . 1 1 151 151 ILE N N 151 117.884 117.884 114.117 3.767 18112 7014 1 9 . 1 1 151 151 ILE C C 151 180.539 180.539 176.689 3.850 18112 7015 1 9 . 1 1 151 151 ILE CA C 151 61.490 61.490 63.028 -1.538 18112 7016 1 9 . 1 1 151 151 ILE CB C 151 33.994 33.994 38.228 -4.234 18112 7017 1 9 . 1 1 151 151 ILE H H 151 8.154 8.154 7.755 0.399 18112 7018 1 9 . 1 1 152 152 CYS N N 152 118.649 118.649 118.893 -0.244 18112 7019 1 9 . 1 1 152 152 CYS HA H 152 4.153 4.153 4.221 -0.068 18112 7020 1 9 . 1 1 152 152 CYS C C 152 174.888 174.888 175.841 -0.953 18112 7021 1 9 . 1 1 152 152 CYS CA C 152 61.052 61.052 58.580 2.472 18112 7022 1 9 . 1 1 152 152 CYS CB C 152 36.364 36.364 27.645 8.719 18112 7023 1 9 . 1 1 152 152 CYS H H 152 8.711 8.711 7.900 0.811 18112 7024 1 9 . 1 1 153 153 LYS N N 153 118.498 118.498 122.145 -3.647 18112 7025 1 9 . 1 1 153 153 LYS C C 153 177.389 177.389 175.369 2.020 18112 7026 1 9 . 1 1 153 153 LYS CA C 153 56.243 56.243 56.164 0.079 18112 7027 1 9 . 1 1 153 153 LYS CB C 153 31.343 31.343 30.600 0.743 18112 7028 1 9 . 1 1 153 153 LYS H H 153 6.782 6.782 7.739 -0.957 18112 7029 1 9 . 1 1 154 154 LEU N N 154 117.318 117.318 119.561 -2.243 18112 7030 1 9 . 1 1 154 154 LEU HA H 154 4.576 4.576 4.382 0.194 18112 7031 1 9 . 1 1 154 154 LEU C C 154 177.161 177.161 176.484 0.677 18112 7032 1 9 . 1 1 154 154 LEU CA C 154 53.782 53.782 55.038 -1.256 18112 7033 1 9 . 1 1 154 154 LEU CB C 154 40.881 40.881 43.563 -2.682 18112 7034 1 9 . 1 1 154 154 LEU H H 154 7.616 7.616 7.538 0.078 18112 7035 1 9 . 1 1 155 155 ASP N N 155 121.564 121.564 118.812 2.752 18112 7036 1 9 . 1 1 155 155 ASP C C 155 177.094 177.094 174.804 2.290 18112 7037 1 9 . 1 1 155 155 ASP CA C 155 55.732 55.732 54.406 1.326 18112 7038 1 9 . 1 1 155 155 ASP CB C 155 40.139 40.139 41.952 -1.812 18112 7039 1 9 . 1 1 155 155 ASP H H 155 7.582 7.582 7.882 -0.300 18112 7040 1 9 . 1 1 156 156 SER N N 156 117.352 117.352 117.684 -0.332 18112 7041 1 9 . 1 1 156 156 SER HA H 156 4.818 4.818 4.322 0.496 18112 7042 1 9 . 1 1 156 156 SER C C 156 173.409 173.409 174.132 -0.723 18112 7043 1 9 . 1 1 156 156 SER CA C 156 57.073 57.073 57.210 -0.137 18112 7044 1 9 . 1 1 156 156 SER CB C 156 65.150 65.150 63.514 1.636 18112 7045 1 9 . 1 1 156 156 SER H H 156 8.846 8.846 8.290 0.556 18112 7046 1 9 . 1 1 157 157 GLU N N 157 120.688 120.688 121.471 -0.783 18112 7047 1 9 . 1 1 157 157 GLU HA H 157 4.038 4.038 4.439 -0.401 18112 7048 1 9 . 1 1 157 157 GLU C C 157 176.332 176.332 176.135 0.197 18112 7049 1 9 . 1 1 157 157 GLU CA C 157 56.464 56.464 56.042 0.422 18112 7050 1 9 . 1 1 157 157 GLU CB C 157 29.206 29.206 30.663 -1.457 18112 7051 1 9 . 1 1 157 157 GLU H H 157 8.356 8.356 7.816 0.540 18112 7052 1 9 . 1 1 158 158 VAL N N 158 126.906 126.906 119.282 7.624 18112 7053 1 9 . 1 1 158 158 VAL HA H 158 3.449 3.449 4.783 -1.334 18112 7054 1 9 . 1 1 158 158 VAL C C 158 176.382 176.382 174.337 2.045 18112 7055 1 9 . 1 1 158 158 VAL CA C 158 59.584 59.584 57.739 1.845 18112 7056 1 9 . 1 1 158 158 VAL CB C 158 31.160 31.160 32.551 -1.391 18112 7057 1 9 . 1 1 158 158 VAL H H 158 8.561 8.561 8.087 0.474 18112 7058 1 9 . 1 1 159 159 PRO HA H 159 4.403 4.403 4.246 0.157 18112 7059 1 9 . 1 1 159 159 PRO C C 159 176.757 176.757 175.893 0.864 18112 7060 1 9 . 1 1 159 159 PRO CA C 159 63.845 63.845 63.371 0.474 18112 7061 1 9 . 1 1 159 159 PRO CB C 159 32.106 32.106 30.671 1.435 18112 7062 1 9 . 1 1 160 160 GLU N N 160 122.904 122.904 123.016 -0.112 18112 7063 1 9 . 1 1 160 160 GLU HA H 160 4.008 4.008 3.910 0.098 18112 7064 1 9 . 1 1 160 160 GLU C C 160 179.132 179.132 176.680 2.452 18112 7065 1 9 . 1 1 160 160 GLU CA C 160 59.407 59.407 58.417 0.990 18112 7066 1 9 . 1 1 160 160 GLU CB C 160 28.991 28.991 29.936 -0.945 18112 7067 1 9 . 1 1 160 160 GLU H H 160 8.650 8.650 8.544 0.106 18112 7068 1 9 . 1 1 161 161 ILE N N 161 119.782 119.782 118.001 1.781 18112 7069 1 9 . 1 1 161 161 ILE HA H 161 4.146 4.146 4.380 -0.234 18112 7070 1 9 . 1 1 161 161 ILE C C 161 176.176 176.176 175.217 0.959 18112 7071 1 9 . 1 1 161 161 ILE CA C 161 62.034 62.034 59.689 2.345 18112 7072 1 9 . 1 1 161 161 ILE CB C 161 37.113 37.113 40.037 -2.924 18112 7073 1 9 . 1 1 161 161 ILE H H 161 8.448 8.448 7.239 1.208 18112 7074 1 9 . 1 1 162 162 PHE N N 162 117.594 117.594 127.042 -9.448 18112 7075 1 9 . 1 1 162 162 PHE C C 162 176.115 176.115 176.573 -0.458 18112 7076 1 9 . 1 1 162 162 PHE CA C 162 61.009 61.009 59.519 1.490 18112 7077 1 9 . 1 1 162 162 PHE CB C 162 38.394 38.394 38.950 -0.556 18112 7078 1 9 . 1 1 162 162 PHE H H 162 8.145 8.145 9.019 -0.874 18112 7079 1 9 . 1 1 163 163 LYS N N 163 116.083 116.083 119.330 -3.247 18112 7080 1 9 . 1 1 163 163 LYS C C 163 178.196 178.196 176.435 1.761 18112 7081 1 9 . 1 1 163 163 LYS CA C 163 58.136 58.136 57.729 0.407 18112 7082 1 9 . 1 1 163 163 LYS CB C 163 31.694 31.694 32.625 -0.931 18112 7083 1 9 . 1 1 163 163 LYS H H 163 8.232 8.232 8.147 0.085 18112 7084 1 9 . 1 1 164 164 SER N N 164 113.680 113.680 112.740 0.940 18112 7085 1 9 . 1 1 164 164 SER CA C 164 55.205 55.205 56.442 -1.237 18112 7086 1 9 . 1 1 164 164 SER CB C 164 63.265 63.265 64.678 -1.413 18112 7087 1 9 . 1 1 164 164 SER H H 164 7.708 7.708 7.586 0.122 18112 7088 1 9 . 1 1 165 165 PRO HA H 165 4.580 4.580 4.285 0.295 18112 7089 1 9 . 1 1 165 165 PRO C C 165 177.541 177.541 176.509 1.032 18112 7090 1 9 . 1 1 165 165 PRO CA C 165 63.950 63.950 64.030 -0.080 18112 7091 1 9 . 1 1 165 165 PRO CB C 165 30.686 30.686 31.029 -0.342 18112 7092 1 9 . 1 1 166 166 ASN N N 166 116.304 116.304 118.676 -2.372 18112 7093 1 9 . 1 1 166 166 ASN HA H 166 5.029 5.029 4.316 0.713 18112 7094 1 9 . 1 1 166 166 ASN C C 166 175.811 175.811 176.213 -0.402 18112 7095 1 9 . 1 1 166 166 ASN CA C 166 51.962 51.962 54.631 -2.669 18112 7096 1 9 . 1 1 166 166 ASN CB C 166 37.915 37.915 38.105 -0.190 18112 7097 1 9 . 1 1 166 166 ASN H H 166 8.216 8.216 8.509 -0.293 18112 7098 1 9 . 1 1 167 167 CYS N N 167 116.078 116.078 119.494 -3.416 18112 7099 1 9 . 1 1 167 167 CYS HA H 167 4.011 4.011 4.245 -0.234 18112 7100 1 9 . 1 1 167 167 CYS C C 167 175.057 175.057 176.071 -1.014 18112 7101 1 9 . 1 1 167 167 CYS CA C 167 59.816 59.816 60.590 -0.774 18112 7102 1 9 . 1 1 167 167 CYS CB C 167 27.446 27.446 26.436 1.010 18112 7103 1 9 . 1 1 167 167 CYS H H 167 7.246 7.246 8.007 -0.761 18112 7104 1 9 . 1 1 168 168 LEU N N 168 120.082 120.082 120.565 -0.483 18112 7105 1 9 . 1 1 168 168 LEU HA H 168 3.880 3.880 4.189 -0.309 18112 7106 1 9 . 1 1 168 168 LEU C C 168 178.541 178.541 178.487 0.054 18112 7107 1 9 . 1 1 168 168 LEU CA C 168 57.734 57.734 56.426 1.308 18112 7108 1 9 . 1 1 168 168 LEU CB C 168 38.825 38.825 40.122 -1.297 18112 7109 1 9 . 1 1 168 168 LEU H H 168 8.451 8.451 8.061 0.390 18112 7110 1 9 . 1 1 169 169 GLN N N 169 116.700 116.700 120.227 -3.527 18112 7111 1 9 . 1 1 169 169 GLN HA H 169 4.064 4.064 3.977 0.087 18112 7112 1 9 . 1 1 169 169 GLN C C 169 177.378 177.378 178.047 -0.669 18112 7113 1 9 . 1 1 169 169 GLN CA C 169 57.675 57.675 58.645 -0.970 18112 7114 1 9 . 1 1 169 169 GLN CB C 169 27.710 27.710 28.308 -0.598 18112 7115 1 9 . 1 1 169 169 GLN H H 169 7.665 7.665 8.026 -0.361 18112 7116 1 9 . 1 1 170 170 GLU N N 170 116.701 116.701 120.565 -3.864 18112 7117 1 9 . 1 1 170 170 GLU HA H 170 4.214 4.214 4.198 0.016 18112 7118 1 9 . 1 1 170 170 GLU C C 170 177.730 177.730 178.089 -0.359 18112 7119 1 9 . 1 1 170 170 GLU CA C 170 56.899 56.899 58.749 -1.850 18112 7120 1 9 . 1 1 170 170 GLU H H 170 7.405 7.405 7.847 -0.442 18112 7121 1 9 . 1 1 171 171 LEU N N 171 118.021 118.021 114.209 3.812 18112 7122 1 9 . 1 1 171 171 LEU HA H 171 4.209 4.209 4.689 -0.480 18112 7123 1 9 . 1 1 171 171 LEU C C 171 177.005 177.005 176.373 0.632 18112 7124 1 9 . 1 1 171 171 LEU CA C 171 55.870 55.870 54.174 1.696 18112 7125 1 9 . 1 1 171 171 LEU CB C 171 43.680 43.680 42.721 0.959 18112 7126 1 9 . 1 1 171 171 LEU H H 171 7.823 7.823 7.441 0.382 18112 7127 1 9 . 1 1 172 172 LEU N N 172 117.580 117.580 122.921 -5.341 18112 7128 1 9 . 1 1 172 172 LEU HA H 172 4.571 4.571 4.505 0.066 18112 7129 1 9 . 1 1 172 172 LEU C C 172 176.411 176.411 175.613 0.798 18112 7130 1 9 . 1 1 172 172 LEU CA C 172 53.972 53.972 54.263 -0.291 18112 7131 1 9 . 1 1 172 172 LEU CB C 172 40.483 40.483 42.363 -1.880 18112 7132 1 9 . 1 1 172 172 LEU H H 172 7.306 7.306 7.362 -0.056 18112 7133 1 9 . 1 1 173 173 HIS N N 173 123.310 123.310 122.327 0.983 18112 7134 1 9 . 1 1 173 173 HIS C C 173 179.022 179.022 174.925 4.097 18112 7135 1 9 . 1 1 173 173 HIS CA C 173 56.693 56.693 54.680 2.013 18112 7136 1 9 . 1 1 173 173 HIS CB C 173 29.371 29.371 31.049 -1.678 18112 7137 1 9 . 1 1 173 173 HIS H H 173 8.028 8.028 8.466 -0.438 18112 7138 1 10 . 1 1 12 12 ALA N N 12 125.167 125.167 123.631 1.536 18112 7139 1 10 . 1 1 12 12 ALA C C 12 177.566 177.566 175.113 2.453 18112 7140 1 10 . 1 1 12 12 ALA CA C 12 52.067 52.067 52.494 -0.427 18112 7141 1 10 . 1 1 12 12 ALA CB C 12 18.456 18.456 21.336 -2.880 18112 7142 1 10 . 1 1 12 12 ALA H H 12 8.311 8.311 8.077 0.234 18112 7143 1 10 . 1 1 13 13 MET N N 13 119.278 119.278 113.786 5.492 18112 7144 1 10 . 1 1 13 13 MET C C 13 176.325 176.325 174.294 2.031 18112 7145 1 10 . 1 1 13 13 MET CA C 13 54.992 54.992 55.849 -0.857 18112 7146 1 10 . 1 1 13 13 MET CB C 13 32.308 32.308 33.141 -0.833 18112 7147 1 10 . 1 1 13 13 MET H H 13 8.269 8.269 8.182 0.087 18112 7148 1 10 . 1 1 14 14 GLN N N 14 120.869 120.869 122.035 -1.166 18112 7149 1 10 . 1 1 14 14 GLN HA H 14 4.399 4.399 4.522 -0.123 18112 7150 1 10 . 1 1 14 14 GLN C C 14 175.644 175.644 175.046 0.598 18112 7151 1 10 . 1 1 14 14 GLN CA C 14 55.139 55.139 55.287 -0.148 18112 7152 1 10 . 1 1 14 14 GLN CB C 14 29.051 29.051 29.639 -0.588 18112 7153 1 10 . 1 1 14 14 GLN H H 14 8.501 8.501 8.043 0.458 18112 7154 1 10 . 1 1 15 15 GLU N N 15 122.042 122.042 122.152 -0.110 18112 7155 1 10 . 1 1 15 15 GLU C C 15 176.242 176.242 175.451 0.791 18112 7156 1 10 . 1 1 15 15 GLU CA C 15 56.064 56.064 55.099 0.965 18112 7157 1 10 . 1 1 15 15 GLU CB C 15 29.302 29.302 31.144 -1.842 18112 7158 1 10 . 1 1 15 15 GLU H H 15 8.547 8.547 8.366 0.181 18112 7159 1 10 . 1 1 16 16 GLY N N 16 108.821 108.821 109.496 -0.675 18112 7160 1 10 . 1 1 16 16 GLY C C 16 172.949 172.949 173.885 -0.936 18112 7161 1 10 . 1 1 16 16 GLY CA C 16 44.227 44.227 45.082 -0.855 18112 7162 1 10 . 1 1 16 16 GLY H H 16 8.100 8.100 8.472 -0.372 18112 7163 1 10 . 1 1 17 17 LEU N N 17 120.315 120.315 122.287 -1.972 18112 7164 1 10 . 1 1 17 17 LEU C C 17 177.334 177.334 177.084 0.250 18112 7165 1 10 . 1 1 17 17 LEU CA C 17 53.544 53.544 54.676 -1.133 18112 7166 1 10 . 1 1 17 17 LEU CB C 17 42.140 42.140 42.514 -0.374 18112 7167 1 10 . 1 1 17 17 LEU H H 17 8.222 8.222 7.641 0.581 18112 7168 1 10 . 1 1 18 18 SER N N 18 126.547 126.547 120.865 5.682 18112 7169 1 10 . 1 1 18 18 SER CA C 18 56.851 56.851 57.026 -0.175 18112 7170 1 10 . 1 1 18 18 SER CB C 18 64.636 64.636 63.145 1.491 18112 7171 1 10 . 1 1 18 18 SER H H 18 11.627 11.627 8.511 3.116 18112 7172 1 10 . 1 1 19 19 PRO C C 19 175.118 175.118 176.596 -1.478 18112 7173 1 10 . 1 1 20 20 ASN N N 20 121.372 121.372 116.681 4.691 18112 7174 1 10 . 1 1 20 20 ASN H H 20 8.172 8.172 8.672 -0.500 18112 7175 1 10 . 1 1 25 25 ALA CB C 25 18.020 18.020 18.598 -0.578 18112 7176 1 10 . 1 1 26 26 LYS N N 26 118.490 118.490 119.025 -0.535 18112 7177 1 10 . 1 1 26 26 LYS CA C 26 56.146 56.146 58.720 -2.574 18112 7178 1 10 . 1 1 26 26 LYS H H 26 6.794 6.794 7.573 -0.779 18112 7179 1 10 . 1 1 31 31 TYR HA H 31 4.398 4.398 4.678 -0.280 18112 7180 1 10 . 1 1 31 31 TYR C C 31 173.714 173.714 176.575 -2.861 18112 7181 1 10 . 1 1 31 31 TYR CA C 31 59.757 59.757 57.177 2.580 18112 7182 1 10 . 1 1 32 32 THR N N 32 111.928 111.928 112.322 -0.394 18112 7183 1 10 . 1 1 32 32 THR HA H 32 4.209 4.209 3.822 0.387 18112 7184 1 10 . 1 1 32 32 THR C C 32 171.061 171.061 175.009 -3.948 18112 7185 1 10 . 1 1 32 32 THR CA C 32 56.905 56.905 65.520 -8.615 18112 7186 1 10 . 1 1 32 32 THR CB C 32 69.707 69.707 68.305 1.402 18112 7187 1 10 . 1 1 32 32 THR H H 32 8.237 8.237 9.091 -0.854 18112 7188 1 10 . 1 1 33 33 ARG N N 33 124.856 124.856 115.537 9.319 18112 7189 1 10 . 1 1 33 33 ARG C C 33 176.451 176.451 174.564 1.887 18112 7190 1 10 . 1 1 33 33 ARG CA C 33 55.627 55.627 56.620 -0.993 18112 7191 1 10 . 1 1 33 33 ARG CB C 33 29.861 29.861 28.201 1.660 18112 7192 1 10 . 1 1 33 33 ARG H H 33 9.159 9.159 7.960 1.199 18112 7193 1 10 . 1 1 34 34 TYR N N 34 117.908 117.908 117.975 -0.067 18112 7194 1 10 . 1 1 34 34 TYR CA C 34 55.320 55.320 55.938 -0.618 18112 7195 1 10 . 1 1 34 34 TYR H H 34 8.995 8.995 7.664 1.331 18112 7196 1 10 . 1 1 35 35 PRO C C 35 177.280 177.280 177.736 -0.456 18112 7197 1 10 . 1 1 36 36 SER N N 36 116.410 116.410 120.116 -3.706 18112 7198 1 10 . 1 1 36 36 SER C C 36 178.938 178.938 176.055 2.883 18112 7199 1 10 . 1 1 36 36 SER CA C 36 64.815 64.815 61.292 3.523 18112 7200 1 10 . 1 1 36 36 SER H H 36 8.106 8.106 8.737 -0.631 18112 7201 1 10 . 1 1 37 37 SER N N 37 117.488 117.488 117.328 0.160 18112 7202 1 10 . 1 1 37 37 SER C C 37 177.698 177.698 176.419 1.279 18112 7203 1 10 . 1 1 37 37 SER CA C 37 61.357 61.357 61.499 -0.142 18112 7204 1 10 . 1 1 37 37 SER CB C 37 68.118 68.118 62.856 5.262 18112 7205 1 10 . 1 1 37 37 SER H H 37 8.169 8.169 8.264 -0.095 18112 7206 1 10 . 1 1 38 38 ASN N N 38 115.638 115.638 119.602 -3.964 18112 7207 1 10 . 1 1 38 38 ASN HA H 38 4.259 4.259 4.280 -0.021 18112 7208 1 10 . 1 1 38 38 ASN C C 38 177.868 177.868 177.523 0.345 18112 7209 1 10 . 1 1 38 38 ASN CA C 38 55.907 55.907 56.167 -0.260 18112 7210 1 10 . 1 1 38 38 ASN CB C 38 37.230 37.230 38.280 -1.050 18112 7211 1 10 . 1 1 38 38 ASN H H 38 8.284 8.284 7.787 0.497 18112 7212 1 10 . 1 1 39 39 MET N N 39 121.352 121.352 118.328 3.024 18112 7213 1 10 . 1 1 39 39 MET HA H 39 4.170 4.170 3.681 0.489 18112 7214 1 10 . 1 1 39 39 MET C C 39 179.068 179.068 178.427 0.641 18112 7215 1 10 . 1 1 39 39 MET CA C 39 58.751 58.751 58.235 0.516 18112 7216 1 10 . 1 1 39 39 MET CB C 39 31.850 31.850 32.327 -0.477 18112 7217 1 10 . 1 1 39 39 MET H H 39 7.857 7.857 7.431 0.426 18112 7218 1 10 . 1 1 40 40 LEU N N 40 118.936 118.936 122.827 -3.891 18112 7219 1 10 . 1 1 40 40 LEU HA H 40 4.139 4.139 4.072 0.067 18112 7220 1 10 . 1 1 40 40 LEU C C 40 178.700 178.700 178.281 0.419 18112 7221 1 10 . 1 1 40 40 LEU CA C 40 58.455 58.455 58.480 -0.025 18112 7222 1 10 . 1 1 40 40 LEU CB C 40 40.304 40.304 41.209 -0.905 18112 7223 1 10 . 1 1 40 40 LEU H H 40 8.167 8.167 8.325 -0.158 18112 7224 1 10 . 1 1 41 41 LYS N N 41 116.791 116.791 118.260 -1.469 18112 7225 1 10 . 1 1 41 41 LYS HA H 41 3.475 3.475 3.901 -0.426 18112 7226 1 10 . 1 1 41 41 LYS C C 41 178.793 178.793 178.844 -0.051 18112 7227 1 10 . 1 1 41 41 LYS CA C 41 59.161 59.161 59.659 -0.498 18112 7228 1 10 . 1 1 41 41 LYS CB C 41 30.992 30.992 32.463 -1.471 18112 7229 1 10 . 1 1 41 41 LYS H H 41 7.632 7.632 7.789 -0.157 18112 7230 1 10 . 1 1 42 42 THR N N 42 112.819 112.819 113.632 -0.813 18112 7231 1 10 . 1 1 42 42 THR HA H 42 4.230 4.230 4.095 0.135 18112 7232 1 10 . 1 1 42 42 THR C C 42 176.142 176.142 177.015 -0.873 18112 7233 1 10 . 1 1 42 42 THR CA C 42 65.107 65.107 66.129 -1.022 18112 7234 1 10 . 1 1 42 42 THR CB C 42 68.306 68.306 68.696 -0.390 18112 7235 1 10 . 1 1 42 42 THR H H 42 7.469 7.469 7.956 -0.487 18112 7236 1 10 . 1 1 43 43 TYR N N 43 118.565 118.565 118.321 0.244 18112 7237 1 10 . 1 1 43 43 TYR HA H 43 4.204 4.204 4.529 -0.325 18112 7238 1 10 . 1 1 43 43 TYR C C 43 174.240 174.240 177.426 -3.186 18112 7239 1 10 . 1 1 43 43 TYR CA C 43 60.886 60.886 57.380 3.506 18112 7240 1 10 . 1 1 43 43 TYR CB C 43 38.165 38.165 38.761 -0.596 18112 7241 1 10 . 1 1 43 43 TYR H H 43 7.978 7.978 7.641 0.337 18112 7242 1 10 . 1 1 44 44 PHE N N 44 120.980 120.980 119.889 1.091 18112 7243 1 10 . 1 1 44 44 PHE HA H 44 4.920 4.920 5.087 -0.167 18112 7244 1 10 . 1 1 44 44 PHE C C 44 176.436 176.436 176.693 -0.257 18112 7245 1 10 . 1 1 44 44 PHE CA C 44 56.672 56.672 56.310 0.361 18112 7246 1 10 . 1 1 44 44 PHE CB C 44 36.570 36.570 36.590 -0.020 18112 7247 1 10 . 1 1 44 44 PHE H H 44 7.955 7.955 8.329 -0.374 18112 7248 1 10 . 1 1 45 45 SER N N 45 113.407 113.407 116.877 -3.470 18112 7249 1 10 . 1 1 45 45 SER HA H 45 4.373 4.373 4.286 0.087 18112 7250 1 10 . 1 1 45 45 SER C C 45 174.424 174.424 175.276 -0.852 18112 7251 1 10 . 1 1 45 45 SER CA C 45 61.037 61.037 60.799 0.238 18112 7252 1 10 . 1 1 45 45 SER CB C 45 62.711 62.711 63.413 -0.702 18112 7253 1 10 . 1 1 45 45 SER H H 45 7.932 7.932 7.862 0.070 18112 7254 1 10 . 1 1 46 46 ASP N N 46 118.099 118.099 117.223 0.876 18112 7255 1 10 . 1 1 46 46 ASP HA H 46 4.572 4.572 4.548 0.024 18112 7256 1 10 . 1 1 46 46 ASP C C 46 174.866 174.866 176.301 -1.435 18112 7257 1 10 . 1 1 46 46 ASP CA C 46 53.602 53.602 54.595 -0.993 18112 7258 1 10 . 1 1 46 46 ASP CB C 46 38.992 38.992 40.936 -1.944 18112 7259 1 10 . 1 1 46 46 ASP H H 46 9.889 9.889 8.601 1.288 18112 7260 1 10 . 1 1 47 47 VAL N N 47 121.496 121.496 122.055 -0.559 18112 7261 1 10 . 1 1 47 47 VAL HA H 47 4.058 4.058 4.110 -0.052 18112 7262 1 10 . 1 1 47 47 VAL C C 47 174.676 174.676 174.727 -0.051 18112 7263 1 10 . 1 1 47 47 VAL CA C 47 61.006 61.006 60.542 0.464 18112 7264 1 10 . 1 1 47 47 VAL CB C 47 32.110 32.110 31.294 0.816 18112 7265 1 10 . 1 1 47 47 VAL H H 47 7.781 7.781 7.553 0.228 18112 7266 1 10 . 1 1 48 48 LYS N N 48 126.100 126.100 129.394 -3.294 18112 7267 1 10 . 1 1 48 48 LYS HA H 48 4.402 4.402 4.001 0.401 18112 7268 1 10 . 1 1 48 48 LYS C C 48 175.564 175.564 175.826 -0.262 18112 7269 1 10 . 1 1 48 48 LYS CA C 48 54.874 54.874 55.769 -0.895 18112 7270 1 10 . 1 1 48 48 LYS CB C 48 30.189 30.189 30.929 -0.740 18112 7271 1 10 . 1 1 48 48 LYS H H 48 8.245 8.245 8.555 -0.310 18112 7272 1 10 . 1 1 49 49 PHE N N 49 125.341 125.341 123.053 2.288 18112 7273 1 10 . 1 1 49 49 PHE HA H 49 3.813 3.813 4.303 -0.490 18112 7274 1 10 . 1 1 49 49 PHE C C 49 175.708 175.708 176.218 -0.510 18112 7275 1 10 . 1 1 49 49 PHE CA C 49 60.861 60.861 58.489 2.372 18112 7276 1 10 . 1 1 49 49 PHE CB C 49 38.616 38.616 37.390 1.226 18112 7277 1 10 . 1 1 49 49 PHE H H 49 8.626 8.626 7.563 1.063 18112 7278 1 10 . 1 1 50 50 ASN N N 50 115.408 115.408 122.583 -7.175 18112 7279 1 10 . 1 1 50 50 ASN C C 50 176.072 176.072 175.487 0.585 18112 7280 1 10 . 1 1 50 50 ASN CA C 50 51.730 51.730 51.856 -0.126 18112 7281 1 10 . 1 1 50 50 ASN H H 50 7.030 7.030 7.939 -0.909 18112 7282 1 10 . 1 1 51 51 ARG N N 51 122.706 122.706 123.978 -1.272 18112 7283 1 10 . 1 1 51 51 ARG CA C 51 59.534 59.534 59.017 0.517 18112 7284 1 10 . 1 1 51 51 ARG H H 51 7.790 7.790 9.040 -1.250 18112 7285 1 10 . 1 1 52 52 CYS N N 52 117.340 117.340 115.326 2.014 18112 7286 1 10 . 1 1 52 52 CYS HA H 52 4.108 4.108 4.703 -0.595 18112 7287 1 10 . 1 1 52 52 CYS C C 52 178.200 178.200 177.257 0.943 18112 7288 1 10 . 1 1 52 52 CYS CA C 52 61.143 61.143 60.520 0.623 18112 7289 1 10 . 1 1 52 52 CYS H H 52 7.681 7.681 8.092 -0.411 18112 7290 1 10 . 1 1 53 53 ILE N N 53 122.321 122.321 119.319 3.002 18112 7291 1 10 . 1 1 53 53 ILE HA H 53 3.588 3.588 3.776 -0.188 18112 7292 1 10 . 1 1 53 53 ILE C C 53 177.492 177.492 177.223 0.269 18112 7293 1 10 . 1 1 53 53 ILE CA C 53 64.109 64.109 63.895 0.214 18112 7294 1 10 . 1 1 53 53 ILE CB C 53 37.603 37.603 37.255 0.348 18112 7295 1 10 . 1 1 53 53 ILE H H 53 8.035 8.035 7.446 0.589 18112 7296 1 10 . 1 1 54 54 THR C C 54 175.903 175.903 176.517 -0.614 18112 7297 1 10 . 1 1 54 54 THR CA C 54 67.308 67.308 67.621 -0.312 18112 7298 1 10 . 1 1 55 55 SER N N 55 113.819 113.819 117.502 -3.683 18112 7299 1 10 . 1 1 55 55 SER H H 55 7.844 7.844 7.914 -0.070 18112 7300 1 10 . 1 1 56 56 GLN C C 56 179.792 179.792 177.768 2.024 18112 7301 1 10 . 1 1 57 57 LEU N N 57 116.701 116.701 121.346 -4.645 18112 7302 1 10 . 1 1 57 57 LEU HA H 57 4.519 4.519 3.439 1.080 18112 7303 1 10 . 1 1 57 57 LEU C C 57 178.775 178.775 178.645 0.130 18112 7304 1 10 . 1 1 57 57 LEU CA C 57 55.232 55.232 57.707 -2.475 18112 7305 1 10 . 1 1 57 57 LEU CB C 57 37.131 37.131 41.907 -4.776 18112 7306 1 10 . 1 1 57 57 LEU H H 57 8.267 8.267 7.550 0.717 18112 7307 1 10 . 1 1 58 58 ILE N N 58 122.522 122.522 117.823 4.699 18112 7308 1 10 . 1 1 58 58 ILE HA H 58 4.640 4.640 3.792 0.848 18112 7309 1 10 . 1 1 58 58 ILE C C 58 177.380 177.380 178.349 -0.969 18112 7310 1 10 . 1 1 58 58 ILE CA C 58 62.163 62.163 63.458 -1.295 18112 7311 1 10 . 1 1 58 58 ILE CB C 58 30.657 30.657 36.334 -5.677 18112 7312 1 10 . 1 1 58 58 ILE H H 58 8.111 8.111 8.128 -0.017 18112 7313 1 10 . 1 1 59 59 LYS N N 59 121.002 121.002 121.726 -0.724 18112 7314 1 10 . 1 1 59 59 LYS C C 59 177.600 177.600 178.860 -1.260 18112 7315 1 10 . 1 1 59 59 LYS CA C 59 57.570 57.570 58.647 -1.077 18112 7316 1 10 . 1 1 59 59 LYS CB C 59 39.101 39.101 31.766 7.335 18112 7317 1 10 . 1 1 59 59 LYS H H 59 7.432 7.432 7.706 -0.274 18112 7318 1 10 . 1 1 60 60 TRP N N 60 118.679 118.679 119.637 -0.958 18112 7319 1 10 . 1 1 60 60 TRP HA H 60 3.739 3.739 3.969 -0.230 18112 7320 1 10 . 1 1 60 60 TRP C C 60 178.246 178.246 178.739 -0.493 18112 7321 1 10 . 1 1 60 60 TRP CA C 60 59.818 59.818 58.113 1.705 18112 7322 1 10 . 1 1 60 60 TRP CB C 60 31.851 31.851 28.059 3.792 18112 7323 1 10 . 1 1 60 60 TRP H H 60 7.565 7.565 7.726 -0.161 18112 7324 1 10 . 1 1 61 61 PHE N N 61 118.005 118.005 116.186 1.819 18112 7325 1 10 . 1 1 61 61 PHE HA H 61 3.882 3.882 3.926 -0.044 18112 7326 1 10 . 1 1 61 61 PHE CA C 61 60.054 60.054 62.048 -1.994 18112 7327 1 10 . 1 1 61 61 PHE H H 61 7.819 7.819 8.612 -0.793 18112 7328 1 10 . 1 1 62 62 SER N N 62 121.144 121.144 115.105 6.039 18112 7329 1 10 . 1 1 62 62 SER C C 62 177.840 177.840 176.610 1.230 18112 7330 1 10 . 1 1 62 62 SER CA C 62 55.892 55.892 60.868 -4.976 18112 7331 1 10 . 1 1 62 62 SER H H 62 8.878 8.878 8.193 0.685 18112 7332 1 10 . 1 1 63 63 ASN N N 63 115.303 115.303 121.136 -5.833 18112 7333 1 10 . 1 1 63 63 ASN C C 63 177.222 177.222 176.837 0.385 18112 7334 1 10 . 1 1 63 63 ASN CA C 63 60.467 60.467 56.225 4.242 18112 7335 1 10 . 1 1 63 63 ASN H H 63 8.001 8.001 7.767 0.234 18112 7336 1 10 . 1 1 64 64 PHE N N 64 112.571 112.571 117.750 -5.179 18112 7337 1 10 . 1 1 64 64 PHE CA C 64 56.453 56.453 60.544 -4.091 18112 7338 1 10 . 1 1 64 64 PHE H H 64 7.082 7.082 7.348 -0.266 18112 7339 1 10 . 1 1 65 65 ARG N N 65 116.695 116.695 119.588 -2.893 18112 7340 1 10 . 1 1 65 65 ARG CA C 65 59.590 59.590 59.478 0.112 18112 7341 1 10 . 1 1 65 65 ARG H H 65 8.091 8.091 8.077 0.014 18112 7342 1 10 . 1 1 66 66 GLU N N 66 121.653 121.653 118.626 3.027 18112 7343 1 10 . 1 1 66 66 GLU HA H 66 4.739 4.739 4.255 0.484 18112 7344 1 10 . 1 1 66 66 GLU C C 66 174.621 174.621 179.218 -4.597 18112 7345 1 10 . 1 1 66 66 GLU CA C 66 59.583 59.583 59.252 0.331 18112 7346 1 10 . 1 1 66 66 GLU H H 66 7.597 7.597 7.953 -0.356 18112 7347 1 10 . 1 1 67 67 PHE N N 67 111.578 111.578 119.738 -8.160 18112 7348 1 10 . 1 1 67 67 PHE C C 67 176.164 176.164 178.291 -2.127 18112 7349 1 10 . 1 1 67 67 PHE CA C 67 61.156 61.156 59.162 1.994 18112 7350 1 10 . 1 1 67 67 PHE H H 67 7.067 7.067 8.494 -1.427 18112 7351 1 10 . 1 1 68 68 TYR N N 68 119.370 119.370 119.961 -0.591 18112 7352 1 10 . 1 1 68 68 TYR C C 68 176.844 176.844 178.575 -1.731 18112 7353 1 10 . 1 1 68 68 TYR CA C 68 61.758 61.758 62.210 -0.452 18112 7354 1 10 . 1 1 68 68 TYR H H 68 7.442 7.442 8.765 -1.323 18112 7355 1 10 . 1 1 69 69 TYR N N 69 116.047 116.047 120.998 -4.951 18112 7356 1 10 . 1 1 69 69 TYR HA H 69 4.086 4.086 4.169 -0.083 18112 7357 1 10 . 1 1 69 69 TYR C C 69 180.328 180.328 177.725 2.603 18112 7358 1 10 . 1 1 69 69 TYR CA C 69 61.528 61.528 62.214 -0.686 18112 7359 1 10 . 1 1 69 69 TYR H H 69 9.127 9.127 8.547 0.580 18112 7360 1 10 . 1 1 70 70 ILE N N 70 124.738 124.738 117.985 6.753 18112 7361 1 10 . 1 1 70 70 ILE HA H 70 3.828 3.828 3.834 -0.006 18112 7362 1 10 . 1 1 70 70 ILE C C 70 179.585 179.585 178.592 0.993 18112 7363 1 10 . 1 1 70 70 ILE CA C 70 65.787 65.787 63.731 2.056 18112 7364 1 10 . 1 1 70 70 ILE CB C 70 36.435 36.435 36.754 -0.319 18112 7365 1 10 . 1 1 70 70 ILE H H 70 8.631 8.631 8.355 0.276 18112 7366 1 10 . 1 1 71 71 GLN N N 71 117.940 117.940 118.968 -1.028 18112 7367 1 10 . 1 1 71 71 GLN HA H 71 3.826 3.826 3.609 0.217 18112 7368 1 10 . 1 1 71 71 GLN C C 71 178.192 178.192 178.213 -0.021 18112 7369 1 10 . 1 1 71 71 GLN CA C 71 57.779 57.779 58.407 -0.628 18112 7370 1 10 . 1 1 71 71 GLN H H 71 7.738 7.738 8.144 -0.406 18112 7371 1 10 . 1 1 72 72 MET N N 72 117.353 117.353 118.369 -1.016 18112 7372 1 10 . 1 1 72 72 MET HA H 72 4.112 4.112 4.103 0.009 18112 7373 1 10 . 1 1 72 72 MET C C 72 177.203 177.203 178.167 -0.964 18112 7374 1 10 . 1 1 72 72 MET CA C 72 57.272 57.272 57.383 -0.111 18112 7375 1 10 . 1 1 72 72 MET H H 72 7.844 7.844 7.981 -0.137 18112 7376 1 10 . 1 1 73 73 GLU N N 73 117.858 117.858 120.074 -2.216 18112 7377 1 10 . 1 1 73 73 GLU HA H 73 3.572 3.572 3.709 -0.137 18112 7378 1 10 . 1 1 73 73 GLU C C 73 177.344 177.344 178.524 -1.180 18112 7379 1 10 . 1 1 73 73 GLU CA C 73 60.324 60.324 59.679 0.645 18112 7380 1 10 . 1 1 73 73 GLU H H 73 7.503 7.503 7.760 -0.257 18112 7381 1 10 . 1 1 74 74 LYS N N 74 118.716 118.716 119.866 -1.150 18112 7382 1 10 . 1 1 74 74 LYS HA H 74 3.867 3.867 4.016 -0.149 18112 7383 1 10 . 1 1 74 74 LYS C C 74 180.077 180.077 179.297 0.780 18112 7384 1 10 . 1 1 74 74 LYS CA C 74 59.754 59.754 58.893 0.861 18112 7385 1 10 . 1 1 74 74 LYS H H 74 7.912 7.912 7.627 0.285 18112 7386 1 10 . 1 1 75 75 TYR N N 75 117.309 117.309 118.840 -1.531 18112 7387 1 10 . 1 1 75 75 TYR HA H 75 4.085 4.085 4.231 -0.146 18112 7388 1 10 . 1 1 75 75 TYR C C 75 178.874 178.874 178.254 0.620 18112 7389 1 10 . 1 1 75 75 TYR CA C 75 63.306 63.306 59.353 3.953 18112 7390 1 10 . 1 1 75 75 TYR H H 75 8.421 8.421 8.198 0.223 18112 7391 1 10 . 1 1 76 76 ALA N N 76 125.392 125.392 121.608 3.784 18112 7392 1 10 . 1 1 76 76 ALA HA H 76 4.221 4.221 3.525 0.696 18112 7393 1 10 . 1 1 76 76 ALA C C 76 178.850 178.850 179.450 -0.600 18112 7394 1 10 . 1 1 76 76 ALA CA C 76 56.280 56.280 55.117 1.163 18112 7395 1 10 . 1 1 76 76 ALA CB C 76 18.687 18.687 18.486 0.201 18112 7396 1 10 . 1 1 76 76 ALA H H 76 8.553 8.553 8.371 0.182 18112 7397 1 10 . 1 1 77 77 ARG N N 77 115.067 115.067 118.263 -3.196 18112 7398 1 10 . 1 1 77 77 ARG HA H 77 3.935 3.935 3.827 0.108 18112 7399 1 10 . 1 1 77 77 ARG C C 77 179.341 179.341 178.724 0.617 18112 7400 1 10 . 1 1 77 77 ARG CA C 77 60.499 60.499 59.993 0.506 18112 7401 1 10 . 1 1 77 77 ARG H H 77 8.471 8.471 8.161 0.310 18112 7402 1 10 . 1 1 78 78 GLN N N 78 120.107 120.107 119.277 0.830 18112 7403 1 10 . 1 1 78 78 GLN HA H 78 3.921 3.921 4.009 -0.088 18112 7404 1 10 . 1 1 78 78 GLN C C 78 177.289 177.289 178.106 -0.817 18112 7405 1 10 . 1 1 78 78 GLN CA C 78 58.619 58.619 58.734 -0.115 18112 7406 1 10 . 1 1 78 78 GLN CB C 78 27.752 27.752 28.648 -0.896 18112 7407 1 10 . 1 1 78 78 GLN H H 78 8.142 8.142 8.077 0.065 18112 7408 1 10 . 1 1 79 79 ALA N N 79 120.809 120.809 122.586 -1.777 18112 7409 1 10 . 1 1 79 79 ALA HA H 79 4.308 4.308 3.918 0.390 18112 7410 1 10 . 1 1 79 79 ALA C C 79 179.924 179.924 179.548 0.376 18112 7411 1 10 . 1 1 79 79 ALA CA C 79 54.970 54.970 55.044 -0.074 18112 7412 1 10 . 1 1 79 79 ALA CB C 79 17.064 17.064 18.027 -0.963 18112 7413 1 10 . 1 1 79 79 ALA H H 79 7.811 7.811 7.829 -0.018 18112 7414 1 10 . 1 1 80 80 ILE N N 80 118.524 118.524 118.504 0.020 18112 7415 1 10 . 1 1 80 80 ILE HA H 80 3.894 3.894 3.683 0.211 18112 7416 1 10 . 1 1 80 80 ILE C C 80 181.268 181.268 178.150 3.118 18112 7417 1 10 . 1 1 80 80 ILE CA C 80 64.841 64.841 64.036 0.805 18112 7418 1 10 . 1 1 80 80 ILE CB C 80 37.125 37.125 37.730 -0.605 18112 7419 1 10 . 1 1 80 80 ILE H H 80 7.837 7.837 7.834 0.003 18112 7420 1 10 . 1 1 81 81 ASN N N 81 121.233 121.233 116.863 4.370 18112 7421 1 10 . 1 1 81 81 ASN HA H 81 4.398 4.398 4.426 -0.028 18112 7422 1 10 . 1 1 81 81 ASN C C 81 176.546 176.546 176.657 -0.111 18112 7423 1 10 . 1 1 81 81 ASN CA C 81 55.892 55.892 55.366 0.526 18112 7424 1 10 . 1 1 81 81 ASN CB C 81 37.603 37.603 38.683 -1.080 18112 7425 1 10 . 1 1 81 81 ASN H H 81 8.262 8.262 7.944 0.318 18112 7426 1 10 . 1 1 82 82 ASP N N 82 119.240 119.240 116.782 2.458 18112 7427 1 10 . 1 1 82 82 ASP HA H 82 4.666 4.666 4.702 -0.036 18112 7428 1 10 . 1 1 82 82 ASP C C 82 176.767 176.767 177.177 -0.410 18112 7429 1 10 . 1 1 82 82 ASP CA C 82 54.771 54.771 54.276 0.495 18112 7430 1 10 . 1 1 82 82 ASP CB C 82 40.121 40.121 42.130 -2.009 18112 7431 1 10 . 1 1 82 82 ASP H H 82 8.316 8.316 7.890 0.426 18112 7432 1 10 . 1 1 83 83 GLY N N 83 106.913 106.913 106.974 -0.061 18112 7433 1 10 . 1 1 83 83 GLY C C 83 174.601 174.601 173.963 0.638 18112 7434 1 10 . 1 1 83 83 GLY CA C 83 45.214 45.214 44.822 0.392 18112 7435 1 10 . 1 1 83 83 GLY H H 83 7.810 7.810 8.128 -0.318 18112 7436 1 10 . 1 1 84 84 VAL N N 84 122.981 122.981 123.302 -0.321 18112 7437 1 10 . 1 1 84 84 VAL HA H 84 3.850 3.850 4.062 -0.212 18112 7438 1 10 . 1 1 84 84 VAL C C 84 177.265 177.265 175.412 1.853 18112 7439 1 10 . 1 1 84 84 VAL CA C 84 64.270 64.270 63.143 1.127 18112 7440 1 10 . 1 1 84 84 VAL CB C 84 30.471 30.471 31.382 -0.911 18112 7441 1 10 . 1 1 84 84 VAL H H 84 8.157 8.157 7.985 0.172 18112 7442 1 10 . 1 1 85 85 THR N N 85 115.232 115.232 115.902 -0.670 18112 7443 1 10 . 1 1 85 85 THR HA H 85 4.716 4.716 4.678 0.038 18112 7444 1 10 . 1 1 85 85 THR C C 85 174.489 174.489 174.440 0.049 18112 7445 1 10 . 1 1 85 85 THR CA C 85 61.618 61.618 61.352 0.266 18112 7446 1 10 . 1 1 85 85 THR CB C 85 70.081 70.081 70.209 -0.128 18112 7447 1 10 . 1 1 85 85 THR H H 85 8.890 8.890 8.531 0.359 18112 7448 1 10 . 1 1 86 86 SER N N 86 117.009 117.009 118.856 -1.847 18112 7449 1 10 . 1 1 86 86 SER HA H 86 5.046 5.046 4.835 0.211 18112 7450 1 10 . 1 1 86 86 SER C C 86 174.473 174.473 175.151 -0.678 18112 7451 1 10 . 1 1 86 86 SER CA C 86 55.922 55.922 57.642 -1.720 18112 7452 1 10 . 1 1 86 86 SER CB C 86 64.385 64.385 65.570 -1.185 18112 7453 1 10 . 1 1 86 86 SER H H 86 7.704 7.704 7.901 -0.197 18112 7454 1 10 . 1 1 87 87 THR N N 87 118.634 118.634 117.375 1.259 18112 7455 1 10 . 1 1 87 87 THR HA H 87 4.065 4.065 3.573 0.492 18112 7456 1 10 . 1 1 87 87 THR C C 87 176.047 176.047 175.623 0.424 18112 7457 1 10 . 1 1 87 87 THR CA C 87 64.983 64.983 64.363 0.620 18112 7458 1 10 . 1 1 87 87 THR CB C 87 68.045 68.045 68.281 -0.236 18112 7459 1 10 . 1 1 87 87 THR H H 87 8.711 8.711 8.671 0.040 18112 7460 1 10 . 1 1 88 88 GLU N N 88 117.889 117.889 119.671 -1.782 18112 7461 1 10 . 1 1 88 88 GLU HA H 88 3.881 3.881 4.165 -0.284 18112 7462 1 10 . 1 1 88 88 GLU C C 88 177.146 177.146 176.976 0.170 18112 7463 1 10 . 1 1 88 88 GLU CA C 88 57.814 57.814 57.640 0.174 18112 7464 1 10 . 1 1 88 88 GLU CB C 88 28.050 28.050 29.062 -1.012 18112 7465 1 10 . 1 1 88 88 GLU H H 88 8.152 8.152 8.379 -0.227 18112 7466 1 10 . 1 1 89 89 GLU N N 89 115.617 115.617 117.577 -1.960 18112 7467 1 10 . 1 1 89 89 GLU HA H 89 4.149 4.149 4.251 -0.102 18112 7468 1 10 . 1 1 89 89 GLU C C 89 176.192 176.192 176.083 0.109 18112 7469 1 10 . 1 1 89 89 GLU CA C 89 56.133 56.133 56.954 -0.821 18112 7470 1 10 . 1 1 89 89 GLU CB C 89 29.415 29.415 30.359 -0.944 18112 7471 1 10 . 1 1 89 89 GLU H H 89 7.311 7.311 7.778 -0.467 18112 7472 1 10 . 1 1 90 90 LEU N N 90 120.870 120.870 114.233 6.637 18112 7473 1 10 . 1 1 90 90 LEU HA H 90 4.439 4.439 4.710 -0.271 18112 7474 1 10 . 1 1 90 90 LEU C C 90 175.267 175.267 175.274 -0.007 18112 7475 1 10 . 1 1 90 90 LEU CA C 90 53.504 53.504 52.505 0.999 18112 7476 1 10 . 1 1 90 90 LEU CB C 90 40.479 40.479 42.848 -2.369 18112 7477 1 10 . 1 1 90 90 LEU H H 90 7.311 7.311 7.294 0.017 18112 7478 1 10 . 1 1 91 91 SER N N 91 118.376 118.376 116.941 1.435 18112 7479 1 10 . 1 1 91 91 SER HA H 91 4.747 4.747 4.339 0.408 18112 7480 1 10 . 1 1 91 91 SER C C 91 173.332 173.332 173.653 -0.321 18112 7481 1 10 . 1 1 91 91 SER CA C 91 56.314 56.314 59.563 -3.249 18112 7482 1 10 . 1 1 91 91 SER CB C 91 64.615 64.615 62.162 2.453 18112 7483 1 10 . 1 1 91 91 SER H H 91 8.221 8.221 8.072 0.148 18112 7484 1 10 . 1 1 92 92 ILE N N 92 122.247 122.247 122.519 -0.272 18112 7485 1 10 . 1 1 92 92 ILE HA H 92 4.537 4.537 4.297 0.240 18112 7486 1 10 . 1 1 92 92 ILE C C 92 174.059 174.059 175.137 -1.078 18112 7487 1 10 . 1 1 92 92 ILE CA C 92 59.881 59.881 59.351 0.530 18112 7488 1 10 . 1 1 92 92 ILE CB C 92 37.820 37.820 42.414 -4.594 18112 7489 1 10 . 1 1 92 92 ILE H H 92 8.570 8.570 7.575 0.995 18112 7490 1 10 . 1 1 93 93 THR N N 93 116.069 116.069 120.701 -4.632 18112 7491 1 10 . 1 1 93 93 THR HA H 93 4.580 4.580 4.196 0.384 18112 7492 1 10 . 1 1 93 93 THR C C 93 175.049 175.049 173.739 1.310 18112 7493 1 10 . 1 1 93 93 THR CA C 93 58.988 58.988 64.371 -5.383 18112 7494 1 10 . 1 1 93 93 THR CB C 93 71.362 71.362 67.990 3.372 18112 7495 1 10 . 1 1 93 93 THR H H 93 7.224 7.224 8.472 -1.248 18112 7496 1 10 . 1 1 94 94 ARG N N 94 116.595 116.595 123.860 -7.265 18112 7497 1 10 . 1 1 94 94 ARG HA H 94 3.077 3.077 4.474 -1.397 18112 7498 1 10 . 1 1 94 94 ARG C C 94 175.076 175.076 174.996 0.080 18112 7499 1 10 . 1 1 94 94 ARG CA C 94 57.119 57.119 54.403 2.716 18112 7500 1 10 . 1 1 94 94 ARG CB C 94 27.838 27.838 33.417 -5.579 18112 7501 1 10 . 1 1 94 94 ARG H H 94 8.596 8.596 8.290 0.306 18112 7502 1 10 . 1 1 95 95 ASP N N 95 113.735 113.735 123.511 -9.776 18112 7503 1 10 . 1 1 95 95 ASP HA H 95 4.765 4.765 3.464 1.301 18112 7504 1 10 . 1 1 95 95 ASP C C 95 175.876 175.876 174.697 1.179 18112 7505 1 10 . 1 1 95 95 ASP CA C 95 53.156 53.156 54.217 -1.061 18112 7506 1 10 . 1 1 95 95 ASP CB C 95 41.166 41.166 38.937 2.229 18112 7507 1 10 . 1 1 95 95 ASP H H 95 7.607 7.607 8.812 -1.205 18112 7508 1 10 . 1 1 96 96 CYS N N 96 116.012 116.012 118.008 -1.996 18112 7509 1 10 . 1 1 96 96 CYS C C 96 174.361 174.361 175.683 -1.322 18112 7510 1 10 . 1 1 96 96 CYS CA C 96 56.562 56.562 59.681 -3.119 18112 7511 1 10 . 1 1 96 96 CYS CB C 96 29.416 29.416 30.074 -0.658 18112 7512 1 10 . 1 1 96 96 CYS H H 96 7.094 7.094 8.164 -1.070 18112 7513 1 10 . 1 1 97 97 GLU N N 97 123.087 123.087 122.279 0.808 18112 7514 1 10 . 1 1 97 97 GLU C C 97 178.748 178.748 178.742 0.006 18112 7515 1 10 . 1 1 97 97 GLU CA C 97 59.912 59.912 59.563 0.349 18112 7516 1 10 . 1 1 97 97 GLU CB C 97 29.195 29.195 28.963 0.232 18112 7517 1 10 . 1 1 97 97 GLU H H 97 9.003 9.003 8.449 0.554 18112 7518 1 10 . 1 1 98 98 LEU N N 98 120.942 120.942 120.803 0.139 18112 7519 1 10 . 1 1 98 98 LEU HA H 98 3.614 3.614 4.124 -0.510 18112 7520 1 10 . 1 1 98 98 LEU C C 98 177.796 177.796 178.790 -0.994 18112 7521 1 10 . 1 1 98 98 LEU CA C 98 58.090 58.090 57.787 0.303 18112 7522 1 10 . 1 1 98 98 LEU CB C 98 39.778 39.778 41.761 -1.983 18112 7523 1 10 . 1 1 98 98 LEU H H 98 8.656 8.656 7.918 0.738 18112 7524 1 10 . 1 1 99 99 TYR N N 99 118.313 118.313 118.281 0.032 18112 7525 1 10 . 1 1 99 99 TYR C C 99 177.077 177.077 178.332 -1.255 18112 7526 1 10 . 1 1 99 99 TYR CA C 99 62.622 62.622 61.890 0.732 18112 7527 1 10 . 1 1 99 99 TYR CB C 99 38.742 38.742 37.696 1.046 18112 7528 1 10 . 1 1 99 99 TYR H H 99 7.522 7.522 8.144 -0.622 18112 7529 1 10 . 1 1 100 100 ARG N N 100 118.101 118.101 118.839 -0.738 18112 7530 1 10 . 1 1 100 100 ARG C C 100 178.616 178.616 178.749 -0.133 18112 7531 1 10 . 1 1 100 100 ARG CA C 100 59.915 59.915 59.468 0.447 18112 7532 1 10 . 1 1 100 100 ARG CB C 100 29.100 29.100 30.018 -0.918 18112 7533 1 10 . 1 1 100 100 ARG H H 100 8.243 8.243 8.660 -0.417 18112 7534 1 10 . 1 1 101 101 ALA N N 101 120.972 120.972 123.310 -2.338 18112 7535 1 10 . 1 1 101 101 ALA HA H 101 4.145 4.145 4.192 -0.047 18112 7536 1 10 . 1 1 101 101 ALA C C 101 181.359 181.359 179.428 1.931 18112 7537 1 10 . 1 1 101 101 ALA CA C 101 55.057 55.057 55.258 -0.201 18112 7538 1 10 . 1 1 101 101 ALA CB C 101 17.543 17.543 18.703 -1.160 18112 7539 1 10 . 1 1 101 101 ALA H H 101 8.352 8.352 8.108 0.244 18112 7540 1 10 . 1 1 102 102 LEU N N 102 115.683 115.683 117.068 -1.385 18112 7541 1 10 . 1 1 102 102 LEU HA H 102 4.333 4.333 4.227 0.106 18112 7542 1 10 . 1 1 102 102 LEU C C 102 178.583 178.583 179.282 -0.699 18112 7543 1 10 . 1 1 102 102 LEU CA C 102 57.634 57.634 57.248 0.386 18112 7544 1 10 . 1 1 102 102 LEU CB C 102 41.716 41.716 41.060 0.656 18112 7545 1 10 . 1 1 102 102 LEU H H 102 7.960 7.960 8.179 -0.219 18112 7546 1 10 . 1 1 103 103 ASN N N 103 118.957 118.957 120.039 -1.082 18112 7547 1 10 . 1 1 103 103 ASN C C 103 177.470 177.470 177.836 -0.366 18112 7548 1 10 . 1 1 103 103 ASN CA C 103 56.974 56.974 55.959 1.014 18112 7549 1 10 . 1 1 103 103 ASN CB C 103 38.140 38.140 38.580 -0.440 18112 7550 1 10 . 1 1 103 103 ASN H H 103 9.301 9.301 8.398 0.903 18112 7551 1 10 . 1 1 104 104 MET N N 104 113.763 113.763 118.881 -5.118 18112 7552 1 10 . 1 1 104 104 MET CA C 104 57.362 57.362 58.420 -1.058 18112 7553 1 10 . 1 1 104 104 MET CB C 104 31.895 31.895 32.811 -0.916 18112 7554 1 10 . 1 1 104 104 MET H H 104 8.332 8.332 8.098 0.234 18112 7555 1 10 . 1 1 105 105 HIS N N 105 116.024 116.024 116.840 -0.816 18112 7556 1 10 . 1 1 105 105 HIS HA H 105 3.764 3.764 4.392 -0.628 18112 7557 1 10 . 1 1 105 105 HIS C C 105 176.939 176.939 176.400 0.539 18112 7558 1 10 . 1 1 105 105 HIS CA C 105 59.069 59.069 59.124 -0.056 18112 7559 1 10 . 1 1 105 105 HIS H H 105 7.156 7.156 8.155 -0.999 18112 7560 1 10 . 1 1 106 106 TYR N N 106 113.161 113.161 116.719 -3.558 18112 7561 1 10 . 1 1 106 106 TYR C C 106 173.767 173.767 176.123 -2.356 18112 7562 1 10 . 1 1 106 106 TYR CA C 106 58.488 58.488 60.273 -1.784 18112 7563 1 10 . 1 1 106 106 TYR CB C 106 38.225 38.225 39.750 -1.525 18112 7564 1 10 . 1 1 106 106 TYR H H 106 7.204 7.204 8.385 -1.181 18112 7565 1 10 . 1 1 107 107 ASN N N 107 118.875 118.875 113.123 5.752 18112 7566 1 10 . 1 1 107 107 ASN HA H 107 3.922 3.922 4.907 -0.985 18112 7567 1 10 . 1 1 107 107 ASN C C 107 175.815 175.815 173.753 2.062 18112 7568 1 10 . 1 1 107 107 ASN CA C 107 51.233 51.233 52.957 -1.724 18112 7569 1 10 . 1 1 107 107 ASN CB C 107 38.142 38.142 40.069 -1.927 18112 7570 1 10 . 1 1 107 107 ASN H H 107 8.127 8.127 7.838 0.289 18112 7571 1 10 . 1 1 108 108 LYS N N 108 122.850 122.850 120.206 2.644 18112 7572 1 10 . 1 1 108 108 LYS HA H 108 3.954 3.954 4.597 -0.643 18112 7573 1 10 . 1 1 108 108 LYS C C 108 177.586 177.586 176.622 0.964 18112 7574 1 10 . 1 1 108 108 LYS CA C 108 59.749 59.749 57.016 2.733 18112 7575 1 10 . 1 1 108 108 LYS CB C 108 31.498 31.498 32.417 -0.919 18112 7576 1 10 . 1 1 108 108 LYS H H 108 7.772 7.772 8.622 -0.850 18112 7577 1 10 . 1 1 109 109 ALA N N 109 118.054 118.054 119.942 -1.888 18112 7578 1 10 . 1 1 109 109 ALA HA H 109 4.137 4.137 4.023 0.114 18112 7579 1 10 . 1 1 109 109 ALA C C 109 177.889 177.889 178.282 -0.393 18112 7580 1 10 . 1 1 109 109 ALA CA C 109 52.299 52.299 52.728 -0.429 18112 7581 1 10 . 1 1 109 109 ALA CB C 109 17.787 17.787 17.095 0.692 18112 7582 1 10 . 1 1 109 109 ALA H H 109 8.307 8.307 8.300 0.007 18112 7583 1 10 . 1 1 110 110 ASN N N 110 115.542 115.542 115.809 -0.267 18112 7584 1 10 . 1 1 110 110 ASN HA H 110 4.480 4.480 4.385 0.095 18112 7585 1 10 . 1 1 110 110 ASN C C 110 174.277 174.277 175.349 -1.072 18112 7586 1 10 . 1 1 110 110 ASN CA C 110 53.504 53.504 56.066 -2.562 18112 7587 1 10 . 1 1 110 110 ASN CB C 110 37.283 37.283 37.826 -0.543 18112 7588 1 10 . 1 1 110 110 ASN H H 110 8.353 8.353 8.582 -0.229 18112 7589 1 10 . 1 1 111 111 ASP N N 111 114.692 114.692 117.322 -2.630 18112 7590 1 10 . 1 1 111 111 ASP HA H 111 4.485 4.485 4.667 -0.182 18112 7591 1 10 . 1 1 111 111 ASP C C 111 174.868 174.868 175.617 -0.749 18112 7592 1 10 . 1 1 111 111 ASP CA C 111 53.227 53.227 54.061 -0.834 18112 7593 1 10 . 1 1 111 111 ASP CB C 111 39.228 39.228 41.349 -2.121 18112 7594 1 10 . 1 1 111 111 ASP H H 111 8.297 8.297 8.236 0.061 18112 7595 1 10 . 1 1 112 112 PHE N N 112 120.927 120.927 121.236 -0.309 18112 7596 1 10 . 1 1 112 112 PHE HA H 112 4.752 4.752 4.567 0.185 18112 7597 1 10 . 1 1 112 112 PHE C C 112 174.633 174.633 176.356 -1.723 18112 7598 1 10 . 1 1 112 112 PHE CA C 112 56.346 56.346 58.424 -2.078 18112 7599 1 10 . 1 1 112 112 PHE H H 112 7.784 7.784 8.230 -0.446 18112 7600 1 10 . 1 1 113 113 GLU N N 113 128.111 128.111 124.734 3.377 18112 7601 1 10 . 1 1 113 113 GLU HA H 113 4.011 4.011 4.490 -0.479 18112 7602 1 10 . 1 1 113 113 GLU C C 113 173.502 173.502 175.910 -2.408 18112 7603 1 10 . 1 1 113 113 GLU CA C 113 55.100 55.100 56.319 -1.219 18112 7604 1 10 . 1 1 113 113 GLU H H 113 7.752 7.752 8.778 -1.026 18112 7605 1 10 . 1 1 114 114 VAL N N 114 129.326 129.326 113.457 15.869 18112 7606 1 10 . 1 1 114 114 VAL HA H 114 3.241 3.241 3.725 -0.484 18112 7607 1 10 . 1 1 114 114 VAL CA C 114 60.838 60.838 61.456 -0.618 18112 7608 1 10 . 1 1 114 114 VAL CB C 114 32.609 32.609 30.869 1.740 18112 7609 1 10 . 1 1 114 114 VAL H H 114 8.008 8.008 7.921 0.087 18112 7610 1 10 . 1 1 115 115 PRO HA H 115 4.429 4.429 4.507 -0.078 18112 7611 1 10 . 1 1 115 115 PRO C C 115 177.421 177.421 177.971 -0.550 18112 7612 1 10 . 1 1 115 115 PRO CA C 115 61.882 61.882 62.925 -1.043 18112 7613 1 10 . 1 1 115 115 PRO CB C 115 30.974 30.974 32.751 -1.776 18112 7614 1 10 . 1 1 116 116 GLU N N 116 123.936 123.936 120.716 3.220 18112 7615 1 10 . 1 1 116 116 GLU C C 116 179.034 179.034 178.742 0.292 18112 7616 1 10 . 1 1 116 116 GLU CA C 116 58.913 58.913 60.786 -1.873 18112 7617 1 10 . 1 1 116 116 GLU CB C 116 28.378 28.378 29.241 -0.863 18112 7618 1 10 . 1 1 116 116 GLU H H 116 8.757 8.757 8.958 -0.201 18112 7619 1 10 . 1 1 117 117 ARG N N 117 116.943 116.943 119.948 -3.005 18112 7620 1 10 . 1 1 117 117 ARG C C 117 177.570 177.570 178.450 -0.880 18112 7621 1 10 . 1 1 117 117 ARG CA C 117 57.033 57.033 58.882 -1.849 18112 7622 1 10 . 1 1 117 117 ARG CB C 117 28.172 28.172 29.782 -1.611 18112 7623 1 10 . 1 1 117 117 ARG H H 117 8.733 8.733 8.190 0.543 18112 7624 1 10 . 1 1 118 118 PHE N N 118 117.528 117.528 120.194 -2.666 18112 7625 1 10 . 1 1 118 118 PHE HA H 118 4.137 4.137 4.377 -0.240 18112 7626 1 10 . 1 1 118 118 PHE C C 118 176.992 176.992 177.481 -0.489 18112 7627 1 10 . 1 1 118 118 PHE CA C 118 61.627 61.627 61.254 0.373 18112 7628 1 10 . 1 1 118 118 PHE CB C 118 37.386 37.386 39.049 -1.663 18112 7629 1 10 . 1 1 118 118 PHE H H 118 7.606 7.606 8.101 -0.495 18112 7630 1 10 . 1 1 119 119 LEU N N 119 118.483 118.483 118.894 -0.411 18112 7631 1 10 . 1 1 119 119 LEU HA H 119 3.684 3.684 3.850 -0.166 18112 7632 1 10 . 1 1 119 119 LEU C C 119 178.802 178.802 179.515 -0.713 18112 7633 1 10 . 1 1 119 119 LEU CA C 119 59.875 59.875 57.691 2.184 18112 7634 1 10 . 1 1 119 119 LEU CB C 119 39.453 39.453 40.475 -1.022 18112 7635 1 10 . 1 1 119 119 LEU H H 119 7.248 7.248 7.671 -0.423 18112 7636 1 10 . 1 1 120 120 GLU N N 120 117.870 117.870 119.197 -1.327 18112 7637 1 10 . 1 1 120 120 GLU C C 120 179.932 179.932 179.757 0.175 18112 7638 1 10 . 1 1 120 120 GLU CA C 120 59.150 59.150 58.931 0.219 18112 7639 1 10 . 1 1 120 120 GLU CB C 120 28.878 28.878 29.191 -0.313 18112 7640 1 10 . 1 1 120 120 GLU H H 120 7.423 7.423 8.311 -0.888 18112 7641 1 10 . 1 1 121 121 VAL N N 121 120.777 120.777 120.595 0.182 18112 7642 1 10 . 1 1 121 121 VAL HA H 121 3.545 3.545 3.543 0.002 18112 7643 1 10 . 1 1 121 121 VAL C C 121 179.302 179.302 177.792 1.510 18112 7644 1 10 . 1 1 121 121 VAL CA C 121 66.875 66.875 66.349 0.526 18112 7645 1 10 . 1 1 121 121 VAL CB C 121 30.823 30.823 31.444 -0.621 18112 7646 1 10 . 1 1 121 121 VAL H H 121 8.313 8.313 8.088 0.225 18112 7647 1 10 . 1 1 122 122 ALA N N 122 127.029 127.029 120.183 6.846 18112 7648 1 10 . 1 1 122 122 ALA HA H 122 4.251 4.251 3.708 0.543 18112 7649 1 10 . 1 1 122 122 ALA C C 122 178.366 178.366 179.509 -1.143 18112 7650 1 10 . 1 1 122 122 ALA CA C 122 54.748 54.748 54.956 -0.208 18112 7651 1 10 . 1 1 122 122 ALA CB C 122 16.565 16.565 17.538 -0.973 18112 7652 1 10 . 1 1 122 122 ALA H H 122 8.896 8.896 7.853 1.043 18112 7653 1 10 . 1 1 123 123 GLN N N 123 119.887 119.887 119.215 0.672 18112 7654 1 10 . 1 1 123 123 GLN C C 123 177.908 177.908 178.343 -0.435 18112 7655 1 10 . 1 1 123 123 GLN CA C 123 60.671 60.671 58.983 1.688 18112 7656 1 10 . 1 1 123 123 GLN H H 123 8.349 8.349 7.880 0.469 18112 7657 1 10 . 1 1 124 124 ILE N N 124 120.632 120.632 118.520 2.112 18112 7658 1 10 . 1 1 124 124 ILE HA H 124 3.651 3.651 3.744 -0.093 18112 7659 1 10 . 1 1 124 124 ILE C C 124 178.703 178.703 178.157 0.546 18112 7660 1 10 . 1 1 124 124 ILE CA C 124 65.945 65.945 64.554 1.391 18112 7661 1 10 . 1 1 124 124 ILE H H 124 8.204 8.204 8.027 0.177 18112 7662 1 10 . 1 1 125 125 THR N N 125 115.084 115.084 117.774 -2.690 18112 7663 1 10 . 1 1 125 125 THR C C 125 175.568 175.568 176.310 -0.742 18112 7664 1 10 . 1 1 125 125 THR CA C 125 67.872 67.872 67.556 0.316 18112 7665 1 10 . 1 1 125 125 THR H H 125 8.399 8.399 8.273 0.126 18112 7666 1 10 . 1 1 126 126 LEU N N 126 125.011 125.011 122.366 2.645 18112 7667 1 10 . 1 1 126 126 LEU HA H 126 4.085 4.085 4.456 -0.371 18112 7668 1 10 . 1 1 126 126 LEU C C 126 178.559 178.559 177.992 0.567 18112 7669 1 10 . 1 1 126 126 LEU CA C 126 58.843 58.843 57.793 1.050 18112 7670 1 10 . 1 1 126 126 LEU CB C 126 41.421 41.421 41.777 -0.356 18112 7671 1 10 . 1 1 126 126 LEU H H 126 8.728 8.728 8.066 0.662 18112 7672 1 10 . 1 1 127 127 ARG N N 127 117.076 117.076 119.543 -2.467 18112 7673 1 10 . 1 1 127 127 ARG HA H 127 3.929 3.929 3.828 0.101 18112 7674 1 10 . 1 1 127 127 ARG C C 127 177.984 177.984 178.295 -0.311 18112 7675 1 10 . 1 1 127 127 ARG CA C 127 60.685 60.685 60.102 0.583 18112 7676 1 10 . 1 1 127 127 ARG CB C 127 28.079 28.079 29.979 -1.900 18112 7677 1 10 . 1 1 127 127 ARG H H 127 8.213 8.213 8.338 -0.125 18112 7678 1 10 . 1 1 128 128 GLU N N 128 118.617 118.617 119.387 -0.770 18112 7679 1 10 . 1 1 128 128 GLU HA H 128 4.147 4.147 4.156 -0.009 18112 7680 1 10 . 1 1 128 128 GLU C C 128 181.150 181.150 179.142 2.008 18112 7681 1 10 . 1 1 128 128 GLU CA C 128 59.508 59.508 58.710 0.798 18112 7682 1 10 . 1 1 128 128 GLU H H 128 8.478 8.478 7.886 0.592 18112 7683 1 10 . 1 1 129 129 PHE N N 129 119.267 119.267 120.326 -1.059 18112 7684 1 10 . 1 1 129 129 PHE HA H 129 4.104 4.104 4.347 -0.243 18112 7685 1 10 . 1 1 129 129 PHE C C 129 177.170 177.170 177.936 -0.766 18112 7686 1 10 . 1 1 129 129 PHE CA C 129 63.694 63.694 62.263 1.431 18112 7687 1 10 . 1 1 129 129 PHE H H 129 8.570 8.570 8.203 0.367 18112 7688 1 10 . 1 1 130 130 PHE N N 130 118.739 118.739 118.476 0.263 18112 7689 1 10 . 1 1 130 130 PHE HA H 130 3.884 3.884 4.158 -0.274 18112 7690 1 10 . 1 1 130 130 PHE C C 130 175.860 175.860 177.885 -2.025 18112 7691 1 10 . 1 1 130 130 PHE CA C 130 62.819 62.819 61.297 1.522 18112 7692 1 10 . 1 1 130 130 PHE H H 130 8.740 8.740 8.959 -0.219 18112 7693 1 10 . 1 1 131 131 ASN N N 131 116.028 116.028 117.780 -1.752 18112 7694 1 10 . 1 1 131 131 ASN HA H 131 4.373 4.373 4.438 -0.065 18112 7695 1 10 . 1 1 131 131 ASN C C 131 178.228 178.228 177.611 0.617 18112 7696 1 10 . 1 1 131 131 ASN CA C 131 55.150 55.150 56.435 -1.285 18112 7697 1 10 . 1 1 131 131 ASN H H 131 8.864 8.864 8.481 0.383 18112 7698 1 10 . 1 1 132 132 ALA N N 132 120.922 120.922 123.478 -2.556 18112 7699 1 10 . 1 1 132 132 ALA HA H 132 4.020 4.020 4.103 -0.083 18112 7700 1 10 . 1 1 132 132 ALA C C 132 178.515 178.515 179.677 -1.162 18112 7701 1 10 . 1 1 132 132 ALA CA C 132 54.924 54.924 55.251 -0.327 18112 7702 1 10 . 1 1 132 132 ALA CB C 132 18.441 18.441 18.818 -0.377 18112 7703 1 10 . 1 1 132 132 ALA H H 132 7.745 7.745 7.743 0.002 18112 7704 1 10 . 1 1 133 133 ILE N N 133 118.200 118.200 119.844 -1.644 18112 7705 1 10 . 1 1 133 133 ILE HA H 133 3.235 3.235 3.664 -0.429 18112 7706 1 10 . 1 1 133 133 ILE C C 133 180.606 180.606 178.218 2.388 18112 7707 1 10 . 1 1 133 133 ILE CA C 133 65.215 65.215 64.462 0.753 18112 7708 1 10 . 1 1 133 133 ILE CB C 133 38.291 38.291 37.640 0.651 18112 7709 1 10 . 1 1 133 133 ILE H H 133 7.999 7.999 8.140 -0.141 18112 7710 1 10 . 1 1 134 134 ILE N N 134 122.564 122.564 120.148 2.416 18112 7711 1 10 . 1 1 134 134 ILE HA H 134 3.788 3.788 3.729 0.059 18112 7712 1 10 . 1 1 134 134 ILE C C 134 177.215 177.215 177.141 0.074 18112 7713 1 10 . 1 1 134 134 ILE CA C 134 63.584 63.584 63.884 -0.300 18112 7714 1 10 . 1 1 134 134 ILE CB C 134 35.636 35.636 37.647 -2.010 18112 7715 1 10 . 1 1 134 134 ILE H H 134 8.670 8.670 8.132 0.538 18112 7716 1 10 . 1 1 135 135 ALA N N 135 119.989 119.989 120.682 -0.693 18112 7717 1 10 . 1 1 135 135 ALA HA H 135 4.357 4.357 4.228 0.129 18112 7718 1 10 . 1 1 135 135 ALA C C 135 177.786 177.786 177.950 -0.164 18112 7719 1 10 . 1 1 135 135 ALA CA C 135 51.521 51.521 52.829 -1.308 18112 7720 1 10 . 1 1 135 135 ALA CB C 135 18.839 18.839 19.815 -0.976 18112 7721 1 10 . 1 1 135 135 ALA H H 135 6.898 6.898 7.910 -1.012 18112 7722 1 10 . 1 1 136 136 GLY N N 136 107.682 107.682 105.509 2.173 18112 7723 1 10 . 1 1 136 136 GLY C C 136 176.324 176.324 175.184 1.140 18112 7724 1 10 . 1 1 136 136 GLY CA C 136 45.469 45.469 44.792 0.677 18112 7725 1 10 . 1 1 136 136 GLY H H 136 7.913 7.913 7.797 0.116 18112 7726 1 10 . 1 1 137 137 LYS N N 137 117.213 117.213 118.799 -1.586 18112 7727 1 10 . 1 1 137 137 LYS HA H 137 4.004 4.004 4.243 -0.239 18112 7728 1 10 . 1 1 137 137 LYS C C 137 176.616 176.616 176.784 -0.168 18112 7729 1 10 . 1 1 137 137 LYS CA C 137 57.499 57.499 57.349 0.150 18112 7730 1 10 . 1 1 137 137 LYS CB C 137 30.927 30.927 32.618 -1.691 18112 7731 1 10 . 1 1 137 137 LYS H H 137 8.312 8.312 8.059 0.253 18112 7732 1 10 . 1 1 138 138 ASP N N 138 113.545 113.545 119.947 -6.402 18112 7733 1 10 . 1 1 138 138 ASP HA H 138 3.061 3.061 3.109 -0.048 18112 7734 1 10 . 1 1 138 138 ASP C C 138 174.698 174.698 176.957 -2.259 18112 7735 1 10 . 1 1 138 138 ASP CA C 138 53.694 53.694 55.376 -1.682 18112 7736 1 10 . 1 1 138 138 ASP CB C 138 36.008 36.008 39.965 -3.957 18112 7737 1 10 . 1 1 138 138 ASP H H 138 8.465 8.465 8.199 0.266 18112 7738 1 10 . 1 1 139 139 VAL N N 139 115.191 115.191 117.515 -2.324 18112 7739 1 10 . 1 1 139 139 VAL HA H 139 3.886 3.886 3.686 0.200 18112 7740 1 10 . 1 1 139 139 VAL C C 139 175.889 175.889 176.098 -0.209 18112 7741 1 10 . 1 1 139 139 VAL CA C 139 62.793 62.793 63.951 -1.158 18112 7742 1 10 . 1 1 139 139 VAL CB C 139 30.662 30.662 31.832 -1.170 18112 7743 1 10 . 1 1 139 139 VAL H H 139 6.610 6.610 7.414 -0.804 18112 7744 1 10 . 1 1 140 140 ASP N N 140 123.363 123.363 117.249 6.114 18112 7745 1 10 . 1 1 140 140 ASP C C 140 175.234 175.234 174.734 0.500 18112 7746 1 10 . 1 1 140 140 ASP CA C 140 50.221 50.221 54.074 -3.853 18112 7747 1 10 . 1 1 140 140 ASP CB C 140 42.254 42.254 40.545 1.709 18112 7748 1 10 . 1 1 140 140 ASP H H 140 7.553 7.553 7.560 -0.007 18112 7749 1 10 . 1 1 141 141 PRO HA H 141 4.682 4.682 4.659 0.023 18112 7750 1 10 . 1 1 141 141 PRO C C 141 178.678 178.678 177.474 1.204 18112 7751 1 10 . 1 1 141 141 PRO CA C 141 64.532 64.532 63.431 1.101 18112 7752 1 10 . 1 1 141 141 PRO CB C 141 31.331 31.331 32.305 -0.974 18112 7753 1 10 . 1 1 142 142 SER N N 142 114.421 114.421 114.141 0.280 18112 7754 1 10 . 1 1 142 142 SER HA H 142 4.565 4.565 4.747 -0.182 18112 7755 1 10 . 1 1 142 142 SER C C 142 176.524 176.524 176.400 0.124 18112 7756 1 10 . 1 1 142 142 SER CA C 142 58.711 58.711 58.930 -0.219 18112 7757 1 10 . 1 1 142 142 SER CB C 142 62.783 62.783 63.109 -0.327 18112 7758 1 10 . 1 1 142 142 SER H H 142 8.703 8.703 8.537 0.166 18112 7759 1 10 . 1 1 143 143 TRP N N 143 123.598 123.598 123.047 0.551 18112 7760 1 10 . 1 1 143 143 TRP HA H 143 4.136 4.136 4.174 -0.038 18112 7761 1 10 . 1 1 143 143 TRP C C 143 177.113 177.113 176.762 0.351 18112 7762 1 10 . 1 1 143 143 TRP CA C 143 59.803 59.803 59.855 -0.052 18112 7763 1 10 . 1 1 143 143 TRP CB C 143 26.364 26.364 27.904 -1.540 18112 7764 1 10 . 1 1 143 143 TRP H H 143 8.374 8.374 8.454 -0.080 18112 7765 1 10 . 1 1 144 144 LYS N N 144 119.293 119.293 118.618 0.675 18112 7766 1 10 . 1 1 144 144 LYS HA H 144 2.719 2.719 3.247 -0.528 18112 7767 1 10 . 1 1 144 144 LYS C C 144 177.243 177.243 178.037 -0.794 18112 7768 1 10 . 1 1 144 144 LYS CA C 144 58.851 58.851 57.888 0.963 18112 7769 1 10 . 1 1 144 144 LYS CB C 144 29.373 29.373 30.915 -1.542 18112 7770 1 10 . 1 1 144 144 LYS H H 144 7.196 7.196 7.615 -0.419 18112 7771 1 10 . 1 1 145 145 LYS N N 145 116.440 116.440 121.100 -4.660 18112 7772 1 10 . 1 1 145 145 LYS HA H 145 3.490 3.490 4.089 -0.599 18112 7773 1 10 . 1 1 145 145 LYS C C 145 179.149 179.149 178.885 0.264 18112 7774 1 10 . 1 1 145 145 LYS CA C 145 59.271 59.271 59.279 -0.008 18112 7775 1 10 . 1 1 145 145 LYS CB C 145 30.521 30.521 31.943 -1.422 18112 7776 1 10 . 1 1 145 145 LYS H H 145 7.389 7.389 7.806 -0.417 18112 7777 1 10 . 1 1 146 146 ALA N N 146 118.582 118.582 121.837 -3.255 18112 7778 1 10 . 1 1 146 146 ALA HA H 146 3.932 3.932 4.123 -0.191 18112 7779 1 10 . 1 1 146 146 ALA C C 146 179.968 179.968 179.563 0.405 18112 7780 1 10 . 1 1 146 146 ALA CA C 146 54.241 54.241 54.868 -0.627 18112 7781 1 10 . 1 1 146 146 ALA CB C 146 17.689 17.689 18.137 -0.448 18112 7782 1 10 . 1 1 146 146 ALA H H 146 7.112 7.112 8.003 -0.891 18112 7783 1 10 . 1 1 147 147 ILE N N 147 118.537 118.537 119.643 -1.106 18112 7784 1 10 . 1 1 147 147 ILE HA H 147 3.642 3.642 3.410 0.232 18112 7785 1 10 . 1 1 147 147 ILE C C 147 178.919 178.919 177.921 0.998 18112 7786 1 10 . 1 1 147 147 ILE CA C 147 64.418 64.418 63.845 0.573 18112 7787 1 10 . 1 1 147 147 ILE CB C 147 36.519 36.519 35.932 0.587 18112 7788 1 10 . 1 1 147 147 ILE H H 147 6.734 6.734 7.636 -0.902 18112 7789 1 10 . 1 1 148 148 TYR N N 148 121.033 121.033 118.192 2.841 18112 7790 1 10 . 1 1 148 148 TYR HA H 148 4.489 4.489 4.029 0.460 18112 7791 1 10 . 1 1 148 148 TYR C C 148 178.348 178.348 178.495 -0.147 18112 7792 1 10 . 1 1 148 148 TYR CA C 148 57.389 57.389 60.449 -3.060 18112 7793 1 10 . 1 1 148 148 TYR CB C 148 35.280 35.280 36.844 -1.564 18112 7794 1 10 . 1 1 148 148 TYR H H 148 8.126 8.126 7.676 0.450 18112 7795 1 10 . 1 1 149 149 LYS N N 149 114.484 114.484 119.754 -5.270 18112 7796 1 10 . 1 1 149 149 LYS C C 149 178.051 178.051 178.890 -0.839 18112 7797 1 10 . 1 1 149 149 LYS CA C 149 59.036 59.036 59.891 -0.855 18112 7798 1 10 . 1 1 149 149 LYS CB C 149 31.575 31.575 32.438 -0.863 18112 7799 1 10 . 1 1 149 149 LYS H H 149 7.364 7.364 8.030 -0.666 18112 7800 1 10 . 1 1 150 150 VAL N N 150 117.812 117.812 117.206 0.606 18112 7801 1 10 . 1 1 150 150 VAL HA H 150 3.770 3.770 3.709 0.061 18112 7802 1 10 . 1 1 150 150 VAL C C 150 178.786 178.786 177.893 0.893 18112 7803 1 10 . 1 1 150 150 VAL CA C 150 65.070 65.070 65.862 -0.792 18112 7804 1 10 . 1 1 150 150 VAL CB C 150 29.515 29.515 31.363 -1.848 18112 7805 1 10 . 1 1 150 150 VAL H H 150 7.254 7.254 7.929 -0.675 18112 7806 1 10 . 1 1 151 151 ILE N N 151 117.884 117.884 116.398 1.486 18112 7807 1 10 . 1 1 151 151 ILE C C 151 180.539 180.539 177.428 3.111 18112 7808 1 10 . 1 1 151 151 ILE CA C 151 61.490 61.490 64.145 -2.655 18112 7809 1 10 . 1 1 151 151 ILE CB C 151 33.994 33.994 37.501 -3.507 18112 7810 1 10 . 1 1 151 151 ILE H H 151 8.154 8.154 7.788 0.366 18112 7811 1 10 . 1 1 152 152 CYS N N 152 118.649 118.649 119.756 -1.107 18112 7812 1 10 . 1 1 152 152 CYS HA H 152 4.153 4.153 4.617 -0.464 18112 7813 1 10 . 1 1 152 152 CYS C C 152 174.888 174.888 175.826 -0.938 18112 7814 1 10 . 1 1 152 152 CYS CA C 152 61.052 61.052 60.486 0.566 18112 7815 1 10 . 1 1 152 152 CYS CB C 152 36.364 36.364 27.932 8.432 18112 7816 1 10 . 1 1 152 152 CYS H H 152 8.711 8.711 8.061 0.650 18112 7817 1 10 . 1 1 153 153 LYS N N 153 118.498 118.498 119.476 -0.978 18112 7818 1 10 . 1 1 153 153 LYS C C 153 177.389 177.389 178.665 -1.276 18112 7819 1 10 . 1 1 153 153 LYS CA C 153 56.243 56.243 58.002 -1.759 18112 7820 1 10 . 1 1 153 153 LYS CB C 153 31.343 31.343 32.302 -0.959 18112 7821 1 10 . 1 1 153 153 LYS H H 153 6.782 6.782 7.751 -0.969 18112 7822 1 10 . 1 1 154 154 LEU N N 154 117.318 117.318 118.915 -1.597 18112 7823 1 10 . 1 1 154 154 LEU HA H 154 4.576 4.576 4.089 0.487 18112 7824 1 10 . 1 1 154 154 LEU C C 154 177.161 177.161 177.249 -0.088 18112 7825 1 10 . 1 1 154 154 LEU CA C 154 53.782 53.782 56.623 -2.841 18112 7826 1 10 . 1 1 154 154 LEU CB C 154 40.881 40.881 42.230 -1.349 18112 7827 1 10 . 1 1 154 154 LEU H H 154 7.616 7.616 7.610 0.006 18112 7828 1 10 . 1 1 155 155 ASP N N 155 121.564 121.564 114.637 6.927 18112 7829 1 10 . 1 1 155 155 ASP C C 155 177.094 177.094 174.268 2.826 18112 7830 1 10 . 1 1 155 155 ASP CA C 155 55.732 55.732 53.578 2.154 18112 7831 1 10 . 1 1 155 155 ASP CB C 155 40.139 40.139 42.927 -2.788 18112 7832 1 10 . 1 1 155 155 ASP H H 155 7.582 7.582 7.522 0.060 18112 7833 1 10 . 1 1 156 156 SER N N 156 117.352 117.352 117.193 0.159 18112 7834 1 10 . 1 1 156 156 SER HA H 156 4.818 4.818 4.449 0.369 18112 7835 1 10 . 1 1 156 156 SER C C 156 173.409 173.409 173.057 0.352 18112 7836 1 10 . 1 1 156 156 SER CA C 156 57.073 57.073 56.968 0.105 18112 7837 1 10 . 1 1 156 156 SER CB C 156 65.150 65.150 62.741 2.409 18112 7838 1 10 . 1 1 156 156 SER H H 156 8.846 8.846 8.255 0.591 18112 7839 1 10 . 1 1 157 157 GLU N N 157 120.688 120.688 119.550 1.138 18112 7840 1 10 . 1 1 157 157 GLU HA H 157 4.038 4.038 4.617 -0.579 18112 7841 1 10 . 1 1 157 157 GLU C C 157 176.332 176.332 174.831 1.501 18112 7842 1 10 . 1 1 157 157 GLU CA C 157 56.464 56.464 56.214 0.250 18112 7843 1 10 . 1 1 157 157 GLU CB C 157 29.206 29.206 32.210 -3.004 18112 7844 1 10 . 1 1 157 157 GLU H H 157 8.356 8.356 7.979 0.377 18112 7845 1 10 . 1 1 158 158 VAL N N 158 126.906 126.906 114.024 12.882 18112 7846 1 10 . 1 1 158 158 VAL HA H 158 3.449 3.449 4.638 -1.189 18112 7847 1 10 . 1 1 158 158 VAL C C 158 176.382 176.382 173.616 2.766 18112 7848 1 10 . 1 1 158 158 VAL CA C 158 59.584 59.584 59.977 -0.393 18112 7849 1 10 . 1 1 158 158 VAL CB C 158 31.160 31.160 31.290 -0.130 18112 7850 1 10 . 1 1 158 158 VAL H H 158 8.561 8.561 8.341 0.220 18112 7851 1 10 . 1 1 159 159 PRO HA H 159 4.403 4.403 4.507 -0.104 18112 7852 1 10 . 1 1 159 159 PRO C C 159 176.757 176.757 175.630 1.127 18112 7853 1 10 . 1 1 159 159 PRO CA C 159 63.845 63.845 63.077 0.768 18112 7854 1 10 . 1 1 159 159 PRO CB C 159 32.106 32.106 30.280 1.826 18112 7855 1 10 . 1 1 160 160 GLU N N 160 122.904 122.904 123.110 -0.206 18112 7856 1 10 . 1 1 160 160 GLU HA H 160 4.008 4.008 4.422 -0.414 18112 7857 1 10 . 1 1 160 160 GLU C C 160 179.132 179.132 174.636 4.496 18112 7858 1 10 . 1 1 160 160 GLU CA C 160 59.407 59.407 55.001 4.406 18112 7859 1 10 . 1 1 160 160 GLU CB C 160 28.991 28.991 30.387 -1.395 18112 7860 1 10 . 1 1 160 160 GLU H H 160 8.650 8.650 8.256 0.394 18112 7861 1 10 . 1 1 161 161 ILE N N 161 119.782 119.782 126.350 -6.568 18112 7862 1 10 . 1 1 161 161 ILE HA H 161 4.146 4.146 4.248 -0.102 18112 7863 1 10 . 1 1 161 161 ILE C C 161 176.176 176.176 175.070 1.106 18112 7864 1 10 . 1 1 161 161 ILE CA C 161 62.034 62.034 60.871 1.163 18112 7865 1 10 . 1 1 161 161 ILE CB C 161 37.113 37.113 38.402 -1.289 18112 7866 1 10 . 1 1 161 161 ILE H H 161 8.448 8.448 8.459 -0.011 18112 7867 1 10 . 1 1 162 162 PHE N N 162 117.594 117.594 128.351 -10.757 18112 7868 1 10 . 1 1 162 162 PHE C C 162 176.115 176.115 177.521 -1.406 18112 7869 1 10 . 1 1 162 162 PHE CA C 162 61.009 61.009 60.004 1.005 18112 7870 1 10 . 1 1 162 162 PHE CB C 162 38.394 38.394 38.866 -0.472 18112 7871 1 10 . 1 1 162 162 PHE H H 162 8.145 8.145 8.935 -0.790 18112 7872 1 10 . 1 1 163 163 LYS N N 163 116.083 116.083 119.858 -3.775 18112 7873 1 10 . 1 1 163 163 LYS C C 163 178.196 178.196 176.125 2.071 18112 7874 1 10 . 1 1 163 163 LYS CA C 163 58.136 58.136 58.401 -0.265 18112 7875 1 10 . 1 1 163 163 LYS CB C 163 31.694 31.694 32.880 -1.186 18112 7876 1 10 . 1 1 163 163 LYS H H 163 8.232 8.232 8.062 0.170 18112 7877 1 10 . 1 1 164 164 SER N N 164 113.680 113.680 111.375 2.305 18112 7878 1 10 . 1 1 164 164 SER CA C 164 55.205 55.205 56.742 -1.537 18112 7879 1 10 . 1 1 164 164 SER CB C 164 63.265 63.265 64.564 -1.299 18112 7880 1 10 . 1 1 164 164 SER H H 164 7.708 7.708 7.664 0.044 18112 7881 1 10 . 1 1 165 165 PRO HA H 165 4.580 4.580 4.226 0.354 18112 7882 1 10 . 1 1 165 165 PRO C C 165 177.541 177.541 177.503 0.038 18112 7883 1 10 . 1 1 165 165 PRO CA C 165 63.950 63.950 64.820 -0.870 18112 7884 1 10 . 1 1 165 165 PRO CB C 165 30.686 30.686 32.047 -1.361 18112 7885 1 10 . 1 1 166 166 ASN N N 166 116.304 116.304 117.811 -1.507 18112 7886 1 10 . 1 1 166 166 ASN HA H 166 5.029 5.029 4.710 0.319 18112 7887 1 10 . 1 1 166 166 ASN C C 166 175.811 175.811 174.716 1.095 18112 7888 1 10 . 1 1 166 166 ASN CA C 166 51.962 51.962 53.355 -1.393 18112 7889 1 10 . 1 1 166 166 ASN CB C 166 37.915 37.915 38.191 -0.277 18112 7890 1 10 . 1 1 166 166 ASN H H 166 8.216 8.216 8.952 -0.736 18112 7891 1 10 . 1 1 167 167 CYS N N 167 116.078 116.078 116.236 -0.158 18112 7892 1 10 . 1 1 167 167 CYS HA H 167 4.011 4.011 5.021 -1.010 18112 7893 1 10 . 1 1 167 167 CYS C C 167 175.057 175.057 175.966 -0.909 18112 7894 1 10 . 1 1 167 167 CYS CA C 167 59.816 59.816 58.684 1.133 18112 7895 1 10 . 1 1 167 167 CYS CB C 167 27.446 27.446 30.127 -2.681 18112 7896 1 10 . 1 1 167 167 CYS H H 167 7.246 7.246 8.100 -0.854 18112 7897 1 10 . 1 1 168 168 LEU N N 168 120.082 120.082 124.241 -4.159 18112 7898 1 10 . 1 1 168 168 LEU HA H 168 3.880 3.880 4.067 -0.187 18112 7899 1 10 . 1 1 168 168 LEU C C 168 178.541 178.541 177.365 1.176 18112 7900 1 10 . 1 1 168 168 LEU CA C 168 57.734 57.734 57.731 0.003 18112 7901 1 10 . 1 1 168 168 LEU CB C 168 38.825 38.825 41.215 -2.390 18112 7902 1 10 . 1 1 168 168 LEU H H 168 8.451 8.451 7.401 1.050 18112 7903 1 10 . 1 1 169 169 GLN N N 169 116.700 116.700 118.872 -2.172 18112 7904 1 10 . 1 1 169 169 GLN HA H 169 4.064 4.064 3.950 0.114 18112 7905 1 10 . 1 1 169 169 GLN C C 169 177.378 177.378 177.904 -0.526 18112 7906 1 10 . 1 1 169 169 GLN CA C 169 57.675 57.675 58.880 -1.205 18112 7907 1 10 . 1 1 169 169 GLN CB C 169 27.710 27.710 28.353 -0.643 18112 7908 1 10 . 1 1 169 169 GLN H H 169 7.665 7.665 8.567 -0.902 18112 7909 1 10 . 1 1 170 170 GLU N N 170 116.701 116.701 116.639 0.062 18112 7910 1 10 . 1 1 170 170 GLU HA H 170 4.214 4.214 4.158 0.056 18112 7911 1 10 . 1 1 170 170 GLU C C 170 177.730 177.730 177.622 0.108 18112 7912 1 10 . 1 1 170 170 GLU CA C 170 56.899 56.899 58.173 -1.274 18112 7913 1 10 . 1 1 170 170 GLU H H 170 7.405 7.405 7.713 -0.308 18112 7914 1 10 . 1 1 171 171 LEU N N 171 118.021 118.021 117.223 0.798 18112 7915 1 10 . 1 1 171 171 LEU HA H 171 4.209 4.209 4.168 0.041 18112 7916 1 10 . 1 1 171 171 LEU C C 171 177.005 177.005 177.931 -0.926 18112 7917 1 10 . 1 1 171 171 LEU CA C 171 55.870 55.870 56.116 -0.246 18112 7918 1 10 . 1 1 171 171 LEU CB C 171 43.680 43.680 42.103 1.577 18112 7919 1 10 . 1 1 171 171 LEU H H 171 7.823 7.823 7.403 0.420 18112 7920 1 10 . 1 1 172 172 LEU N N 172 117.580 117.580 119.080 -1.500 18112 7921 1 10 . 1 1 172 172 LEU HA H 172 4.571 4.571 4.325 0.246 18112 7922 1 10 . 1 1 172 172 LEU C C 172 176.411 176.411 175.887 0.524 18112 7923 1 10 . 1 1 172 172 LEU CA C 172 53.972 53.972 54.781 -0.809 18112 7924 1 10 . 1 1 172 172 LEU CB C 172 40.483 40.483 39.875 0.608 18112 7925 1 10 . 1 1 172 172 LEU H H 172 7.306 7.306 7.436 -0.130 18112 7926 1 10 . 1 1 173 173 HIS N N 173 123.310 123.310 122.855 0.455 18112 7927 1 10 . 1 1 173 173 HIS C C 173 179.022 179.022 173.474 5.548 18112 7928 1 10 . 1 1 173 173 HIS CA C 173 56.693 56.693 55.553 1.140 18112 7929 1 10 . 1 1 173 173 HIS CB C 173 29.371 29.371 32.422 -3.051 18112 7930 1 10 . 1 1 173 173 HIS H H 173 8.028 8.028 7.909 0.119 18112 7931 1 11 . 1 1 12 12 ALA N N 12 125.167 125.167 128.014 -2.847 18112 7932 1 11 . 1 1 12 12 ALA C C 12 177.566 177.566 176.635 0.931 18112 7933 1 11 . 1 1 12 12 ALA CA C 12 52.067 52.067 50.712 1.355 18112 7934 1 11 . 1 1 12 12 ALA CB C 12 18.456 18.456 19.598 -1.142 18112 7935 1 11 . 1 1 12 12 ALA H H 12 8.311 8.311 8.385 -0.074 18112 7936 1 11 . 1 1 13 13 MET N N 13 119.278 119.278 124.140 -4.862 18112 7937 1 11 . 1 1 13 13 MET C C 13 176.325 176.325 176.030 0.295 18112 7938 1 11 . 1 1 13 13 MET CA C 13 54.992 54.992 55.034 -0.042 18112 7939 1 11 . 1 1 13 13 MET CB C 13 32.308 32.308 30.774 1.534 18112 7940 1 11 . 1 1 13 13 MET H H 13 8.269 8.269 8.816 -0.547 18112 7941 1 11 . 1 1 14 14 GLN N N 14 120.869 120.869 121.585 -0.716 18112 7942 1 11 . 1 1 14 14 GLN HA H 14 4.399 4.399 4.674 -0.275 18112 7943 1 11 . 1 1 14 14 GLN C C 14 175.644 175.644 175.579 0.065 18112 7944 1 11 . 1 1 14 14 GLN CA C 14 55.139 55.139 55.348 -0.209 18112 7945 1 11 . 1 1 14 14 GLN CB C 14 29.051 29.051 30.032 -0.981 18112 7946 1 11 . 1 1 14 14 GLN H H 14 8.501 8.501 8.236 0.265 18112 7947 1 11 . 1 1 15 15 GLU N N 15 122.042 122.042 125.386 -3.344 18112 7948 1 11 . 1 1 15 15 GLU C C 15 176.242 176.242 177.997 -1.755 18112 7949 1 11 . 1 1 15 15 GLU CA C 15 56.064 56.064 57.691 -1.627 18112 7950 1 11 . 1 1 15 15 GLU CB C 15 29.302 29.302 29.703 -0.401 18112 7951 1 11 . 1 1 15 15 GLU H H 15 8.547 8.547 8.856 -0.309 18112 7952 1 11 . 1 1 16 16 GLY N N 16 108.821 108.821 107.692 1.129 18112 7953 1 11 . 1 1 16 16 GLY C C 16 172.949 172.949 174.362 -1.413 18112 7954 1 11 . 1 1 16 16 GLY CA C 16 44.227 44.227 45.517 -1.290 18112 7955 1 11 . 1 1 16 16 GLY H H 16 8.100 8.100 8.490 -0.390 18112 7956 1 11 . 1 1 17 17 LEU N N 17 120.315 120.315 119.596 0.719 18112 7957 1 11 . 1 1 17 17 LEU C C 17 177.334 177.334 176.195 1.139 18112 7958 1 11 . 1 1 17 17 LEU CA C 17 53.544 53.544 55.345 -1.801 18112 7959 1 11 . 1 1 17 17 LEU CB C 17 42.140 42.140 38.633 3.507 18112 7960 1 11 . 1 1 17 17 LEU H H 17 8.222 8.222 8.305 -0.083 18112 7961 1 11 . 1 1 18 18 SER N N 18 126.547 126.547 117.819 8.728 18112 7962 1 11 . 1 1 18 18 SER CA C 18 56.851 56.851 59.187 -2.336 18112 7963 1 11 . 1 1 18 18 SER CB C 18 64.636 64.636 63.142 1.494 18112 7964 1 11 . 1 1 18 18 SER H H 18 11.627 11.627 8.598 3.029 18112 7965 1 11 . 1 1 19 19 PRO C C 19 175.118 175.118 178.706 -3.588 18112 7966 1 11 . 1 1 20 20 ASN N N 20 121.372 121.372 118.533 2.839 18112 7967 1 11 . 1 1 20 20 ASN H H 20 8.172 8.172 8.709 -0.537 18112 7968 1 11 . 1 1 25 25 ALA CB C 25 18.020 18.020 18.591 -0.571 18112 7969 1 11 . 1 1 26 26 LYS N N 26 118.490 118.490 118.936 -0.446 18112 7970 1 11 . 1 1 26 26 LYS CA C 26 56.146 56.146 59.133 -2.987 18112 7971 1 11 . 1 1 26 26 LYS H H 26 6.794 6.794 7.705 -0.911 18112 7972 1 11 . 1 1 31 31 TYR HA H 31 4.398 4.398 3.813 0.585 18112 7973 1 11 . 1 1 31 31 TYR C C 31 173.714 173.714 175.449 -1.735 18112 7974 1 11 . 1 1 31 31 TYR CA C 31 59.757 59.757 58.131 1.626 18112 7975 1 11 . 1 1 32 32 THR N N 32 111.928 111.928 110.475 1.453 18112 7976 1 11 . 1 1 32 32 THR HA H 32 4.209 4.209 4.512 -0.303 18112 7977 1 11 . 1 1 32 32 THR C C 32 171.061 171.061 175.065 -4.004 18112 7978 1 11 . 1 1 32 32 THR CA C 32 56.905 56.905 61.341 -4.436 18112 7979 1 11 . 1 1 32 32 THR CB C 32 69.707 69.707 70.278 -0.571 18112 7980 1 11 . 1 1 32 32 THR H H 32 8.237 8.237 7.349 0.888 18112 7981 1 11 . 1 1 33 33 ARG N N 33 124.856 124.856 122.984 1.872 18112 7982 1 11 . 1 1 33 33 ARG C C 33 176.451 176.451 175.518 0.933 18112 7983 1 11 . 1 1 33 33 ARG CA C 33 55.627 55.627 57.291 -1.664 18112 7984 1 11 . 1 1 33 33 ARG CB C 33 29.861 29.861 29.404 0.457 18112 7985 1 11 . 1 1 33 33 ARG H H 33 9.159 9.159 8.194 0.965 18112 7986 1 11 . 1 1 34 34 TYR N N 34 117.908 117.908 119.842 -1.934 18112 7987 1 11 . 1 1 34 34 TYR CA C 34 55.320 55.320 57.888 -2.568 18112 7988 1 11 . 1 1 34 34 TYR H H 34 8.995 8.995 8.168 0.827 18112 7989 1 11 . 1 1 35 35 PRO C C 35 177.280 177.280 177.593 -0.313 18112 7990 1 11 . 1 1 36 36 SER N N 36 116.410 116.410 116.310 0.100 18112 7991 1 11 . 1 1 36 36 SER C C 36 178.938 178.938 176.780 2.158 18112 7992 1 11 . 1 1 36 36 SER CA C 36 64.815 64.815 62.018 2.797 18112 7993 1 11 . 1 1 36 36 SER H H 36 8.106 8.106 8.556 -0.450 18112 7994 1 11 . 1 1 37 37 SER N N 37 117.488 117.488 118.122 -0.634 18112 7995 1 11 . 1 1 37 37 SER C C 37 177.698 177.698 176.747 0.951 18112 7996 1 11 . 1 1 37 37 SER CA C 37 61.357 61.357 61.845 -0.488 18112 7997 1 11 . 1 1 37 37 SER CB C 37 68.118 68.118 62.794 5.324 18112 7998 1 11 . 1 1 37 37 SER H H 37 8.169 8.169 8.407 -0.238 18112 7999 1 11 . 1 1 38 38 ASN N N 38 115.638 115.638 120.591 -4.953 18112 8000 1 11 . 1 1 38 38 ASN HA H 38 4.259 4.259 4.453 -0.194 18112 8001 1 11 . 1 1 38 38 ASN C C 38 177.868 177.868 177.468 0.400 18112 8002 1 11 . 1 1 38 38 ASN CA C 38 55.907 55.907 56.336 -0.429 18112 8003 1 11 . 1 1 38 38 ASN CB C 38 37.230 37.230 38.385 -1.155 18112 8004 1 11 . 1 1 38 38 ASN H H 38 8.284 8.284 7.898 0.386 18112 8005 1 11 . 1 1 39 39 MET N N 39 121.352 121.352 118.801 2.551 18112 8006 1 11 . 1 1 39 39 MET HA H 39 4.170 4.170 3.618 0.552 18112 8007 1 11 . 1 1 39 39 MET C C 39 179.068 179.068 178.186 0.882 18112 8008 1 11 . 1 1 39 39 MET CA C 39 58.751 58.751 58.759 -0.008 18112 8009 1 11 . 1 1 39 39 MET CB C 39 31.850 31.850 32.165 -0.315 18112 8010 1 11 . 1 1 39 39 MET H H 39 7.857 7.857 7.692 0.165 18112 8011 1 11 . 1 1 40 40 LEU N N 40 118.936 118.936 122.154 -3.218 18112 8012 1 11 . 1 1 40 40 LEU HA H 40 4.139 4.139 4.398 -0.259 18112 8013 1 11 . 1 1 40 40 LEU C C 40 178.700 178.700 178.667 0.033 18112 8014 1 11 . 1 1 40 40 LEU CA C 40 58.455 58.455 58.489 -0.034 18112 8015 1 11 . 1 1 40 40 LEU CB C 40 40.304 40.304 41.733 -1.429 18112 8016 1 11 . 1 1 40 40 LEU H H 40 8.167 8.167 8.267 -0.100 18112 8017 1 11 . 1 1 41 41 LYS N N 41 116.791 116.791 117.424 -0.633 18112 8018 1 11 . 1 1 41 41 LYS HA H 41 3.475 3.475 4.107 -0.632 18112 8019 1 11 . 1 1 41 41 LYS C C 41 178.793 178.793 178.856 -0.063 18112 8020 1 11 . 1 1 41 41 LYS CA C 41 59.161 59.161 59.316 -0.155 18112 8021 1 11 . 1 1 41 41 LYS CB C 41 30.992 30.992 32.284 -1.292 18112 8022 1 11 . 1 1 41 41 LYS H H 41 7.632 7.632 7.928 -0.296 18112 8023 1 11 . 1 1 42 42 THR N N 42 112.819 112.819 114.304 -1.485 18112 8024 1 11 . 1 1 42 42 THR HA H 42 4.230 4.230 4.247 -0.017 18112 8025 1 11 . 1 1 42 42 THR C C 42 176.142 176.142 175.997 0.145 18112 8026 1 11 . 1 1 42 42 THR CA C 42 65.107 65.107 65.674 -0.567 18112 8027 1 11 . 1 1 42 42 THR CB C 42 68.306 68.306 68.937 -0.631 18112 8028 1 11 . 1 1 42 42 THR H H 42 7.469 7.469 7.946 -0.477 18112 8029 1 11 . 1 1 43 43 TYR N N 43 118.565 118.565 118.220 0.345 18112 8030 1 11 . 1 1 43 43 TYR HA H 43 4.204 4.204 4.392 -0.188 18112 8031 1 11 . 1 1 43 43 TYR C C 43 174.240 174.240 175.972 -1.732 18112 8032 1 11 . 1 1 43 43 TYR CA C 43 60.886 60.886 58.566 2.320 18112 8033 1 11 . 1 1 43 43 TYR CB C 43 38.165 38.165 38.648 -0.483 18112 8034 1 11 . 1 1 43 43 TYR H H 43 7.978 7.978 7.606 0.372 18112 8035 1 11 . 1 1 44 44 PHE N N 44 120.980 120.980 118.204 2.776 18112 8036 1 11 . 1 1 44 44 PHE HA H 44 4.920 4.920 5.022 -0.102 18112 8037 1 11 . 1 1 44 44 PHE C C 44 176.436 176.436 175.629 0.807 18112 8038 1 11 . 1 1 44 44 PHE CA C 44 56.672 56.672 56.333 0.339 18112 8039 1 11 . 1 1 44 44 PHE CB C 44 36.570 36.570 37.120 -0.550 18112 8040 1 11 . 1 1 44 44 PHE H H 44 7.955 7.955 8.016 -0.061 18112 8041 1 11 . 1 1 45 45 SER N N 45 113.407 113.407 117.510 -4.103 18112 8042 1 11 . 1 1 45 45 SER HA H 45 4.373 4.373 4.509 -0.136 18112 8043 1 11 . 1 1 45 45 SER C C 45 174.424 174.424 175.780 -1.356 18112 8044 1 11 . 1 1 45 45 SER CA C 45 61.037 61.037 60.485 0.552 18112 8045 1 11 . 1 1 45 45 SER CB C 45 62.711 62.711 64.403 -1.692 18112 8046 1 11 . 1 1 45 45 SER H H 45 7.932 7.932 8.172 -0.240 18112 8047 1 11 . 1 1 46 46 ASP N N 46 118.099 118.099 121.331 -3.232 18112 8048 1 11 . 1 1 46 46 ASP HA H 46 4.572 4.572 4.453 0.119 18112 8049 1 11 . 1 1 46 46 ASP C C 46 174.866 174.866 176.599 -1.733 18112 8050 1 11 . 1 1 46 46 ASP CA C 46 53.602 53.602 55.880 -2.278 18112 8051 1 11 . 1 1 46 46 ASP CB C 46 38.992 38.992 39.963 -0.971 18112 8052 1 11 . 1 1 46 46 ASP H H 46 9.889 9.889 8.522 1.367 18112 8053 1 11 . 1 1 47 47 VAL N N 47 121.496 121.496 120.213 1.283 18112 8054 1 11 . 1 1 47 47 VAL HA H 47 4.058 4.058 3.573 0.485 18112 8055 1 11 . 1 1 47 47 VAL C C 47 174.676 174.676 176.861 -2.185 18112 8056 1 11 . 1 1 47 47 VAL CA C 47 61.006 61.006 63.887 -2.881 18112 8057 1 11 . 1 1 47 47 VAL CB C 47 32.110 32.110 31.572 0.538 18112 8058 1 11 . 1 1 47 47 VAL H H 47 7.781 7.781 7.594 0.187 18112 8059 1 11 . 1 1 48 48 LYS N N 48 126.100 126.100 117.208 8.892 18112 8060 1 11 . 1 1 48 48 LYS HA H 48 4.402 4.402 3.899 0.503 18112 8061 1 11 . 1 1 48 48 LYS C C 48 175.564 175.564 175.662 -0.098 18112 8062 1 11 . 1 1 48 48 LYS CA C 48 54.874 54.874 57.783 -2.909 18112 8063 1 11 . 1 1 48 48 LYS CB C 48 30.189 30.189 31.710 -1.521 18112 8064 1 11 . 1 1 48 48 LYS H H 48 8.245 8.245 7.492 0.753 18112 8065 1 11 . 1 1 49 49 PHE N N 49 125.341 125.341 115.373 9.968 18112 8066 1 11 . 1 1 49 49 PHE HA H 49 3.813 3.813 4.082 -0.269 18112 8067 1 11 . 1 1 49 49 PHE C C 49 175.708 175.708 174.843 0.865 18112 8068 1 11 . 1 1 49 49 PHE CA C 49 60.861 60.861 58.232 2.629 18112 8069 1 11 . 1 1 49 49 PHE CB C 49 38.616 38.616 35.988 2.628 18112 8070 1 11 . 1 1 49 49 PHE H H 49 8.626 8.626 7.637 0.989 18112 8071 1 11 . 1 1 50 50 ASN N N 50 115.408 115.408 119.562 -4.154 18112 8072 1 11 . 1 1 50 50 ASN C C 50 176.072 176.072 176.482 -0.410 18112 8073 1 11 . 1 1 50 50 ASN CA C 50 51.730 51.730 52.803 -1.073 18112 8074 1 11 . 1 1 50 50 ASN H H 50 7.030 7.030 8.259 -1.229 18112 8075 1 11 . 1 1 51 51 ARG N N 51 122.706 122.706 122.827 -0.121 18112 8076 1 11 . 1 1 51 51 ARG CA C 51 59.534 59.534 58.673 0.861 18112 8077 1 11 . 1 1 51 51 ARG H H 51 7.790 7.790 8.900 -1.110 18112 8078 1 11 . 1 1 52 52 CYS N N 52 117.340 117.340 117.072 0.268 18112 8079 1 11 . 1 1 52 52 CYS HA H 52 4.108 4.108 4.181 -0.073 18112 8080 1 11 . 1 1 52 52 CYS C C 52 178.200 178.200 176.740 1.460 18112 8081 1 11 . 1 1 52 52 CYS CA C 52 61.143 61.143 63.495 -2.352 18112 8082 1 11 . 1 1 52 52 CYS H H 52 7.681 7.681 7.910 -0.229 18112 8083 1 11 . 1 1 53 53 ILE N N 53 122.321 122.321 116.632 5.689 18112 8084 1 11 . 1 1 53 53 ILE HA H 53 3.588 3.588 3.790 -0.202 18112 8085 1 11 . 1 1 53 53 ILE C C 53 177.492 177.492 177.269 0.223 18112 8086 1 11 . 1 1 53 53 ILE CA C 53 64.109 64.109 64.007 0.102 18112 8087 1 11 . 1 1 53 53 ILE CB C 53 37.603 37.603 37.215 0.388 18112 8088 1 11 . 1 1 53 53 ILE H H 53 8.035 8.035 7.670 0.365 18112 8089 1 11 . 1 1 54 54 THR C C 54 175.903 175.903 176.513 -0.610 18112 8090 1 11 . 1 1 54 54 THR CA C 54 67.308 67.308 66.326 0.982 18112 8091 1 11 . 1 1 55 55 SER N N 55 113.819 113.819 117.465 -3.646 18112 8092 1 11 . 1 1 55 55 SER H H 55 7.844 7.844 7.930 -0.086 18112 8093 1 11 . 1 1 56 56 GLN C C 56 179.792 179.792 177.505 2.287 18112 8094 1 11 . 1 1 57 57 LEU N N 57 116.701 116.701 120.456 -3.755 18112 8095 1 11 . 1 1 57 57 LEU HA H 57 4.519 4.519 2.881 1.638 18112 8096 1 11 . 1 1 57 57 LEU C C 57 178.775 178.775 178.522 0.253 18112 8097 1 11 . 1 1 57 57 LEU CA C 57 55.232 55.232 57.290 -2.058 18112 8098 1 11 . 1 1 57 57 LEU CB C 57 37.131 37.131 41.593 -4.462 18112 8099 1 11 . 1 1 57 57 LEU H H 57 8.267 8.267 7.449 0.818 18112 8100 1 11 . 1 1 58 58 ILE N N 58 122.522 122.522 117.888 4.634 18112 8101 1 11 . 1 1 58 58 ILE HA H 58 4.640 4.640 3.654 0.986 18112 8102 1 11 . 1 1 58 58 ILE C C 58 177.380 177.380 178.395 -1.015 18112 8103 1 11 . 1 1 58 58 ILE CA C 58 62.163 62.163 63.475 -1.312 18112 8104 1 11 . 1 1 58 58 ILE CB C 58 30.657 30.657 36.497 -5.840 18112 8105 1 11 . 1 1 58 58 ILE H H 58 8.111 8.111 7.827 0.284 18112 8106 1 11 . 1 1 59 59 LYS N N 59 121.002 121.002 121.345 -0.343 18112 8107 1 11 . 1 1 59 59 LYS C C 59 177.600 177.600 178.907 -1.307 18112 8108 1 11 . 1 1 59 59 LYS CA C 59 57.570 57.570 59.019 -1.449 18112 8109 1 11 . 1 1 59 59 LYS CB C 59 39.101 39.101 31.881 7.220 18112 8110 1 11 . 1 1 59 59 LYS H H 59 7.432 7.432 7.675 -0.243 18112 8111 1 11 . 1 1 60 60 TRP N N 60 118.679 118.679 119.699 -1.020 18112 8112 1 11 . 1 1 60 60 TRP HA H 60 3.739 3.739 4.110 -0.371 18112 8113 1 11 . 1 1 60 60 TRP C C 60 178.246 178.246 178.903 -0.657 18112 8114 1 11 . 1 1 60 60 TRP CA C 60 59.818 59.818 58.388 1.430 18112 8115 1 11 . 1 1 60 60 TRP CB C 60 31.851 31.851 28.285 3.567 18112 8116 1 11 . 1 1 60 60 TRP H H 60 7.565 7.565 7.848 -0.283 18112 8117 1 11 . 1 1 61 61 PHE N N 61 118.005 118.005 117.634 0.371 18112 8118 1 11 . 1 1 61 61 PHE HA H 61 3.882 3.882 4.128 -0.246 18112 8119 1 11 . 1 1 61 61 PHE CA C 61 60.054 60.054 59.322 0.732 18112 8120 1 11 . 1 1 61 61 PHE H H 61 7.819 7.819 8.512 -0.693 18112 8121 1 11 . 1 1 62 62 SER N N 62 121.144 121.144 115.907 5.237 18112 8122 1 11 . 1 1 62 62 SER C C 62 177.840 177.840 176.629 1.211 18112 8123 1 11 . 1 1 62 62 SER CA C 62 55.892 55.892 62.069 -6.177 18112 8124 1 11 . 1 1 62 62 SER H H 62 8.878 8.878 8.276 0.602 18112 8125 1 11 . 1 1 63 63 ASN N N 63 115.303 115.303 120.336 -5.033 18112 8126 1 11 . 1 1 63 63 ASN C C 63 177.222 177.222 178.006 -0.784 18112 8127 1 11 . 1 1 63 63 ASN CA C 63 60.467 60.467 55.918 4.549 18112 8128 1 11 . 1 1 63 63 ASN H H 63 8.001 8.001 8.155 -0.154 18112 8129 1 11 . 1 1 64 64 PHE N N 64 112.571 112.571 121.351 -8.780 18112 8130 1 11 . 1 1 64 64 PHE CA C 64 56.453 56.453 60.496 -4.043 18112 8131 1 11 . 1 1 64 64 PHE H H 64 7.082 7.082 8.294 -1.212 18112 8132 1 11 . 1 1 65 65 ARG N N 65 116.695 116.695 118.863 -2.168 18112 8133 1 11 . 1 1 65 65 ARG CA C 65 59.590 59.590 60.544 -0.954 18112 8134 1 11 . 1 1 65 65 ARG H H 65 8.091 8.091 8.722 -0.631 18112 8135 1 11 . 1 1 66 66 GLU N N 66 121.653 121.653 119.273 2.380 18112 8136 1 11 . 1 1 66 66 GLU HA H 66 4.739 4.739 4.253 0.486 18112 8137 1 11 . 1 1 66 66 GLU C C 66 174.621 174.621 178.703 -4.082 18112 8138 1 11 . 1 1 66 66 GLU CA C 66 59.583 59.583 59.402 0.181 18112 8139 1 11 . 1 1 66 66 GLU H H 66 7.597 7.597 8.386 -0.789 18112 8140 1 11 . 1 1 67 67 PHE N N 67 111.578 111.578 121.298 -9.720 18112 8141 1 11 . 1 1 67 67 PHE C C 67 176.164 176.164 177.655 -1.491 18112 8142 1 11 . 1 1 67 67 PHE CA C 67 61.156 61.156 61.800 -0.644 18112 8143 1 11 . 1 1 67 67 PHE H H 67 7.067 7.067 8.179 -1.112 18112 8144 1 11 . 1 1 68 68 TYR N N 68 119.370 119.370 119.294 0.076 18112 8145 1 11 . 1 1 68 68 TYR C C 68 176.844 176.844 178.450 -1.606 18112 8146 1 11 . 1 1 68 68 TYR CA C 68 61.758 61.758 61.974 -0.215 18112 8147 1 11 . 1 1 68 68 TYR H H 68 7.442 7.442 9.023 -1.581 18112 8148 1 11 . 1 1 69 69 TYR N N 69 116.047 116.047 119.850 -3.803 18112 8149 1 11 . 1 1 69 69 TYR HA H 69 4.086 4.086 4.160 -0.074 18112 8150 1 11 . 1 1 69 69 TYR C C 69 180.328 180.328 177.581 2.747 18112 8151 1 11 . 1 1 69 69 TYR CA C 69 61.528 61.528 62.029 -0.501 18112 8152 1 11 . 1 1 69 69 TYR H H 69 9.127 9.127 8.442 0.685 18112 8153 1 11 . 1 1 70 70 ILE N N 70 124.738 124.738 118.779 5.959 18112 8154 1 11 . 1 1 70 70 ILE HA H 70 3.828 3.828 3.493 0.335 18112 8155 1 11 . 1 1 70 70 ILE C C 70 179.585 179.585 178.179 1.406 18112 8156 1 11 . 1 1 70 70 ILE CA C 70 65.787 65.787 64.445 1.341 18112 8157 1 11 . 1 1 70 70 ILE CB C 70 36.435 36.435 37.448 -1.013 18112 8158 1 11 . 1 1 70 70 ILE H H 70 8.631 8.631 8.200 0.431 18112 8159 1 11 . 1 1 71 71 GLN N N 71 117.940 117.940 118.686 -0.746 18112 8160 1 11 . 1 1 71 71 GLN HA H 71 3.826 3.826 3.437 0.389 18112 8161 1 11 . 1 1 71 71 GLN C C 71 178.192 178.192 178.158 0.034 18112 8162 1 11 . 1 1 71 71 GLN CA C 71 57.779 57.779 58.021 -0.242 18112 8163 1 11 . 1 1 71 71 GLN H H 71 7.738 7.738 8.049 -0.311 18112 8164 1 11 . 1 1 72 72 MET N N 72 117.353 117.353 117.618 -0.265 18112 8165 1 11 . 1 1 72 72 MET HA H 72 4.112 4.112 3.975 0.137 18112 8166 1 11 . 1 1 72 72 MET C C 72 177.203 177.203 178.355 -1.152 18112 8167 1 11 . 1 1 72 72 MET CA C 72 57.272 57.272 56.090 1.181 18112 8168 1 11 . 1 1 72 72 MET H H 72 7.844 7.844 7.780 0.064 18112 8169 1 11 . 1 1 73 73 GLU N N 73 117.858 117.858 120.473 -2.615 18112 8170 1 11 . 1 1 73 73 GLU HA H 73 3.572 3.572 3.932 -0.360 18112 8171 1 11 . 1 1 73 73 GLU C C 73 177.344 177.344 178.466 -1.122 18112 8172 1 11 . 1 1 73 73 GLU CA C 73 60.324 60.324 59.710 0.614 18112 8173 1 11 . 1 1 73 73 GLU H H 73 7.503 7.503 8.049 -0.546 18112 8174 1 11 . 1 1 74 74 LYS N N 74 118.716 118.716 118.999 -0.283 18112 8175 1 11 . 1 1 74 74 LYS HA H 74 3.867 3.867 4.005 -0.138 18112 8176 1 11 . 1 1 74 74 LYS C C 74 180.077 180.077 179.415 0.662 18112 8177 1 11 . 1 1 74 74 LYS CA C 74 59.754 59.754 59.202 0.552 18112 8178 1 11 . 1 1 74 74 LYS H H 74 7.912 7.912 7.519 0.393 18112 8179 1 11 . 1 1 75 75 TYR N N 75 117.309 117.309 118.759 -1.450 18112 8180 1 11 . 1 1 75 75 TYR HA H 75 4.085 4.085 4.251 -0.166 18112 8181 1 11 . 1 1 75 75 TYR C C 75 178.874 178.874 178.176 0.698 18112 8182 1 11 . 1 1 75 75 TYR CA C 75 63.306 63.306 58.696 4.610 18112 8183 1 11 . 1 1 75 75 TYR H H 75 8.421 8.421 7.959 0.462 18112 8184 1 11 . 1 1 76 76 ALA N N 76 125.392 125.392 121.943 3.449 18112 8185 1 11 . 1 1 76 76 ALA HA H 76 4.221 4.221 4.146 0.075 18112 8186 1 11 . 1 1 76 76 ALA C C 76 178.850 178.850 179.313 -0.463 18112 8187 1 11 . 1 1 76 76 ALA CA C 76 56.280 56.280 55.392 0.888 18112 8188 1 11 . 1 1 76 76 ALA CB C 76 18.687 18.687 18.434 0.253 18112 8189 1 11 . 1 1 76 76 ALA H H 76 8.553 8.553 8.465 0.088 18112 8190 1 11 . 1 1 77 77 ARG N N 77 115.067 115.067 118.538 -3.471 18112 8191 1 11 . 1 1 77 77 ARG HA H 77 3.935 3.935 3.931 0.004 18112 8192 1 11 . 1 1 77 77 ARG C C 77 179.341 179.341 178.385 0.956 18112 8193 1 11 . 1 1 77 77 ARG CA C 77 60.499 60.499 59.823 0.676 18112 8194 1 11 . 1 1 77 77 ARG H H 77 8.471 8.471 8.380 0.091 18112 8195 1 11 . 1 1 78 78 GLN N N 78 120.107 120.107 118.917 1.190 18112 8196 1 11 . 1 1 78 78 GLN HA H 78 3.921 3.921 4.145 -0.224 18112 8197 1 11 . 1 1 78 78 GLN C C 78 177.289 177.289 178.313 -1.024 18112 8198 1 11 . 1 1 78 78 GLN CA C 78 58.619 58.619 58.466 0.153 18112 8199 1 11 . 1 1 78 78 GLN CB C 78 27.752 27.752 28.214 -0.462 18112 8200 1 11 . 1 1 78 78 GLN H H 78 8.142 8.142 7.998 0.144 18112 8201 1 11 . 1 1 79 79 ALA N N 79 120.809 120.809 122.757 -1.948 18112 8202 1 11 . 1 1 79 79 ALA HA H 79 4.308 4.308 4.117 0.191 18112 8203 1 11 . 1 1 79 79 ALA C C 79 179.924 179.924 180.083 -0.159 18112 8204 1 11 . 1 1 79 79 ALA CA C 79 54.970 54.970 55.245 -0.275 18112 8205 1 11 . 1 1 79 79 ALA CB C 79 17.064 17.064 18.594 -1.530 18112 8206 1 11 . 1 1 79 79 ALA H H 79 7.811 7.811 8.015 -0.204 18112 8207 1 11 . 1 1 80 80 ILE N N 80 118.524 118.524 118.927 -0.403 18112 8208 1 11 . 1 1 80 80 ILE HA H 80 3.894 3.894 3.648 0.246 18112 8209 1 11 . 1 1 80 80 ILE C C 80 181.268 181.268 178.011 3.257 18112 8210 1 11 . 1 1 80 80 ILE CA C 80 64.841 64.841 64.723 0.118 18112 8211 1 11 . 1 1 80 80 ILE CB C 80 37.125 37.125 37.822 -0.696 18112 8212 1 11 . 1 1 80 80 ILE H H 80 7.837 7.837 8.146 -0.309 18112 8213 1 11 . 1 1 81 81 ASN N N 81 121.233 121.233 117.126 4.107 18112 8214 1 11 . 1 1 81 81 ASN HA H 81 4.398 4.398 4.416 -0.018 18112 8215 1 11 . 1 1 81 81 ASN C C 81 176.546 176.546 177.106 -0.560 18112 8216 1 11 . 1 1 81 81 ASN CA C 81 55.892 55.892 55.781 0.111 18112 8217 1 11 . 1 1 81 81 ASN CB C 81 37.603 37.603 38.747 -1.144 18112 8218 1 11 . 1 1 81 81 ASN H H 81 8.262 8.262 8.143 0.119 18112 8219 1 11 . 1 1 82 82 ASP N N 82 119.240 119.240 117.585 1.655 18112 8220 1 11 . 1 1 82 82 ASP HA H 82 4.666 4.666 4.634 0.032 18112 8221 1 11 . 1 1 82 82 ASP C C 82 176.767 176.767 176.961 -0.194 18112 8222 1 11 . 1 1 82 82 ASP CA C 82 54.771 54.771 54.551 0.220 18112 8223 1 11 . 1 1 82 82 ASP CB C 82 40.121 40.121 41.684 -1.563 18112 8224 1 11 . 1 1 82 82 ASP H H 82 8.316 8.316 8.080 0.236 18112 8225 1 11 . 1 1 83 83 GLY N N 83 106.913 106.913 106.519 0.394 18112 8226 1 11 . 1 1 83 83 GLY C C 83 174.601 174.601 175.378 -0.777 18112 8227 1 11 . 1 1 83 83 GLY CA C 83 45.214 45.214 45.493 -0.279 18112 8228 1 11 . 1 1 83 83 GLY H H 83 7.810 7.810 7.972 -0.162 18112 8229 1 11 . 1 1 84 84 VAL N N 84 122.981 122.981 119.992 2.989 18112 8230 1 11 . 1 1 84 84 VAL HA H 84 3.850 3.850 3.767 0.083 18112 8231 1 11 . 1 1 84 84 VAL C C 84 177.265 177.265 177.849 -0.584 18112 8232 1 11 . 1 1 84 84 VAL CA C 84 64.270 64.270 64.688 -0.418 18112 8233 1 11 . 1 1 84 84 VAL CB C 84 30.471 30.471 32.066 -1.595 18112 8234 1 11 . 1 1 84 84 VAL H H 84 8.157 8.157 7.903 0.254 18112 8235 1 11 . 1 1 85 85 THR N N 85 115.232 115.232 107.802 7.430 18112 8236 1 11 . 1 1 85 85 THR HA H 85 4.716 4.716 4.208 0.508 18112 8237 1 11 . 1 1 85 85 THR C C 85 174.489 174.489 173.480 1.009 18112 8238 1 11 . 1 1 85 85 THR CA C 85 61.618 61.618 63.649 -2.031 18112 8239 1 11 . 1 1 85 85 THR CB C 85 70.081 70.081 68.338 1.743 18112 8240 1 11 . 1 1 85 85 THR H H 85 8.890 8.890 7.793 1.097 18112 8241 1 11 . 1 1 86 86 SER N N 86 117.009 117.009 115.637 1.372 18112 8242 1 11 . 1 1 86 86 SER HA H 86 5.046 5.046 4.458 0.588 18112 8243 1 11 . 1 1 86 86 SER C C 86 174.473 174.473 175.217 -0.744 18112 8244 1 11 . 1 1 86 86 SER CA C 86 55.922 55.922 55.858 0.064 18112 8245 1 11 . 1 1 86 86 SER CB C 86 64.385 64.385 64.599 -0.214 18112 8246 1 11 . 1 1 86 86 SER H H 86 7.704 7.704 7.713 -0.009 18112 8247 1 11 . 1 1 87 87 THR N N 87 118.634 118.634 118.957 -0.323 18112 8248 1 11 . 1 1 87 87 THR HA H 87 4.065 4.065 4.158 -0.093 18112 8249 1 11 . 1 1 87 87 THR C C 87 176.047 176.047 175.937 0.110 18112 8250 1 11 . 1 1 87 87 THR CA C 87 64.983 64.983 63.930 1.053 18112 8251 1 11 . 1 1 87 87 THR CB C 87 68.045 68.045 68.630 -0.585 18112 8252 1 11 . 1 1 87 87 THR H H 87 8.711 8.711 8.465 0.246 18112 8253 1 11 . 1 1 88 88 GLU N N 88 117.889 117.889 120.409 -2.520 18112 8254 1 11 . 1 1 88 88 GLU HA H 88 3.881 3.881 4.113 -0.232 18112 8255 1 11 . 1 1 88 88 GLU C C 88 177.146 177.146 176.697 0.449 18112 8256 1 11 . 1 1 88 88 GLU CA C 88 57.814 57.814 57.973 -0.159 18112 8257 1 11 . 1 1 88 88 GLU CB C 88 28.050 28.050 28.817 -0.767 18112 8258 1 11 . 1 1 88 88 GLU H H 88 8.152 8.152 8.065 0.087 18112 8259 1 11 . 1 1 89 89 GLU N N 89 115.617 115.617 118.302 -2.685 18112 8260 1 11 . 1 1 89 89 GLU HA H 89 4.149 4.149 4.194 -0.045 18112 8261 1 11 . 1 1 89 89 GLU C C 89 176.192 176.192 177.344 -1.152 18112 8262 1 11 . 1 1 89 89 GLU CA C 89 56.133 56.133 57.093 -0.960 18112 8263 1 11 . 1 1 89 89 GLU CB C 89 29.415 29.415 30.060 -0.645 18112 8264 1 11 . 1 1 89 89 GLU H H 89 7.311 7.311 7.482 -0.171 18112 8265 1 11 . 1 1 90 90 LEU N N 90 120.870 120.870 118.676 2.194 18112 8266 1 11 . 1 1 90 90 LEU HA H 90 4.439 4.439 4.317 0.122 18112 8267 1 11 . 1 1 90 90 LEU C C 90 175.267 175.267 176.919 -1.652 18112 8268 1 11 . 1 1 90 90 LEU CA C 90 53.504 53.504 55.582 -2.078 18112 8269 1 11 . 1 1 90 90 LEU CB C 90 40.479 40.479 42.353 -1.874 18112 8270 1 11 . 1 1 90 90 LEU H H 90 7.311 7.311 7.359 -0.048 18112 8271 1 11 . 1 1 91 91 SER N N 91 118.376 118.376 113.917 4.459 18112 8272 1 11 . 1 1 91 91 SER HA H 91 4.747 4.747 4.707 0.040 18112 8273 1 11 . 1 1 91 91 SER C C 91 173.332 173.332 173.007 0.325 18112 8274 1 11 . 1 1 91 91 SER CA C 91 56.314 56.314 57.850 -1.536 18112 8275 1 11 . 1 1 91 91 SER CB C 91 64.615 64.615 64.125 0.490 18112 8276 1 11 . 1 1 91 91 SER H H 91 8.221 8.221 7.735 0.486 18112 8277 1 11 . 1 1 92 92 ILE N N 92 122.247 122.247 122.447 -0.200 18112 8278 1 11 . 1 1 92 92 ILE HA H 92 4.537 4.537 4.264 0.273 18112 8279 1 11 . 1 1 92 92 ILE C C 92 174.059 174.059 174.323 -0.264 18112 8280 1 11 . 1 1 92 92 ILE CA C 92 59.881 59.881 59.530 0.351 18112 8281 1 11 . 1 1 92 92 ILE CB C 92 37.820 37.820 42.291 -4.471 18112 8282 1 11 . 1 1 92 92 ILE H H 92 8.570 8.570 8.394 0.176 18112 8283 1 11 . 1 1 93 93 THR N N 93 116.069 116.069 120.503 -4.434 18112 8284 1 11 . 1 1 93 93 THR HA H 93 4.580 4.580 4.186 0.394 18112 8285 1 11 . 1 1 93 93 THR C C 93 175.049 175.049 174.025 1.024 18112 8286 1 11 . 1 1 93 93 THR CA C 93 58.988 58.988 64.339 -5.351 18112 8287 1 11 . 1 1 93 93 THR CB C 93 71.362 71.362 68.005 3.357 18112 8288 1 11 . 1 1 93 93 THR H H 93 7.224 7.224 8.649 -1.425 18112 8289 1 11 . 1 1 94 94 ARG N N 94 116.595 116.595 128.290 -11.695 18112 8290 1 11 . 1 1 94 94 ARG HA H 94 3.077 3.077 4.585 -1.508 18112 8291 1 11 . 1 1 94 94 ARG C C 94 175.076 175.076 176.235 -1.159 18112 8292 1 11 . 1 1 94 94 ARG CA C 94 57.119 57.119 54.714 2.405 18112 8293 1 11 . 1 1 94 94 ARG CB C 94 27.838 27.838 31.698 -3.860 18112 8294 1 11 . 1 1 94 94 ARG H H 94 8.596 8.596 7.946 0.650 18112 8295 1 11 . 1 1 95 95 ASP N N 95 113.735 113.735 121.861 -8.126 18112 8296 1 11 . 1 1 95 95 ASP HA H 95 4.765 4.765 3.762 1.003 18112 8297 1 11 . 1 1 95 95 ASP C C 95 175.876 175.876 175.568 0.308 18112 8298 1 11 . 1 1 95 95 ASP CA C 95 53.156 53.156 56.039 -2.883 18112 8299 1 11 . 1 1 95 95 ASP CB C 95 41.166 41.166 40.501 0.665 18112 8300 1 11 . 1 1 95 95 ASP H H 95 7.607 7.607 8.728 -1.121 18112 8301 1 11 . 1 1 96 96 CYS N N 96 116.012 116.012 116.346 -0.334 18112 8302 1 11 . 1 1 96 96 CYS C C 96 174.361 174.361 176.152 -1.791 18112 8303 1 11 . 1 1 96 96 CYS CA C 96 56.562 56.562 59.700 -3.138 18112 8304 1 11 . 1 1 96 96 CYS CB C 96 29.416 29.416 28.602 0.814 18112 8305 1 11 . 1 1 96 96 CYS H H 96 7.094 7.094 7.651 -0.557 18112 8306 1 11 . 1 1 97 97 GLU N N 97 123.087 123.087 121.545 1.542 18112 8307 1 11 . 1 1 97 97 GLU C C 97 178.748 178.748 178.211 0.537 18112 8308 1 11 . 1 1 97 97 GLU CA C 97 59.912 59.912 59.408 0.504 18112 8309 1 11 . 1 1 97 97 GLU CB C 97 29.195 29.195 29.471 -0.276 18112 8310 1 11 . 1 1 97 97 GLU H H 97 9.003 9.003 8.099 0.904 18112 8311 1 11 . 1 1 98 98 LEU N N 98 120.942 120.942 120.142 0.800 18112 8312 1 11 . 1 1 98 98 LEU HA H 98 3.614 3.614 4.098 -0.484 18112 8313 1 11 . 1 1 98 98 LEU C C 98 177.796 177.796 178.915 -1.119 18112 8314 1 11 . 1 1 98 98 LEU CA C 98 58.090 58.090 57.362 0.728 18112 8315 1 11 . 1 1 98 98 LEU CB C 98 39.778 39.778 41.690 -1.912 18112 8316 1 11 . 1 1 98 98 LEU H H 98 8.656 8.656 7.646 1.010 18112 8317 1 11 . 1 1 99 99 TYR N N 99 118.313 118.313 119.214 -0.901 18112 8318 1 11 . 1 1 99 99 TYR C C 99 177.077 177.077 178.338 -1.261 18112 8319 1 11 . 1 1 99 99 TYR CA C 99 62.622 62.622 60.815 1.807 18112 8320 1 11 . 1 1 99 99 TYR CB C 99 38.742 38.742 37.380 1.362 18112 8321 1 11 . 1 1 99 99 TYR H H 99 7.522 7.522 7.751 -0.229 18112 8322 1 11 . 1 1 100 100 ARG N N 100 118.101 118.101 117.671 0.430 18112 8323 1 11 . 1 1 100 100 ARG C C 100 178.616 178.616 178.791 -0.175 18112 8324 1 11 . 1 1 100 100 ARG CA C 100 59.915 59.915 56.428 3.487 18112 8325 1 11 . 1 1 100 100 ARG CB C 100 29.100 29.100 29.249 -0.149 18112 8326 1 11 . 1 1 100 100 ARG H H 100 8.243 8.243 8.212 0.031 18112 8327 1 11 . 1 1 101 101 ALA N N 101 120.972 120.972 124.306 -3.334 18112 8328 1 11 . 1 1 101 101 ALA HA H 101 4.145 4.145 4.148 -0.003 18112 8329 1 11 . 1 1 101 101 ALA C C 101 181.359 181.359 179.002 2.357 18112 8330 1 11 . 1 1 101 101 ALA CA C 101 55.057 55.057 55.149 -0.092 18112 8331 1 11 . 1 1 101 101 ALA CB C 101 17.543 17.543 18.453 -0.910 18112 8332 1 11 . 1 1 101 101 ALA H H 101 8.352 8.352 8.307 0.045 18112 8333 1 11 . 1 1 102 102 LEU N N 102 115.683 115.683 117.959 -2.276 18112 8334 1 11 . 1 1 102 102 LEU HA H 102 4.333 4.333 4.264 0.069 18112 8335 1 11 . 1 1 102 102 LEU C C 102 178.583 178.583 179.731 -1.148 18112 8336 1 11 . 1 1 102 102 LEU CA C 102 57.634 57.634 57.657 -0.023 18112 8337 1 11 . 1 1 102 102 LEU CB C 102 41.716 41.716 41.265 0.451 18112 8338 1 11 . 1 1 102 102 LEU H H 102 7.960 7.960 8.121 -0.161 18112 8339 1 11 . 1 1 103 103 ASN N N 103 118.957 118.957 119.754 -0.797 18112 8340 1 11 . 1 1 103 103 ASN C C 103 177.470 177.470 177.932 -0.462 18112 8341 1 11 . 1 1 103 103 ASN CA C 103 56.974 56.974 55.956 1.018 18112 8342 1 11 . 1 1 103 103 ASN CB C 103 38.140 38.140 38.641 -0.501 18112 8343 1 11 . 1 1 103 103 ASN H H 103 9.301 9.301 8.314 0.987 18112 8344 1 11 . 1 1 104 104 MET N N 104 113.763 113.763 116.214 -2.451 18112 8345 1 11 . 1 1 104 104 MET CA C 104 57.362 57.362 57.116 0.246 18112 8346 1 11 . 1 1 104 104 MET CB C 104 31.895 31.895 31.888 0.007 18112 8347 1 11 . 1 1 104 104 MET H H 104 8.332 8.332 8.106 0.226 18112 8348 1 11 . 1 1 105 105 HIS N N 105 116.024 116.024 116.316 -0.292 18112 8349 1 11 . 1 1 105 105 HIS HA H 105 3.764 3.764 4.578 -0.814 18112 8350 1 11 . 1 1 105 105 HIS C C 105 176.939 176.939 176.762 0.177 18112 8351 1 11 . 1 1 105 105 HIS CA C 105 59.069 59.069 58.180 0.889 18112 8352 1 11 . 1 1 105 105 HIS H H 105 7.156 7.156 8.525 -1.369 18112 8353 1 11 . 1 1 106 106 TYR N N 106 113.161 113.161 116.829 -3.668 18112 8354 1 11 . 1 1 106 106 TYR C C 106 173.767 173.767 175.912 -2.145 18112 8355 1 11 . 1 1 106 106 TYR CA C 106 58.488 58.488 60.224 -1.736 18112 8356 1 11 . 1 1 106 106 TYR CB C 106 38.225 38.225 39.913 -1.688 18112 8357 1 11 . 1 1 106 106 TYR H H 106 7.204 7.204 8.347 -1.143 18112 8358 1 11 . 1 1 107 107 ASN N N 107 118.875 118.875 112.121 6.754 18112 8359 1 11 . 1 1 107 107 ASN HA H 107 3.922 3.922 4.886 -0.964 18112 8360 1 11 . 1 1 107 107 ASN C C 107 175.815 175.815 173.220 2.595 18112 8361 1 11 . 1 1 107 107 ASN CA C 107 51.233 51.233 53.311 -2.078 18112 8362 1 11 . 1 1 107 107 ASN CB C 107 38.142 38.142 40.733 -2.591 18112 8363 1 11 . 1 1 107 107 ASN H H 107 8.127 8.127 8.228 -0.101 18112 8364 1 11 . 1 1 108 108 LYS N N 108 122.850 122.850 119.460 3.390 18112 8365 1 11 . 1 1 108 108 LYS HA H 108 3.954 3.954 4.381 -0.427 18112 8366 1 11 . 1 1 108 108 LYS C C 108 177.586 177.586 176.482 1.104 18112 8367 1 11 . 1 1 108 108 LYS CA C 108 59.749 59.749 56.738 3.011 18112 8368 1 11 . 1 1 108 108 LYS CB C 108 31.498 31.498 32.570 -1.072 18112 8369 1 11 . 1 1 108 108 LYS H H 108 7.772 7.772 8.709 -0.937 18112 8370 1 11 . 1 1 109 109 ALA N N 109 118.054 118.054 121.003 -2.949 18112 8371 1 11 . 1 1 109 109 ALA HA H 109 4.137 4.137 4.280 -0.143 18112 8372 1 11 . 1 1 109 109 ALA C C 109 177.889 177.889 177.756 0.133 18112 8373 1 11 . 1 1 109 109 ALA CA C 109 52.299 52.299 52.366 -0.067 18112 8374 1 11 . 1 1 109 109 ALA CB C 109 17.787 17.787 18.564 -0.777 18112 8375 1 11 . 1 1 109 109 ALA H H 109 8.307 8.307 8.114 0.193 18112 8376 1 11 . 1 1 110 110 ASN N N 110 115.542 115.542 117.539 -1.997 18112 8377 1 11 . 1 1 110 110 ASN HA H 110 4.480 4.480 4.635 -0.155 18112 8378 1 11 . 1 1 110 110 ASN C C 110 174.277 174.277 174.310 -0.033 18112 8379 1 11 . 1 1 110 110 ASN CA C 110 53.504 53.504 53.952 -0.448 18112 8380 1 11 . 1 1 110 110 ASN CB C 110 37.283 37.283 37.306 -0.023 18112 8381 1 11 . 1 1 110 110 ASN H H 110 8.353 8.353 8.060 0.293 18112 8382 1 11 . 1 1 111 111 ASP N N 111 114.692 114.692 120.692 -6.000 18112 8383 1 11 . 1 1 111 111 ASP HA H 111 4.485 4.485 4.618 -0.133 18112 8384 1 11 . 1 1 111 111 ASP C C 111 174.868 174.868 176.736 -1.868 18112 8385 1 11 . 1 1 111 111 ASP CA C 111 53.227 53.227 55.833 -2.606 18112 8386 1 11 . 1 1 111 111 ASP CB C 111 39.228 39.228 41.844 -2.616 18112 8387 1 11 . 1 1 111 111 ASP H H 111 8.297 8.297 7.921 0.376 18112 8388 1 11 . 1 1 112 112 PHE N N 112 120.927 120.927 121.670 -0.743 18112 8389 1 11 . 1 1 112 112 PHE HA H 112 4.752 4.752 4.563 0.189 18112 8390 1 11 . 1 1 112 112 PHE C C 112 174.633 174.633 175.727 -1.094 18112 8391 1 11 . 1 1 112 112 PHE CA C 112 56.346 56.346 57.761 -1.415 18112 8392 1 11 . 1 1 112 112 PHE H H 112 7.784 7.784 8.331 -0.547 18112 8393 1 11 . 1 1 113 113 GLU N N 113 128.111 128.111 126.315 1.796 18112 8394 1 11 . 1 1 113 113 GLU HA H 113 4.011 4.011 3.827 0.184 18112 8395 1 11 . 1 1 113 113 GLU C C 113 173.502 173.502 175.314 -1.812 18112 8396 1 11 . 1 1 113 113 GLU CA C 113 55.100 55.100 57.899 -2.799 18112 8397 1 11 . 1 1 113 113 GLU H H 113 7.752 7.752 8.652 -0.900 18112 8398 1 11 . 1 1 114 114 VAL N N 114 129.326 129.326 113.537 15.789 18112 8399 1 11 . 1 1 114 114 VAL HA H 114 3.241 3.241 3.492 -0.251 18112 8400 1 11 . 1 1 114 114 VAL CA C 114 60.838 60.838 61.919 -1.081 18112 8401 1 11 . 1 1 114 114 VAL CB C 114 32.609 32.609 29.510 3.099 18112 8402 1 11 . 1 1 114 114 VAL H H 114 8.008 8.008 7.613 0.395 18112 8403 1 11 . 1 1 115 115 PRO HA H 115 4.429 4.429 4.516 -0.087 18112 8404 1 11 . 1 1 115 115 PRO C C 115 177.421 177.421 178.289 -0.868 18112 8405 1 11 . 1 1 115 115 PRO CA C 115 61.882 61.882 62.560 -0.678 18112 8406 1 11 . 1 1 115 115 PRO CB C 115 30.974 30.974 32.759 -1.785 18112 8407 1 11 . 1 1 116 116 GLU N N 116 123.936 123.936 119.081 4.855 18112 8408 1 11 . 1 1 116 116 GLU C C 116 179.034 179.034 178.704 0.330 18112 8409 1 11 . 1 1 116 116 GLU CA C 116 58.913 58.913 60.184 -1.271 18112 8410 1 11 . 1 1 116 116 GLU CB C 116 28.378 28.378 29.124 -0.746 18112 8411 1 11 . 1 1 116 116 GLU H H 116 8.757 8.757 8.824 -0.067 18112 8412 1 11 . 1 1 117 117 ARG N N 117 116.943 116.943 117.499 -0.556 18112 8413 1 11 . 1 1 117 117 ARG C C 117 177.570 177.570 178.294 -0.724 18112 8414 1 11 . 1 1 117 117 ARG CA C 117 57.033 57.033 58.379 -1.346 18112 8415 1 11 . 1 1 117 117 ARG CB C 117 28.172 28.172 29.203 -1.031 18112 8416 1 11 . 1 1 117 117 ARG H H 117 8.733 8.733 8.594 0.139 18112 8417 1 11 . 1 1 118 118 PHE N N 118 117.528 117.528 121.879 -4.351 18112 8418 1 11 . 1 1 118 118 PHE HA H 118 4.137 4.137 4.260 -0.123 18112 8419 1 11 . 1 1 118 118 PHE C C 118 176.992 176.992 176.805 0.187 18112 8420 1 11 . 1 1 118 118 PHE CA C 118 61.627 61.627 61.360 0.267 18112 8421 1 11 . 1 1 118 118 PHE CB C 118 37.386 37.386 39.180 -1.794 18112 8422 1 11 . 1 1 118 118 PHE H H 118 7.606 7.606 7.953 -0.347 18112 8423 1 11 . 1 1 119 119 LEU N N 119 118.483 118.483 118.701 -0.218 18112 8424 1 11 . 1 1 119 119 LEU HA H 119 3.684 3.684 3.917 -0.233 18112 8425 1 11 . 1 1 119 119 LEU C C 119 178.802 178.802 179.157 -0.355 18112 8426 1 11 . 1 1 119 119 LEU CA C 119 59.875 59.875 56.999 2.876 18112 8427 1 11 . 1 1 119 119 LEU CB C 119 39.453 39.453 40.210 -0.757 18112 8428 1 11 . 1 1 119 119 LEU H H 119 7.248 7.248 7.689 -0.441 18112 8429 1 11 . 1 1 120 120 GLU N N 120 117.870 117.870 120.585 -2.715 18112 8430 1 11 . 1 1 120 120 GLU C C 120 179.932 179.932 179.107 0.825 18112 8431 1 11 . 1 1 120 120 GLU CA C 120 59.150 59.150 59.170 -0.020 18112 8432 1 11 . 1 1 120 120 GLU CB C 120 28.878 28.878 29.224 -0.346 18112 8433 1 11 . 1 1 120 120 GLU H H 120 7.423 7.423 8.114 -0.691 18112 8434 1 11 . 1 1 121 121 VAL N N 121 120.777 120.777 120.160 0.617 18112 8435 1 11 . 1 1 121 121 VAL HA H 121 3.545 3.545 3.335 0.210 18112 8436 1 11 . 1 1 121 121 VAL C C 121 179.302 179.302 177.742 1.560 18112 8437 1 11 . 1 1 121 121 VAL CA C 121 66.875 66.875 66.697 0.178 18112 8438 1 11 . 1 1 121 121 VAL CB C 121 30.823 30.823 31.453 -0.630 18112 8439 1 11 . 1 1 121 121 VAL H H 121 8.313 8.313 7.861 0.452 18112 8440 1 11 . 1 1 122 122 ALA N N 122 127.029 127.029 119.979 7.050 18112 8441 1 11 . 1 1 122 122 ALA HA H 122 4.251 4.251 3.686 0.565 18112 8442 1 11 . 1 1 122 122 ALA C C 122 178.366 178.366 179.449 -1.083 18112 8443 1 11 . 1 1 122 122 ALA CA C 122 54.748 54.748 55.167 -0.419 18112 8444 1 11 . 1 1 122 122 ALA CB C 122 16.565 16.565 17.966 -1.401 18112 8445 1 11 . 1 1 122 122 ALA H H 122 8.896 8.896 7.748 1.148 18112 8446 1 11 . 1 1 123 123 GLN N N 123 119.887 119.887 117.828 2.059 18112 8447 1 11 . 1 1 123 123 GLN C C 123 177.908 177.908 178.330 -0.422 18112 8448 1 11 . 1 1 123 123 GLN CA C 123 60.671 60.671 58.281 2.390 18112 8449 1 11 . 1 1 123 123 GLN H H 123 8.349 8.349 7.918 0.431 18112 8450 1 11 . 1 1 124 124 ILE N N 124 120.632 120.632 121.400 -0.768 18112 8451 1 11 . 1 1 124 124 ILE HA H 124 3.651 3.651 3.662 -0.011 18112 8452 1 11 . 1 1 124 124 ILE C C 124 178.703 178.703 178.378 0.325 18112 8453 1 11 . 1 1 124 124 ILE CA C 124 65.945 65.945 64.855 1.090 18112 8454 1 11 . 1 1 124 124 ILE H H 124 8.204 8.204 8.058 0.146 18112 8455 1 11 . 1 1 125 125 THR N N 125 115.084 115.084 117.259 -2.175 18112 8456 1 11 . 1 1 125 125 THR C C 125 175.568 175.568 176.555 -0.987 18112 8457 1 11 . 1 1 125 125 THR CA C 125 67.872 67.872 67.168 0.704 18112 8458 1 11 . 1 1 125 125 THR H H 125 8.399 8.399 8.208 0.191 18112 8459 1 11 . 1 1 126 126 LEU N N 126 125.011 125.011 121.615 3.396 18112 8460 1 11 . 1 1 126 126 LEU HA H 126 4.085 4.085 4.373 -0.288 18112 8461 1 11 . 1 1 126 126 LEU C C 126 178.559 178.559 177.990 0.569 18112 8462 1 11 . 1 1 126 126 LEU CA C 126 58.843 58.843 57.517 1.326 18112 8463 1 11 . 1 1 126 126 LEU CB C 126 41.421 41.421 41.870 -0.449 18112 8464 1 11 . 1 1 126 126 LEU H H 126 8.728 8.728 8.041 0.687 18112 8465 1 11 . 1 1 127 127 ARG N N 127 117.076 117.076 118.364 -1.288 18112 8466 1 11 . 1 1 127 127 ARG HA H 127 3.929 3.929 4.158 -0.229 18112 8467 1 11 . 1 1 127 127 ARG C C 127 177.984 177.984 178.513 -0.529 18112 8468 1 11 . 1 1 127 127 ARG CA C 127 60.685 60.685 59.261 1.424 18112 8469 1 11 . 1 1 127 127 ARG CB C 127 28.079 28.079 29.477 -1.398 18112 8470 1 11 . 1 1 127 127 ARG H H 127 8.213 8.213 8.284 -0.071 18112 8471 1 11 . 1 1 128 128 GLU N N 128 118.617 118.617 121.262 -2.645 18112 8472 1 11 . 1 1 128 128 GLU HA H 128 4.147 4.147 4.184 -0.037 18112 8473 1 11 . 1 1 128 128 GLU C C 128 181.150 181.150 178.868 2.282 18112 8474 1 11 . 1 1 128 128 GLU CA C 128 59.508 59.508 59.147 0.361 18112 8475 1 11 . 1 1 128 128 GLU H H 128 8.478 8.478 8.061 0.417 18112 8476 1 11 . 1 1 129 129 PHE N N 129 119.267 119.267 119.620 -0.353 18112 8477 1 11 . 1 1 129 129 PHE HA H 129 4.104 4.104 4.343 -0.239 18112 8478 1 11 . 1 1 129 129 PHE C C 129 177.170 177.170 177.693 -0.523 18112 8479 1 11 . 1 1 129 129 PHE CA C 129 63.694 63.694 62.633 1.061 18112 8480 1 11 . 1 1 129 129 PHE H H 129 8.570 8.570 8.435 0.135 18112 8481 1 11 . 1 1 130 130 PHE N N 130 118.739 118.739 119.443 -0.704 18112 8482 1 11 . 1 1 130 130 PHE HA H 130 3.884 3.884 4.045 -0.161 18112 8483 1 11 . 1 1 130 130 PHE C C 130 175.860 175.860 177.061 -1.201 18112 8484 1 11 . 1 1 130 130 PHE CA C 130 62.819 62.819 62.189 0.630 18112 8485 1 11 . 1 1 130 130 PHE H H 130 8.740 8.740 8.610 0.130 18112 8486 1 11 . 1 1 131 131 ASN N N 131 116.028 116.028 117.740 -1.712 18112 8487 1 11 . 1 1 131 131 ASN HA H 131 4.373 4.373 4.282 0.091 18112 8488 1 11 . 1 1 131 131 ASN C C 131 178.228 178.228 177.584 0.644 18112 8489 1 11 . 1 1 131 131 ASN CA C 131 55.150 55.150 56.571 -1.421 18112 8490 1 11 . 1 1 131 131 ASN H H 131 8.864 8.864 8.335 0.529 18112 8491 1 11 . 1 1 132 132 ALA N N 132 120.922 120.922 123.093 -2.171 18112 8492 1 11 . 1 1 132 132 ALA HA H 132 4.020 4.020 4.155 -0.135 18112 8493 1 11 . 1 1 132 132 ALA C C 132 178.515 178.515 179.720 -1.205 18112 8494 1 11 . 1 1 132 132 ALA CA C 132 54.924 54.924 54.931 -0.007 18112 8495 1 11 . 1 1 132 132 ALA CB C 132 18.441 18.441 18.692 -0.251 18112 8496 1 11 . 1 1 132 132 ALA H H 132 7.745 7.745 7.926 -0.181 18112 8497 1 11 . 1 1 133 133 ILE N N 133 118.200 118.200 118.486 -0.286 18112 8498 1 11 . 1 1 133 133 ILE HA H 133 3.235 3.235 3.640 -0.405 18112 8499 1 11 . 1 1 133 133 ILE C C 133 180.606 180.606 177.996 2.610 18112 8500 1 11 . 1 1 133 133 ILE CA C 133 65.215 65.215 64.447 0.768 18112 8501 1 11 . 1 1 133 133 ILE CB C 133 38.291 38.291 37.878 0.413 18112 8502 1 11 . 1 1 133 133 ILE H H 133 7.999 7.999 7.736 0.263 18112 8503 1 11 . 1 1 134 134 ILE N N 134 122.564 122.564 120.021 2.543 18112 8504 1 11 . 1 1 134 134 ILE HA H 134 3.788 3.788 3.678 0.110 18112 8505 1 11 . 1 1 134 134 ILE C C 134 177.215 177.215 176.753 0.462 18112 8506 1 11 . 1 1 134 134 ILE CA C 134 63.584 63.584 63.004 0.580 18112 8507 1 11 . 1 1 134 134 ILE CB C 134 35.636 35.636 37.835 -2.199 18112 8508 1 11 . 1 1 134 134 ILE H H 134 8.670 8.670 7.870 0.800 18112 8509 1 11 . 1 1 135 135 ALA N N 135 119.989 119.989 121.556 -1.567 18112 8510 1 11 . 1 1 135 135 ALA HA H 135 4.357 4.357 4.163 0.194 18112 8511 1 11 . 1 1 135 135 ALA C C 135 177.786 177.786 178.672 -0.886 18112 8512 1 11 . 1 1 135 135 ALA CA C 135 51.521 51.521 53.923 -2.402 18112 8513 1 11 . 1 1 135 135 ALA CB C 135 18.839 18.839 19.501 -0.662 18112 8514 1 11 . 1 1 135 135 ALA H H 135 6.898 6.898 7.927 -1.029 18112 8515 1 11 . 1 1 136 136 GLY N N 136 107.682 107.682 102.992 4.690 18112 8516 1 11 . 1 1 136 136 GLY C C 136 176.324 176.324 173.985 2.339 18112 8517 1 11 . 1 1 136 136 GLY CA C 136 45.469 45.469 44.734 0.735 18112 8518 1 11 . 1 1 136 136 GLY H H 136 7.913 7.913 7.678 0.235 18112 8519 1 11 . 1 1 137 137 LYS N N 137 117.213 117.213 119.837 -2.624 18112 8520 1 11 . 1 1 137 137 LYS HA H 137 4.004 4.004 3.725 0.279 18112 8521 1 11 . 1 1 137 137 LYS C C 137 176.616 176.616 174.741 1.875 18112 8522 1 11 . 1 1 137 137 LYS CA C 137 57.499 57.499 56.802 0.697 18112 8523 1 11 . 1 1 137 137 LYS CB C 137 30.927 30.927 30.162 0.765 18112 8524 1 11 . 1 1 137 137 LYS H H 137 8.312 8.312 8.056 0.256 18112 8525 1 11 . 1 1 138 138 ASP N N 138 113.545 113.545 119.781 -6.236 18112 8526 1 11 . 1 1 138 138 ASP HA H 138 3.061 3.061 4.457 -1.396 18112 8527 1 11 . 1 1 138 138 ASP C C 138 174.698 174.698 175.603 -0.905 18112 8528 1 11 . 1 1 138 138 ASP CA C 138 53.694 53.694 54.933 -1.239 18112 8529 1 11 . 1 1 138 138 ASP CB C 138 36.008 36.008 39.762 -3.754 18112 8530 1 11 . 1 1 138 138 ASP H H 138 8.465 8.465 7.580 0.885 18112 8531 1 11 . 1 1 139 139 VAL N N 139 115.191 115.191 119.298 -4.107 18112 8532 1 11 . 1 1 139 139 VAL HA H 139 3.886 3.886 3.603 0.283 18112 8533 1 11 . 1 1 139 139 VAL C C 139 175.889 175.889 175.556 0.333 18112 8534 1 11 . 1 1 139 139 VAL CA C 139 62.793 62.793 62.393 0.400 18112 8535 1 11 . 1 1 139 139 VAL CB C 139 30.662 30.662 31.439 -0.777 18112 8536 1 11 . 1 1 139 139 VAL H H 139 6.610 6.610 7.604 -0.994 18112 8537 1 11 . 1 1 140 140 ASP N N 140 123.363 123.363 120.541 2.822 18112 8538 1 11 . 1 1 140 140 ASP C C 140 175.234 175.234 176.311 -1.077 18112 8539 1 11 . 1 1 140 140 ASP CA C 140 50.221 50.221 51.677 -1.456 18112 8540 1 11 . 1 1 140 140 ASP CB C 140 42.254 42.254 40.880 1.375 18112 8541 1 11 . 1 1 140 140 ASP H H 140 7.553 7.553 7.656 -0.103 18112 8542 1 11 . 1 1 141 141 PRO HA H 141 4.682 4.682 4.499 0.183 18112 8543 1 11 . 1 1 141 141 PRO C C 141 178.678 178.678 178.419 0.259 18112 8544 1 11 . 1 1 141 141 PRO CA C 141 64.532 64.532 64.725 -0.193 18112 8545 1 11 . 1 1 141 141 PRO CB C 141 31.331 31.331 31.882 -0.551 18112 8546 1 11 . 1 1 142 142 SER N N 142 114.421 114.421 115.383 -0.962 18112 8547 1 11 . 1 1 142 142 SER HA H 142 4.565 4.565 4.288 0.277 18112 8548 1 11 . 1 1 142 142 SER C C 142 176.524 176.524 176.674 -0.150 18112 8549 1 11 . 1 1 142 142 SER CA C 142 58.711 58.711 61.114 -2.403 18112 8550 1 11 . 1 1 142 142 SER CB C 142 62.783 62.783 62.803 -0.020 18112 8551 1 11 . 1 1 142 142 SER H H 142 8.703 8.703 8.252 0.451 18112 8552 1 11 . 1 1 143 143 TRP N N 143 123.598 123.598 120.720 2.878 18112 8553 1 11 . 1 1 143 143 TRP HA H 143 4.136 4.136 4.312 -0.176 18112 8554 1 11 . 1 1 143 143 TRP C C 143 177.113 177.113 176.746 0.367 18112 8555 1 11 . 1 1 143 143 TRP CA C 143 59.803 59.803 57.969 1.834 18112 8556 1 11 . 1 1 143 143 TRP CB C 143 26.364 26.364 27.898 -1.534 18112 8557 1 11 . 1 1 143 143 TRP H H 143 8.374 8.374 8.466 -0.092 18112 8558 1 11 . 1 1 144 144 LYS N N 144 119.293 119.293 120.749 -1.456 18112 8559 1 11 . 1 1 144 144 LYS HA H 144 2.719 2.719 3.033 -0.314 18112 8560 1 11 . 1 1 144 144 LYS C C 144 177.243 177.243 178.203 -0.960 18112 8561 1 11 . 1 1 144 144 LYS CA C 144 58.851 58.851 59.243 -0.392 18112 8562 1 11 . 1 1 144 144 LYS CB C 144 29.373 29.373 31.722 -2.349 18112 8563 1 11 . 1 1 144 144 LYS H H 144 7.196 7.196 7.278 -0.082 18112 8564 1 11 . 1 1 145 145 LYS N N 145 116.440 116.440 119.483 -3.043 18112 8565 1 11 . 1 1 145 145 LYS HA H 145 3.490 3.490 4.097 -0.607 18112 8566 1 11 . 1 1 145 145 LYS C C 145 179.149 179.149 178.869 0.280 18112 8567 1 11 . 1 1 145 145 LYS CA C 145 59.271 59.271 59.196 0.075 18112 8568 1 11 . 1 1 145 145 LYS CB C 145 30.521 30.521 32.438 -1.917 18112 8569 1 11 . 1 1 145 145 LYS H H 145 7.389 7.389 7.610 -0.221 18112 8570 1 11 . 1 1 146 146 ALA N N 146 118.582 118.582 121.968 -3.386 18112 8571 1 11 . 1 1 146 146 ALA HA H 146 3.932 3.932 4.021 -0.089 18112 8572 1 11 . 1 1 146 146 ALA C C 146 179.968 179.968 179.673 0.295 18112 8573 1 11 . 1 1 146 146 ALA CA C 146 54.241 54.241 55.044 -0.803 18112 8574 1 11 . 1 1 146 146 ALA CB C 146 17.689 17.689 18.125 -0.436 18112 8575 1 11 . 1 1 146 146 ALA H H 146 7.112 7.112 7.756 -0.644 18112 8576 1 11 . 1 1 147 147 ILE N N 147 118.537 118.537 119.014 -0.477 18112 8577 1 11 . 1 1 147 147 ILE HA H 147 3.642 3.642 3.414 0.228 18112 8578 1 11 . 1 1 147 147 ILE C C 147 178.919 178.919 178.000 0.919 18112 8579 1 11 . 1 1 147 147 ILE CA C 147 64.418 64.418 65.626 -1.208 18112 8580 1 11 . 1 1 147 147 ILE CB C 147 36.519 36.519 37.512 -0.993 18112 8581 1 11 . 1 1 147 147 ILE H H 147 6.734 6.734 7.688 -0.954 18112 8582 1 11 . 1 1 148 148 TYR N N 148 121.033 121.033 117.818 3.215 18112 8583 1 11 . 1 1 148 148 TYR HA H 148 4.489 4.489 4.146 0.343 18112 8584 1 11 . 1 1 148 148 TYR C C 148 178.348 178.348 178.346 0.002 18112 8585 1 11 . 1 1 148 148 TYR CA C 148 57.389 57.389 59.587 -2.198 18112 8586 1 11 . 1 1 148 148 TYR CB C 148 35.280 35.280 37.207 -1.927 18112 8587 1 11 . 1 1 148 148 TYR H H 148 8.126 8.126 7.981 0.145 18112 8588 1 11 . 1 1 149 149 LYS N N 149 114.484 114.484 120.063 -5.579 18112 8589 1 11 . 1 1 149 149 LYS C C 149 178.051 178.051 178.646 -0.595 18112 8590 1 11 . 1 1 149 149 LYS CA C 149 59.036 59.036 59.744 -0.708 18112 8591 1 11 . 1 1 149 149 LYS CB C 149 31.575 31.575 32.597 -1.022 18112 8592 1 11 . 1 1 149 149 LYS H H 149 7.364 7.364 7.928 -0.564 18112 8593 1 11 . 1 1 150 150 VAL N N 150 117.812 117.812 117.946 -0.134 18112 8594 1 11 . 1 1 150 150 VAL HA H 150 3.770 3.770 3.746 0.024 18112 8595 1 11 . 1 1 150 150 VAL C C 150 178.786 178.786 177.394 1.392 18112 8596 1 11 . 1 1 150 150 VAL CA C 150 65.070 65.070 65.626 -0.556 18112 8597 1 11 . 1 1 150 150 VAL CB C 150 29.515 29.515 31.706 -2.191 18112 8598 1 11 . 1 1 150 150 VAL H H 150 7.254 7.254 7.949 -0.695 18112 8599 1 11 . 1 1 151 151 ILE N N 151 117.884 117.884 113.363 4.521 18112 8600 1 11 . 1 1 151 151 ILE C C 151 180.539 180.539 176.969 3.570 18112 8601 1 11 . 1 1 151 151 ILE CA C 151 61.490 61.490 62.100 -0.610 18112 8602 1 11 . 1 1 151 151 ILE CB C 151 33.994 33.994 38.062 -4.069 18112 8603 1 11 . 1 1 151 151 ILE H H 151 8.154 8.154 7.887 0.267 18112 8604 1 11 . 1 1 152 152 CYS N N 152 118.649 118.649 121.767 -3.118 18112 8605 1 11 . 1 1 152 152 CYS HA H 152 4.153 4.153 4.440 -0.287 18112 8606 1 11 . 1 1 152 152 CYS C C 152 174.888 174.888 176.382 -1.494 18112 8607 1 11 . 1 1 152 152 CYS CA C 152 61.052 61.052 61.474 -0.422 18112 8608 1 11 . 1 1 152 152 CYS CB C 152 36.364 36.364 28.060 8.304 18112 8609 1 11 . 1 1 152 152 CYS H H 152 8.711 8.711 7.942 0.769 18112 8610 1 11 . 1 1 153 153 LYS N N 153 118.498 118.498 118.940 -0.442 18112 8611 1 11 . 1 1 153 153 LYS C C 153 177.389 177.389 177.794 -0.405 18112 8612 1 11 . 1 1 153 153 LYS CA C 153 56.243 56.243 58.728 -2.485 18112 8613 1 11 . 1 1 153 153 LYS CB C 153 31.343 31.343 32.217 -0.874 18112 8614 1 11 . 1 1 153 153 LYS H H 153 6.782 6.782 7.723 -0.941 18112 8615 1 11 . 1 1 154 154 LEU N N 154 117.318 117.318 116.251 1.067 18112 8616 1 11 . 1 1 154 154 LEU HA H 154 4.576 4.576 4.196 0.380 18112 8617 1 11 . 1 1 154 154 LEU C C 154 177.161 177.161 177.425 -0.264 18112 8618 1 11 . 1 1 154 154 LEU CA C 154 53.782 53.782 55.188 -1.406 18112 8619 1 11 . 1 1 154 154 LEU CB C 154 40.881 40.881 41.967 -1.086 18112 8620 1 11 . 1 1 154 154 LEU H H 154 7.616 7.616 7.124 0.492 18112 8621 1 11 . 1 1 155 155 ASP N N 155 121.564 121.564 118.828 2.736 18112 8622 1 11 . 1 1 155 155 ASP C C 155 177.094 177.094 176.350 0.744 18112 8623 1 11 . 1 1 155 155 ASP CA C 155 55.732 55.732 54.378 1.354 18112 8624 1 11 . 1 1 155 155 ASP CB C 155 40.139 40.139 42.495 -2.356 18112 8625 1 11 . 1 1 155 155 ASP H H 155 7.582 7.582 7.685 -0.103 18112 8626 1 11 . 1 1 156 156 SER N N 156 117.352 117.352 119.297 -1.945 18112 8627 1 11 . 1 1 156 156 SER HA H 156 4.818 4.818 4.442 0.376 18112 8628 1 11 . 1 1 156 156 SER C C 156 173.409 173.409 174.218 -0.809 18112 8629 1 11 . 1 1 156 156 SER CA C 156 57.073 57.073 60.005 -2.932 18112 8630 1 11 . 1 1 156 156 SER CB C 156 65.150 65.150 64.129 1.021 18112 8631 1 11 . 1 1 156 156 SER H H 156 8.846 8.846 8.665 0.181 18112 8632 1 11 . 1 1 157 157 GLU N N 157 120.688 120.688 118.560 2.128 18112 8633 1 11 . 1 1 157 157 GLU HA H 157 4.038 4.038 4.465 -0.427 18112 8634 1 11 . 1 1 157 157 GLU C C 157 176.332 176.332 174.419 1.913 18112 8635 1 11 . 1 1 157 157 GLU CA C 157 56.464 56.464 55.387 1.077 18112 8636 1 11 . 1 1 157 157 GLU CB C 157 29.206 29.206 30.968 -1.762 18112 8637 1 11 . 1 1 157 157 GLU H H 157 8.356 8.356 7.543 0.813 18112 8638 1 11 . 1 1 158 158 VAL N N 158 126.906 126.906 114.654 12.252 18112 8639 1 11 . 1 1 158 158 VAL HA H 158 3.449 3.449 4.526 -1.077 18112 8640 1 11 . 1 1 158 158 VAL C C 158 176.382 176.382 174.141 2.241 18112 8641 1 11 . 1 1 158 158 VAL CA C 158 59.584 59.584 58.656 0.929 18112 8642 1 11 . 1 1 158 158 VAL CB C 158 31.160 31.160 31.180 -0.020 18112 8643 1 11 . 1 1 158 158 VAL H H 158 8.561 8.561 8.038 0.523 18112 8644 1 11 . 1 1 159 159 PRO HA H 159 4.403 4.403 4.327 0.076 18112 8645 1 11 . 1 1 159 159 PRO C C 159 176.757 176.757 175.528 1.229 18112 8646 1 11 . 1 1 159 159 PRO CA C 159 63.845 63.845 62.490 1.355 18112 8647 1 11 . 1 1 159 159 PRO CB C 159 32.106 32.106 31.343 0.762 18112 8648 1 11 . 1 1 160 160 GLU N N 160 122.904 122.904 121.772 1.132 18112 8649 1 11 . 1 1 160 160 GLU HA H 160 4.008 4.008 3.892 0.116 18112 8650 1 11 . 1 1 160 160 GLU C C 160 179.132 179.132 175.798 3.334 18112 8651 1 11 . 1 1 160 160 GLU CA C 160 59.407 59.407 56.871 2.536 18112 8652 1 11 . 1 1 160 160 GLU CB C 160 28.991 28.991 29.622 -0.631 18112 8653 1 11 . 1 1 160 160 GLU H H 160 8.650 8.650 8.372 0.278 18112 8654 1 11 . 1 1 161 161 ILE N N 161 119.782 119.782 116.200 3.582 18112 8655 1 11 . 1 1 161 161 ILE HA H 161 4.146 4.146 4.208 -0.062 18112 8656 1 11 . 1 1 161 161 ILE C C 161 176.176 176.176 173.659 2.517 18112 8657 1 11 . 1 1 161 161 ILE CA C 161 62.034 62.034 60.286 1.748 18112 8658 1 11 . 1 1 161 161 ILE CB C 161 37.113 37.113 38.819 -1.706 18112 8659 1 11 . 1 1 161 161 ILE H H 161 8.448 8.448 7.063 1.385 18112 8660 1 11 . 1 1 162 162 PHE N N 162 117.594 117.594 126.738 -9.144 18112 8661 1 11 . 1 1 162 162 PHE C C 162 176.115 176.115 177.338 -1.223 18112 8662 1 11 . 1 1 162 162 PHE CA C 162 61.009 61.009 60.009 1.000 18112 8663 1 11 . 1 1 162 162 PHE CB C 162 38.394 38.394 39.011 -0.617 18112 8664 1 11 . 1 1 162 162 PHE H H 162 8.145 8.145 8.880 -0.735 18112 8665 1 11 . 1 1 163 163 LYS N N 163 116.083 116.083 119.609 -3.526 18112 8666 1 11 . 1 1 163 163 LYS C C 163 178.196 178.196 175.577 2.619 18112 8667 1 11 . 1 1 163 163 LYS CA C 163 58.136 58.136 58.139 -0.003 18112 8668 1 11 . 1 1 163 163 LYS CB C 163 31.694 31.694 32.567 -0.873 18112 8669 1 11 . 1 1 163 163 LYS H H 163 8.232 8.232 8.414 -0.182 18112 8670 1 11 . 1 1 164 164 SER N N 164 113.680 113.680 111.952 1.728 18112 8671 1 11 . 1 1 164 164 SER CA C 164 55.205 55.205 55.554 -0.349 18112 8672 1 11 . 1 1 164 164 SER CB C 164 63.265 63.265 64.303 -1.038 18112 8673 1 11 . 1 1 164 164 SER H H 164 7.708 7.708 7.684 0.024 18112 8674 1 11 . 1 1 165 165 PRO HA H 165 4.580 4.580 4.228 0.352 18112 8675 1 11 . 1 1 165 165 PRO C C 165 177.541 177.541 176.966 0.575 18112 8676 1 11 . 1 1 165 165 PRO CA C 165 63.950 63.950 63.907 0.043 18112 8677 1 11 . 1 1 165 165 PRO CB C 165 30.686 30.686 31.627 -0.941 18112 8678 1 11 . 1 1 166 166 ASN N N 166 116.304 116.304 117.918 -1.614 18112 8679 1 11 . 1 1 166 166 ASN HA H 166 5.029 5.029 4.489 0.540 18112 8680 1 11 . 1 1 166 166 ASN C C 166 175.811 175.811 176.790 -0.979 18112 8681 1 11 . 1 1 166 166 ASN CA C 166 51.962 51.962 55.301 -3.339 18112 8682 1 11 . 1 1 166 166 ASN CB C 166 37.915 37.915 38.060 -0.145 18112 8683 1 11 . 1 1 166 166 ASN H H 166 8.216 8.216 8.830 -0.614 18112 8684 1 11 . 1 1 167 167 CYS N N 167 116.078 116.078 119.484 -3.406 18112 8685 1 11 . 1 1 167 167 CYS HA H 167 4.011 4.011 4.329 -0.318 18112 8686 1 11 . 1 1 167 167 CYS C C 167 175.057 175.057 175.962 -0.905 18112 8687 1 11 . 1 1 167 167 CYS CA C 167 59.816 59.816 60.271 -0.455 18112 8688 1 11 . 1 1 167 167 CYS CB C 167 27.446 27.446 26.257 1.189 18112 8689 1 11 . 1 1 167 167 CYS H H 167 7.246 7.246 7.922 -0.676 18112 8690 1 11 . 1 1 168 168 LEU N N 168 120.082 120.082 119.556 0.526 18112 8691 1 11 . 1 1 168 168 LEU HA H 168 3.880 3.880 4.257 -0.377 18112 8692 1 11 . 1 1 168 168 LEU C C 168 178.541 178.541 178.102 0.439 18112 8693 1 11 . 1 1 168 168 LEU CA C 168 57.734 57.734 56.066 1.668 18112 8694 1 11 . 1 1 168 168 LEU CB C 168 38.825 38.825 39.742 -0.917 18112 8695 1 11 . 1 1 168 168 LEU H H 168 8.451 8.451 8.231 0.220 18112 8696 1 11 . 1 1 169 169 GLN N N 169 116.700 116.700 120.843 -4.143 18112 8697 1 11 . 1 1 169 169 GLN HA H 169 4.064 4.064 4.153 -0.089 18112 8698 1 11 . 1 1 169 169 GLN C C 169 177.378 177.378 177.730 -0.352 18112 8699 1 11 . 1 1 169 169 GLN CA C 169 57.675 57.675 58.310 -0.635 18112 8700 1 11 . 1 1 169 169 GLN CB C 169 27.710 27.710 28.309 -0.599 18112 8701 1 11 . 1 1 169 169 GLN H H 169 7.665 7.665 7.835 -0.170 18112 8702 1 11 . 1 1 170 170 GLU N N 170 116.701 116.701 119.444 -2.743 18112 8703 1 11 . 1 1 170 170 GLU HA H 170 4.214 4.214 4.131 0.083 18112 8704 1 11 . 1 1 170 170 GLU C C 170 177.730 177.730 177.553 0.177 18112 8705 1 11 . 1 1 170 170 GLU CA C 170 56.899 56.899 58.524 -1.625 18112 8706 1 11 . 1 1 170 170 GLU H H 170 7.405 7.405 7.753 -0.348 18112 8707 1 11 . 1 1 171 171 LEU N N 171 118.021 118.021 117.060 0.961 18112 8708 1 11 . 1 1 171 171 LEU HA H 171 4.209 4.209 4.206 0.003 18112 8709 1 11 . 1 1 171 171 LEU C C 171 177.005 177.005 177.550 -0.545 18112 8710 1 11 . 1 1 171 171 LEU CA C 171 55.870 55.870 55.386 0.484 18112 8711 1 11 . 1 1 171 171 LEU CB C 171 43.680 43.680 41.971 1.709 18112 8712 1 11 . 1 1 171 171 LEU H H 171 7.823 7.823 7.481 0.342 18112 8713 1 11 . 1 1 172 172 LEU N N 172 117.580 117.580 118.746 -1.166 18112 8714 1 11 . 1 1 172 172 LEU HA H 172 4.571 4.571 4.299 0.272 18112 8715 1 11 . 1 1 172 172 LEU C C 172 176.411 176.411 175.975 0.436 18112 8716 1 11 . 1 1 172 172 LEU CA C 172 53.972 53.972 54.811 -0.839 18112 8717 1 11 . 1 1 172 172 LEU CB C 172 40.483 40.483 39.213 1.270 18112 8718 1 11 . 1 1 172 172 LEU H H 172 7.306 7.306 7.280 0.026 18112 8719 1 11 . 1 1 173 173 HIS N N 173 123.310 123.310 122.296 1.014 18112 8720 1 11 . 1 1 173 173 HIS C C 173 179.022 179.022 174.127 4.895 18112 8721 1 11 . 1 1 173 173 HIS CA C 173 56.693 56.693 55.415 1.278 18112 8722 1 11 . 1 1 173 173 HIS CB C 173 29.371 29.371 32.900 -3.529 18112 8723 1 11 . 1 1 173 173 HIS H H 173 8.028 8.028 7.999 0.029 18112 8724 1 12 . 1 1 12 12 ALA N N 12 125.167 125.167 124.819 0.348 18112 8725 1 12 . 1 1 12 12 ALA C C 12 177.566 177.566 176.122 1.444 18112 8726 1 12 . 1 1 12 12 ALA CA C 12 52.067 52.067 51.173 0.894 18112 8727 1 12 . 1 1 12 12 ALA CB C 12 18.456 18.456 21.540 -3.084 18112 8728 1 12 . 1 1 12 12 ALA H H 12 8.311 8.311 7.879 0.432 18112 8729 1 12 . 1 1 13 13 MET N N 13 119.278 119.278 121.025 -1.747 18112 8730 1 12 . 1 1 13 13 MET C C 13 176.325 176.325 176.233 0.092 18112 8731 1 12 . 1 1 13 13 MET CA C 13 54.992 54.992 57.066 -2.074 18112 8732 1 12 . 1 1 13 13 MET CB C 13 32.308 32.308 33.346 -1.038 18112 8733 1 12 . 1 1 13 13 MET H H 13 8.269 8.269 8.599 -0.330 18112 8734 1 12 . 1 1 14 14 GLN N N 14 120.869 120.869 117.645 3.224 18112 8735 1 12 . 1 1 14 14 GLN HA H 14 4.399 4.399 4.346 0.053 18112 8736 1 12 . 1 1 14 14 GLN C C 14 175.644 175.644 174.058 1.586 18112 8737 1 12 . 1 1 14 14 GLN CA C 14 55.139 55.139 55.869 -0.730 18112 8738 1 12 . 1 1 14 14 GLN CB C 14 29.051 29.051 29.279 -0.228 18112 8739 1 12 . 1 1 14 14 GLN H H 14 8.501 8.501 8.193 0.308 18112 8740 1 12 . 1 1 15 15 GLU N N 15 122.042 122.042 124.797 -2.755 18112 8741 1 12 . 1 1 15 15 GLU C C 15 176.242 176.242 175.357 0.885 18112 8742 1 12 . 1 1 15 15 GLU CA C 15 56.064 56.064 55.562 0.502 18112 8743 1 12 . 1 1 15 15 GLU CB C 15 29.302 29.302 30.933 -1.631 18112 8744 1 12 . 1 1 15 15 GLU H H 15 8.547 8.547 8.229 0.318 18112 8745 1 12 . 1 1 16 16 GLY N N 16 108.821 108.821 111.515 -2.694 18112 8746 1 12 . 1 1 16 16 GLY C C 16 172.949 172.949 174.198 -1.249 18112 8747 1 12 . 1 1 16 16 GLY CA C 16 44.227 44.227 44.979 -0.752 18112 8748 1 12 . 1 1 16 16 GLY H H 16 8.100 8.100 8.250 -0.150 18112 8749 1 12 . 1 1 17 17 LEU N N 17 120.315 120.315 123.048 -2.733 18112 8750 1 12 . 1 1 17 17 LEU C C 17 177.334 177.334 177.406 -0.072 18112 8751 1 12 . 1 1 17 17 LEU CA C 17 53.544 53.544 54.524 -0.980 18112 8752 1 12 . 1 1 17 17 LEU CB C 17 42.140 42.140 42.849 -0.709 18112 8753 1 12 . 1 1 17 17 LEU H H 17 8.222 8.222 8.227 -0.005 18112 8754 1 12 . 1 1 18 18 SER N N 18 126.547 126.547 116.533 10.014 18112 8755 1 12 . 1 1 18 18 SER CA C 18 56.851 56.851 57.081 -0.230 18112 8756 1 12 . 1 1 18 18 SER CB C 18 64.636 64.636 63.219 1.417 18112 8757 1 12 . 1 1 18 18 SER H H 18 11.627 11.627 8.632 2.995 18112 8758 1 12 . 1 1 19 19 PRO C C 19 175.118 175.118 178.282 -3.164 18112 8759 1 12 . 1 1 20 20 ASN N N 20 121.372 121.372 116.611 4.761 18112 8760 1 12 . 1 1 20 20 ASN H H 20 8.172 8.172 8.792 -0.620 18112 8761 1 12 . 1 1 25 25 ALA CB C 25 18.020 18.020 18.604 -0.584 18112 8762 1 12 . 1 1 26 26 LYS N N 26 118.490 118.490 117.646 0.844 18112 8763 1 12 . 1 1 26 26 LYS CA C 26 56.146 56.146 58.827 -2.681 18112 8764 1 12 . 1 1 26 26 LYS H H 26 6.794 6.794 7.878 -1.084 18112 8765 1 12 . 1 1 31 31 TYR HA H 31 4.398 4.398 3.811 0.587 18112 8766 1 12 . 1 1 31 31 TYR C C 31 173.714 173.714 173.203 0.511 18112 8767 1 12 . 1 1 31 31 TYR CA C 31 59.757 59.757 58.410 1.347 18112 8768 1 12 . 1 1 32 32 THR N N 32 111.928 111.928 114.356 -2.428 18112 8769 1 12 . 1 1 32 32 THR HA H 32 4.209 4.209 4.313 -0.104 18112 8770 1 12 . 1 1 32 32 THR C C 32 171.061 171.061 172.624 -1.563 18112 8771 1 12 . 1 1 32 32 THR CA C 32 56.905 56.905 61.137 -4.232 18112 8772 1 12 . 1 1 32 32 THR CB C 32 69.707 69.707 70.931 -1.224 18112 8773 1 12 . 1 1 32 32 THR H H 32 8.237 8.237 7.511 0.726 18112 8774 1 12 . 1 1 33 33 ARG N N 33 124.856 124.856 125.676 -0.820 18112 8775 1 12 . 1 1 33 33 ARG C C 33 176.451 176.451 175.447 1.004 18112 8776 1 12 . 1 1 33 33 ARG CA C 33 55.627 55.627 55.402 0.225 18112 8777 1 12 . 1 1 33 33 ARG CB C 33 29.861 29.861 28.312 1.549 18112 8778 1 12 . 1 1 33 33 ARG H H 33 9.159 9.159 8.794 0.365 18112 8779 1 12 . 1 1 34 34 TYR N N 34 117.908 117.908 125.543 -7.635 18112 8780 1 12 . 1 1 34 34 TYR CA C 34 55.320 55.320 58.121 -2.801 18112 8781 1 12 . 1 1 34 34 TYR H H 34 8.995 8.995 8.119 0.876 18112 8782 1 12 . 1 1 35 35 PRO C C 35 177.280 177.280 178.162 -0.882 18112 8783 1 12 . 1 1 36 36 SER N N 36 116.410 116.410 112.225 4.185 18112 8784 1 12 . 1 1 36 36 SER C C 36 178.938 178.938 176.671 2.267 18112 8785 1 12 . 1 1 36 36 SER CA C 36 64.815 64.815 62.043 2.772 18112 8786 1 12 . 1 1 36 36 SER H H 36 8.106 8.106 7.976 0.130 18112 8787 1 12 . 1 1 37 37 SER N N 37 117.488 117.488 115.687 1.801 18112 8788 1 12 . 1 1 37 37 SER C C 37 177.698 177.698 176.870 0.828 18112 8789 1 12 . 1 1 37 37 SER CA C 37 61.357 61.357 61.261 0.096 18112 8790 1 12 . 1 1 37 37 SER CB C 37 68.118 68.118 62.688 5.430 18112 8791 1 12 . 1 1 37 37 SER H H 37 8.169 8.169 8.551 -0.382 18112 8792 1 12 . 1 1 38 38 ASN N N 38 115.638 115.638 121.228 -5.590 18112 8793 1 12 . 1 1 38 38 ASN HA H 38 4.259 4.259 4.343 -0.084 18112 8794 1 12 . 1 1 38 38 ASN C C 38 177.868 177.868 177.219 0.649 18112 8795 1 12 . 1 1 38 38 ASN CA C 38 55.907 55.907 56.141 -0.234 18112 8796 1 12 . 1 1 38 38 ASN CB C 38 37.230 37.230 38.369 -1.139 18112 8797 1 12 . 1 1 38 38 ASN H H 38 8.284 8.284 7.899 0.385 18112 8798 1 12 . 1 1 39 39 MET N N 39 121.352 121.352 119.926 1.426 18112 8799 1 12 . 1 1 39 39 MET HA H 39 4.170 4.170 3.374 0.796 18112 8800 1 12 . 1 1 39 39 MET C C 39 179.068 179.068 177.972 1.096 18112 8801 1 12 . 1 1 39 39 MET CA C 39 58.751 58.751 57.777 0.974 18112 8802 1 12 . 1 1 39 39 MET CB C 39 31.850 31.850 31.446 0.404 18112 8803 1 12 . 1 1 39 39 MET H H 39 7.857 7.857 7.923 -0.066 18112 8804 1 12 . 1 1 40 40 LEU N N 40 118.936 118.936 120.406 -1.470 18112 8805 1 12 . 1 1 40 40 LEU HA H 40 4.139 4.139 4.519 -0.380 18112 8806 1 12 . 1 1 40 40 LEU C C 40 178.700 178.700 178.483 0.217 18112 8807 1 12 . 1 1 40 40 LEU CA C 40 58.455 58.455 58.980 -0.525 18112 8808 1 12 . 1 1 40 40 LEU CB C 40 40.304 40.304 41.836 -1.532 18112 8809 1 12 . 1 1 40 40 LEU H H 40 8.167 8.167 8.121 0.046 18112 8810 1 12 . 1 1 41 41 LYS N N 41 116.791 116.791 115.709 1.082 18112 8811 1 12 . 1 1 41 41 LYS HA H 41 3.475 3.475 4.036 -0.561 18112 8812 1 12 . 1 1 41 41 LYS C C 41 178.793 178.793 178.802 -0.009 18112 8813 1 12 . 1 1 41 41 LYS CA C 41 59.161 59.161 59.120 0.041 18112 8814 1 12 . 1 1 41 41 LYS CB C 41 30.992 30.992 31.811 -0.819 18112 8815 1 12 . 1 1 41 41 LYS H H 41 7.632 7.632 7.965 -0.333 18112 8816 1 12 . 1 1 42 42 THR N N 42 112.819 112.819 115.540 -2.721 18112 8817 1 12 . 1 1 42 42 THR HA H 42 4.230 4.230 4.282 -0.052 18112 8818 1 12 . 1 1 42 42 THR C C 42 176.142 176.142 176.523 -0.381 18112 8819 1 12 . 1 1 42 42 THR CA C 42 65.107 65.107 65.819 -0.712 18112 8820 1 12 . 1 1 42 42 THR CB C 42 68.306 68.306 69.300 -0.994 18112 8821 1 12 . 1 1 42 42 THR H H 42 7.469 7.469 7.940 -0.471 18112 8822 1 12 . 1 1 43 43 TYR N N 43 118.565 118.565 119.473 -0.908 18112 8823 1 12 . 1 1 43 43 TYR HA H 43 4.204 4.204 4.396 -0.192 18112 8824 1 12 . 1 1 43 43 TYR C C 43 174.240 174.240 177.217 -2.977 18112 8825 1 12 . 1 1 43 43 TYR CA C 43 60.886 60.886 57.027 3.859 18112 8826 1 12 . 1 1 43 43 TYR CB C 43 38.165 38.165 38.182 -0.017 18112 8827 1 12 . 1 1 43 43 TYR H H 43 7.978 7.978 7.635 0.343 18112 8828 1 12 . 1 1 44 44 PHE N N 44 120.980 120.980 118.883 2.097 18112 8829 1 12 . 1 1 44 44 PHE HA H 44 4.920 4.920 4.827 0.093 18112 8830 1 12 . 1 1 44 44 PHE C C 44 176.436 176.436 175.809 0.627 18112 8831 1 12 . 1 1 44 44 PHE CA C 44 56.672 56.672 57.681 -1.009 18112 8832 1 12 . 1 1 44 44 PHE CB C 44 36.570 36.570 37.121 -0.551 18112 8833 1 12 . 1 1 44 44 PHE H H 44 7.955 7.955 7.912 0.043 18112 8834 1 12 . 1 1 45 45 SER N N 45 113.407 113.407 117.373 -3.966 18112 8835 1 12 . 1 1 45 45 SER HA H 45 4.373 4.373 4.591 -0.218 18112 8836 1 12 . 1 1 45 45 SER C C 45 174.424 174.424 174.791 -0.367 18112 8837 1 12 . 1 1 45 45 SER CA C 45 61.037 61.037 59.361 1.676 18112 8838 1 12 . 1 1 45 45 SER CB C 45 62.711 62.711 63.717 -1.006 18112 8839 1 12 . 1 1 45 45 SER H H 45 7.932 7.932 8.236 -0.304 18112 8840 1 12 . 1 1 46 46 ASP N N 46 118.099 118.099 119.684 -1.585 18112 8841 1 12 . 1 1 46 46 ASP HA H 46 4.572 4.572 4.612 -0.040 18112 8842 1 12 . 1 1 46 46 ASP C C 46 174.866 174.866 175.420 -0.554 18112 8843 1 12 . 1 1 46 46 ASP CA C 46 53.602 53.602 53.937 -0.334 18112 8844 1 12 . 1 1 46 46 ASP CB C 46 38.992 38.992 40.786 -1.794 18112 8845 1 12 . 1 1 46 46 ASP H H 46 9.889 9.889 8.439 1.450 18112 8846 1 12 . 1 1 47 47 VAL N N 47 121.496 121.496 120.791 0.705 18112 8847 1 12 . 1 1 47 47 VAL HA H 47 4.058 4.058 3.981 0.077 18112 8848 1 12 . 1 1 47 47 VAL C C 47 174.676 174.676 175.456 -0.780 18112 8849 1 12 . 1 1 47 47 VAL CA C 47 61.006 61.006 61.608 -0.602 18112 8850 1 12 . 1 1 47 47 VAL CB C 47 32.110 32.110 32.487 -0.377 18112 8851 1 12 . 1 1 47 47 VAL H H 47 7.781 7.781 7.479 0.302 18112 8852 1 12 . 1 1 48 48 LYS N N 48 126.100 126.100 126.026 0.074 18112 8853 1 12 . 1 1 48 48 LYS HA H 48 4.402 4.402 4.031 0.371 18112 8854 1 12 . 1 1 48 48 LYS C C 48 175.564 175.564 176.322 -0.758 18112 8855 1 12 . 1 1 48 48 LYS CA C 48 54.874 54.874 57.356 -2.482 18112 8856 1 12 . 1 1 48 48 LYS CB C 48 30.189 30.189 32.525 -2.336 18112 8857 1 12 . 1 1 48 48 LYS H H 48 8.245 8.245 8.362 -0.117 18112 8858 1 12 . 1 1 49 49 PHE N N 49 125.341 125.341 115.694 9.647 18112 8859 1 12 . 1 1 49 49 PHE HA H 49 3.813 3.813 4.201 -0.388 18112 8860 1 12 . 1 1 49 49 PHE C C 49 175.708 175.708 174.942 0.766 18112 8861 1 12 . 1 1 49 49 PHE CA C 49 60.861 60.861 57.200 3.661 18112 8862 1 12 . 1 1 49 49 PHE CB C 49 38.616 38.616 35.946 2.670 18112 8863 1 12 . 1 1 49 49 PHE H H 49 8.626 8.626 7.923 0.703 18112 8864 1 12 . 1 1 50 50 ASN N N 50 115.408 115.408 118.221 -2.813 18112 8865 1 12 . 1 1 50 50 ASN C C 50 176.072 176.072 176.204 -0.132 18112 8866 1 12 . 1 1 50 50 ASN CA C 50 51.730 51.730 52.627 -0.897 18112 8867 1 12 . 1 1 50 50 ASN H H 50 7.030 7.030 7.994 -0.964 18112 8868 1 12 . 1 1 51 51 ARG N N 51 122.706 122.706 119.366 3.340 18112 8869 1 12 . 1 1 51 51 ARG CA C 51 59.534 59.534 60.091 -0.557 18112 8870 1 12 . 1 1 51 51 ARG H H 51 7.790 7.790 8.783 -0.993 18112 8871 1 12 . 1 1 52 52 CYS N N 52 117.340 117.340 116.584 0.756 18112 8872 1 12 . 1 1 52 52 CYS HA H 52 4.108 4.108 4.098 0.010 18112 8873 1 12 . 1 1 52 52 CYS C C 52 178.200 178.200 176.730 1.470 18112 8874 1 12 . 1 1 52 52 CYS CA C 52 61.143 61.143 62.782 -1.639 18112 8875 1 12 . 1 1 52 52 CYS H H 52 7.681 7.681 8.119 -0.438 18112 8876 1 12 . 1 1 53 53 ILE N N 53 122.321 122.321 120.589 1.732 18112 8877 1 12 . 1 1 53 53 ILE HA H 53 3.588 3.588 3.573 0.015 18112 8878 1 12 . 1 1 53 53 ILE C C 53 177.492 177.492 176.809 0.683 18112 8879 1 12 . 1 1 53 53 ILE CA C 53 64.109 64.109 64.434 -0.325 18112 8880 1 12 . 1 1 53 53 ILE CB C 53 37.603 37.603 38.063 -0.460 18112 8881 1 12 . 1 1 53 53 ILE H H 53 8.035 8.035 7.834 0.201 18112 8882 1 12 . 1 1 54 54 THR C C 54 175.903 175.903 176.680 -0.777 18112 8883 1 12 . 1 1 54 54 THR CA C 54 67.308 67.308 67.374 -0.066 18112 8884 1 12 . 1 1 55 55 SER N N 55 113.819 113.819 118.229 -4.410 18112 8885 1 12 . 1 1 55 55 SER H H 55 7.844 7.844 8.051 -0.207 18112 8886 1 12 . 1 1 56 56 GLN C C 56 179.792 179.792 177.582 2.210 18112 8887 1 12 . 1 1 57 57 LEU N N 57 116.701 116.701 120.170 -3.469 18112 8888 1 12 . 1 1 57 57 LEU HA H 57 4.519 4.519 3.222 1.297 18112 8889 1 12 . 1 1 57 57 LEU C C 57 178.775 178.775 178.579 0.196 18112 8890 1 12 . 1 1 57 57 LEU CA C 57 55.232 55.232 57.211 -1.979 18112 8891 1 12 . 1 1 57 57 LEU CB C 57 37.131 37.131 41.739 -4.609 18112 8892 1 12 . 1 1 57 57 LEU H H 57 8.267 8.267 7.619 0.648 18112 8893 1 12 . 1 1 58 58 ILE N N 58 122.522 122.522 117.862 4.660 18112 8894 1 12 . 1 1 58 58 ILE HA H 58 4.640 4.640 3.663 0.977 18112 8895 1 12 . 1 1 58 58 ILE C C 58 177.380 177.380 178.057 -0.677 18112 8896 1 12 . 1 1 58 58 ILE CA C 58 62.163 62.163 62.981 -0.818 18112 8897 1 12 . 1 1 58 58 ILE CB C 58 30.657 30.657 36.581 -5.924 18112 8898 1 12 . 1 1 58 58 ILE H H 58 8.111 8.111 7.940 0.171 18112 8899 1 12 . 1 1 59 59 LYS N N 59 121.002 121.002 121.386 -0.384 18112 8900 1 12 . 1 1 59 59 LYS C C 59 177.600 177.600 178.992 -1.392 18112 8901 1 12 . 1 1 59 59 LYS CA C 59 57.570 57.570 59.195 -1.625 18112 8902 1 12 . 1 1 59 59 LYS CB C 59 39.101 39.101 31.855 7.246 18112 8903 1 12 . 1 1 59 59 LYS H H 59 7.432 7.432 7.773 -0.341 18112 8904 1 12 . 1 1 60 60 TRP N N 60 118.679 118.679 120.391 -1.712 18112 8905 1 12 . 1 1 60 60 TRP HA H 60 3.739 3.739 4.852 -1.113 18112 8906 1 12 . 1 1 60 60 TRP C C 60 178.246 178.246 179.509 -1.263 18112 8907 1 12 . 1 1 60 60 TRP CA C 60 59.818 59.818 58.426 1.392 18112 8908 1 12 . 1 1 60 60 TRP CB C 60 31.851 31.851 28.397 3.454 18112 8909 1 12 . 1 1 60 60 TRP H H 60 7.565 7.565 7.775 -0.210 18112 8910 1 12 . 1 1 61 61 PHE N N 61 118.005 118.005 117.082 0.923 18112 8911 1 12 . 1 1 61 61 PHE HA H 61 3.882 3.882 3.918 -0.036 18112 8912 1 12 . 1 1 61 61 PHE CA C 61 60.054 60.054 58.891 1.163 18112 8913 1 12 . 1 1 61 61 PHE H H 61 7.819 7.819 8.380 -0.561 18112 8914 1 12 . 1 1 62 62 SER N N 62 121.144 121.144 115.878 5.266 18112 8915 1 12 . 1 1 62 62 SER C C 62 177.840 177.840 176.148 1.692 18112 8916 1 12 . 1 1 62 62 SER CA C 62 55.892 55.892 61.446 -5.554 18112 8917 1 12 . 1 1 62 62 SER H H 62 8.878 8.878 8.306 0.572 18112 8918 1 12 . 1 1 63 63 ASN N N 63 115.303 115.303 120.562 -5.259 18112 8919 1 12 . 1 1 63 63 ASN C C 63 177.222 177.222 177.757 -0.535 18112 8920 1 12 . 1 1 63 63 ASN CA C 63 60.467 60.467 56.001 4.466 18112 8921 1 12 . 1 1 63 63 ASN H H 63 8.001 8.001 8.352 -0.351 18112 8922 1 12 . 1 1 64 64 PHE N N 64 112.571 112.571 123.232 -10.661 18112 8923 1 12 . 1 1 64 64 PHE CA C 64 56.453 56.453 61.317 -4.864 18112 8924 1 12 . 1 1 64 64 PHE H H 64 7.082 7.082 8.633 -1.551 18112 8925 1 12 . 1 1 65 65 ARG N N 65 116.695 116.695 119.193 -2.498 18112 8926 1 12 . 1 1 65 65 ARG CA C 65 59.590 59.590 60.326 -0.736 18112 8927 1 12 . 1 1 65 65 ARG H H 65 8.091 8.091 8.359 -0.268 18112 8928 1 12 . 1 1 66 66 GLU N N 66 121.653 121.653 119.374 2.279 18112 8929 1 12 . 1 1 66 66 GLU HA H 66 4.739 4.739 4.251 0.488 18112 8930 1 12 . 1 1 66 66 GLU C C 66 174.621 174.621 178.926 -4.305 18112 8931 1 12 . 1 1 66 66 GLU CA C 66 59.583 59.583 59.429 0.154 18112 8932 1 12 . 1 1 66 66 GLU H H 66 7.597 7.597 8.256 -0.659 18112 8933 1 12 . 1 1 67 67 PHE N N 67 111.578 111.578 120.997 -9.419 18112 8934 1 12 . 1 1 67 67 PHE C C 67 176.164 176.164 176.867 -0.703 18112 8935 1 12 . 1 1 67 67 PHE CA C 67 61.156 61.156 60.951 0.205 18112 8936 1 12 . 1 1 67 67 PHE H H 67 7.067 7.067 8.158 -1.091 18112 8937 1 12 . 1 1 68 68 TYR N N 68 119.370 119.370 120.619 -1.249 18112 8938 1 12 . 1 1 68 68 TYR C C 68 176.844 176.844 177.500 -0.656 18112 8939 1 12 . 1 1 68 68 TYR CA C 68 61.758 61.758 60.913 0.845 18112 8940 1 12 . 1 1 68 68 TYR H H 68 7.442 7.442 8.425 -0.983 18112 8941 1 12 . 1 1 69 69 TYR N N 69 116.047 116.047 119.347 -3.300 18112 8942 1 12 . 1 1 69 69 TYR HA H 69 4.086 4.086 3.991 0.095 18112 8943 1 12 . 1 1 69 69 TYR C C 69 180.328 180.328 177.570 2.758 18112 8944 1 12 . 1 1 69 69 TYR CA C 69 61.528 61.528 62.434 -0.906 18112 8945 1 12 . 1 1 69 69 TYR H H 69 9.127 9.127 8.322 0.805 18112 8946 1 12 . 1 1 70 70 ILE N N 70 124.738 124.738 118.428 6.310 18112 8947 1 12 . 1 1 70 70 ILE HA H 70 3.828 3.828 3.663 0.165 18112 8948 1 12 . 1 1 70 70 ILE C C 70 179.585 179.585 178.232 1.353 18112 8949 1 12 . 1 1 70 70 ILE CA C 70 65.787 65.787 63.938 1.849 18112 8950 1 12 . 1 1 70 70 ILE CB C 70 36.435 36.435 37.687 -1.252 18112 8951 1 12 . 1 1 70 70 ILE H H 70 8.631 8.631 8.206 0.425 18112 8952 1 12 . 1 1 71 71 GLN N N 71 117.940 117.940 119.497 -1.557 18112 8953 1 12 . 1 1 71 71 GLN HA H 71 3.826 3.826 3.743 0.083 18112 8954 1 12 . 1 1 71 71 GLN C C 71 178.192 178.192 177.627 0.565 18112 8955 1 12 . 1 1 71 71 GLN CA C 71 57.779 57.779 58.079 -0.300 18112 8956 1 12 . 1 1 71 71 GLN H H 71 7.738 7.738 7.875 -0.137 18112 8957 1 12 . 1 1 72 72 MET N N 72 117.353 117.353 119.834 -2.481 18112 8958 1 12 . 1 1 72 72 MET HA H 72 4.112 4.112 3.598 0.514 18112 8959 1 12 . 1 1 72 72 MET C C 72 177.203 177.203 177.423 -0.220 18112 8960 1 12 . 1 1 72 72 MET CA C 72 57.272 57.272 58.087 -0.815 18112 8961 1 12 . 1 1 72 72 MET H H 72 7.844 7.844 7.650 0.194 18112 8962 1 12 . 1 1 73 73 GLU N N 73 117.858 117.858 118.344 -0.486 18112 8963 1 12 . 1 1 73 73 GLU HA H 73 3.572 3.572 3.816 -0.244 18112 8964 1 12 . 1 1 73 73 GLU C C 73 177.344 177.344 178.283 -0.939 18112 8965 1 12 . 1 1 73 73 GLU CA C 73 60.324 60.324 59.396 0.928 18112 8966 1 12 . 1 1 73 73 GLU H H 73 7.503 7.503 7.818 -0.315 18112 8967 1 12 . 1 1 74 74 LYS N N 74 118.716 118.716 120.448 -1.732 18112 8968 1 12 . 1 1 74 74 LYS HA H 74 3.867 3.867 4.011 -0.144 18112 8969 1 12 . 1 1 74 74 LYS C C 74 180.077 180.077 179.295 0.782 18112 8970 1 12 . 1 1 74 74 LYS CA C 74 59.754 59.754 58.799 0.955 18112 8971 1 12 . 1 1 74 74 LYS H H 74 7.912 7.912 7.483 0.429 18112 8972 1 12 . 1 1 75 75 TYR N N 75 117.309 117.309 118.449 -1.140 18112 8973 1 12 . 1 1 75 75 TYR HA H 75 4.085 4.085 4.208 -0.123 18112 8974 1 12 . 1 1 75 75 TYR C C 75 178.874 178.874 178.404 0.470 18112 8975 1 12 . 1 1 75 75 TYR CA C 75 63.306 63.306 58.806 4.500 18112 8976 1 12 . 1 1 75 75 TYR H H 75 8.421 8.421 7.825 0.596 18112 8977 1 12 . 1 1 76 76 ALA N N 76 125.392 125.392 120.839 4.553 18112 8978 1 12 . 1 1 76 76 ALA HA H 76 4.221 4.221 4.070 0.151 18112 8979 1 12 . 1 1 76 76 ALA C C 76 178.850 178.850 179.908 -1.058 18112 8980 1 12 . 1 1 76 76 ALA CA C 76 56.280 56.280 55.288 0.991 18112 8981 1 12 . 1 1 76 76 ALA CB C 76 18.687 18.687 18.352 0.335 18112 8982 1 12 . 1 1 76 76 ALA H H 76 8.553 8.553 8.210 0.343 18112 8983 1 12 . 1 1 77 77 ARG N N 77 115.067 115.067 118.450 -3.383 18112 8984 1 12 . 1 1 77 77 ARG HA H 77 3.935 3.935 4.078 -0.143 18112 8985 1 12 . 1 1 77 77 ARG C C 77 179.341 179.341 178.314 1.027 18112 8986 1 12 . 1 1 77 77 ARG CA C 77 60.499 60.499 59.329 1.170 18112 8987 1 12 . 1 1 77 77 ARG H H 77 8.471 8.471 8.419 0.052 18112 8988 1 12 . 1 1 78 78 GLN N N 78 120.107 120.107 119.883 0.224 18112 8989 1 12 . 1 1 78 78 GLN HA H 78 3.921 3.921 4.115 -0.194 18112 8990 1 12 . 1 1 78 78 GLN C C 78 177.289 177.289 178.071 -0.782 18112 8991 1 12 . 1 1 78 78 GLN CA C 78 58.619 58.619 58.945 -0.326 18112 8992 1 12 . 1 1 78 78 GLN CB C 78 27.752 27.752 28.661 -0.909 18112 8993 1 12 . 1 1 78 78 GLN H H 78 8.142 8.142 8.192 -0.050 18112 8994 1 12 . 1 1 79 79 ALA N N 79 120.809 120.809 122.751 -1.942 18112 8995 1 12 . 1 1 79 79 ALA HA H 79 4.308 4.308 4.039 0.269 18112 8996 1 12 . 1 1 79 79 ALA C C 79 179.924 179.924 180.164 -0.240 18112 8997 1 12 . 1 1 79 79 ALA CA C 79 54.970 54.970 55.226 -0.256 18112 8998 1 12 . 1 1 79 79 ALA CB C 79 17.064 17.064 18.385 -1.321 18112 8999 1 12 . 1 1 79 79 ALA H H 79 7.811 7.811 7.934 -0.123 18112 9000 1 12 . 1 1 80 80 ILE N N 80 118.524 118.524 119.514 -0.990 18112 9001 1 12 . 1 1 80 80 ILE HA H 80 3.894 3.894 3.763 0.131 18112 9002 1 12 . 1 1 80 80 ILE C C 80 181.268 181.268 178.243 3.025 18112 9003 1 12 . 1 1 80 80 ILE CA C 80 64.841 64.841 63.495 1.346 18112 9004 1 12 . 1 1 80 80 ILE CB C 80 37.125 37.125 36.466 0.659 18112 9005 1 12 . 1 1 80 80 ILE H H 80 7.837 7.837 8.185 -0.348 18112 9006 1 12 . 1 1 81 81 ASN N N 81 121.233 121.233 117.405 3.828 18112 9007 1 12 . 1 1 81 81 ASN HA H 81 4.398 4.398 4.501 -0.103 18112 9008 1 12 . 1 1 81 81 ASN C C 81 176.546 176.546 177.198 -0.652 18112 9009 1 12 . 1 1 81 81 ASN CA C 81 55.892 55.892 55.629 0.263 18112 9010 1 12 . 1 1 81 81 ASN CB C 81 37.603 37.603 38.735 -1.132 18112 9011 1 12 . 1 1 81 81 ASN H H 81 8.262 8.262 8.057 0.205 18112 9012 1 12 . 1 1 82 82 ASP N N 82 119.240 119.240 117.293 1.947 18112 9013 1 12 . 1 1 82 82 ASP HA H 82 4.666 4.666 4.593 0.073 18112 9014 1 12 . 1 1 82 82 ASP C C 82 176.767 176.767 177.328 -0.561 18112 9015 1 12 . 1 1 82 82 ASP CA C 82 54.771 54.771 54.825 -0.054 18112 9016 1 12 . 1 1 82 82 ASP CB C 82 40.121 40.121 42.222 -2.101 18112 9017 1 12 . 1 1 82 82 ASP H H 82 8.316 8.316 8.113 0.203 18112 9018 1 12 . 1 1 83 83 GLY N N 83 106.913 106.913 107.497 -0.584 18112 9019 1 12 . 1 1 83 83 GLY C C 83 174.601 174.601 176.156 -1.555 18112 9020 1 12 . 1 1 83 83 GLY CA C 83 45.214 45.214 45.114 0.100 18112 9021 1 12 . 1 1 83 83 GLY H H 83 7.810 7.810 7.993 -0.183 18112 9022 1 12 . 1 1 84 84 VAL N N 84 122.981 122.981 122.247 0.734 18112 9023 1 12 . 1 1 84 84 VAL HA H 84 3.850 3.850 3.693 0.157 18112 9024 1 12 . 1 1 84 84 VAL C C 84 177.265 177.265 176.592 0.673 18112 9025 1 12 . 1 1 84 84 VAL CA C 84 64.270 64.270 65.775 -1.505 18112 9026 1 12 . 1 1 84 84 VAL CB C 84 30.471 30.471 31.899 -1.428 18112 9027 1 12 . 1 1 84 84 VAL H H 84 8.157 8.157 7.939 0.218 18112 9028 1 12 . 1 1 85 85 THR N N 85 115.232 115.232 107.357 7.875 18112 9029 1 12 . 1 1 85 85 THR HA H 85 4.716 4.716 4.110 0.606 18112 9030 1 12 . 1 1 85 85 THR C C 85 174.489 174.489 173.489 1.000 18112 9031 1 12 . 1 1 85 85 THR CA C 85 61.618 61.618 63.897 -2.279 18112 9032 1 12 . 1 1 85 85 THR CB C 85 70.081 70.081 68.600 1.481 18112 9033 1 12 . 1 1 85 85 THR H H 85 8.890 8.890 7.814 1.076 18112 9034 1 12 . 1 1 86 86 SER N N 86 117.009 117.009 116.025 0.984 18112 9035 1 12 . 1 1 86 86 SER HA H 86 5.046 5.046 4.323 0.723 18112 9036 1 12 . 1 1 86 86 SER C C 86 174.473 174.473 175.093 -0.620 18112 9037 1 12 . 1 1 86 86 SER CA C 86 55.922 55.922 56.965 -1.044 18112 9038 1 12 . 1 1 86 86 SER CB C 86 64.385 64.385 65.062 -0.677 18112 9039 1 12 . 1 1 86 86 SER H H 86 7.704 7.704 7.569 0.135 18112 9040 1 12 . 1 1 87 87 THR N N 87 118.634 118.634 118.443 0.191 18112 9041 1 12 . 1 1 87 87 THR HA H 87 4.065 4.065 3.929 0.136 18112 9042 1 12 . 1 1 87 87 THR C C 87 176.047 176.047 175.486 0.561 18112 9043 1 12 . 1 1 87 87 THR CA C 87 64.983 64.983 64.836 0.147 18112 9044 1 12 . 1 1 87 87 THR CB C 87 68.045 68.045 68.505 -0.460 18112 9045 1 12 . 1 1 87 87 THR H H 87 8.711 8.711 8.251 0.460 18112 9046 1 12 . 1 1 88 88 GLU N N 88 117.889 117.889 120.211 -2.322 18112 9047 1 12 . 1 1 88 88 GLU HA H 88 3.881 3.881 4.117 -0.236 18112 9048 1 12 . 1 1 88 88 GLU C C 88 177.146 177.146 177.339 -0.193 18112 9049 1 12 . 1 1 88 88 GLU CA C 88 57.814 57.814 57.989 -0.175 18112 9050 1 12 . 1 1 88 88 GLU CB C 88 28.050 28.050 28.561 -0.511 18112 9051 1 12 . 1 1 88 88 GLU H H 88 8.152 8.152 8.611 -0.459 18112 9052 1 12 . 1 1 89 89 GLU N N 89 115.617 115.617 119.643 -4.026 18112 9053 1 12 . 1 1 89 89 GLU HA H 89 4.149 4.149 4.174 -0.025 18112 9054 1 12 . 1 1 89 89 GLU C C 89 176.192 176.192 177.825 -1.633 18112 9055 1 12 . 1 1 89 89 GLU CA C 89 56.133 56.133 58.398 -2.265 18112 9056 1 12 . 1 1 89 89 GLU CB C 89 29.415 29.415 30.172 -0.757 18112 9057 1 12 . 1 1 89 89 GLU H H 89 7.311 7.311 7.695 -0.384 18112 9058 1 12 . 1 1 90 90 LEU N N 90 120.870 120.870 117.888 2.982 18112 9059 1 12 . 1 1 90 90 LEU HA H 90 4.439 4.439 4.493 -0.054 18112 9060 1 12 . 1 1 90 90 LEU C C 90 175.267 175.267 178.044 -2.777 18112 9061 1 12 . 1 1 90 90 LEU CA C 90 53.504 53.504 55.886 -2.382 18112 9062 1 12 . 1 1 90 90 LEU CB C 90 40.479 40.479 41.666 -1.187 18112 9063 1 12 . 1 1 90 90 LEU H H 90 7.311 7.311 7.338 -0.027 18112 9064 1 12 . 1 1 91 91 SER N N 91 118.376 118.376 116.838 1.538 18112 9065 1 12 . 1 1 91 91 SER HA H 91 4.747 4.747 4.539 0.208 18112 9066 1 12 . 1 1 91 91 SER C C 91 173.332 173.332 173.146 0.186 18112 9067 1 12 . 1 1 91 91 SER CA C 91 56.314 56.314 57.791 -1.477 18112 9068 1 12 . 1 1 91 91 SER CB C 91 64.615 64.615 61.507 3.108 18112 9069 1 12 . 1 1 91 91 SER H H 91 8.221 8.221 8.200 0.021 18112 9070 1 12 . 1 1 92 92 ILE N N 92 122.247 122.247 122.464 -0.217 18112 9071 1 12 . 1 1 92 92 ILE HA H 92 4.537 4.537 4.438 0.099 18112 9072 1 12 . 1 1 92 92 ILE C C 92 174.059 174.059 175.470 -1.411 18112 9073 1 12 . 1 1 92 92 ILE CA C 92 59.881 59.881 59.034 0.847 18112 9074 1 12 . 1 1 92 92 ILE CB C 92 37.820 37.820 41.352 -3.532 18112 9075 1 12 . 1 1 92 92 ILE H H 92 8.570 8.570 7.664 0.906 18112 9076 1 12 . 1 1 93 93 THR N N 93 116.069 116.069 119.807 -3.738 18112 9077 1 12 . 1 1 93 93 THR HA H 93 4.580 4.580 4.374 0.206 18112 9078 1 12 . 1 1 93 93 THR C C 93 175.049 175.049 174.506 0.543 18112 9079 1 12 . 1 1 93 93 THR CA C 93 58.988 58.988 64.139 -5.151 18112 9080 1 12 . 1 1 93 93 THR CB C 93 71.362 71.362 68.963 2.400 18112 9081 1 12 . 1 1 93 93 THR H H 93 7.224 7.224 8.404 -1.180 18112 9082 1 12 . 1 1 94 94 ARG N N 94 116.595 116.595 128.912 -12.317 18112 9083 1 12 . 1 1 94 94 ARG HA H 94 3.077 3.077 4.500 -1.423 18112 9084 1 12 . 1 1 94 94 ARG C C 94 175.076 175.076 175.565 -0.489 18112 9085 1 12 . 1 1 94 94 ARG CA C 94 57.119 57.119 55.089 2.030 18112 9086 1 12 . 1 1 94 94 ARG CB C 94 27.838 27.838 30.495 -2.657 18112 9087 1 12 . 1 1 94 94 ARG H H 94 8.596 8.596 8.411 0.185 18112 9088 1 12 . 1 1 95 95 ASP N N 95 113.735 113.735 119.517 -5.782 18112 9089 1 12 . 1 1 95 95 ASP HA H 95 4.765 4.765 2.274 2.491 18112 9090 1 12 . 1 1 95 95 ASP C C 95 175.876 175.876 176.663 -0.787 18112 9091 1 12 . 1 1 95 95 ASP CA C 95 53.156 53.156 56.180 -3.024 18112 9092 1 12 . 1 1 95 95 ASP CB C 95 41.166 41.166 38.626 2.541 18112 9093 1 12 . 1 1 95 95 ASP H H 95 7.607 7.607 8.145 -0.538 18112 9094 1 12 . 1 1 96 96 CYS N N 96 116.012 116.012 121.467 -5.455 18112 9095 1 12 . 1 1 96 96 CYS C C 96 174.361 174.361 176.963 -2.602 18112 9096 1 12 . 1 1 96 96 CYS CA C 96 56.562 56.562 61.756 -5.194 18112 9097 1 12 . 1 1 96 96 CYS CB C 96 29.416 29.416 26.414 3.002 18112 9098 1 12 . 1 1 96 96 CYS H H 96 7.094 7.094 8.030 -0.936 18112 9099 1 12 . 1 1 97 97 GLU N N 97 123.087 123.087 119.605 3.482 18112 9100 1 12 . 1 1 97 97 GLU C C 97 178.748 178.748 178.839 -0.091 18112 9101 1 12 . 1 1 97 97 GLU CA C 97 59.912 59.912 59.299 0.613 18112 9102 1 12 . 1 1 97 97 GLU CB C 97 29.195 29.195 29.378 -0.183 18112 9103 1 12 . 1 1 97 97 GLU H H 97 9.003 9.003 8.543 0.460 18112 9104 1 12 . 1 1 98 98 LEU N N 98 120.942 120.942 120.516 0.426 18112 9105 1 12 . 1 1 98 98 LEU HA H 98 3.614 3.614 4.062 -0.448 18112 9106 1 12 . 1 1 98 98 LEU C C 98 177.796 177.796 178.982 -1.186 18112 9107 1 12 . 1 1 98 98 LEU CA C 98 58.090 58.090 57.852 0.238 18112 9108 1 12 . 1 1 98 98 LEU CB C 98 39.778 39.778 41.768 -1.990 18112 9109 1 12 . 1 1 98 98 LEU H H 98 8.656 8.656 7.810 0.846 18112 9110 1 12 . 1 1 99 99 TYR N N 99 118.313 118.313 117.761 0.552 18112 9111 1 12 . 1 1 99 99 TYR C C 99 177.077 177.077 178.532 -1.455 18112 9112 1 12 . 1 1 99 99 TYR CA C 99 62.622 62.622 60.265 2.357 18112 9113 1 12 . 1 1 99 99 TYR CB C 99 38.742 38.742 37.354 1.388 18112 9114 1 12 . 1 1 99 99 TYR H H 99 7.522 7.522 8.384 -0.862 18112 9115 1 12 . 1 1 100 100 ARG N N 100 118.101 118.101 119.042 -0.941 18112 9116 1 12 . 1 1 100 100 ARG C C 100 178.616 178.616 178.827 -0.211 18112 9117 1 12 . 1 1 100 100 ARG CA C 100 59.915 59.915 59.501 0.414 18112 9118 1 12 . 1 1 100 100 ARG CB C 100 29.100 29.100 29.952 -0.852 18112 9119 1 12 . 1 1 100 100 ARG H H 100 8.243 8.243 8.226 0.017 18112 9120 1 12 . 1 1 101 101 ALA N N 101 120.972 120.972 123.225 -2.253 18112 9121 1 12 . 1 1 101 101 ALA HA H 101 4.145 4.145 4.348 -0.203 18112 9122 1 12 . 1 1 101 101 ALA C C 101 181.359 181.359 179.337 2.022 18112 9123 1 12 . 1 1 101 101 ALA CA C 101 55.057 55.057 54.992 0.065 18112 9124 1 12 . 1 1 101 101 ALA CB C 101 17.543 17.543 18.763 -1.220 18112 9125 1 12 . 1 1 101 101 ALA H H 101 8.352 8.352 8.039 0.313 18112 9126 1 12 . 1 1 102 102 LEU N N 102 115.683 115.683 118.413 -2.730 18112 9127 1 12 . 1 1 102 102 LEU HA H 102 4.333 4.333 4.281 0.052 18112 9128 1 12 . 1 1 102 102 LEU C C 102 178.583 178.583 179.757 -1.174 18112 9129 1 12 . 1 1 102 102 LEU CA C 102 57.634 57.634 58.156 -0.522 18112 9130 1 12 . 1 1 102 102 LEU CB C 102 41.716 41.716 41.437 0.279 18112 9131 1 12 . 1 1 102 102 LEU H H 102 7.960 7.960 8.357 -0.397 18112 9132 1 12 . 1 1 103 103 ASN N N 103 118.957 118.957 118.429 0.528 18112 9133 1 12 . 1 1 103 103 ASN C C 103 177.470 177.470 177.556 -0.086 18112 9134 1 12 . 1 1 103 103 ASN CA C 103 56.974 56.974 56.337 0.637 18112 9135 1 12 . 1 1 103 103 ASN CB C 103 38.140 38.140 38.519 -0.379 18112 9136 1 12 . 1 1 103 103 ASN H H 103 9.301 9.301 8.354 0.947 18112 9137 1 12 . 1 1 104 104 MET N N 104 113.763 113.763 119.719 -5.956 18112 9138 1 12 . 1 1 104 104 MET CA C 104 57.362 57.362 59.048 -1.686 18112 9139 1 12 . 1 1 104 104 MET CB C 104 31.895 31.895 33.027 -1.132 18112 9140 1 12 . 1 1 104 104 MET H H 104 8.332 8.332 8.095 0.237 18112 9141 1 12 . 1 1 105 105 HIS N N 105 116.024 116.024 116.990 -0.966 18112 9142 1 12 . 1 1 105 105 HIS HA H 105 3.764 3.764 4.494 -0.730 18112 9143 1 12 . 1 1 105 105 HIS C C 105 176.939 176.939 177.214 -0.275 18112 9144 1 12 . 1 1 105 105 HIS CA C 105 59.069 59.069 59.511 -0.442 18112 9145 1 12 . 1 1 105 105 HIS H H 105 7.156 7.156 8.529 -1.373 18112 9146 1 12 . 1 1 106 106 TYR N N 106 113.161 113.161 116.685 -3.524 18112 9147 1 12 . 1 1 106 106 TYR C C 106 173.767 173.767 176.524 -2.757 18112 9148 1 12 . 1 1 106 106 TYR CA C 106 58.488 58.488 61.160 -2.672 18112 9149 1 12 . 1 1 106 106 TYR CB C 106 38.225 38.225 39.597 -1.372 18112 9150 1 12 . 1 1 106 106 TYR H H 106 7.204 7.204 8.417 -1.213 18112 9151 1 12 . 1 1 107 107 ASN N N 107 118.875 118.875 114.630 4.245 18112 9152 1 12 . 1 1 107 107 ASN HA H 107 3.922 3.922 4.772 -0.850 18112 9153 1 12 . 1 1 107 107 ASN C C 107 175.815 175.815 176.806 -0.991 18112 9154 1 12 . 1 1 107 107 ASN CA C 107 51.233 51.233 53.742 -2.509 18112 9155 1 12 . 1 1 107 107 ASN CB C 107 38.142 38.142 40.326 -2.184 18112 9156 1 12 . 1 1 107 107 ASN H H 107 8.127 8.127 8.089 0.038 18112 9157 1 12 . 1 1 108 108 LYS N N 108 122.850 122.850 117.473 5.377 18112 9158 1 12 . 1 1 108 108 LYS HA H 108 3.954 3.954 4.075 -0.121 18112 9159 1 12 . 1 1 108 108 LYS C C 108 177.586 177.586 176.115 1.471 18112 9160 1 12 . 1 1 108 108 LYS CA C 108 59.749 59.749 59.233 0.516 18112 9161 1 12 . 1 1 108 108 LYS CB C 108 31.498 31.498 30.944 0.554 18112 9162 1 12 . 1 1 108 108 LYS H H 108 7.772 7.772 8.868 -1.096 18112 9163 1 12 . 1 1 109 109 ALA N N 109 118.054 118.054 121.897 -3.843 18112 9164 1 12 . 1 1 109 109 ALA HA H 109 4.137 4.137 4.592 -0.455 18112 9165 1 12 . 1 1 109 109 ALA C C 109 177.889 177.889 176.304 1.585 18112 9166 1 12 . 1 1 109 109 ALA CA C 109 52.299 52.299 50.828 1.470 18112 9167 1 12 . 1 1 109 109 ALA CB C 109 17.787 17.787 18.512 -0.726 18112 9168 1 12 . 1 1 109 109 ALA H H 109 8.307 8.307 7.844 0.463 18112 9169 1 12 . 1 1 110 110 ASN N N 110 115.542 115.542 115.541 0.001 18112 9170 1 12 . 1 1 110 110 ASN HA H 110 4.480 4.480 4.341 0.139 18112 9171 1 12 . 1 1 110 110 ASN C C 110 174.277 174.277 175.201 -0.924 18112 9172 1 12 . 1 1 110 110 ASN CA C 110 53.504 53.504 53.983 -0.479 18112 9173 1 12 . 1 1 110 110 ASN CB C 110 37.283 37.283 35.880 1.403 18112 9174 1 12 . 1 1 110 110 ASN H H 110 8.353 8.353 8.236 0.117 18112 9175 1 12 . 1 1 111 111 ASP N N 111 114.692 114.692 118.566 -3.874 18112 9176 1 12 . 1 1 111 111 ASP HA H 111 4.485 4.485 4.358 0.127 18112 9177 1 12 . 1 1 111 111 ASP C C 111 174.868 174.868 176.450 -1.582 18112 9178 1 12 . 1 1 111 111 ASP CA C 111 53.227 53.227 56.643 -3.416 18112 9179 1 12 . 1 1 111 111 ASP CB C 111 39.228 39.228 41.229 -2.001 18112 9180 1 12 . 1 1 111 111 ASP H H 111 8.297 8.297 8.521 -0.224 18112 9181 1 12 . 1 1 112 112 PHE N N 112 120.927 120.927 118.344 2.583 18112 9182 1 12 . 1 1 112 112 PHE HA H 112 4.752 4.752 4.578 0.174 18112 9183 1 12 . 1 1 112 112 PHE C C 112 174.633 174.633 175.371 -0.738 18112 9184 1 12 . 1 1 112 112 PHE CA C 112 56.346 56.346 56.961 -0.615 18112 9185 1 12 . 1 1 112 112 PHE H H 112 7.784 7.784 7.854 -0.070 18112 9186 1 12 . 1 1 113 113 GLU N N 113 128.111 128.111 123.090 5.021 18112 9187 1 12 . 1 1 113 113 GLU HA H 113 4.011 4.011 4.004 0.007 18112 9188 1 12 . 1 1 113 113 GLU C C 113 173.502 173.502 175.702 -2.200 18112 9189 1 12 . 1 1 113 113 GLU CA C 113 55.100 55.100 56.188 -1.088 18112 9190 1 12 . 1 1 113 113 GLU H H 113 7.752 7.752 7.949 -0.197 18112 9191 1 12 . 1 1 114 114 VAL N N 114 129.326 129.326 114.330 14.996 18112 9192 1 12 . 1 1 114 114 VAL HA H 114 3.241 3.241 3.215 0.026 18112 9193 1 12 . 1 1 114 114 VAL CA C 114 60.838 60.838 61.242 -0.404 18112 9194 1 12 . 1 1 114 114 VAL CB C 114 32.609 32.609 29.869 2.740 18112 9195 1 12 . 1 1 114 114 VAL H H 114 8.008 8.008 6.872 1.136 18112 9196 1 12 . 1 1 115 115 PRO HA H 115 4.429 4.429 4.517 -0.088 18112 9197 1 12 . 1 1 115 115 PRO C C 115 177.421 177.421 177.563 -0.142 18112 9198 1 12 . 1 1 115 115 PRO CA C 115 61.882 61.882 62.052 -0.170 18112 9199 1 12 . 1 1 115 115 PRO CB C 115 30.974 30.974 32.713 -1.739 18112 9200 1 12 . 1 1 116 116 GLU N N 116 123.936 123.936 120.696 3.240 18112 9201 1 12 . 1 1 116 116 GLU C C 116 179.034 179.034 178.823 0.211 18112 9202 1 12 . 1 1 116 116 GLU CA C 116 58.913 58.913 60.239 -1.326 18112 9203 1 12 . 1 1 116 116 GLU CB C 116 28.378 28.378 29.273 -0.895 18112 9204 1 12 . 1 1 116 116 GLU H H 116 8.757 8.757 8.761 -0.004 18112 9205 1 12 . 1 1 117 117 ARG N N 117 116.943 116.943 117.459 -0.516 18112 9206 1 12 . 1 1 117 117 ARG C C 117 177.570 177.570 178.710 -1.140 18112 9207 1 12 . 1 1 117 117 ARG CA C 117 57.033 57.033 59.047 -2.014 18112 9208 1 12 . 1 1 117 117 ARG CB C 117 28.172 28.172 29.477 -1.305 18112 9209 1 12 . 1 1 117 117 ARG H H 117 8.733 8.733 8.401 0.332 18112 9210 1 12 . 1 1 118 118 PHE N N 118 117.528 117.528 120.942 -3.414 18112 9211 1 12 . 1 1 118 118 PHE HA H 118 4.137 4.137 4.575 -0.438 18112 9212 1 12 . 1 1 118 118 PHE C C 118 176.992 176.992 177.327 -0.335 18112 9213 1 12 . 1 1 118 118 PHE CA C 118 61.627 61.627 61.395 0.232 18112 9214 1 12 . 1 1 118 118 PHE CB C 118 37.386 37.386 39.165 -1.779 18112 9215 1 12 . 1 1 118 118 PHE H H 118 7.606 7.606 7.657 -0.051 18112 9216 1 12 . 1 1 119 119 LEU N N 119 118.483 118.483 117.953 0.530 18112 9217 1 12 . 1 1 119 119 LEU HA H 119 3.684 3.684 4.225 -0.541 18112 9218 1 12 . 1 1 119 119 LEU C C 119 178.802 178.802 179.183 -0.381 18112 9219 1 12 . 1 1 119 119 LEU CA C 119 59.875 59.875 56.352 3.522 18112 9220 1 12 . 1 1 119 119 LEU CB C 119 39.453 39.453 40.328 -0.875 18112 9221 1 12 . 1 1 119 119 LEU H H 119 7.248 7.248 8.173 -0.925 18112 9222 1 12 . 1 1 120 120 GLU N N 120 117.870 117.870 121.707 -3.837 18112 9223 1 12 . 1 1 120 120 GLU C C 120 179.932 179.932 178.950 0.982 18112 9224 1 12 . 1 1 120 120 GLU CA C 120 59.150 59.150 59.366 -0.216 18112 9225 1 12 . 1 1 120 120 GLU CB C 120 28.878 28.878 29.214 -0.336 18112 9226 1 12 . 1 1 120 120 GLU H H 120 7.423 7.423 8.292 -0.869 18112 9227 1 12 . 1 1 121 121 VAL N N 121 120.777 120.777 120.289 0.488 18112 9228 1 12 . 1 1 121 121 VAL HA H 121 3.545 3.545 3.639 -0.094 18112 9229 1 12 . 1 1 121 121 VAL C C 121 179.302 179.302 177.893 1.409 18112 9230 1 12 . 1 1 121 121 VAL CA C 121 66.875 66.875 66.556 0.319 18112 9231 1 12 . 1 1 121 121 VAL CB C 121 30.823 30.823 31.562 -0.739 18112 9232 1 12 . 1 1 121 121 VAL H H 121 8.313 8.313 8.037 0.276 18112 9233 1 12 . 1 1 122 122 ALA N N 122 127.029 127.029 121.896 5.133 18112 9234 1 12 . 1 1 122 122 ALA HA H 122 4.251 4.251 4.043 0.208 18112 9235 1 12 . 1 1 122 122 ALA C C 122 178.366 178.366 179.477 -1.111 18112 9236 1 12 . 1 1 122 122 ALA CA C 122 54.748 54.748 55.220 -0.472 18112 9237 1 12 . 1 1 122 122 ALA CB C 122 16.565 16.565 18.337 -1.772 18112 9238 1 12 . 1 1 122 122 ALA H H 122 8.896 8.896 8.216 0.680 18112 9239 1 12 . 1 1 123 123 GLN N N 123 119.887 119.887 119.602 0.285 18112 9240 1 12 . 1 1 123 123 GLN C C 123 177.908 177.908 178.593 -0.685 18112 9241 1 12 . 1 1 123 123 GLN CA C 123 60.671 60.671 58.943 1.728 18112 9242 1 12 . 1 1 123 123 GLN H H 123 8.349 8.349 7.843 0.506 18112 9243 1 12 . 1 1 124 124 ILE N N 124 120.632 120.632 119.171 1.461 18112 9244 1 12 . 1 1 124 124 ILE HA H 124 3.651 3.651 3.777 -0.126 18112 9245 1 12 . 1 1 124 124 ILE C C 124 178.703 178.703 178.323 0.380 18112 9246 1 12 . 1 1 124 124 ILE CA C 124 65.945 65.945 65.123 0.822 18112 9247 1 12 . 1 1 124 124 ILE H H 124 8.204 8.204 8.135 0.069 18112 9248 1 12 . 1 1 125 125 THR N N 125 115.084 115.084 115.971 -0.887 18112 9249 1 12 . 1 1 125 125 THR C C 125 175.568 175.568 176.773 -1.205 18112 9250 1 12 . 1 1 125 125 THR CA C 125 67.872 67.872 66.987 0.885 18112 9251 1 12 . 1 1 125 125 THR H H 125 8.399 8.399 8.377 0.022 18112 9252 1 12 . 1 1 126 126 LEU N N 126 125.011 125.011 122.542 2.469 18112 9253 1 12 . 1 1 126 126 LEU HA H 126 4.085 4.085 4.191 -0.106 18112 9254 1 12 . 1 1 126 126 LEU C C 126 178.559 178.559 178.205 0.354 18112 9255 1 12 . 1 1 126 126 LEU CA C 126 58.843 58.843 57.958 0.885 18112 9256 1 12 . 1 1 126 126 LEU CB C 126 41.421 41.421 41.788 -0.367 18112 9257 1 12 . 1 1 126 126 LEU H H 126 8.728 8.728 8.132 0.596 18112 9258 1 12 . 1 1 127 127 ARG N N 127 117.076 117.076 119.231 -2.155 18112 9259 1 12 . 1 1 127 127 ARG HA H 127 3.929 3.929 4.115 -0.186 18112 9260 1 12 . 1 1 127 127 ARG C C 127 177.984 177.984 178.621 -0.637 18112 9261 1 12 . 1 1 127 127 ARG CA C 127 60.685 60.685 59.697 0.988 18112 9262 1 12 . 1 1 127 127 ARG CB C 127 28.079 28.079 30.094 -2.015 18112 9263 1 12 . 1 1 127 127 ARG H H 127 8.213 8.213 8.296 -0.083 18112 9264 1 12 . 1 1 128 128 GLU N N 128 118.617 118.617 119.884 -1.267 18112 9265 1 12 . 1 1 128 128 GLU HA H 128 4.147 4.147 4.068 0.079 18112 9266 1 12 . 1 1 128 128 GLU C C 128 181.150 181.150 178.868 2.282 18112 9267 1 12 . 1 1 128 128 GLU CA C 128 59.508 59.508 58.915 0.593 18112 9268 1 12 . 1 1 128 128 GLU H H 128 8.478 8.478 7.959 0.519 18112 9269 1 12 . 1 1 129 129 PHE N N 129 119.267 119.267 120.045 -0.778 18112 9270 1 12 . 1 1 129 129 PHE HA H 129 4.104 4.104 3.596 0.508 18112 9271 1 12 . 1 1 129 129 PHE C C 129 177.170 177.170 177.746 -0.576 18112 9272 1 12 . 1 1 129 129 PHE CA C 129 63.694 63.694 61.827 1.867 18112 9273 1 12 . 1 1 129 129 PHE H H 129 8.570 8.570 8.574 -0.004 18112 9274 1 12 . 1 1 130 130 PHE N N 130 118.739 118.739 119.288 -0.549 18112 9275 1 12 . 1 1 130 130 PHE HA H 130 3.884 3.884 3.981 -0.097 18112 9276 1 12 . 1 1 130 130 PHE C C 130 175.860 175.860 176.996 -1.136 18112 9277 1 12 . 1 1 130 130 PHE CA C 130 62.819 62.819 61.566 1.253 18112 9278 1 12 . 1 1 130 130 PHE H H 130 8.740 8.740 8.719 0.021 18112 9279 1 12 . 1 1 131 131 ASN N N 131 116.028 116.028 117.929 -1.901 18112 9280 1 12 . 1 1 131 131 ASN HA H 131 4.373 4.373 3.859 0.514 18112 9281 1 12 . 1 1 131 131 ASN C C 131 178.228 178.228 177.589 0.639 18112 9282 1 12 . 1 1 131 131 ASN CA C 131 55.150 55.150 55.919 -0.769 18112 9283 1 12 . 1 1 131 131 ASN H H 131 8.864 8.864 8.111 0.753 18112 9284 1 12 . 1 1 132 132 ALA N N 132 120.922 120.922 122.391 -1.469 18112 9285 1 12 . 1 1 132 132 ALA HA H 132 4.020 4.020 3.990 0.030 18112 9286 1 12 . 1 1 132 132 ALA C C 132 178.515 178.515 179.911 -1.396 18112 9287 1 12 . 1 1 132 132 ALA CA C 132 54.924 54.924 54.929 -0.005 18112 9288 1 12 . 1 1 132 132 ALA CB C 132 18.441 18.441 18.176 0.265 18112 9289 1 12 . 1 1 132 132 ALA H H 132 7.745 7.745 7.790 -0.045 18112 9290 1 12 . 1 1 133 133 ILE N N 133 118.200 118.200 119.282 -1.082 18112 9291 1 12 . 1 1 133 133 ILE HA H 133 3.235 3.235 3.889 -0.654 18112 9292 1 12 . 1 1 133 133 ILE C C 133 180.606 180.606 178.089 2.517 18112 9293 1 12 . 1 1 133 133 ILE CA C 133 65.215 65.215 65.349 -0.134 18112 9294 1 12 . 1 1 133 133 ILE CB C 133 38.291 38.291 38.204 0.087 18112 9295 1 12 . 1 1 133 133 ILE H H 133 7.999 7.999 7.837 0.162 18112 9296 1 12 . 1 1 134 134 ILE N N 134 122.564 122.564 119.814 2.750 18112 9297 1 12 . 1 1 134 134 ILE HA H 134 3.788 3.788 3.715 0.073 18112 9298 1 12 . 1 1 134 134 ILE C C 134 177.215 177.215 177.025 0.190 18112 9299 1 12 . 1 1 134 134 ILE CA C 134 63.584 63.584 63.719 -0.135 18112 9300 1 12 . 1 1 134 134 ILE CB C 134 35.636 35.636 37.479 -1.843 18112 9301 1 12 . 1 1 134 134 ILE H H 134 8.670 8.670 8.084 0.586 18112 9302 1 12 . 1 1 135 135 ALA N N 135 119.989 119.989 121.044 -1.055 18112 9303 1 12 . 1 1 135 135 ALA HA H 135 4.357 4.357 4.157 0.200 18112 9304 1 12 . 1 1 135 135 ALA C C 135 177.786 177.786 178.432 -0.646 18112 9305 1 12 . 1 1 135 135 ALA CA C 135 51.521 51.521 53.246 -1.725 18112 9306 1 12 . 1 1 135 135 ALA CB C 135 18.839 18.839 19.652 -0.813 18112 9307 1 12 . 1 1 135 135 ALA H H 135 6.898 6.898 7.698 -0.800 18112 9308 1 12 . 1 1 136 136 GLY N N 136 107.682 107.682 106.069 1.613 18112 9309 1 12 . 1 1 136 136 GLY C C 136 176.324 176.324 175.559 0.765 18112 9310 1 12 . 1 1 136 136 GLY CA C 136 45.469 45.469 44.965 0.504 18112 9311 1 12 . 1 1 136 136 GLY H H 136 7.913 7.913 7.930 -0.017 18112 9312 1 12 . 1 1 137 137 LYS N N 137 117.213 117.213 121.708 -4.495 18112 9313 1 12 . 1 1 137 137 LYS HA H 137 4.004 4.004 4.339 -0.335 18112 9314 1 12 . 1 1 137 137 LYS C C 137 176.616 176.616 177.031 -0.415 18112 9315 1 12 . 1 1 137 137 LYS CA C 137 57.499 57.499 57.229 0.270 18112 9316 1 12 . 1 1 137 137 LYS CB C 137 30.927 30.927 32.057 -1.130 18112 9317 1 12 . 1 1 137 137 LYS H H 137 8.312 8.312 8.426 -0.114 18112 9318 1 12 . 1 1 138 138 ASP N N 138 113.545 113.545 119.097 -5.552 18112 9319 1 12 . 1 1 138 138 ASP HA H 138 3.061 3.061 4.184 -1.123 18112 9320 1 12 . 1 1 138 138 ASP C C 138 174.698 174.698 177.444 -2.746 18112 9321 1 12 . 1 1 138 138 ASP CA C 138 53.694 53.694 56.111 -2.417 18112 9322 1 12 . 1 1 138 138 ASP CB C 138 36.008 36.008 39.569 -3.561 18112 9323 1 12 . 1 1 138 138 ASP H H 138 8.465 8.465 8.634 -0.169 18112 9324 1 12 . 1 1 139 139 VAL N N 139 115.191 115.191 114.268 0.923 18112 9325 1 12 . 1 1 139 139 VAL HA H 139 3.886 3.886 3.700 0.185 18112 9326 1 12 . 1 1 139 139 VAL C C 139 175.889 175.889 176.388 -0.499 18112 9327 1 12 . 1 1 139 139 VAL CA C 139 62.793 62.793 63.434 -0.642 18112 9328 1 12 . 1 1 139 139 VAL CB C 139 30.662 30.662 31.666 -1.004 18112 9329 1 12 . 1 1 139 139 VAL H H 139 6.610 6.610 7.169 -0.559 18112 9330 1 12 . 1 1 140 140 ASP N N 140 123.363 123.363 119.763 3.600 18112 9331 1 12 . 1 1 140 140 ASP C C 140 175.234 175.234 174.541 0.693 18112 9332 1 12 . 1 1 140 140 ASP CA C 140 50.221 50.221 53.964 -3.743 18112 9333 1 12 . 1 1 140 140 ASP CB C 140 42.254 42.254 40.458 1.796 18112 9334 1 12 . 1 1 140 140 ASP H H 140 7.553 7.553 7.699 -0.145 18112 9335 1 12 . 1 1 141 141 PRO HA H 141 4.682 4.682 4.536 0.146 18112 9336 1 12 . 1 1 141 141 PRO C C 141 178.678 178.678 178.163 0.515 18112 9337 1 12 . 1 1 141 141 PRO CA C 141 64.532 64.532 63.156 1.376 18112 9338 1 12 . 1 1 141 141 PRO CB C 141 31.331 31.331 32.550 -1.219 18112 9339 1 12 . 1 1 142 142 SER N N 142 114.421 114.421 115.771 -1.350 18112 9340 1 12 . 1 1 142 142 SER HA H 142 4.565 4.565 4.381 0.184 18112 9341 1 12 . 1 1 142 142 SER C C 142 176.524 176.524 176.747 -0.223 18112 9342 1 12 . 1 1 142 142 SER CA C 142 58.711 58.711 60.120 -1.409 18112 9343 1 12 . 1 1 142 142 SER CB C 142 62.783 62.783 62.885 -0.102 18112 9344 1 12 . 1 1 142 142 SER H H 142 8.703 8.703 8.509 0.194 18112 9345 1 12 . 1 1 143 143 TRP N N 143 123.598 123.598 121.633 1.965 18112 9346 1 12 . 1 1 143 143 TRP HA H 143 4.136 4.136 4.080 0.056 18112 9347 1 12 . 1 1 143 143 TRP C C 143 177.113 177.113 177.652 -0.539 18112 9348 1 12 . 1 1 143 143 TRP CA C 143 59.803 59.803 60.836 -1.033 18112 9349 1 12 . 1 1 143 143 TRP CB C 143 26.364 26.364 28.779 -2.415 18112 9350 1 12 . 1 1 143 143 TRP H H 143 8.374 8.374 8.388 -0.014 18112 9351 1 12 . 1 1 144 144 LYS N N 144 119.293 119.293 118.017 1.276 18112 9352 1 12 . 1 1 144 144 LYS HA H 144 2.719 2.719 3.775 -1.056 18112 9353 1 12 . 1 1 144 144 LYS C C 144 177.243 177.243 178.493 -1.250 18112 9354 1 12 . 1 1 144 144 LYS CA C 144 58.851 58.851 59.863 -1.012 18112 9355 1 12 . 1 1 144 144 LYS CB C 144 29.373 29.373 31.600 -2.227 18112 9356 1 12 . 1 1 144 144 LYS H H 144 7.196 7.196 8.499 -1.303 18112 9357 1 12 . 1 1 145 145 LYS N N 145 116.440 116.440 119.135 -2.695 18112 9358 1 12 . 1 1 145 145 LYS HA H 145 3.490 3.490 4.228 -0.738 18112 9359 1 12 . 1 1 145 145 LYS C C 145 179.149 179.149 179.152 -0.003 18112 9360 1 12 . 1 1 145 145 LYS CA C 145 59.271 59.271 59.041 0.230 18112 9361 1 12 . 1 1 145 145 LYS CB C 145 30.521 30.521 32.181 -1.660 18112 9362 1 12 . 1 1 145 145 LYS H H 145 7.389 7.389 8.052 -0.663 18112 9363 1 12 . 1 1 146 146 ALA N N 146 118.582 118.582 123.549 -4.967 18112 9364 1 12 . 1 1 146 146 ALA HA H 146 3.932 3.932 4.075 -0.143 18112 9365 1 12 . 1 1 146 146 ALA C C 146 179.968 179.968 179.726 0.242 18112 9366 1 12 . 1 1 146 146 ALA CA C 146 54.241 54.241 55.134 -0.893 18112 9367 1 12 . 1 1 146 146 ALA CB C 146 17.689 17.689 18.200 -0.511 18112 9368 1 12 . 1 1 146 146 ALA H H 146 7.112 7.112 7.967 -0.855 18112 9369 1 12 . 1 1 147 147 ILE N N 147 118.537 118.537 118.650 -0.113 18112 9370 1 12 . 1 1 147 147 ILE HA H 147 3.642 3.642 3.604 0.038 18112 9371 1 12 . 1 1 147 147 ILE C C 147 178.919 178.919 178.353 0.566 18112 9372 1 12 . 1 1 147 147 ILE CA C 147 64.418 64.418 64.170 0.248 18112 9373 1 12 . 1 1 147 147 ILE CB C 147 36.519 36.519 36.458 0.061 18112 9374 1 12 . 1 1 147 147 ILE H H 147 6.734 6.734 8.293 -1.559 18112 9375 1 12 . 1 1 148 148 TYR N N 148 121.033 121.033 118.365 2.668 18112 9376 1 12 . 1 1 148 148 TYR HA H 148 4.489 4.489 4.116 0.373 18112 9377 1 12 . 1 1 148 148 TYR C C 148 178.348 178.348 178.362 -0.014 18112 9378 1 12 . 1 1 148 148 TYR CA C 148 57.389 57.389 59.298 -1.909 18112 9379 1 12 . 1 1 148 148 TYR CB C 148 35.280 35.280 36.933 -1.653 18112 9380 1 12 . 1 1 148 148 TYR H H 148 8.126 8.126 8.100 0.026 18112 9381 1 12 . 1 1 149 149 LYS N N 149 114.484 114.484 119.976 -5.492 18112 9382 1 12 . 1 1 149 149 LYS C C 149 178.051 178.051 178.715 -0.664 18112 9383 1 12 . 1 1 149 149 LYS CA C 149 59.036 59.036 59.407 -0.371 18112 9384 1 12 . 1 1 149 149 LYS CB C 149 31.575 31.575 32.495 -0.920 18112 9385 1 12 . 1 1 149 149 LYS H H 149 7.364 7.364 8.061 -0.697 18112 9386 1 12 . 1 1 150 150 VAL N N 150 117.812 117.812 117.361 0.451 18112 9387 1 12 . 1 1 150 150 VAL HA H 150 3.770 3.770 3.799 -0.029 18112 9388 1 12 . 1 1 150 150 VAL C C 150 178.786 178.786 178.221 0.565 18112 9389 1 12 . 1 1 150 150 VAL CA C 150 65.070 65.070 65.799 -0.729 18112 9390 1 12 . 1 1 150 150 VAL CB C 150 29.515 29.515 31.075 -1.560 18112 9391 1 12 . 1 1 150 150 VAL H H 150 7.254 7.254 7.917 -0.663 18112 9392 1 12 . 1 1 151 151 ILE N N 151 117.884 117.884 116.511 1.373 18112 9393 1 12 . 1 1 151 151 ILE C C 151 180.539 180.539 177.488 3.051 18112 9394 1 12 . 1 1 151 151 ILE CA C 151 61.490 61.490 63.961 -2.471 18112 9395 1 12 . 1 1 151 151 ILE CB C 151 33.994 33.994 37.378 -3.384 18112 9396 1 12 . 1 1 151 151 ILE H H 151 8.154 8.154 7.995 0.159 18112 9397 1 12 . 1 1 152 152 CYS N N 152 118.649 118.649 120.708 -2.059 18112 9398 1 12 . 1 1 152 152 CYS HA H 152 4.153 4.153 4.143 0.010 18112 9399 1 12 . 1 1 152 152 CYS C C 152 174.888 174.888 176.351 -1.463 18112 9400 1 12 . 1 1 152 152 CYS CA C 152 61.052 61.052 60.668 0.384 18112 9401 1 12 . 1 1 152 152 CYS CB C 152 36.364 36.364 28.120 8.243 18112 9402 1 12 . 1 1 152 152 CYS H H 152 8.711 8.711 8.265 0.446 18112 9403 1 12 . 1 1 153 153 LYS N N 153 118.498 118.498 119.972 -1.474 18112 9404 1 12 . 1 1 153 153 LYS C C 153 177.389 177.389 178.270 -0.881 18112 9405 1 12 . 1 1 153 153 LYS CA C 153 56.243 56.243 58.750 -2.507 18112 9406 1 12 . 1 1 153 153 LYS CB C 153 31.343 31.343 32.067 -0.724 18112 9407 1 12 . 1 1 153 153 LYS H H 153 6.782 6.782 7.779 -0.997 18112 9408 1 12 . 1 1 154 154 LEU N N 154 117.318 117.318 118.601 -1.283 18112 9409 1 12 . 1 1 154 154 LEU HA H 154 4.576 4.576 4.112 0.464 18112 9410 1 12 . 1 1 154 154 LEU C C 154 177.161 177.161 177.529 -0.368 18112 9411 1 12 . 1 1 154 154 LEU CA C 154 53.782 53.782 56.722 -2.940 18112 9412 1 12 . 1 1 154 154 LEU CB C 154 40.881 40.881 42.430 -1.549 18112 9413 1 12 . 1 1 154 154 LEU H H 154 7.616 7.616 7.549 0.067 18112 9414 1 12 . 1 1 155 155 ASP N N 155 121.564 121.564 116.119 5.445 18112 9415 1 12 . 1 1 155 155 ASP C C 155 177.094 177.094 174.359 2.735 18112 9416 1 12 . 1 1 155 155 ASP CA C 155 55.732 55.732 53.997 1.735 18112 9417 1 12 . 1 1 155 155 ASP CB C 155 40.139 40.139 41.951 -1.812 18112 9418 1 12 . 1 1 155 155 ASP H H 155 7.582 7.582 7.602 -0.020 18112 9419 1 12 . 1 1 156 156 SER N N 156 117.352 117.352 120.512 -3.160 18112 9420 1 12 . 1 1 156 156 SER HA H 156 4.818 4.818 4.279 0.539 18112 9421 1 12 . 1 1 156 156 SER C C 156 173.409 173.409 173.681 -0.272 18112 9422 1 12 . 1 1 156 156 SER CA C 156 57.073 57.073 57.969 -0.896 18112 9423 1 12 . 1 1 156 156 SER CB C 156 65.150 65.150 62.327 2.823 18112 9424 1 12 . 1 1 156 156 SER H H 156 8.846 8.846 8.194 0.652 18112 9425 1 12 . 1 1 157 157 GLU N N 157 120.688 120.688 122.374 -1.686 18112 9426 1 12 . 1 1 157 157 GLU HA H 157 4.038 4.038 4.503 -0.465 18112 9427 1 12 . 1 1 157 157 GLU C C 157 176.332 176.332 174.002 2.330 18112 9428 1 12 . 1 1 157 157 GLU CA C 157 56.464 56.464 55.227 1.237 18112 9429 1 12 . 1 1 157 157 GLU CB C 157 29.206 29.206 31.960 -2.754 18112 9430 1 12 . 1 1 157 157 GLU H H 157 8.356 8.356 7.543 0.813 18112 9431 1 12 . 1 1 158 158 VAL N N 158 126.906 126.906 114.359 12.547 18112 9432 1 12 . 1 1 158 158 VAL HA H 158 3.449 3.449 4.724 -1.275 18112 9433 1 12 . 1 1 158 158 VAL C C 158 176.382 176.382 173.994 2.388 18112 9434 1 12 . 1 1 158 158 VAL CA C 158 59.584 59.584 58.265 1.319 18112 9435 1 12 . 1 1 158 158 VAL CB C 158 31.160 31.160 33.369 -2.209 18112 9436 1 12 . 1 1 158 158 VAL H H 158 8.561 8.561 8.170 0.391 18112 9437 1 12 . 1 1 159 159 PRO HA H 159 4.403 4.403 4.397 0.006 18112 9438 1 12 . 1 1 159 159 PRO C C 159 176.757 176.757 175.877 0.880 18112 9439 1 12 . 1 1 159 159 PRO CA C 159 63.845 63.845 63.217 0.628 18112 9440 1 12 . 1 1 159 159 PRO CB C 159 32.106 32.106 32.023 0.083 18112 9441 1 12 . 1 1 160 160 GLU N N 160 122.904 122.904 122.985 -0.081 18112 9442 1 12 . 1 1 160 160 GLU HA H 160 4.008 4.008 3.941 0.067 18112 9443 1 12 . 1 1 160 160 GLU C C 160 179.132 179.132 176.624 2.508 18112 9444 1 12 . 1 1 160 160 GLU CA C 160 59.407 59.407 57.586 1.821 18112 9445 1 12 . 1 1 160 160 GLU CB C 160 28.991 28.991 29.960 -0.969 18112 9446 1 12 . 1 1 160 160 GLU H H 160 8.650 8.650 8.475 0.175 18112 9447 1 12 . 1 1 161 161 ILE N N 161 119.782 119.782 117.758 2.024 18112 9448 1 12 . 1 1 161 161 ILE HA H 161 4.146 4.146 4.130 0.016 18112 9449 1 12 . 1 1 161 161 ILE C C 161 176.176 176.176 174.470 1.706 18112 9450 1 12 . 1 1 161 161 ILE CA C 161 62.034 62.034 60.100 1.933 18112 9451 1 12 . 1 1 161 161 ILE CB C 161 37.113 37.113 38.606 -1.493 18112 9452 1 12 . 1 1 161 161 ILE H H 161 8.448 8.448 7.338 1.110 18112 9453 1 12 . 1 1 162 162 PHE N N 162 117.594 117.594 125.087 -7.493 18112 9454 1 12 . 1 1 162 162 PHE C C 162 176.115 176.115 177.013 -0.898 18112 9455 1 12 . 1 1 162 162 PHE CA C 162 61.009 61.009 59.319 1.690 18112 9456 1 12 . 1 1 162 162 PHE CB C 162 38.394 38.394 39.250 -0.856 18112 9457 1 12 . 1 1 162 162 PHE H H 162 8.145 8.145 8.607 -0.462 18112 9458 1 12 . 1 1 163 163 LYS N N 163 116.083 116.083 120.855 -4.772 18112 9459 1 12 . 1 1 163 163 LYS C C 163 178.196 178.196 175.752 2.444 18112 9460 1 12 . 1 1 163 163 LYS CA C 163 58.136 58.136 58.545 -0.409 18112 9461 1 12 . 1 1 163 163 LYS CB C 163 31.694 31.694 32.642 -0.948 18112 9462 1 12 . 1 1 163 163 LYS H H 163 8.232 8.232 8.068 0.164 18112 9463 1 12 . 1 1 164 164 SER N N 164 113.680 113.680 111.240 2.440 18112 9464 1 12 . 1 1 164 164 SER CA C 164 55.205 55.205 55.790 -0.585 18112 9465 1 12 . 1 1 164 164 SER CB C 164 63.265 63.265 64.130 -0.865 18112 9466 1 12 . 1 1 164 164 SER H H 164 7.708 7.708 7.676 0.032 18112 9467 1 12 . 1 1 165 165 PRO HA H 165 4.580 4.580 4.440 0.140 18112 9468 1 12 . 1 1 165 165 PRO C C 165 177.541 177.541 177.035 0.506 18112 9469 1 12 . 1 1 165 165 PRO CA C 165 63.950 63.950 64.114 -0.164 18112 9470 1 12 . 1 1 165 165 PRO CB C 165 30.686 30.686 31.933 -1.247 18112 9471 1 12 . 1 1 166 166 ASN N N 166 116.304 116.304 115.279 1.025 18112 9472 1 12 . 1 1 166 166 ASN HA H 166 5.029 5.029 4.322 0.707 18112 9473 1 12 . 1 1 166 166 ASN C C 166 175.811 175.811 176.338 -0.527 18112 9474 1 12 . 1 1 166 166 ASN CA C 166 51.962 51.962 56.039 -4.077 18112 9475 1 12 . 1 1 166 166 ASN CB C 166 37.915 37.915 36.606 1.309 18112 9476 1 12 . 1 1 166 166 ASN H H 166 8.216 8.216 8.585 -0.369 18112 9477 1 12 . 1 1 167 167 CYS N N 167 116.078 116.078 120.274 -4.196 18112 9478 1 12 . 1 1 167 167 CYS HA H 167 4.011 4.011 4.353 -0.342 18112 9479 1 12 . 1 1 167 167 CYS C C 167 175.057 175.057 176.341 -1.284 18112 9480 1 12 . 1 1 167 167 CYS CA C 167 59.816 59.816 61.224 -1.408 18112 9481 1 12 . 1 1 167 167 CYS CB C 167 27.446 27.446 27.653 -0.207 18112 9482 1 12 . 1 1 167 167 CYS H H 167 7.246 7.246 7.757 -0.511 18112 9483 1 12 . 1 1 168 168 LEU N N 168 120.082 120.082 119.121 0.961 18112 9484 1 12 . 1 1 168 168 LEU HA H 168 3.880 3.880 4.257 -0.377 18112 9485 1 12 . 1 1 168 168 LEU C C 168 178.541 178.541 178.319 0.222 18112 9486 1 12 . 1 1 168 168 LEU CA C 168 57.734 57.734 56.313 1.421 18112 9487 1 12 . 1 1 168 168 LEU CB C 168 38.825 38.825 39.579 -0.754 18112 9488 1 12 . 1 1 168 168 LEU H H 168 8.451 8.451 7.941 0.510 18112 9489 1 12 . 1 1 169 169 GLN N N 169 116.700 116.700 120.698 -3.998 18112 9490 1 12 . 1 1 169 169 GLN HA H 169 4.064 4.064 3.990 0.074 18112 9491 1 12 . 1 1 169 169 GLN C C 169 177.378 177.378 177.919 -0.541 18112 9492 1 12 . 1 1 169 169 GLN CA C 169 57.675 57.675 58.643 -0.968 18112 9493 1 12 . 1 1 169 169 GLN CB C 169 27.710 27.710 28.051 -0.341 18112 9494 1 12 . 1 1 169 169 GLN H H 169 7.665 7.665 7.688 -0.023 18112 9495 1 12 . 1 1 170 170 GLU N N 170 116.701 116.701 118.023 -1.322 18112 9496 1 12 . 1 1 170 170 GLU HA H 170 4.214 4.214 4.276 -0.062 18112 9497 1 12 . 1 1 170 170 GLU C C 170 177.730 177.730 178.712 -0.982 18112 9498 1 12 . 1 1 170 170 GLU CA C 170 56.899 56.899 58.230 -1.331 18112 9499 1 12 . 1 1 170 170 GLU H H 170 7.405 7.405 7.736 -0.331 18112 9500 1 12 . 1 1 171 171 LEU N N 171 118.021 118.021 118.302 -0.281 18112 9501 1 12 . 1 1 171 171 LEU HA H 171 4.209 4.209 4.163 0.046 18112 9502 1 12 . 1 1 171 171 LEU C C 171 177.005 177.005 177.865 -0.860 18112 9503 1 12 . 1 1 171 171 LEU CA C 171 55.870 55.870 56.983 -1.113 18112 9504 1 12 . 1 1 171 171 LEU CB C 171 43.680 43.680 42.015 1.665 18112 9505 1 12 . 1 1 171 171 LEU H H 171 7.823 7.823 7.796 0.027 18112 9506 1 12 . 1 1 172 172 LEU N N 172 117.580 117.580 115.059 2.521 18112 9507 1 12 . 1 1 172 172 LEU HA H 172 4.571 4.571 4.642 -0.071 18112 9508 1 12 . 1 1 172 172 LEU C C 172 176.411 176.411 175.581 0.830 18112 9509 1 12 . 1 1 172 172 LEU CA C 172 53.972 53.972 54.070 -0.098 18112 9510 1 12 . 1 1 172 172 LEU CB C 172 40.483 40.483 40.314 0.169 18112 9511 1 12 . 1 1 172 172 LEU H H 172 7.306 7.306 7.505 -0.199 18112 9512 1 12 . 1 1 173 173 HIS N N 173 123.310 123.310 120.908 2.402 18112 9513 1 12 . 1 1 173 173 HIS C C 173 179.022 179.022 174.081 4.941 18112 9514 1 12 . 1 1 173 173 HIS CA C 173 56.693 56.693 56.300 0.393 18112 9515 1 12 . 1 1 173 173 HIS CB C 173 29.371 29.371 31.678 -2.308 18112 9516 1 12 . 1 1 173 173 HIS H H 173 8.028 8.028 7.981 0.047 18112 9517 1 13 . 1 1 12 12 ALA N N 12 125.167 125.167 126.946 -1.779 18112 9518 1 13 . 1 1 12 12 ALA C C 12 177.566 177.566 175.368 2.198 18112 9519 1 13 . 1 1 12 12 ALA CA C 12 52.067 52.067 51.327 0.741 18112 9520 1 13 . 1 1 12 12 ALA CB C 12 18.456 18.456 22.370 -3.914 18112 9521 1 13 . 1 1 12 12 ALA H H 12 8.311 8.311 8.334 -0.023 18112 9522 1 13 . 1 1 13 13 MET N N 13 119.278 119.278 119.774 -0.496 18112 9523 1 13 . 1 1 13 13 MET C C 13 176.325 176.325 176.442 -0.117 18112 9524 1 13 . 1 1 13 13 MET CA C 13 54.992 54.992 56.186 -1.194 18112 9525 1 13 . 1 1 13 13 MET CB C 13 32.308 32.308 31.724 0.584 18112 9526 1 13 . 1 1 13 13 MET H H 13 8.269 8.269 8.400 -0.131 18112 9527 1 13 . 1 1 14 14 GLN N N 14 120.869 120.869 119.705 1.164 18112 9528 1 13 . 1 1 14 14 GLN HA H 14 4.399 4.399 4.463 -0.064 18112 9529 1 13 . 1 1 14 14 GLN C C 14 175.644 175.644 175.470 0.174 18112 9530 1 13 . 1 1 14 14 GLN CA C 14 55.139 55.139 54.796 0.343 18112 9531 1 13 . 1 1 14 14 GLN CB C 14 29.051 29.051 29.823 -0.772 18112 9532 1 13 . 1 1 14 14 GLN H H 14 8.501 8.501 8.832 -0.331 18112 9533 1 13 . 1 1 15 15 GLU N N 15 122.042 122.042 120.427 1.615 18112 9534 1 13 . 1 1 15 15 GLU C C 15 176.242 176.242 175.800 0.442 18112 9535 1 13 . 1 1 15 15 GLU CA C 15 56.064 56.064 56.794 -0.730 18112 9536 1 13 . 1 1 15 15 GLU CB C 15 29.302 29.302 29.776 -0.474 18112 9537 1 13 . 1 1 15 15 GLU H H 15 8.547 8.547 7.867 0.680 18112 9538 1 13 . 1 1 16 16 GLY N N 16 108.821 108.821 111.844 -3.023 18112 9539 1 13 . 1 1 16 16 GLY C C 16 172.949 172.949 173.626 -0.677 18112 9540 1 13 . 1 1 16 16 GLY CA C 16 44.227 44.227 44.699 -0.472 18112 9541 1 13 . 1 1 16 16 GLY H H 16 8.100 8.100 8.778 -0.678 18112 9542 1 13 . 1 1 17 17 LEU N N 17 120.315 120.315 119.746 0.569 18112 9543 1 13 . 1 1 17 17 LEU C C 17 177.334 177.334 175.807 1.527 18112 9544 1 13 . 1 1 17 17 LEU CA C 17 53.544 53.544 55.460 -1.916 18112 9545 1 13 . 1 1 17 17 LEU CB C 17 42.140 42.140 39.798 2.342 18112 9546 1 13 . 1 1 17 17 LEU H H 17 8.222 8.222 7.814 0.408 18112 9547 1 13 . 1 1 18 18 SER N N 18 126.547 126.547 117.689 8.858 18112 9548 1 13 . 1 1 18 18 SER CA C 18 56.851 56.851 56.142 0.709 18112 9549 1 13 . 1 1 18 18 SER CB C 18 64.636 64.636 65.763 -1.127 18112 9550 1 13 . 1 1 18 18 SER H H 18 11.627 11.627 8.417 3.210 18112 9551 1 13 . 1 1 19 19 PRO C C 19 175.118 175.118 178.449 -3.331 18112 9552 1 13 . 1 1 20 20 ASN N N 20 121.372 121.372 116.134 5.238 18112 9553 1 13 . 1 1 20 20 ASN H H 20 8.172 8.172 8.862 -0.690 18112 9554 1 13 . 1 1 25 25 ALA CB C 25 18.020 18.020 18.402 -0.382 18112 9555 1 13 . 1 1 26 26 LYS N N 26 118.490 118.490 119.345 -0.855 18112 9556 1 13 . 1 1 26 26 LYS CA C 26 56.146 56.146 58.786 -2.640 18112 9557 1 13 . 1 1 26 26 LYS H H 26 6.794 6.794 7.344 -0.550 18112 9558 1 13 . 1 1 31 31 TYR HA H 31 4.398 4.398 4.035 0.363 18112 9559 1 13 . 1 1 31 31 TYR C C 31 173.714 173.714 175.558 -1.844 18112 9560 1 13 . 1 1 31 31 TYR CA C 31 59.757 59.757 58.297 1.460 18112 9561 1 13 . 1 1 32 32 THR N N 32 111.928 111.928 110.461 1.467 18112 9562 1 13 . 1 1 32 32 THR HA H 32 4.209 4.209 4.461 -0.252 18112 9563 1 13 . 1 1 32 32 THR C C 32 171.061 171.061 175.301 -4.240 18112 9564 1 13 . 1 1 32 32 THR CA C 32 56.905 56.905 62.225 -5.320 18112 9565 1 13 . 1 1 32 32 THR CB C 32 69.707 69.707 69.722 -0.014 18112 9566 1 13 . 1 1 32 32 THR H H 32 8.237 8.237 7.525 0.712 18112 9567 1 13 . 1 1 33 33 ARG N N 33 124.856 124.856 122.281 2.575 18112 9568 1 13 . 1 1 33 33 ARG C C 33 176.451 176.451 175.996 0.455 18112 9569 1 13 . 1 1 33 33 ARG CA C 33 55.627 55.627 57.003 -1.376 18112 9570 1 13 . 1 1 33 33 ARG CB C 33 29.861 29.861 31.043 -1.181 18112 9571 1 13 . 1 1 33 33 ARG H H 33 9.159 9.159 8.053 1.106 18112 9572 1 13 . 1 1 34 34 TYR N N 34 117.908 117.908 119.554 -1.646 18112 9573 1 13 . 1 1 34 34 TYR CA C 34 55.320 55.320 57.901 -2.581 18112 9574 1 13 . 1 1 34 34 TYR H H 34 8.995 8.995 8.503 0.492 18112 9575 1 13 . 1 1 35 35 PRO C C 35 177.280 177.280 177.302 -0.022 18112 9576 1 13 . 1 1 36 36 SER N N 36 116.410 116.410 119.912 -3.502 18112 9577 1 13 . 1 1 36 36 SER C C 36 178.938 178.938 176.702 2.236 18112 9578 1 13 . 1 1 36 36 SER CA C 36 64.815 64.815 61.970 2.845 18112 9579 1 13 . 1 1 36 36 SER H H 36 8.106 8.106 8.530 -0.424 18112 9580 1 13 . 1 1 37 37 SER N N 37 117.488 117.488 116.434 1.054 18112 9581 1 13 . 1 1 37 37 SER C C 37 177.698 177.698 176.714 0.984 18112 9582 1 13 . 1 1 37 37 SER CA C 37 61.357 61.357 61.231 0.126 18112 9583 1 13 . 1 1 37 37 SER CB C 37 68.118 68.118 62.596 5.522 18112 9584 1 13 . 1 1 37 37 SER H H 37 8.169 8.169 8.197 -0.028 18112 9585 1 13 . 1 1 38 38 ASN N N 38 115.638 115.638 120.222 -4.584 18112 9586 1 13 . 1 1 38 38 ASN HA H 38 4.259 4.259 4.389 -0.130 18112 9587 1 13 . 1 1 38 38 ASN C C 38 177.868 177.868 177.781 0.087 18112 9588 1 13 . 1 1 38 38 ASN CA C 38 55.907 55.907 56.199 -0.292 18112 9589 1 13 . 1 1 38 38 ASN CB C 38 37.230 37.230 38.495 -1.265 18112 9590 1 13 . 1 1 38 38 ASN H H 38 8.284 8.284 8.002 0.282 18112 9591 1 13 . 1 1 39 39 MET N N 39 121.352 121.352 118.642 2.710 18112 9592 1 13 . 1 1 39 39 MET HA H 39 4.170 4.170 3.748 0.422 18112 9593 1 13 . 1 1 39 39 MET C C 39 179.068 179.068 178.157 0.911 18112 9594 1 13 . 1 1 39 39 MET CA C 39 58.751 58.751 57.760 0.991 18112 9595 1 13 . 1 1 39 39 MET CB C 39 31.850 31.850 31.423 0.427 18112 9596 1 13 . 1 1 39 39 MET H H 39 7.857 7.857 7.560 0.297 18112 9597 1 13 . 1 1 40 40 LEU N N 40 118.936 118.936 122.377 -3.441 18112 9598 1 13 . 1 1 40 40 LEU HA H 40 4.139 4.139 4.306 -0.167 18112 9599 1 13 . 1 1 40 40 LEU C C 40 178.700 178.700 178.743 -0.043 18112 9600 1 13 . 1 1 40 40 LEU CA C 40 58.455 58.455 58.673 -0.218 18112 9601 1 13 . 1 1 40 40 LEU CB C 40 40.304 40.304 41.760 -1.456 18112 9602 1 13 . 1 1 40 40 LEU H H 40 8.167 8.167 8.187 -0.020 18112 9603 1 13 . 1 1 41 41 LYS N N 41 116.791 116.791 117.072 -0.281 18112 9604 1 13 . 1 1 41 41 LYS HA H 41 3.475 3.475 4.336 -0.861 18112 9605 1 13 . 1 1 41 41 LYS C C 41 178.793 178.793 179.181 -0.388 18112 9606 1 13 . 1 1 41 41 LYS CA C 41 59.161 59.161 59.736 -0.575 18112 9607 1 13 . 1 1 41 41 LYS CB C 41 30.992 30.992 32.506 -1.514 18112 9608 1 13 . 1 1 41 41 LYS H H 41 7.632 7.632 7.975 -0.343 18112 9609 1 13 . 1 1 42 42 THR N N 42 112.819 112.819 115.555 -2.736 18112 9610 1 13 . 1 1 42 42 THR HA H 42 4.230 4.230 4.299 -0.069 18112 9611 1 13 . 1 1 42 42 THR C C 42 176.142 176.142 177.574 -1.432 18112 9612 1 13 . 1 1 42 42 THR CA C 42 65.107 65.107 66.374 -1.267 18112 9613 1 13 . 1 1 42 42 THR CB C 42 68.306 68.306 69.352 -1.046 18112 9614 1 13 . 1 1 42 42 THR H H 42 7.469 7.469 8.223 -0.754 18112 9615 1 13 . 1 1 43 43 TYR N N 43 118.565 118.565 120.816 -2.251 18112 9616 1 13 . 1 1 43 43 TYR HA H 43 4.204 4.204 4.339 -0.135 18112 9617 1 13 . 1 1 43 43 TYR C C 43 174.240 174.240 176.950 -2.710 18112 9618 1 13 . 1 1 43 43 TYR CA C 43 60.886 60.886 58.175 2.711 18112 9619 1 13 . 1 1 43 43 TYR CB C 43 38.165 38.165 37.961 0.205 18112 9620 1 13 . 1 1 43 43 TYR H H 43 7.978 7.978 8.037 -0.059 18112 9621 1 13 . 1 1 44 44 PHE N N 44 120.980 120.980 115.001 5.979 18112 9622 1 13 . 1 1 44 44 PHE HA H 44 4.920 4.920 4.789 0.131 18112 9623 1 13 . 1 1 44 44 PHE C C 44 176.436 176.436 176.915 -0.479 18112 9624 1 13 . 1 1 44 44 PHE CA C 44 56.672 56.672 56.400 0.272 18112 9625 1 13 . 1 1 44 44 PHE CB C 44 36.570 36.570 37.501 -0.931 18112 9626 1 13 . 1 1 44 44 PHE H H 44 7.955 7.955 8.225 -0.270 18112 9627 1 13 . 1 1 45 45 SER N N 45 113.407 113.407 117.173 -3.766 18112 9628 1 13 . 1 1 45 45 SER HA H 45 4.373 4.373 4.343 0.030 18112 9629 1 13 . 1 1 45 45 SER C C 45 174.424 174.424 175.512 -1.088 18112 9630 1 13 . 1 1 45 45 SER CA C 45 61.037 61.037 60.852 0.185 18112 9631 1 13 . 1 1 45 45 SER CB C 45 62.711 62.711 63.099 -0.388 18112 9632 1 13 . 1 1 45 45 SER H H 45 7.932 7.932 7.686 0.246 18112 9633 1 13 . 1 1 46 46 ASP N N 46 118.099 118.099 120.340 -2.241 18112 9634 1 13 . 1 1 46 46 ASP HA H 46 4.572 4.572 4.565 0.007 18112 9635 1 13 . 1 1 46 46 ASP C C 46 174.866 174.866 176.524 -1.658 18112 9636 1 13 . 1 1 46 46 ASP CA C 46 53.602 53.602 55.809 -2.207 18112 9637 1 13 . 1 1 46 46 ASP CB C 46 38.992 38.992 41.689 -2.697 18112 9638 1 13 . 1 1 46 46 ASP H H 46 9.889 9.889 8.313 1.576 18112 9639 1 13 . 1 1 47 47 VAL N N 47 121.496 121.496 121.495 0.001 18112 9640 1 13 . 1 1 47 47 VAL HA H 47 4.058 4.058 3.802 0.256 18112 9641 1 13 . 1 1 47 47 VAL C C 47 174.676 174.676 175.653 -0.977 18112 9642 1 13 . 1 1 47 47 VAL CA C 47 61.006 61.006 62.551 -1.546 18112 9643 1 13 . 1 1 47 47 VAL CB C 47 32.110 32.110 31.027 1.083 18112 9644 1 13 . 1 1 47 47 VAL H H 47 7.781 7.781 7.481 0.300 18112 9645 1 13 . 1 1 48 48 LYS N N 48 126.100 126.100 127.391 -1.291 18112 9646 1 13 . 1 1 48 48 LYS HA H 48 4.402 4.402 4.073 0.329 18112 9647 1 13 . 1 1 48 48 LYS C C 48 175.564 175.564 175.990 -0.426 18112 9648 1 13 . 1 1 48 48 LYS CA C 48 54.874 54.874 57.810 -2.936 18112 9649 1 13 . 1 1 48 48 LYS CB C 48 30.189 30.189 32.672 -2.483 18112 9650 1 13 . 1 1 48 48 LYS H H 48 8.245 8.245 8.207 0.038 18112 9651 1 13 . 1 1 49 49 PHE N N 49 125.341 125.341 113.397 11.944 18112 9652 1 13 . 1 1 49 49 PHE HA H 49 3.813 3.813 4.243 -0.430 18112 9653 1 13 . 1 1 49 49 PHE C C 49 175.708 175.708 175.021 0.687 18112 9654 1 13 . 1 1 49 49 PHE CA C 49 60.861 60.861 58.201 2.660 18112 9655 1 13 . 1 1 49 49 PHE CB C 49 38.616 38.616 37.182 1.434 18112 9656 1 13 . 1 1 49 49 PHE H H 49 8.626 8.626 7.650 0.976 18112 9657 1 13 . 1 1 50 50 ASN N N 50 115.408 115.408 121.360 -5.952 18112 9658 1 13 . 1 1 50 50 ASN C C 50 176.072 176.072 175.127 0.945 18112 9659 1 13 . 1 1 50 50 ASN CA C 50 51.730 51.730 51.575 0.155 18112 9660 1 13 . 1 1 50 50 ASN H H 50 7.030 7.030 8.096 -1.066 18112 9661 1 13 . 1 1 51 51 ARG N N 51 122.706 122.706 121.831 0.875 18112 9662 1 13 . 1 1 51 51 ARG CA C 51 59.534 59.534 60.303 -0.769 18112 9663 1 13 . 1 1 51 51 ARG H H 51 7.790 7.790 8.957 -1.167 18112 9664 1 13 . 1 1 52 52 CYS N N 52 117.340 117.340 117.164 0.176 18112 9665 1 13 . 1 1 52 52 CYS HA H 52 4.108 4.108 4.252 -0.144 18112 9666 1 13 . 1 1 52 52 CYS C C 52 178.200 178.200 177.144 1.056 18112 9667 1 13 . 1 1 52 52 CYS CA C 52 61.143 61.143 61.272 -0.128 18112 9668 1 13 . 1 1 52 52 CYS H H 52 7.681 7.681 8.239 -0.558 18112 9669 1 13 . 1 1 53 53 ILE N N 53 122.321 122.321 117.066 5.255 18112 9670 1 13 . 1 1 53 53 ILE HA H 53 3.588 3.588 3.711 -0.123 18112 9671 1 13 . 1 1 53 53 ILE C C 53 177.492 177.492 177.025 0.467 18112 9672 1 13 . 1 1 53 53 ILE CA C 53 64.109 64.109 64.412 -0.302 18112 9673 1 13 . 1 1 53 53 ILE CB C 53 37.603 37.603 37.393 0.210 18112 9674 1 13 . 1 1 53 53 ILE H H 53 8.035 8.035 7.852 0.183 18112 9675 1 13 . 1 1 54 54 THR C C 54 175.903 175.903 176.693 -0.790 18112 9676 1 13 . 1 1 54 54 THR CA C 54 67.308 67.308 66.222 1.086 18112 9677 1 13 . 1 1 55 55 SER N N 55 113.819 113.819 118.171 -4.352 18112 9678 1 13 . 1 1 55 55 SER H H 55 7.844 7.844 8.036 -0.192 18112 9679 1 13 . 1 1 56 56 GLN C C 56 179.792 179.792 177.741 2.051 18112 9680 1 13 . 1 1 57 57 LEU N N 57 116.701 116.701 120.752 -4.051 18112 9681 1 13 . 1 1 57 57 LEU HA H 57 4.519 4.519 3.121 1.398 18112 9682 1 13 . 1 1 57 57 LEU C C 57 178.775 178.775 178.745 0.030 18112 9683 1 13 . 1 1 57 57 LEU CA C 57 55.232 55.232 57.620 -2.388 18112 9684 1 13 . 1 1 57 57 LEU CB C 57 37.131 37.131 41.850 -4.719 18112 9685 1 13 . 1 1 57 57 LEU H H 57 8.267 8.267 7.463 0.804 18112 9686 1 13 . 1 1 58 58 ILE N N 58 122.522 122.522 118.108 4.414 18112 9687 1 13 . 1 1 58 58 ILE HA H 58 4.640 4.640 3.619 1.021 18112 9688 1 13 . 1 1 58 58 ILE C C 58 177.380 177.380 177.891 -0.511 18112 9689 1 13 . 1 1 58 58 ILE CA C 58 62.163 62.163 64.966 -2.803 18112 9690 1 13 . 1 1 58 58 ILE CB C 58 30.657 30.657 37.557 -6.900 18112 9691 1 13 . 1 1 58 58 ILE H H 58 8.111 8.111 8.082 0.029 18112 9692 1 13 . 1 1 59 59 LYS N N 59 121.002 121.002 121.168 -0.166 18112 9693 1 13 . 1 1 59 59 LYS C C 59 177.600 177.600 178.425 -0.825 18112 9694 1 13 . 1 1 59 59 LYS CA C 59 57.570 57.570 59.040 -1.470 18112 9695 1 13 . 1 1 59 59 LYS CB C 59 39.101 39.101 31.662 7.439 18112 9696 1 13 . 1 1 59 59 LYS H H 59 7.432 7.432 7.817 -0.385 18112 9697 1 13 . 1 1 60 60 TRP N N 60 118.679 118.679 119.687 -1.008 18112 9698 1 13 . 1 1 60 60 TRP HA H 60 3.739 3.739 4.349 -0.610 18112 9699 1 13 . 1 1 60 60 TRP C C 60 178.246 178.246 178.904 -0.658 18112 9700 1 13 . 1 1 60 60 TRP CA C 60 59.818 59.818 58.831 0.987 18112 9701 1 13 . 1 1 60 60 TRP CB C 60 31.851 31.851 28.619 3.232 18112 9702 1 13 . 1 1 60 60 TRP H H 60 7.565 7.565 8.242 -0.677 18112 9703 1 13 . 1 1 61 61 PHE N N 61 118.005 118.005 118.544 -0.539 18112 9704 1 13 . 1 1 61 61 PHE HA H 61 3.882 3.882 3.552 0.330 18112 9705 1 13 . 1 1 61 61 PHE CA C 61 60.054 60.054 62.168 -2.114 18112 9706 1 13 . 1 1 61 61 PHE H H 61 7.819 7.819 8.515 -0.696 18112 9707 1 13 . 1 1 62 62 SER N N 62 121.144 121.144 114.523 6.621 18112 9708 1 13 . 1 1 62 62 SER C C 62 177.840 177.840 176.578 1.262 18112 9709 1 13 . 1 1 62 62 SER CA C 62 55.892 55.892 62.172 -6.280 18112 9710 1 13 . 1 1 62 62 SER H H 62 8.878 8.878 8.185 0.693 18112 9711 1 13 . 1 1 63 63 ASN N N 63 115.303 115.303 121.316 -6.013 18112 9712 1 13 . 1 1 63 63 ASN C C 63 177.222 177.222 177.265 -0.043 18112 9713 1 13 . 1 1 63 63 ASN CA C 63 60.467 60.467 55.762 4.705 18112 9714 1 13 . 1 1 63 63 ASN H H 63 8.001 8.001 8.068 -0.067 18112 9715 1 13 . 1 1 64 64 PHE N N 64 112.571 112.571 118.979 -6.408 18112 9716 1 13 . 1 1 64 64 PHE CA C 64 56.453 56.453 61.272 -4.819 18112 9717 1 13 . 1 1 64 64 PHE H H 64 7.082 7.082 8.287 -1.205 18112 9718 1 13 . 1 1 65 65 ARG N N 65 116.695 116.695 120.853 -4.158 18112 9719 1 13 . 1 1 65 65 ARG CA C 65 59.590 59.590 60.449 -0.859 18112 9720 1 13 . 1 1 65 65 ARG H H 65 8.091 8.091 8.325 -0.234 18112 9721 1 13 . 1 1 66 66 GLU N N 66 121.653 121.653 118.940 2.713 18112 9722 1 13 . 1 1 66 66 GLU HA H 66 4.739 4.739 4.119 0.620 18112 9723 1 13 . 1 1 66 66 GLU C C 66 174.621 174.621 179.123 -4.502 18112 9724 1 13 . 1 1 66 66 GLU CA C 66 59.583 59.583 59.370 0.213 18112 9725 1 13 . 1 1 66 66 GLU H H 66 7.597 7.597 7.942 -0.345 18112 9726 1 13 . 1 1 67 67 PHE N N 67 111.578 111.578 119.664 -8.086 18112 9727 1 13 . 1 1 67 67 PHE C C 67 176.164 176.164 178.523 -2.359 18112 9728 1 13 . 1 1 67 67 PHE CA C 67 61.156 61.156 60.100 1.056 18112 9729 1 13 . 1 1 67 67 PHE H H 67 7.067 7.067 7.786 -0.719 18112 9730 1 13 . 1 1 68 68 TYR N N 68 119.370 119.370 118.857 0.513 18112 9731 1 13 . 1 1 68 68 TYR C C 68 176.844 176.844 178.675 -1.831 18112 9732 1 13 . 1 1 68 68 TYR CA C 68 61.758 61.758 62.075 -0.318 18112 9733 1 13 . 1 1 68 68 TYR H H 68 7.442 7.442 8.681 -1.239 18112 9734 1 13 . 1 1 69 69 TYR N N 69 116.047 116.047 119.582 -3.535 18112 9735 1 13 . 1 1 69 69 TYR HA H 69 4.086 4.086 4.057 0.029 18112 9736 1 13 . 1 1 69 69 TYR C C 69 180.328 180.328 177.456 2.872 18112 9737 1 13 . 1 1 69 69 TYR CA C 69 61.528 61.528 61.485 0.043 18112 9738 1 13 . 1 1 69 69 TYR H H 69 9.127 9.127 8.321 0.806 18112 9739 1 13 . 1 1 70 70 ILE N N 70 124.738 124.738 119.345 5.393 18112 9740 1 13 . 1 1 70 70 ILE HA H 70 3.828 3.828 3.512 0.316 18112 9741 1 13 . 1 1 70 70 ILE C C 70 179.585 179.585 178.485 1.100 18112 9742 1 13 . 1 1 70 70 ILE CA C 70 65.787 65.787 64.054 1.733 18112 9743 1 13 . 1 1 70 70 ILE CB C 70 36.435 36.435 37.477 -1.042 18112 9744 1 13 . 1 1 70 70 ILE H H 70 8.631 8.631 8.265 0.366 18112 9745 1 13 . 1 1 71 71 GLN N N 71 117.940 117.940 119.191 -1.251 18112 9746 1 13 . 1 1 71 71 GLN HA H 71 3.826 3.826 3.726 0.100 18112 9747 1 13 . 1 1 71 71 GLN C C 71 178.192 178.192 178.074 0.118 18112 9748 1 13 . 1 1 71 71 GLN CA C 71 57.779 57.779 58.604 -0.825 18112 9749 1 13 . 1 1 71 71 GLN H H 71 7.738 7.738 8.157 -0.419 18112 9750 1 13 . 1 1 72 72 MET N N 72 117.353 117.353 118.329 -0.976 18112 9751 1 13 . 1 1 72 72 MET HA H 72 4.112 4.112 4.172 -0.060 18112 9752 1 13 . 1 1 72 72 MET C C 72 177.203 177.203 178.254 -1.051 18112 9753 1 13 . 1 1 72 72 MET CA C 72 57.272 57.272 57.536 -0.264 18112 9754 1 13 . 1 1 72 72 MET H H 72 7.844 7.844 8.076 -0.232 18112 9755 1 13 . 1 1 73 73 GLU N N 73 117.858 117.858 119.768 -1.910 18112 9756 1 13 . 1 1 73 73 GLU HA H 73 3.572 3.572 3.724 -0.152 18112 9757 1 13 . 1 1 73 73 GLU C C 73 177.344 177.344 178.434 -1.090 18112 9758 1 13 . 1 1 73 73 GLU CA C 73 60.324 60.324 59.538 0.786 18112 9759 1 13 . 1 1 73 73 GLU H H 73 7.503 7.503 8.119 -0.616 18112 9760 1 13 . 1 1 74 74 LYS N N 74 118.716 118.716 120.356 -1.640 18112 9761 1 13 . 1 1 74 74 LYS HA H 74 3.867 3.867 3.995 -0.128 18112 9762 1 13 . 1 1 74 74 LYS C C 74 180.077 180.077 179.492 0.585 18112 9763 1 13 . 1 1 74 74 LYS CA C 74 59.754 59.754 58.611 1.143 18112 9764 1 13 . 1 1 74 74 LYS H H 74 7.912 7.912 7.548 0.364 18112 9765 1 13 . 1 1 75 75 TYR N N 75 117.309 117.309 118.308 -0.999 18112 9766 1 13 . 1 1 75 75 TYR HA H 75 4.085 4.085 4.292 -0.207 18112 9767 1 13 . 1 1 75 75 TYR C C 75 178.874 178.874 178.243 0.631 18112 9768 1 13 . 1 1 75 75 TYR CA C 75 63.306 63.306 59.091 4.215 18112 9769 1 13 . 1 1 75 75 TYR H H 75 8.421 8.421 7.828 0.593 18112 9770 1 13 . 1 1 76 76 ALA N N 76 125.392 125.392 122.545 2.847 18112 9771 1 13 . 1 1 76 76 ALA HA H 76 4.221 4.221 4.152 0.069 18112 9772 1 13 . 1 1 76 76 ALA C C 76 178.850 178.850 179.332 -0.482 18112 9773 1 13 . 1 1 76 76 ALA CA C 76 56.280 56.280 55.456 0.824 18112 9774 1 13 . 1 1 76 76 ALA CB C 76 18.687 18.687 18.392 0.295 18112 9775 1 13 . 1 1 76 76 ALA H H 76 8.553 8.553 8.505 0.048 18112 9776 1 13 . 1 1 77 77 ARG N N 77 115.067 115.067 118.486 -3.419 18112 9777 1 13 . 1 1 77 77 ARG HA H 77 3.935 3.935 3.934 0.001 18112 9778 1 13 . 1 1 77 77 ARG C C 77 179.341 179.341 178.357 0.984 18112 9779 1 13 . 1 1 77 77 ARG CA C 77 60.499 60.499 59.433 1.066 18112 9780 1 13 . 1 1 77 77 ARG H H 77 8.471 8.471 8.231 0.240 18112 9781 1 13 . 1 1 78 78 GLN N N 78 120.107 120.107 119.270 0.837 18112 9782 1 13 . 1 1 78 78 GLN HA H 78 3.921 3.921 4.142 -0.221 18112 9783 1 13 . 1 1 78 78 GLN C C 78 177.289 177.289 178.127 -0.838 18112 9784 1 13 . 1 1 78 78 GLN CA C 78 58.619 58.619 58.823 -0.204 18112 9785 1 13 . 1 1 78 78 GLN CB C 78 27.752 27.752 28.597 -0.845 18112 9786 1 13 . 1 1 78 78 GLN H H 78 8.142 8.142 8.056 0.086 18112 9787 1 13 . 1 1 79 79 ALA N N 79 120.809 120.809 122.603 -1.794 18112 9788 1 13 . 1 1 79 79 ALA HA H 79 4.308 4.308 4.083 0.225 18112 9789 1 13 . 1 1 79 79 ALA C C 79 179.924 179.924 180.039 -0.115 18112 9790 1 13 . 1 1 79 79 ALA CA C 79 54.970 54.970 55.213 -0.243 18112 9791 1 13 . 1 1 79 79 ALA CB C 79 17.064 17.064 18.564 -1.500 18112 9792 1 13 . 1 1 79 79 ALA H H 79 7.811 7.811 7.996 -0.185 18112 9793 1 13 . 1 1 80 80 ILE N N 80 118.524 118.524 118.929 -0.405 18112 9794 1 13 . 1 1 80 80 ILE HA H 80 3.894 3.894 3.690 0.204 18112 9795 1 13 . 1 1 80 80 ILE C C 80 181.268 181.268 178.171 3.097 18112 9796 1 13 . 1 1 80 80 ILE CA C 80 64.841 64.841 64.970 -0.129 18112 9797 1 13 . 1 1 80 80 ILE CB C 80 37.125 37.125 37.683 -0.558 18112 9798 1 13 . 1 1 80 80 ILE H H 80 7.837 7.837 8.173 -0.336 18112 9799 1 13 . 1 1 81 81 ASN N N 81 121.233 121.233 117.217 4.016 18112 9800 1 13 . 1 1 81 81 ASN HA H 81 4.398 4.398 4.442 -0.044 18112 9801 1 13 . 1 1 81 81 ASN C C 81 176.546 176.546 177.145 -0.599 18112 9802 1 13 . 1 1 81 81 ASN CA C 81 55.892 55.892 55.729 0.163 18112 9803 1 13 . 1 1 81 81 ASN CB C 81 37.603 37.603 38.558 -0.955 18112 9804 1 13 . 1 1 81 81 ASN H H 81 8.262 8.262 8.058 0.204 18112 9805 1 13 . 1 1 82 82 ASP N N 82 119.240 119.240 117.287 1.953 18112 9806 1 13 . 1 1 82 82 ASP HA H 82 4.666 4.666 4.678 -0.012 18112 9807 1 13 . 1 1 82 82 ASP C C 82 176.767 176.767 177.144 -0.377 18112 9808 1 13 . 1 1 82 82 ASP CA C 82 54.771 54.771 54.533 0.238 18112 9809 1 13 . 1 1 82 82 ASP CB C 82 40.121 40.121 41.645 -1.524 18112 9810 1 13 . 1 1 82 82 ASP H H 82 8.316 8.316 8.149 0.167 18112 9811 1 13 . 1 1 83 83 GLY N N 83 106.913 106.913 107.000 -0.087 18112 9812 1 13 . 1 1 83 83 GLY C C 83 174.601 174.601 175.432 -0.831 18112 9813 1 13 . 1 1 83 83 GLY CA C 83 45.214 45.214 45.598 -0.384 18112 9814 1 13 . 1 1 83 83 GLY H H 83 7.810 7.810 7.896 -0.086 18112 9815 1 13 . 1 1 84 84 VAL N N 84 122.981 122.981 119.981 3.000 18112 9816 1 13 . 1 1 84 84 VAL HA H 84 3.850 3.850 3.749 0.101 18112 9817 1 13 . 1 1 84 84 VAL C C 84 177.265 177.265 177.158 0.107 18112 9818 1 13 . 1 1 84 84 VAL CA C 84 64.270 64.270 64.659 -0.389 18112 9819 1 13 . 1 1 84 84 VAL CB C 84 30.471 30.471 31.844 -1.373 18112 9820 1 13 . 1 1 84 84 VAL H H 84 8.157 8.157 7.688 0.469 18112 9821 1 13 . 1 1 85 85 THR N N 85 115.232 115.232 107.702 7.530 18112 9822 1 13 . 1 1 85 85 THR HA H 85 4.716 4.716 4.052 0.664 18112 9823 1 13 . 1 1 85 85 THR C C 85 174.489 174.489 173.046 1.443 18112 9824 1 13 . 1 1 85 85 THR CA C 85 61.618 61.618 63.841 -2.223 18112 9825 1 13 . 1 1 85 85 THR CB C 85 70.081 70.081 68.374 1.707 18112 9826 1 13 . 1 1 85 85 THR H H 85 8.890 8.890 7.827 1.063 18112 9827 1 13 . 1 1 86 86 SER N N 86 117.009 117.009 115.258 1.751 18112 9828 1 13 . 1 1 86 86 SER HA H 86 5.046 5.046 4.731 0.315 18112 9829 1 13 . 1 1 86 86 SER C C 86 174.473 174.473 175.211 -0.738 18112 9830 1 13 . 1 1 86 86 SER CA C 86 55.922 55.922 57.077 -1.155 18112 9831 1 13 . 1 1 86 86 SER CB C 86 64.385 64.385 65.662 -1.277 18112 9832 1 13 . 1 1 86 86 SER H H 86 7.704 7.704 7.741 -0.037 18112 9833 1 13 . 1 1 87 87 THR N N 87 118.634 118.634 116.648 1.986 18112 9834 1 13 . 1 1 87 87 THR HA H 87 4.065 4.065 4.110 -0.045 18112 9835 1 13 . 1 1 87 87 THR C C 87 176.047 176.047 175.437 0.610 18112 9836 1 13 . 1 1 87 87 THR CA C 87 64.983 64.983 64.027 0.956 18112 9837 1 13 . 1 1 87 87 THR CB C 87 68.045 68.045 68.745 -0.700 18112 9838 1 13 . 1 1 87 87 THR H H 87 8.711 8.711 8.489 0.222 18112 9839 1 13 . 1 1 88 88 GLU N N 88 117.889 117.889 119.085 -1.196 18112 9840 1 13 . 1 1 88 88 GLU HA H 88 3.881 3.881 4.175 -0.294 18112 9841 1 13 . 1 1 88 88 GLU C C 88 177.146 177.146 176.701 0.445 18112 9842 1 13 . 1 1 88 88 GLU CA C 88 57.814 57.814 57.432 0.382 18112 9843 1 13 . 1 1 88 88 GLU CB C 88 28.050 28.050 28.031 0.019 18112 9844 1 13 . 1 1 88 88 GLU H H 88 8.152 8.152 8.648 -0.496 18112 9845 1 13 . 1 1 89 89 GLU N N 89 115.617 115.617 117.443 -1.826 18112 9846 1 13 . 1 1 89 89 GLU HA H 89 4.149 4.149 4.361 -0.212 18112 9847 1 13 . 1 1 89 89 GLU C C 89 176.192 176.192 177.235 -1.043 18112 9848 1 13 . 1 1 89 89 GLU CA C 89 56.133 56.133 56.430 -0.297 18112 9849 1 13 . 1 1 89 89 GLU CB C 89 29.415 29.415 30.733 -1.318 18112 9850 1 13 . 1 1 89 89 GLU H H 89 7.311 7.311 7.482 -0.171 18112 9851 1 13 . 1 1 90 90 LEU N N 90 120.870 120.870 119.538 1.332 18112 9852 1 13 . 1 1 90 90 LEU HA H 90 4.439 4.439 4.168 0.271 18112 9853 1 13 . 1 1 90 90 LEU C C 90 175.267 175.267 177.293 -2.026 18112 9854 1 13 . 1 1 90 90 LEU CA C 90 53.504 53.504 55.886 -2.382 18112 9855 1 13 . 1 1 90 90 LEU CB C 90 40.479 40.479 42.705 -2.226 18112 9856 1 13 . 1 1 90 90 LEU H H 90 7.311 7.311 7.464 -0.153 18112 9857 1 13 . 1 1 91 91 SER N N 91 118.376 118.376 114.401 3.975 18112 9858 1 13 . 1 1 91 91 SER HA H 91 4.747 4.747 4.621 0.126 18112 9859 1 13 . 1 1 91 91 SER C C 91 173.332 173.332 173.557 -0.225 18112 9860 1 13 . 1 1 91 91 SER CA C 91 56.314 56.314 57.625 -1.311 18112 9861 1 13 . 1 1 91 91 SER CB C 91 64.615 64.615 62.752 1.863 18112 9862 1 13 . 1 1 91 91 SER H H 91 8.221 8.221 7.981 0.240 18112 9863 1 13 . 1 1 92 92 ILE N N 92 122.247 122.247 124.052 -1.805 18112 9864 1 13 . 1 1 92 92 ILE HA H 92 4.537 4.537 4.559 -0.022 18112 9865 1 13 . 1 1 92 92 ILE C C 92 174.059 174.059 176.300 -2.241 18112 9866 1 13 . 1 1 92 92 ILE CA C 92 59.881 59.881 58.916 0.965 18112 9867 1 13 . 1 1 92 92 ILE CB C 92 37.820 37.820 42.394 -4.574 18112 9868 1 13 . 1 1 92 92 ILE H H 92 8.570 8.570 7.566 1.004 18112 9869 1 13 . 1 1 93 93 THR N N 93 116.069 116.069 115.010 1.059 18112 9870 1 13 . 1 1 93 93 THR HA H 93 4.580 4.580 4.461 0.119 18112 9871 1 13 . 1 1 93 93 THR C C 93 175.049 175.049 175.642 -0.593 18112 9872 1 13 . 1 1 93 93 THR CA C 93 58.988 58.988 64.335 -5.348 18112 9873 1 13 . 1 1 93 93 THR CB C 93 71.362 71.362 69.376 1.986 18112 9874 1 13 . 1 1 93 93 THR H H 93 7.224 7.224 8.671 -1.447 18112 9875 1 13 . 1 1 94 94 ARG N N 94 116.595 116.595 115.801 0.794 18112 9876 1 13 . 1 1 94 94 ARG HA H 94 3.077 3.077 3.933 -0.856 18112 9877 1 13 . 1 1 94 94 ARG C C 94 175.076 175.076 174.203 0.873 18112 9878 1 13 . 1 1 94 94 ARG CA C 94 57.119 57.119 56.481 0.638 18112 9879 1 13 . 1 1 94 94 ARG CB C 94 27.838 27.838 29.355 -1.517 18112 9880 1 13 . 1 1 94 94 ARG H H 94 8.596 8.596 8.894 -0.298 18112 9881 1 13 . 1 1 95 95 ASP N N 95 113.735 113.735 117.267 -3.532 18112 9882 1 13 . 1 1 95 95 ASP HA H 95 4.765 4.765 2.990 1.775 18112 9883 1 13 . 1 1 95 95 ASP C C 95 175.876 175.876 175.127 0.749 18112 9884 1 13 . 1 1 95 95 ASP CA C 95 53.156 53.156 54.605 -1.449 18112 9885 1 13 . 1 1 95 95 ASP CB C 95 41.166 41.166 39.860 1.306 18112 9886 1 13 . 1 1 95 95 ASP H H 95 7.607 7.607 7.723 -0.116 18112 9887 1 13 . 1 1 96 96 CYS N N 96 116.012 116.012 118.541 -2.529 18112 9888 1 13 . 1 1 96 96 CYS C C 96 174.361 174.361 175.159 -0.798 18112 9889 1 13 . 1 1 96 96 CYS CA C 96 56.562 56.562 56.396 0.166 18112 9890 1 13 . 1 1 96 96 CYS CB C 96 29.416 29.416 30.872 -1.456 18112 9891 1 13 . 1 1 96 96 CYS H H 96 7.094 7.094 7.863 -0.769 18112 9892 1 13 . 1 1 97 97 GLU N N 97 123.087 123.087 120.347 2.740 18112 9893 1 13 . 1 1 97 97 GLU C C 97 178.748 178.748 178.441 0.307 18112 9894 1 13 . 1 1 97 97 GLU CA C 97 59.912 59.912 59.101 0.811 18112 9895 1 13 . 1 1 97 97 GLU CB C 97 29.195 29.195 28.728 0.467 18112 9896 1 13 . 1 1 97 97 GLU H H 97 9.003 9.003 8.927 0.076 18112 9897 1 13 . 1 1 98 98 LEU N N 98 120.942 120.942 121.557 -0.615 18112 9898 1 13 . 1 1 98 98 LEU HA H 98 3.614 3.614 4.130 -0.516 18112 9899 1 13 . 1 1 98 98 LEU C C 98 177.796 177.796 178.191 -0.395 18112 9900 1 13 . 1 1 98 98 LEU CA C 98 58.090 58.090 57.954 0.136 18112 9901 1 13 . 1 1 98 98 LEU CB C 98 39.778 39.778 41.701 -1.923 18112 9902 1 13 . 1 1 98 98 LEU H H 98 8.656 8.656 7.628 1.028 18112 9903 1 13 . 1 1 99 99 TYR N N 99 118.313 118.313 117.595 0.718 18112 9904 1 13 . 1 1 99 99 TYR C C 99 177.077 177.077 178.490 -1.413 18112 9905 1 13 . 1 1 99 99 TYR CA C 99 62.622 62.622 61.385 1.237 18112 9906 1 13 . 1 1 99 99 TYR CB C 99 38.742 38.742 37.570 1.172 18112 9907 1 13 . 1 1 99 99 TYR H H 99 7.522 7.522 7.894 -0.372 18112 9908 1 13 . 1 1 100 100 ARG N N 100 118.101 118.101 119.927 -1.826 18112 9909 1 13 . 1 1 100 100 ARG C C 100 178.616 178.616 178.462 0.154 18112 9910 1 13 . 1 1 100 100 ARG CA C 100 59.915 59.915 59.695 0.220 18112 9911 1 13 . 1 1 100 100 ARG CB C 100 29.100 29.100 30.274 -1.174 18112 9912 1 13 . 1 1 100 100 ARG H H 100 8.243 8.243 8.430 -0.187 18112 9913 1 13 . 1 1 101 101 ALA N N 101 120.972 120.972 122.158 -1.186 18112 9914 1 13 . 1 1 101 101 ALA HA H 101 4.145 4.145 4.218 -0.073 18112 9915 1 13 . 1 1 101 101 ALA C C 101 181.359 181.359 179.977 1.382 18112 9916 1 13 . 1 1 101 101 ALA CA C 101 55.057 55.057 55.136 -0.080 18112 9917 1 13 . 1 1 101 101 ALA CB C 101 17.543 17.543 18.666 -1.123 18112 9918 1 13 . 1 1 101 101 ALA H H 101 8.352 8.352 7.869 0.483 18112 9919 1 13 . 1 1 102 102 LEU N N 102 115.683 115.683 118.610 -2.927 18112 9920 1 13 . 1 1 102 102 LEU HA H 102 4.333 4.333 4.262 0.071 18112 9921 1 13 . 1 1 102 102 LEU C C 102 178.583 178.583 179.554 -0.971 18112 9922 1 13 . 1 1 102 102 LEU CA C 102 57.634 57.634 58.084 -0.450 18112 9923 1 13 . 1 1 102 102 LEU CB C 102 41.716 41.716 41.410 0.306 18112 9924 1 13 . 1 1 102 102 LEU H H 102 7.960 7.960 8.490 -0.530 18112 9925 1 13 . 1 1 103 103 ASN N N 103 118.957 118.957 117.903 1.054 18112 9926 1 13 . 1 1 103 103 ASN C C 103 177.470 177.470 177.766 -0.296 18112 9927 1 13 . 1 1 103 103 ASN CA C 103 56.974 56.974 55.982 0.992 18112 9928 1 13 . 1 1 103 103 ASN CB C 103 38.140 38.140 38.572 -0.432 18112 9929 1 13 . 1 1 103 103 ASN H H 103 9.301 9.301 8.299 1.002 18112 9930 1 13 . 1 1 104 104 MET N N 104 113.763 113.763 119.435 -5.672 18112 9931 1 13 . 1 1 104 104 MET CA C 104 57.362 57.362 59.362 -2.000 18112 9932 1 13 . 1 1 104 104 MET CB C 104 31.895 31.895 32.897 -1.002 18112 9933 1 13 . 1 1 104 104 MET H H 104 8.332 8.332 8.128 0.204 18112 9934 1 13 . 1 1 105 105 HIS N N 105 116.024 116.024 116.283 -0.259 18112 9935 1 13 . 1 1 105 105 HIS HA H 105 3.764 3.764 4.208 -0.444 18112 9936 1 13 . 1 1 105 105 HIS C C 105 176.939 176.939 177.088 -0.149 18112 9937 1 13 . 1 1 105 105 HIS CA C 105 59.069 59.069 58.630 0.439 18112 9938 1 13 . 1 1 105 105 HIS H H 105 7.156 7.156 8.474 -1.318 18112 9939 1 13 . 1 1 106 106 TYR N N 106 113.161 113.161 116.266 -3.105 18112 9940 1 13 . 1 1 106 106 TYR C C 106 173.767 173.767 174.900 -1.133 18112 9941 1 13 . 1 1 106 106 TYR CA C 106 58.488 58.488 59.434 -0.946 18112 9942 1 13 . 1 1 106 106 TYR CB C 106 38.225 38.225 38.903 -0.678 18112 9943 1 13 . 1 1 106 106 TYR H H 106 7.204 7.204 8.157 -0.953 18112 9944 1 13 . 1 1 107 107 ASN N N 107 118.875 118.875 113.918 4.957 18112 9945 1 13 . 1 1 107 107 ASN HA H 107 3.922 3.922 4.524 -0.602 18112 9946 1 13 . 1 1 107 107 ASN C C 107 175.815 175.815 175.832 -0.017 18112 9947 1 13 . 1 1 107 107 ASN CA C 107 51.233 51.233 53.278 -2.045 18112 9948 1 13 . 1 1 107 107 ASN CB C 107 38.142 38.142 38.217 -0.075 18112 9949 1 13 . 1 1 107 107 ASN H H 107 8.127 8.127 7.875 0.252 18112 9950 1 13 . 1 1 108 108 LYS N N 108 122.850 122.850 122.434 0.416 18112 9951 1 13 . 1 1 108 108 LYS HA H 108 3.954 3.954 4.226 -0.272 18112 9952 1 13 . 1 1 108 108 LYS C C 108 177.586 177.586 177.299 0.287 18112 9953 1 13 . 1 1 108 108 LYS CA C 108 59.749 59.749 59.356 0.393 18112 9954 1 13 . 1 1 108 108 LYS CB C 108 31.498 31.498 32.203 -0.705 18112 9955 1 13 . 1 1 108 108 LYS H H 108 7.772 7.772 8.867 -1.095 18112 9956 1 13 . 1 1 109 109 ALA N N 109 118.054 118.054 118.198 -0.144 18112 9957 1 13 . 1 1 109 109 ALA HA H 109 4.137 4.137 4.225 -0.088 18112 9958 1 13 . 1 1 109 109 ALA C C 109 177.889 177.889 177.760 0.129 18112 9959 1 13 . 1 1 109 109 ALA CA C 109 52.299 52.299 52.285 0.014 18112 9960 1 13 . 1 1 109 109 ALA CB C 109 17.787 17.787 18.974 -1.187 18112 9961 1 13 . 1 1 109 109 ALA H H 109 8.307 8.307 7.684 0.623 18112 9962 1 13 . 1 1 110 110 ASN N N 110 115.542 115.542 119.345 -3.803 18112 9963 1 13 . 1 1 110 110 ASN HA H 110 4.480 4.480 4.671 -0.191 18112 9964 1 13 . 1 1 110 110 ASN C C 110 174.277 174.277 174.736 -0.459 18112 9965 1 13 . 1 1 110 110 ASN CA C 110 53.504 53.504 54.176 -0.672 18112 9966 1 13 . 1 1 110 110 ASN CB C 110 37.283 37.283 37.418 -0.135 18112 9967 1 13 . 1 1 110 110 ASN H H 110 8.353 8.353 8.049 0.304 18112 9968 1 13 . 1 1 111 111 ASP N N 111 114.692 114.692 122.382 -7.690 18112 9969 1 13 . 1 1 111 111 ASP HA H 111 4.485 4.485 4.454 0.031 18112 9970 1 13 . 1 1 111 111 ASP C C 111 174.868 174.868 176.627 -1.759 18112 9971 1 13 . 1 1 111 111 ASP CA C 111 53.227 53.227 55.818 -2.591 18112 9972 1 13 . 1 1 111 111 ASP CB C 111 39.228 39.228 41.131 -1.903 18112 9973 1 13 . 1 1 111 111 ASP H H 111 8.297 8.297 7.915 0.382 18112 9974 1 13 . 1 1 112 112 PHE N N 112 120.927 120.927 119.007 1.920 18112 9975 1 13 . 1 1 112 112 PHE HA H 112 4.752 4.752 4.442 0.310 18112 9976 1 13 . 1 1 112 112 PHE C C 112 174.633 174.633 176.755 -2.122 18112 9977 1 13 . 1 1 112 112 PHE CA C 112 56.346 56.346 58.613 -2.267 18112 9978 1 13 . 1 1 112 112 PHE H H 112 7.784 7.784 8.069 -0.285 18112 9979 1 13 . 1 1 113 113 GLU N N 113 128.111 128.111 127.459 0.652 18112 9980 1 13 . 1 1 113 113 GLU HA H 113 4.011 4.011 4.314 -0.303 18112 9981 1 13 . 1 1 113 113 GLU C C 113 173.502 173.502 175.692 -2.190 18112 9982 1 13 . 1 1 113 113 GLU CA C 113 55.100 55.100 55.969 -0.870 18112 9983 1 13 . 1 1 113 113 GLU H H 113 7.752 7.752 8.940 -1.188 18112 9984 1 13 . 1 1 114 114 VAL N N 114 129.326 129.326 115.139 14.187 18112 9985 1 13 . 1 1 114 114 VAL HA H 114 3.241 3.241 3.766 -0.525 18112 9986 1 13 . 1 1 114 114 VAL CA C 114 60.838 60.838 61.078 -0.240 18112 9987 1 13 . 1 1 114 114 VAL CB C 114 32.609 32.609 30.840 1.770 18112 9988 1 13 . 1 1 114 114 VAL H H 114 8.008 8.008 7.411 0.597 18112 9989 1 13 . 1 1 115 115 PRO HA H 115 4.429 4.429 4.168 0.261 18112 9990 1 13 . 1 1 115 115 PRO C C 115 177.421 177.421 177.638 -0.217 18112 9991 1 13 . 1 1 115 115 PRO CA C 115 61.882 61.882 63.098 -1.216 18112 9992 1 13 . 1 1 115 115 PRO CB C 115 30.974 30.974 32.115 -1.141 18112 9993 1 13 . 1 1 116 116 GLU N N 116 123.936 123.936 123.014 0.922 18112 9994 1 13 . 1 1 116 116 GLU C C 116 179.034 179.034 178.854 0.180 18112 9995 1 13 . 1 1 116 116 GLU CA C 116 58.913 58.913 59.972 -1.059 18112 9996 1 13 . 1 1 116 116 GLU CB C 116 28.378 28.378 29.160 -0.782 18112 9997 1 13 . 1 1 116 116 GLU H H 116 8.757 8.757 8.851 -0.094 18112 9998 1 13 . 1 1 117 117 ARG N N 117 116.943 116.943 118.997 -2.054 18112 9999 1 13 . 1 1 117 117 ARG C C 117 177.570 177.570 178.864 -1.294 18112 10000 1 13 . 1 1 117 117 ARG CA C 117 57.033 57.033 59.064 -2.031 18112 10001 1 13 . 1 1 117 117 ARG CB C 117 28.172 28.172 29.295 -1.123 18112 10002 1 13 . 1 1 117 117 ARG H H 117 8.733 8.733 8.280 0.453 18112 10003 1 13 . 1 1 118 118 PHE N N 118 117.528 117.528 117.758 -0.230 18112 10004 1 13 . 1 1 118 118 PHE HA H 118 4.137 4.137 4.410 -0.273 18112 10005 1 13 . 1 1 118 118 PHE C C 118 176.992 176.992 178.168 -1.176 18112 10006 1 13 . 1 1 118 118 PHE CA C 118 61.627 61.627 59.142 2.486 18112 10007 1 13 . 1 1 118 118 PHE CB C 118 37.386 37.386 37.931 -0.545 18112 10008 1 13 . 1 1 118 118 PHE H H 118 7.606 7.606 7.665 -0.059 18112 10009 1 13 . 1 1 119 119 LEU N N 119 118.483 118.483 120.247 -1.764 18112 10010 1 13 . 1 1 119 119 LEU HA H 119 3.684 3.684 4.086 -0.402 18112 10011 1 13 . 1 1 119 119 LEU C C 119 178.802 178.802 179.288 -0.486 18112 10012 1 13 . 1 1 119 119 LEU CA C 119 59.875 59.875 57.719 2.156 18112 10013 1 13 . 1 1 119 119 LEU CB C 119 39.453 39.453 40.475 -1.022 18112 10014 1 13 . 1 1 119 119 LEU H H 119 7.248 7.248 7.400 -0.152 18112 10015 1 13 . 1 1 120 120 GLU N N 120 117.870 117.870 119.785 -1.915 18112 10016 1 13 . 1 1 120 120 GLU C C 120 179.932 179.932 179.623 0.309 18112 10017 1 13 . 1 1 120 120 GLU CA C 120 59.150 59.150 59.358 -0.208 18112 10018 1 13 . 1 1 120 120 GLU CB C 120 28.878 28.878 29.293 -0.415 18112 10019 1 13 . 1 1 120 120 GLU H H 120 7.423 7.423 8.132 -0.709 18112 10020 1 13 . 1 1 121 121 VAL N N 121 120.777 120.777 119.890 0.887 18112 10021 1 13 . 1 1 121 121 VAL HA H 121 3.545 3.545 3.472 0.073 18112 10022 1 13 . 1 1 121 121 VAL C C 121 179.302 179.302 177.857 1.445 18112 10023 1 13 . 1 1 121 121 VAL CA C 121 66.875 66.875 66.499 0.376 18112 10024 1 13 . 1 1 121 121 VAL CB C 121 30.823 30.823 31.259 -0.436 18112 10025 1 13 . 1 1 121 121 VAL H H 121 8.313 8.313 8.265 0.048 18112 10026 1 13 . 1 1 122 122 ALA N N 122 127.029 127.029 121.452 5.577 18112 10027 1 13 . 1 1 122 122 ALA HA H 122 4.251 4.251 3.943 0.308 18112 10028 1 13 . 1 1 122 122 ALA C C 122 178.366 178.366 179.424 -1.058 18112 10029 1 13 . 1 1 122 122 ALA CA C 122 54.748 54.748 55.333 -0.584 18112 10030 1 13 . 1 1 122 122 ALA CB C 122 16.565 16.565 18.086 -1.521 18112 10031 1 13 . 1 1 122 122 ALA H H 122 8.896 8.896 7.885 1.011 18112 10032 1 13 . 1 1 123 123 GLN N N 123 119.887 119.887 119.475 0.412 18112 10033 1 13 . 1 1 123 123 GLN C C 123 177.908 177.908 178.607 -0.699 18112 10034 1 13 . 1 1 123 123 GLN CA C 123 60.671 60.671 59.024 1.647 18112 10035 1 13 . 1 1 123 123 GLN H H 123 8.349 8.349 7.934 0.415 18112 10036 1 13 . 1 1 124 124 ILE N N 124 120.632 120.632 118.754 1.878 18112 10037 1 13 . 1 1 124 124 ILE HA H 124 3.651 3.651 3.777 -0.126 18112 10038 1 13 . 1 1 124 124 ILE C C 124 178.703 178.703 178.323 0.380 18112 10039 1 13 . 1 1 124 124 ILE CA C 124 65.945 65.945 65.127 0.818 18112 10040 1 13 . 1 1 124 124 ILE H H 124 8.204 8.204 8.139 0.065 18112 10041 1 13 . 1 1 125 125 THR N N 125 115.084 115.084 115.792 -0.708 18112 10042 1 13 . 1 1 125 125 THR C C 125 175.568 175.568 176.385 -0.817 18112 10043 1 13 . 1 1 125 125 THR CA C 125 67.872 67.872 66.380 1.492 18112 10044 1 13 . 1 1 125 125 THR H H 125 8.399 8.399 8.338 0.061 18112 10045 1 13 . 1 1 126 126 LEU N N 126 125.011 125.011 122.804 2.207 18112 10046 1 13 . 1 1 126 126 LEU HA H 126 4.085 4.085 4.556 -0.471 18112 10047 1 13 . 1 1 126 126 LEU C C 126 178.559 178.559 178.231 0.328 18112 10048 1 13 . 1 1 126 126 LEU CA C 126 58.843 58.843 58.097 0.746 18112 10049 1 13 . 1 1 126 126 LEU CB C 126 41.421 41.421 41.917 -0.496 18112 10050 1 13 . 1 1 126 126 LEU H H 126 8.728 8.728 8.221 0.507 18112 10051 1 13 . 1 1 127 127 ARG N N 127 117.076 117.076 119.492 -2.416 18112 10052 1 13 . 1 1 127 127 ARG HA H 127 3.929 3.929 4.086 -0.157 18112 10053 1 13 . 1 1 127 127 ARG C C 127 177.984 177.984 178.652 -0.668 18112 10054 1 13 . 1 1 127 127 ARG CA C 127 60.685 60.685 59.615 1.070 18112 10055 1 13 . 1 1 127 127 ARG CB C 127 28.079 28.079 30.025 -1.946 18112 10056 1 13 . 1 1 127 127 ARG H H 127 8.213 8.213 8.316 -0.103 18112 10057 1 13 . 1 1 128 128 GLU N N 128 118.617 118.617 119.478 -0.861 18112 10058 1 13 . 1 1 128 128 GLU HA H 128 4.147 4.147 4.185 -0.038 18112 10059 1 13 . 1 1 128 128 GLU C C 128 181.150 181.150 179.278 1.872 18112 10060 1 13 . 1 1 128 128 GLU CA C 128 59.508 59.508 59.018 0.490 18112 10061 1 13 . 1 1 128 128 GLU H H 128 8.478 8.478 8.032 0.446 18112 10062 1 13 . 1 1 129 129 PHE N N 129 119.267 119.267 120.045 -0.778 18112 10063 1 13 . 1 1 129 129 PHE HA H 129 4.104 4.104 4.362 -0.258 18112 10064 1 13 . 1 1 129 129 PHE C C 129 177.170 177.170 177.664 -0.494 18112 10065 1 13 . 1 1 129 129 PHE CA C 129 63.694 63.694 61.331 2.363 18112 10066 1 13 . 1 1 129 129 PHE H H 129 8.570 8.570 8.567 0.003 18112 10067 1 13 . 1 1 130 130 PHE N N 130 118.739 118.739 120.642 -1.903 18112 10068 1 13 . 1 1 130 130 PHE HA H 130 3.884 3.884 4.003 -0.119 18112 10069 1 13 . 1 1 130 130 PHE C C 130 175.860 175.860 176.949 -1.089 18112 10070 1 13 . 1 1 130 130 PHE CA C 130 62.819 62.819 62.024 0.795 18112 10071 1 13 . 1 1 130 130 PHE H H 130 8.740 8.740 8.768 -0.028 18112 10072 1 13 . 1 1 131 131 ASN N N 131 116.028 116.028 118.039 -2.011 18112 10073 1 13 . 1 1 131 131 ASN HA H 131 4.373 4.373 4.176 0.197 18112 10074 1 13 . 1 1 131 131 ASN C C 131 178.228 178.228 177.590 0.638 18112 10075 1 13 . 1 1 131 131 ASN CA C 131 55.150 55.150 56.167 -1.017 18112 10076 1 13 . 1 1 131 131 ASN H H 131 8.864 8.864 8.390 0.474 18112 10077 1 13 . 1 1 132 132 ALA N N 132 120.922 120.922 122.073 -1.151 18112 10078 1 13 . 1 1 132 132 ALA HA H 132 4.020 4.020 4.049 -0.029 18112 10079 1 13 . 1 1 132 132 ALA C C 132 178.515 178.515 179.911 -1.396 18112 10080 1 13 . 1 1 132 132 ALA CA C 132 54.924 54.924 54.816 0.108 18112 10081 1 13 . 1 1 132 132 ALA CB C 132 18.441 18.441 18.434 0.007 18112 10082 1 13 . 1 1 132 132 ALA H H 132 7.745 7.745 7.797 -0.052 18112 10083 1 13 . 1 1 133 133 ILE N N 133 118.200 118.200 118.972 -0.772 18112 10084 1 13 . 1 1 133 133 ILE HA H 133 3.235 3.235 3.664 -0.429 18112 10085 1 13 . 1 1 133 133 ILE C C 133 180.606 180.606 177.693 2.913 18112 10086 1 13 . 1 1 133 133 ILE CA C 133 65.215 65.215 63.946 1.269 18112 10087 1 13 . 1 1 133 133 ILE CB C 133 38.291 38.291 37.979 0.312 18112 10088 1 13 . 1 1 133 133 ILE H H 133 7.999 7.999 7.690 0.309 18112 10089 1 13 . 1 1 134 134 ILE N N 134 122.564 122.564 120.229 2.335 18112 10090 1 13 . 1 1 134 134 ILE HA H 134 3.788 3.788 3.620 0.168 18112 10091 1 13 . 1 1 134 134 ILE C C 134 177.215 177.215 176.634 0.581 18112 10092 1 13 . 1 1 134 134 ILE CA C 134 63.584 63.584 63.205 0.379 18112 10093 1 13 . 1 1 134 134 ILE CB C 134 35.636 35.636 37.803 -2.167 18112 10094 1 13 . 1 1 134 134 ILE H H 134 8.670 8.670 7.853 0.817 18112 10095 1 13 . 1 1 135 135 ALA N N 135 119.989 119.989 121.252 -1.263 18112 10096 1 13 . 1 1 135 135 ALA HA H 135 4.357 4.357 4.223 0.134 18112 10097 1 13 . 1 1 135 135 ALA C C 135 177.786 177.786 178.707 -0.921 18112 10098 1 13 . 1 1 135 135 ALA CA C 135 51.521 51.521 53.553 -2.032 18112 10099 1 13 . 1 1 135 135 ALA CB C 135 18.839 18.839 19.334 -0.495 18112 10100 1 13 . 1 1 135 135 ALA H H 135 6.898 6.898 7.909 -1.011 18112 10101 1 13 . 1 1 136 136 GLY N N 136 107.682 107.682 104.030 3.652 18112 10102 1 13 . 1 1 136 136 GLY C C 136 176.324 176.324 174.155 2.169 18112 10103 1 13 . 1 1 136 136 GLY CA C 136 45.469 45.469 44.323 1.146 18112 10104 1 13 . 1 1 136 136 GLY H H 136 7.913 7.913 7.706 0.207 18112 10105 1 13 . 1 1 137 137 LYS N N 137 117.213 117.213 121.089 -3.876 18112 10106 1 13 . 1 1 137 137 LYS HA H 137 4.004 4.004 3.673 0.331 18112 10107 1 13 . 1 1 137 137 LYS C C 137 176.616 176.616 176.180 0.436 18112 10108 1 13 . 1 1 137 137 LYS CA C 137 57.499 57.499 57.510 -0.011 18112 10109 1 13 . 1 1 137 137 LYS CB C 137 30.927 30.927 31.173 -0.246 18112 10110 1 13 . 1 1 137 137 LYS H H 137 8.312 8.312 8.025 0.287 18112 10111 1 13 . 1 1 138 138 ASP N N 138 113.545 113.545 115.580 -2.035 18112 10112 1 13 . 1 1 138 138 ASP HA H 138 3.061 3.061 3.652 -0.591 18112 10113 1 13 . 1 1 138 138 ASP C C 138 174.698 174.698 177.091 -2.393 18112 10114 1 13 . 1 1 138 138 ASP CA C 138 53.694 53.694 56.763 -3.069 18112 10115 1 13 . 1 1 138 138 ASP CB C 138 36.008 36.008 39.999 -3.991 18112 10116 1 13 . 1 1 138 138 ASP H H 138 8.465 8.465 7.876 0.589 18112 10117 1 13 . 1 1 139 139 VAL N N 139 115.191 115.191 118.779 -3.588 18112 10118 1 13 . 1 1 139 139 VAL HA H 139 3.886 3.886 3.717 0.169 18112 10119 1 13 . 1 1 139 139 VAL C C 139 175.889 175.889 176.815 -0.926 18112 10120 1 13 . 1 1 139 139 VAL CA C 139 62.793 62.793 64.553 -1.760 18112 10121 1 13 . 1 1 139 139 VAL CB C 139 30.662 30.662 31.553 -0.891 18112 10122 1 13 . 1 1 139 139 VAL H H 139 6.610 6.610 7.599 -0.989 18112 10123 1 13 . 1 1 140 140 ASP N N 140 123.363 123.363 120.470 2.893 18112 10124 1 13 . 1 1 140 140 ASP C C 140 175.234 175.234 175.599 -0.365 18112 10125 1 13 . 1 1 140 140 ASP CA C 140 50.221 50.221 52.544 -2.322 18112 10126 1 13 . 1 1 140 140 ASP CB C 140 42.254 42.254 42.082 0.172 18112 10127 1 13 . 1 1 140 140 ASP H H 140 7.553 7.553 7.533 0.020 18112 10128 1 13 . 1 1 141 141 PRO HA H 141 4.682 4.682 4.487 0.195 18112 10129 1 13 . 1 1 141 141 PRO C C 141 178.678 178.678 178.019 0.659 18112 10130 1 13 . 1 1 141 141 PRO CA C 141 64.532 64.532 64.624 -0.092 18112 10131 1 13 . 1 1 141 141 PRO CB C 141 31.331 31.331 32.477 -1.145 18112 10132 1 13 . 1 1 142 142 SER N N 142 114.421 114.421 114.315 0.106 18112 10133 1 13 . 1 1 142 142 SER HA H 142 4.565 4.565 4.334 0.231 18112 10134 1 13 . 1 1 142 142 SER C C 142 176.524 176.524 176.561 -0.037 18112 10135 1 13 . 1 1 142 142 SER CA C 142 58.711 58.711 60.138 -1.427 18112 10136 1 13 . 1 1 142 142 SER CB C 142 62.783 62.783 62.090 0.693 18112 10137 1 13 . 1 1 142 142 SER H H 142 8.703 8.703 8.025 0.678 18112 10138 1 13 . 1 1 143 143 TRP N N 143 123.598 123.598 123.343 0.255 18112 10139 1 13 . 1 1 143 143 TRP HA H 143 4.136 4.136 4.323 -0.187 18112 10140 1 13 . 1 1 143 143 TRP C C 143 177.113 177.113 176.915 0.198 18112 10141 1 13 . 1 1 143 143 TRP CA C 143 59.803 59.803 59.704 0.099 18112 10142 1 13 . 1 1 143 143 TRP CB C 143 26.364 26.364 28.021 -1.657 18112 10143 1 13 . 1 1 143 143 TRP H H 143 8.374 8.374 8.009 0.365 18112 10144 1 13 . 1 1 144 144 LYS N N 144 119.293 119.293 119.781 -0.488 18112 10145 1 13 . 1 1 144 144 LYS HA H 144 2.719 2.719 2.884 -0.165 18112 10146 1 13 . 1 1 144 144 LYS C C 144 177.243 177.243 177.931 -0.688 18112 10147 1 13 . 1 1 144 144 LYS CA C 144 58.851 58.851 58.642 0.209 18112 10148 1 13 . 1 1 144 144 LYS CB C 144 29.373 29.373 30.620 -1.247 18112 10149 1 13 . 1 1 144 144 LYS H H 144 7.196 7.196 6.981 0.215 18112 10150 1 13 . 1 1 145 145 LYS N N 145 116.440 116.440 119.979 -3.539 18112 10151 1 13 . 1 1 145 145 LYS HA H 145 3.490 3.490 4.150 -0.660 18112 10152 1 13 . 1 1 145 145 LYS C C 145 179.149 179.149 178.632 0.517 18112 10153 1 13 . 1 1 145 145 LYS CA C 145 59.271 59.271 57.840 1.431 18112 10154 1 13 . 1 1 145 145 LYS CB C 145 30.521 30.521 31.559 -1.038 18112 10155 1 13 . 1 1 145 145 LYS H H 145 7.389 7.389 7.545 -0.156 18112 10156 1 13 . 1 1 146 146 ALA N N 146 118.582 118.582 122.770 -4.188 18112 10157 1 13 . 1 1 146 146 ALA HA H 146 3.932 3.932 4.063 -0.131 18112 10158 1 13 . 1 1 146 146 ALA C C 146 179.968 179.968 179.724 0.244 18112 10159 1 13 . 1 1 146 146 ALA CA C 146 54.241 54.241 55.081 -0.840 18112 10160 1 13 . 1 1 146 146 ALA CB C 146 17.689 17.689 18.166 -0.477 18112 10161 1 13 . 1 1 146 146 ALA H H 146 7.112 7.112 7.779 -0.667 18112 10162 1 13 . 1 1 147 147 ILE N N 147 118.537 118.537 119.739 -1.202 18112 10163 1 13 . 1 1 147 147 ILE HA H 147 3.642 3.642 3.549 0.093 18112 10164 1 13 . 1 1 147 147 ILE C C 147 178.919 178.919 178.078 0.841 18112 10165 1 13 . 1 1 147 147 ILE CA C 147 64.418 64.418 64.780 -0.362 18112 10166 1 13 . 1 1 147 147 ILE CB C 147 36.519 36.519 37.232 -0.713 18112 10167 1 13 . 1 1 147 147 ILE H H 147 6.734 6.734 7.931 -1.197 18112 10168 1 13 . 1 1 148 148 TYR N N 148 121.033 121.033 117.891 3.142 18112 10169 1 13 . 1 1 148 148 TYR HA H 148 4.489 4.489 4.068 0.421 18112 10170 1 13 . 1 1 148 148 TYR C C 148 178.348 178.348 178.402 -0.054 18112 10171 1 13 . 1 1 148 148 TYR CA C 148 57.389 57.389 59.463 -2.074 18112 10172 1 13 . 1 1 148 148 TYR CB C 148 35.280 35.280 36.977 -1.697 18112 10173 1 13 . 1 1 148 148 TYR H H 148 8.126 8.126 8.003 0.123 18112 10174 1 13 . 1 1 149 149 LYS N N 149 114.484 114.484 120.357 -5.873 18112 10175 1 13 . 1 1 149 149 LYS C C 149 178.051 178.051 178.889 -0.838 18112 10176 1 13 . 1 1 149 149 LYS CA C 149 59.036 59.036 59.568 -0.532 18112 10177 1 13 . 1 1 149 149 LYS CB C 149 31.575 31.575 32.619 -1.044 18112 10178 1 13 . 1 1 149 149 LYS H H 149 7.364 7.364 7.826 -0.462 18112 10179 1 13 . 1 1 150 150 VAL N N 150 117.812 117.812 116.316 1.496 18112 10180 1 13 . 1 1 150 150 VAL HA H 150 3.770 3.770 3.689 0.081 18112 10181 1 13 . 1 1 150 150 VAL C C 150 178.786 178.786 178.266 0.520 18112 10182 1 13 . 1 1 150 150 VAL CA C 150 65.070 65.070 65.748 -0.677 18112 10183 1 13 . 1 1 150 150 VAL CB C 150 29.515 29.515 31.718 -2.203 18112 10184 1 13 . 1 1 150 150 VAL H H 150 7.254 7.254 7.922 -0.668 18112 10185 1 13 . 1 1 151 151 ILE N N 151 117.884 117.884 115.437 2.447 18112 10186 1 13 . 1 1 151 151 ILE C C 151 180.539 180.539 177.066 3.473 18112 10187 1 13 . 1 1 151 151 ILE CA C 151 61.490 61.490 63.725 -2.235 18112 10188 1 13 . 1 1 151 151 ILE CB C 151 33.994 33.994 37.805 -3.811 18112 10189 1 13 . 1 1 151 151 ILE H H 151 8.154 8.154 7.953 0.201 18112 10190 1 13 . 1 1 152 152 CYS N N 152 118.649 118.649 119.597 -0.948 18112 10191 1 13 . 1 1 152 152 CYS HA H 152 4.153 4.153 4.532 -0.379 18112 10192 1 13 . 1 1 152 152 CYS C C 152 174.888 174.888 175.419 -0.531 18112 10193 1 13 . 1 1 152 152 CYS CA C 152 61.052 61.052 58.962 2.091 18112 10194 1 13 . 1 1 152 152 CYS CB C 152 36.364 36.364 26.914 9.450 18112 10195 1 13 . 1 1 152 152 CYS H H 152 8.711 8.711 8.052 0.659 18112 10196 1 13 . 1 1 153 153 LYS N N 153 118.498 118.498 119.572 -1.074 18112 10197 1 13 . 1 1 153 153 LYS C C 153 177.389 177.389 177.234 0.155 18112 10198 1 13 . 1 1 153 153 LYS CA C 153 56.243 56.243 57.652 -1.409 18112 10199 1 13 . 1 1 153 153 LYS CB C 153 31.343 31.343 32.401 -1.058 18112 10200 1 13 . 1 1 153 153 LYS H H 153 6.782 6.782 7.861 -1.079 18112 10201 1 13 . 1 1 154 154 LEU N N 154 117.318 117.318 119.021 -1.703 18112 10202 1 13 . 1 1 154 154 LEU HA H 154 4.576 4.576 4.316 0.260 18112 10203 1 13 . 1 1 154 154 LEU C C 154 177.161 177.161 177.289 -0.128 18112 10204 1 13 . 1 1 154 154 LEU CA C 154 53.782 53.782 54.846 -1.064 18112 10205 1 13 . 1 1 154 154 LEU CB C 154 40.881 40.881 42.319 -1.438 18112 10206 1 13 . 1 1 154 154 LEU H H 154 7.616 7.616 7.248 0.368 18112 10207 1 13 . 1 1 155 155 ASP N N 155 121.564 121.564 120.036 1.528 18112 10208 1 13 . 1 1 155 155 ASP C C 155 177.094 177.094 176.100 0.994 18112 10209 1 13 . 1 1 155 155 ASP CA C 155 55.732 55.732 54.959 0.773 18112 10210 1 13 . 1 1 155 155 ASP CB C 155 40.139 40.139 41.125 -0.986 18112 10211 1 13 . 1 1 155 155 ASP H H 155 7.582 7.582 7.849 -0.267 18112 10212 1 13 . 1 1 156 156 SER N N 156 117.352 117.352 113.573 3.779 18112 10213 1 13 . 1 1 156 156 SER HA H 156 4.818 4.818 4.796 0.021 18112 10214 1 13 . 1 1 156 156 SER C C 156 173.409 173.409 173.899 -0.490 18112 10215 1 13 . 1 1 156 156 SER CA C 156 57.073 57.073 56.733 0.340 18112 10216 1 13 . 1 1 156 156 SER CB C 156 65.150 65.150 66.684 -1.534 18112 10217 1 13 . 1 1 156 156 SER H H 156 8.846 8.846 8.241 0.605 18112 10218 1 13 . 1 1 157 157 GLU N N 157 120.688 120.688 121.301 -0.613 18112 10219 1 13 . 1 1 157 157 GLU HA H 157 4.038 4.038 4.583 -0.545 18112 10220 1 13 . 1 1 157 157 GLU C C 157 176.332 176.332 176.947 -0.615 18112 10221 1 13 . 1 1 157 157 GLU CA C 157 56.464 56.464 56.508 -0.044 18112 10222 1 13 . 1 1 157 157 GLU CB C 157 29.206 29.206 30.736 -1.530 18112 10223 1 13 . 1 1 157 157 GLU H H 157 8.356 8.356 8.718 -0.362 18112 10224 1 13 . 1 1 158 158 VAL N N 158 126.906 126.906 114.798 12.108 18112 10225 1 13 . 1 1 158 158 VAL HA H 158 3.449 3.449 4.373 -0.924 18112 10226 1 13 . 1 1 158 158 VAL C C 158 176.382 176.382 174.924 1.458 18112 10227 1 13 . 1 1 158 158 VAL CA C 158 59.584 59.584 59.430 0.154 18112 10228 1 13 . 1 1 158 158 VAL CB C 158 31.160 31.160 30.951 0.208 18112 10229 1 13 . 1 1 158 158 VAL H H 158 8.561 8.561 8.211 0.350 18112 10230 1 13 . 1 1 159 159 PRO HA H 159 4.403 4.403 4.464 -0.061 18112 10231 1 13 . 1 1 159 159 PRO C C 159 176.757 176.757 176.602 0.155 18112 10232 1 13 . 1 1 159 159 PRO CA C 159 63.845 63.845 63.432 0.413 18112 10233 1 13 . 1 1 159 159 PRO CB C 159 32.106 32.106 32.145 -0.039 18112 10234 1 13 . 1 1 160 160 GLU N N 160 122.904 122.904 116.605 6.299 18112 10235 1 13 . 1 1 160 160 GLU HA H 160 4.008 4.008 4.513 -0.505 18112 10236 1 13 . 1 1 160 160 GLU C C 160 179.132 179.132 175.388 3.744 18112 10237 1 13 . 1 1 160 160 GLU CA C 160 59.407 59.407 53.742 5.665 18112 10238 1 13 . 1 1 160 160 GLU CB C 160 28.991 28.991 31.838 -2.848 18112 10239 1 13 . 1 1 160 160 GLU H H 160 8.650 8.650 7.418 1.232 18112 10240 1 13 . 1 1 161 161 ILE N N 161 119.782 119.782 119.504 0.278 18112 10241 1 13 . 1 1 161 161 ILE HA H 161 4.146 4.146 4.200 -0.054 18112 10242 1 13 . 1 1 161 161 ILE C C 161 176.176 176.176 174.854 1.322 18112 10243 1 13 . 1 1 161 161 ILE CA C 161 62.034 62.034 60.332 1.702 18112 10244 1 13 . 1 1 161 161 ILE CB C 161 37.113 37.113 40.098 -2.985 18112 10245 1 13 . 1 1 161 161 ILE H H 161 8.448 8.448 8.091 0.357 18112 10246 1 13 . 1 1 162 162 PHE N N 162 117.594 117.594 125.780 -8.186 18112 10247 1 13 . 1 1 162 162 PHE C C 162 176.115 176.115 177.350 -1.235 18112 10248 1 13 . 1 1 162 162 PHE CA C 162 61.009 61.009 60.704 0.305 18112 10249 1 13 . 1 1 162 162 PHE CB C 162 38.394 38.394 38.666 -0.272 18112 10250 1 13 . 1 1 162 162 PHE H H 162 8.145 8.145 8.710 -0.565 18112 10251 1 13 . 1 1 163 163 LYS N N 163 116.083 116.083 118.378 -2.295 18112 10252 1 13 . 1 1 163 163 LYS C C 163 178.196 178.196 176.401 1.795 18112 10253 1 13 . 1 1 163 163 LYS CA C 163 58.136 58.136 58.122 0.014 18112 10254 1 13 . 1 1 163 163 LYS CB C 163 31.694 31.694 32.818 -1.124 18112 10255 1 13 . 1 1 163 163 LYS H H 163 8.232 8.232 8.024 0.208 18112 10256 1 13 . 1 1 164 164 SER N N 164 113.680 113.680 110.812 2.868 18112 10257 1 13 . 1 1 164 164 SER CA C 164 55.205 55.205 57.093 -1.888 18112 10258 1 13 . 1 1 164 164 SER CB C 164 63.265 63.265 64.121 -0.856 18112 10259 1 13 . 1 1 164 164 SER H H 164 7.708 7.708 7.608 0.100 18112 10260 1 13 . 1 1 165 165 PRO HA H 165 4.580 4.580 4.444 0.136 18112 10261 1 13 . 1 1 165 165 PRO C C 165 177.541 177.541 176.264 1.277 18112 10262 1 13 . 1 1 165 165 PRO CA C 165 63.950 63.950 63.910 0.040 18112 10263 1 13 . 1 1 165 165 PRO CB C 165 30.686 30.686 31.446 -0.760 18112 10264 1 13 . 1 1 166 166 ASN N N 166 116.304 116.304 116.956 -0.652 18112 10265 1 13 . 1 1 166 166 ASN HA H 166 5.029 5.029 3.996 1.033 18112 10266 1 13 . 1 1 166 166 ASN C C 166 175.811 175.811 176.353 -0.542 18112 10267 1 13 . 1 1 166 166 ASN CA C 166 51.962 51.962 54.435 -2.473 18112 10268 1 13 . 1 1 166 166 ASN CB C 166 37.915 37.915 37.198 0.717 18112 10269 1 13 . 1 1 166 166 ASN H H 166 8.216 8.216 8.451 -0.235 18112 10270 1 13 . 1 1 167 167 CYS N N 167 116.078 116.078 119.614 -3.536 18112 10271 1 13 . 1 1 167 167 CYS HA H 167 4.011 4.011 4.233 -0.222 18112 10272 1 13 . 1 1 167 167 CYS C C 167 175.057 175.057 175.876 -0.819 18112 10273 1 13 . 1 1 167 167 CYS CA C 167 59.816 59.816 60.971 -1.155 18112 10274 1 13 . 1 1 167 167 CYS CB C 167 27.446 27.446 26.552 0.894 18112 10275 1 13 . 1 1 167 167 CYS H H 167 7.246 7.246 7.855 -0.609 18112 10276 1 13 . 1 1 168 168 LEU N N 168 120.082 120.082 120.178 -0.096 18112 10277 1 13 . 1 1 168 168 LEU HA H 168 3.880 3.880 4.097 -0.217 18112 10278 1 13 . 1 1 168 168 LEU C C 168 178.541 178.541 177.987 0.554 18112 10279 1 13 . 1 1 168 168 LEU CA C 168 57.734 57.734 56.416 1.318 18112 10280 1 13 . 1 1 168 168 LEU CB C 168 38.825 38.825 39.902 -1.077 18112 10281 1 13 . 1 1 168 168 LEU H H 168 8.451 8.451 8.039 0.412 18112 10282 1 13 . 1 1 169 169 GLN N N 169 116.700 116.700 120.094 -3.394 18112 10283 1 13 . 1 1 169 169 GLN HA H 169 4.064 4.064 3.940 0.124 18112 10284 1 13 . 1 1 169 169 GLN C C 169 177.378 177.378 177.809 -0.431 18112 10285 1 13 . 1 1 169 169 GLN CA C 169 57.675 57.675 58.488 -0.813 18112 10286 1 13 . 1 1 169 169 GLN CB C 169 27.710 27.710 28.840 -1.130 18112 10287 1 13 . 1 1 169 169 GLN H H 169 7.665 7.665 7.669 -0.004 18112 10288 1 13 . 1 1 170 170 GLU N N 170 116.701 116.701 119.368 -2.667 18112 10289 1 13 . 1 1 170 170 GLU HA H 170 4.214 4.214 4.106 0.108 18112 10290 1 13 . 1 1 170 170 GLU C C 170 177.730 177.730 178.421 -0.691 18112 10291 1 13 . 1 1 170 170 GLU CA C 170 56.899 56.899 58.802 -1.903 18112 10292 1 13 . 1 1 170 170 GLU H H 170 7.405 7.405 7.923 -0.518 18112 10293 1 13 . 1 1 171 171 LEU N N 171 118.021 118.021 114.893 3.128 18112 10294 1 13 . 1 1 171 171 LEU HA H 171 4.209 4.209 4.566 -0.357 18112 10295 1 13 . 1 1 171 171 LEU C C 171 177.005 177.005 177.084 -0.079 18112 10296 1 13 . 1 1 171 171 LEU CA C 171 55.870 55.870 54.928 0.942 18112 10297 1 13 . 1 1 171 171 LEU CB C 171 43.680 43.680 42.115 1.565 18112 10298 1 13 . 1 1 171 171 LEU H H 171 7.823 7.823 7.391 0.431 18112 10299 1 13 . 1 1 172 172 LEU N N 172 117.580 117.580 122.224 -4.644 18112 10300 1 13 . 1 1 172 172 LEU HA H 172 4.571 4.571 4.322 0.249 18112 10301 1 13 . 1 1 172 172 LEU C C 172 176.411 176.411 175.985 0.426 18112 10302 1 13 . 1 1 172 172 LEU CA C 172 53.972 53.972 55.215 -1.243 18112 10303 1 13 . 1 1 172 172 LEU CB C 172 40.483 40.483 41.055 -0.572 18112 10304 1 13 . 1 1 172 172 LEU H H 172 7.306 7.306 7.394 -0.088 18112 10305 1 13 . 1 1 173 173 HIS N N 173 123.310 123.310 126.302 -2.992 18112 10306 1 13 . 1 1 173 173 HIS C C 173 179.022 179.022 174.316 4.706 18112 10307 1 13 . 1 1 173 173 HIS CA C 173 56.693 56.693 55.590 1.103 18112 10308 1 13 . 1 1 173 173 HIS CB C 173 29.371 29.371 30.569 -1.198 18112 10309 1 13 . 1 1 173 173 HIS H H 173 8.028 8.028 8.323 -0.295 18112 10310 1 14 . 1 1 12 12 ALA N N 12 125.167 125.167 121.774 3.393 18112 10311 1 14 . 1 1 12 12 ALA C C 12 177.566 177.566 176.856 0.710 18112 10312 1 14 . 1 1 12 12 ALA CA C 12 52.067 52.067 51.559 0.508 18112 10313 1 14 . 1 1 12 12 ALA CB C 12 18.456 18.456 21.016 -2.560 18112 10314 1 14 . 1 1 12 12 ALA H H 12 8.311 8.311 8.355 -0.044 18112 10315 1 14 . 1 1 13 13 MET N N 13 119.278 119.278 122.472 -3.194 18112 10316 1 14 . 1 1 13 13 MET C C 13 176.325 176.325 175.894 0.431 18112 10317 1 14 . 1 1 13 13 MET CA C 13 54.992 54.992 54.727 0.265 18112 10318 1 14 . 1 1 13 13 MET CB C 13 32.308 32.308 31.302 1.006 18112 10319 1 14 . 1 1 13 13 MET H H 13 8.269 8.269 8.557 -0.288 18112 10320 1 14 . 1 1 14 14 GLN N N 14 120.869 120.869 122.512 -1.643 18112 10321 1 14 . 1 1 14 14 GLN HA H 14 4.399 4.399 4.687 -0.288 18112 10322 1 14 . 1 1 14 14 GLN C C 14 175.644 175.644 175.863 -0.219 18112 10323 1 14 . 1 1 14 14 GLN CA C 14 55.139 55.139 54.340 0.799 18112 10324 1 14 . 1 1 14 14 GLN CB C 14 29.051 29.051 31.369 -2.318 18112 10325 1 14 . 1 1 14 14 GLN H H 14 8.501 8.501 8.602 -0.101 18112 10326 1 14 . 1 1 15 15 GLU N N 15 122.042 122.042 123.493 -1.451 18112 10327 1 14 . 1 1 15 15 GLU C C 15 176.242 176.242 177.080 -0.838 18112 10328 1 14 . 1 1 15 15 GLU CA C 15 56.064 56.064 55.981 0.083 18112 10329 1 14 . 1 1 15 15 GLU CB C 15 29.302 29.302 29.038 0.264 18112 10330 1 14 . 1 1 15 15 GLU H H 15 8.547 8.547 8.740 -0.193 18112 10331 1 14 . 1 1 16 16 GLY N N 16 108.821 108.821 108.939 -0.118 18112 10332 1 14 . 1 1 16 16 GLY C C 16 172.949 172.949 174.598 -1.649 18112 10333 1 14 . 1 1 16 16 GLY CA C 16 44.227 44.227 45.353 -1.126 18112 10334 1 14 . 1 1 16 16 GLY H H 16 8.100 8.100 8.410 -0.310 18112 10335 1 14 . 1 1 17 17 LEU N N 17 120.315 120.315 121.726 -1.411 18112 10336 1 14 . 1 1 17 17 LEU C C 17 177.334 177.334 176.507 0.827 18112 10337 1 14 . 1 1 17 17 LEU CA C 17 53.544 53.544 53.730 -0.186 18112 10338 1 14 . 1 1 17 17 LEU CB C 17 42.140 42.140 42.345 -0.205 18112 10339 1 14 . 1 1 17 17 LEU H H 17 8.222 8.222 7.423 0.799 18112 10340 1 14 . 1 1 18 18 SER N N 18 126.547 126.547 120.587 5.960 18112 10341 1 14 . 1 1 18 18 SER CA C 18 56.851 56.851 56.881 -0.030 18112 10342 1 14 . 1 1 18 18 SER CB C 18 64.636 64.636 62.864 1.772 18112 10343 1 14 . 1 1 18 18 SER H H 18 11.627 11.627 8.937 2.690 18112 10344 1 14 . 1 1 19 19 PRO C C 19 175.118 175.118 178.114 -2.996 18112 10345 1 14 . 1 1 20 20 ASN N N 20 121.372 121.372 116.766 4.606 18112 10346 1 14 . 1 1 20 20 ASN H H 20 8.172 8.172 8.944 -0.772 18112 10347 1 14 . 1 1 25 25 ALA CB C 25 18.020 18.020 18.502 -0.482 18112 10348 1 14 . 1 1 26 26 LYS N N 26 118.490 118.490 120.847 -2.357 18112 10349 1 14 . 1 1 26 26 LYS CA C 26 56.146 56.146 58.929 -2.783 18112 10350 1 14 . 1 1 26 26 LYS H H 26 6.794 6.794 7.743 -0.949 18112 10351 1 14 . 1 1 31 31 TYR HA H 31 4.398 4.398 4.981 -0.583 18112 10352 1 14 . 1 1 31 31 TYR C C 31 173.714 173.714 173.771 -0.057 18112 10353 1 14 . 1 1 31 31 TYR CA C 31 59.757 59.757 55.665 4.092 18112 10354 1 14 . 1 1 32 32 THR N N 32 111.928 111.928 113.794 -1.866 18112 10355 1 14 . 1 1 32 32 THR HA H 32 4.209 4.209 4.335 -0.127 18112 10356 1 14 . 1 1 32 32 THR C C 32 171.061 171.061 174.090 -3.029 18112 10357 1 14 . 1 1 32 32 THR CA C 32 56.905 56.905 61.623 -4.718 18112 10358 1 14 . 1 1 32 32 THR CB C 32 69.707 69.707 70.866 -1.159 18112 10359 1 14 . 1 1 32 32 THR H H 32 8.237 8.237 8.419 -0.182 18112 10360 1 14 . 1 1 33 33 ARG N N 33 124.856 124.856 118.580 6.276 18112 10361 1 14 . 1 1 33 33 ARG C C 33 176.451 176.451 174.972 1.479 18112 10362 1 14 . 1 1 33 33 ARG CA C 33 55.627 55.627 55.839 -0.212 18112 10363 1 14 . 1 1 33 33 ARG CB C 33 29.861 29.861 31.897 -2.036 18112 10364 1 14 . 1 1 33 33 ARG H H 33 9.159 9.159 7.488 1.671 18112 10365 1 14 . 1 1 34 34 TYR N N 34 117.908 117.908 122.679 -4.771 18112 10366 1 14 . 1 1 34 34 TYR CA C 34 55.320 55.320 58.276 -2.956 18112 10367 1 14 . 1 1 34 34 TYR H H 34 8.995 8.995 8.855 0.140 18112 10368 1 14 . 1 1 35 35 PRO C C 35 177.280 177.280 176.896 0.384 18112 10369 1 14 . 1 1 36 36 SER N N 36 116.410 116.410 121.497 -5.087 18112 10370 1 14 . 1 1 36 36 SER C C 36 178.938 178.938 176.106 2.832 18112 10371 1 14 . 1 1 36 36 SER CA C 36 64.815 64.815 61.782 3.033 18112 10372 1 14 . 1 1 36 36 SER H H 36 8.106 8.106 8.633 -0.527 18112 10373 1 14 . 1 1 37 37 SER N N 37 117.488 117.488 118.046 -0.558 18112 10374 1 14 . 1 1 37 37 SER C C 37 177.698 177.698 176.710 0.988 18112 10375 1 14 . 1 1 37 37 SER CA C 37 61.357 61.357 61.273 0.084 18112 10376 1 14 . 1 1 37 37 SER CB C 37 68.118 68.118 62.308 5.810 18112 10377 1 14 . 1 1 37 37 SER H H 37 8.169 8.169 8.431 -0.262 18112 10378 1 14 . 1 1 38 38 ASN N N 38 115.638 115.638 121.221 -5.583 18112 10379 1 14 . 1 1 38 38 ASN HA H 38 4.259 4.259 4.414 -0.155 18112 10380 1 14 . 1 1 38 38 ASN C C 38 177.868 177.868 177.308 0.560 18112 10381 1 14 . 1 1 38 38 ASN CA C 38 55.907 55.907 55.734 0.173 18112 10382 1 14 . 1 1 38 38 ASN CB C 38 37.230 37.230 37.988 -0.758 18112 10383 1 14 . 1 1 38 38 ASN H H 38 8.284 8.284 7.740 0.544 18112 10384 1 14 . 1 1 39 39 MET N N 39 121.352 121.352 118.745 2.607 18112 10385 1 14 . 1 1 39 39 MET HA H 39 4.170 4.170 3.278 0.892 18112 10386 1 14 . 1 1 39 39 MET C C 39 179.068 179.068 178.002 1.066 18112 10387 1 14 . 1 1 39 39 MET CA C 39 58.751 58.751 58.371 0.380 18112 10388 1 14 . 1 1 39 39 MET CB C 39 31.850 31.850 31.935 -0.085 18112 10389 1 14 . 1 1 39 39 MET H H 39 7.857 7.857 7.558 0.299 18112 10390 1 14 . 1 1 40 40 LEU N N 40 118.936 118.936 122.045 -3.109 18112 10391 1 14 . 1 1 40 40 LEU HA H 40 4.139 4.139 3.991 0.148 18112 10392 1 14 . 1 1 40 40 LEU C C 40 178.700 178.700 178.602 0.098 18112 10393 1 14 . 1 1 40 40 LEU CA C 40 58.455 58.455 58.692 -0.237 18112 10394 1 14 . 1 1 40 40 LEU CB C 40 40.304 40.304 41.634 -1.330 18112 10395 1 14 . 1 1 40 40 LEU H H 40 8.167 8.167 7.944 0.223 18112 10396 1 14 . 1 1 41 41 LYS N N 41 116.791 116.791 117.640 -0.849 18112 10397 1 14 . 1 1 41 41 LYS HA H 41 3.475 3.475 4.061 -0.586 18112 10398 1 14 . 1 1 41 41 LYS C C 41 178.793 178.793 178.811 -0.018 18112 10399 1 14 . 1 1 41 41 LYS CA C 41 59.161 59.161 59.556 -0.396 18112 10400 1 14 . 1 1 41 41 LYS CB C 41 30.992 30.992 32.480 -1.488 18112 10401 1 14 . 1 1 41 41 LYS H H 41 7.632 7.632 7.839 -0.207 18112 10402 1 14 . 1 1 42 42 THR N N 42 112.819 112.819 114.406 -1.587 18112 10403 1 14 . 1 1 42 42 THR HA H 42 4.230 4.230 4.124 0.106 18112 10404 1 14 . 1 1 42 42 THR C C 42 176.142 176.142 177.533 -1.391 18112 10405 1 14 . 1 1 42 42 THR CA C 42 65.107 65.107 66.245 -1.138 18112 10406 1 14 . 1 1 42 42 THR CB C 42 68.306 68.306 69.031 -0.725 18112 10407 1 14 . 1 1 42 42 THR H H 42 7.469 7.469 7.856 -0.387 18112 10408 1 14 . 1 1 43 43 TYR N N 43 118.565 118.565 120.216 -1.651 18112 10409 1 14 . 1 1 43 43 TYR HA H 43 4.204 4.204 4.341 -0.137 18112 10410 1 14 . 1 1 43 43 TYR C C 43 174.240 174.240 177.367 -3.127 18112 10411 1 14 . 1 1 43 43 TYR CA C 43 60.886 60.886 57.977 2.909 18112 10412 1 14 . 1 1 43 43 TYR CB C 43 38.165 38.165 38.146 0.019 18112 10413 1 14 . 1 1 43 43 TYR H H 43 7.978 7.978 7.673 0.305 18112 10414 1 14 . 1 1 44 44 PHE N N 44 120.980 120.980 117.063 3.917 18112 10415 1 14 . 1 1 44 44 PHE HA H 44 4.920 4.920 5.033 -0.113 18112 10416 1 14 . 1 1 44 44 PHE C C 44 176.436 176.436 176.655 -0.219 18112 10417 1 14 . 1 1 44 44 PHE CA C 44 56.672 56.672 55.023 1.649 18112 10418 1 14 . 1 1 44 44 PHE CB C 44 36.570 36.570 36.845 -0.275 18112 10419 1 14 . 1 1 44 44 PHE H H 44 7.955 7.955 7.948 0.007 18112 10420 1 14 . 1 1 45 45 SER N N 45 113.407 113.407 115.700 -2.293 18112 10421 1 14 . 1 1 45 45 SER HA H 45 4.373 4.373 4.430 -0.057 18112 10422 1 14 . 1 1 45 45 SER C C 45 174.424 174.424 175.500 -1.076 18112 10423 1 14 . 1 1 45 45 SER CA C 45 61.037 61.037 59.817 1.220 18112 10424 1 14 . 1 1 45 45 SER CB C 45 62.711 62.711 63.340 -0.629 18112 10425 1 14 . 1 1 45 45 SER H H 45 7.932 7.932 7.853 0.079 18112 10426 1 14 . 1 1 46 46 ASP N N 46 118.099 118.099 121.329 -3.230 18112 10427 1 14 . 1 1 46 46 ASP HA H 46 4.572 4.572 4.532 0.040 18112 10428 1 14 . 1 1 46 46 ASP C C 46 174.866 174.866 176.406 -1.540 18112 10429 1 14 . 1 1 46 46 ASP CA C 46 53.602 53.602 56.197 -2.595 18112 10430 1 14 . 1 1 46 46 ASP CB C 46 38.992 38.992 41.016 -2.024 18112 10431 1 14 . 1 1 46 46 ASP H H 46 9.889 9.889 8.590 1.299 18112 10432 1 14 . 1 1 47 47 VAL N N 47 121.496 121.496 121.108 0.388 18112 10433 1 14 . 1 1 47 47 VAL HA H 47 4.058 4.058 3.746 0.312 18112 10434 1 14 . 1 1 47 47 VAL C C 47 174.676 174.676 175.577 -0.901 18112 10435 1 14 . 1 1 47 47 VAL CA C 47 61.006 61.006 62.249 -1.243 18112 10436 1 14 . 1 1 47 47 VAL CB C 47 32.110 32.110 31.562 0.548 18112 10437 1 14 . 1 1 47 47 VAL H H 47 7.781 7.781 7.250 0.531 18112 10438 1 14 . 1 1 48 48 LYS N N 48 126.100 126.100 128.199 -2.099 18112 10439 1 14 . 1 1 48 48 LYS HA H 48 4.402 4.402 4.120 0.282 18112 10440 1 14 . 1 1 48 48 LYS C C 48 175.564 175.564 176.189 -0.625 18112 10441 1 14 . 1 1 48 48 LYS CA C 48 54.874 54.874 57.091 -2.217 18112 10442 1 14 . 1 1 48 48 LYS CB C 48 30.189 30.189 32.741 -2.552 18112 10443 1 14 . 1 1 48 48 LYS H H 48 8.245 8.245 8.490 -0.245 18112 10444 1 14 . 1 1 49 49 PHE N N 49 125.341 125.341 115.280 10.061 18112 10445 1 14 . 1 1 49 49 PHE HA H 49 3.813 3.813 4.148 -0.335 18112 10446 1 14 . 1 1 49 49 PHE C C 49 175.708 175.708 174.366 1.342 18112 10447 1 14 . 1 1 49 49 PHE CA C 49 60.861 60.861 58.118 2.743 18112 10448 1 14 . 1 1 49 49 PHE CB C 49 38.616 38.616 36.781 1.835 18112 10449 1 14 . 1 1 49 49 PHE H H 49 8.626 8.626 7.713 0.913 18112 10450 1 14 . 1 1 50 50 ASN N N 50 115.408 115.408 119.391 -3.983 18112 10451 1 14 . 1 1 50 50 ASN C C 50 176.072 176.072 176.042 0.030 18112 10452 1 14 . 1 1 50 50 ASN CA C 50 51.730 51.730 51.468 0.262 18112 10453 1 14 . 1 1 50 50 ASN H H 50 7.030 7.030 7.998 -0.968 18112 10454 1 14 . 1 1 51 51 ARG N N 51 122.706 122.706 121.357 1.349 18112 10455 1 14 . 1 1 51 51 ARG CA C 51 59.534 59.534 60.572 -1.038 18112 10456 1 14 . 1 1 51 51 ARG H H 51 7.790 7.790 8.832 -1.042 18112 10457 1 14 . 1 1 52 52 CYS N N 52 117.340 117.340 115.641 1.699 18112 10458 1 14 . 1 1 52 52 CYS HA H 52 4.108 4.108 4.073 0.035 18112 10459 1 14 . 1 1 52 52 CYS C C 52 178.200 178.200 177.122 1.078 18112 10460 1 14 . 1 1 52 52 CYS CA C 52 61.143 61.143 62.175 -1.032 18112 10461 1 14 . 1 1 52 52 CYS H H 52 7.681 7.681 8.219 -0.538 18112 10462 1 14 . 1 1 53 53 ILE N N 53 122.321 122.321 117.999 4.322 18112 10463 1 14 . 1 1 53 53 ILE HA H 53 3.588 3.588 3.685 -0.097 18112 10464 1 14 . 1 1 53 53 ILE C C 53 177.492 177.492 177.278 0.214 18112 10465 1 14 . 1 1 53 53 ILE CA C 53 64.109 64.109 63.899 0.210 18112 10466 1 14 . 1 1 53 53 ILE CB C 53 37.603 37.603 37.349 0.255 18112 10467 1 14 . 1 1 53 53 ILE H H 53 8.035 8.035 7.768 0.267 18112 10468 1 14 . 1 1 54 54 THR C C 54 175.903 175.903 176.694 -0.791 18112 10469 1 14 . 1 1 54 54 THR CA C 54 67.308 67.308 67.549 -0.242 18112 10470 1 14 . 1 1 55 55 SER N N 55 113.819 113.819 118.096 -4.277 18112 10471 1 14 . 1 1 55 55 SER H H 55 7.844 7.844 8.100 -0.256 18112 10472 1 14 . 1 1 56 56 GLN C C 56 179.792 179.792 177.657 2.135 18112 10473 1 14 . 1 1 57 57 LEU N N 57 116.701 116.701 121.073 -4.372 18112 10474 1 14 . 1 1 57 57 LEU HA H 57 4.519 4.519 3.212 1.307 18112 10475 1 14 . 1 1 57 57 LEU C C 57 178.775 178.775 178.278 0.497 18112 10476 1 14 . 1 1 57 57 LEU CA C 57 55.232 55.232 57.503 -2.271 18112 10477 1 14 . 1 1 57 57 LEU CB C 57 37.131 37.131 41.654 -4.523 18112 10478 1 14 . 1 1 57 57 LEU H H 57 8.267 8.267 7.663 0.604 18112 10479 1 14 . 1 1 58 58 ILE N N 58 122.522 122.522 118.659 3.863 18112 10480 1 14 . 1 1 58 58 ILE HA H 58 4.640 4.640 3.397 1.243 18112 10481 1 14 . 1 1 58 58 ILE C C 58 177.380 177.380 177.892 -0.512 18112 10482 1 14 . 1 1 58 58 ILE CA C 58 62.163 62.163 65.489 -3.326 18112 10483 1 14 . 1 1 58 58 ILE CB C 58 30.657 30.657 37.543 -6.886 18112 10484 1 14 . 1 1 58 58 ILE H H 58 8.111 8.111 8.208 -0.097 18112 10485 1 14 . 1 1 59 59 LYS N N 59 121.002 121.002 120.011 0.991 18112 10486 1 14 . 1 1 59 59 LYS C C 59 177.600 177.600 178.837 -1.237 18112 10487 1 14 . 1 1 59 59 LYS CA C 59 57.570 57.570 60.007 -2.437 18112 10488 1 14 . 1 1 59 59 LYS CB C 59 39.101 39.101 32.338 6.763 18112 10489 1 14 . 1 1 59 59 LYS H H 59 7.432 7.432 7.723 -0.291 18112 10490 1 14 . 1 1 60 60 TRP N N 60 118.679 118.679 119.971 -1.292 18112 10491 1 14 . 1 1 60 60 TRP HA H 60 3.739 3.739 4.327 -0.588 18112 10492 1 14 . 1 1 60 60 TRP C C 60 178.246 178.246 179.269 -1.023 18112 10493 1 14 . 1 1 60 60 TRP CA C 60 59.818 59.818 58.561 1.257 18112 10494 1 14 . 1 1 60 60 TRP CB C 60 31.851 31.851 28.442 3.409 18112 10495 1 14 . 1 1 60 60 TRP H H 60 7.565 7.565 8.112 -0.547 18112 10496 1 14 . 1 1 61 61 PHE N N 61 118.005 118.005 116.653 1.352 18112 10497 1 14 . 1 1 61 61 PHE HA H 61 3.882 3.882 3.697 0.185 18112 10498 1 14 . 1 1 61 61 PHE CA C 61 60.054 60.054 60.449 -0.395 18112 10499 1 14 . 1 1 61 61 PHE H H 61 7.819 7.819 8.825 -1.006 18112 10500 1 14 . 1 1 62 62 SER N N 62 121.144 121.144 115.105 6.039 18112 10501 1 14 . 1 1 62 62 SER C C 62 177.840 177.840 176.708 1.132 18112 10502 1 14 . 1 1 62 62 SER CA C 62 55.892 55.892 60.769 -4.877 18112 10503 1 14 . 1 1 62 62 SER H H 62 8.878 8.878 8.415 0.464 18112 10504 1 14 . 1 1 63 63 ASN N N 63 115.303 115.303 121.323 -6.020 18112 10505 1 14 . 1 1 63 63 ASN C C 63 177.222 177.222 177.089 0.133 18112 10506 1 14 . 1 1 63 63 ASN CA C 63 60.467 60.467 56.058 4.409 18112 10507 1 14 . 1 1 63 63 ASN H H 63 8.001 8.001 7.985 0.016 18112 10508 1 14 . 1 1 64 64 PHE N N 64 112.571 112.571 119.335 -6.764 18112 10509 1 14 . 1 1 64 64 PHE CA C 64 56.453 56.453 61.714 -5.261 18112 10510 1 14 . 1 1 64 64 PHE H H 64 7.082 7.082 8.200 -1.118 18112 10511 1 14 . 1 1 65 65 ARG N N 65 116.695 116.695 119.540 -2.845 18112 10512 1 14 . 1 1 65 65 ARG CA C 65 59.590 59.590 59.995 -0.405 18112 10513 1 14 . 1 1 65 65 ARG H H 65 8.091 8.091 8.035 0.056 18112 10514 1 14 . 1 1 66 66 GLU N N 66 121.653 121.653 119.019 2.634 18112 10515 1 14 . 1 1 66 66 GLU HA H 66 4.739 4.739 4.079 0.660 18112 10516 1 14 . 1 1 66 66 GLU C C 66 174.621 174.621 179.062 -4.441 18112 10517 1 14 . 1 1 66 66 GLU CA C 66 59.583 59.583 59.456 0.127 18112 10518 1 14 . 1 1 66 66 GLU H H 66 7.597 7.597 7.749 -0.152 18112 10519 1 14 . 1 1 67 67 PHE N N 67 111.578 111.578 118.664 -7.086 18112 10520 1 14 . 1 1 67 67 PHE C C 67 176.164 176.164 178.003 -1.839 18112 10521 1 14 . 1 1 67 67 PHE CA C 67 61.156 61.156 60.365 0.791 18112 10522 1 14 . 1 1 67 67 PHE H H 67 7.067 7.067 8.227 -1.160 18112 10523 1 14 . 1 1 68 68 TYR N N 68 119.370 119.370 119.951 -0.581 18112 10524 1 14 . 1 1 68 68 TYR C C 68 176.844 176.844 178.368 -1.524 18112 10525 1 14 . 1 1 68 68 TYR CA C 68 61.758 61.758 61.320 0.438 18112 10526 1 14 . 1 1 68 68 TYR H H 68 7.442 7.442 8.196 -0.754 18112 10527 1 14 . 1 1 69 69 TYR N N 69 116.047 116.047 119.911 -3.864 18112 10528 1 14 . 1 1 69 69 TYR HA H 69 4.086 4.086 4.193 -0.107 18112 10529 1 14 . 1 1 69 69 TYR C C 69 180.328 180.328 177.748 2.580 18112 10530 1 14 . 1 1 69 69 TYR CA C 69 61.528 61.528 61.770 -0.242 18112 10531 1 14 . 1 1 69 69 TYR H H 69 9.127 9.127 8.488 0.639 18112 10532 1 14 . 1 1 70 70 ILE N N 70 124.738 124.738 118.404 6.334 18112 10533 1 14 . 1 1 70 70 ILE HA H 70 3.828 3.828 3.553 0.275 18112 10534 1 14 . 1 1 70 70 ILE C C 70 179.585 179.585 178.543 1.042 18112 10535 1 14 . 1 1 70 70 ILE CA C 70 65.787 65.787 64.082 1.705 18112 10536 1 14 . 1 1 70 70 ILE CB C 70 36.435 36.435 36.768 -0.333 18112 10537 1 14 . 1 1 70 70 ILE H H 70 8.631 8.631 8.382 0.249 18112 10538 1 14 . 1 1 71 71 GLN N N 71 117.940 117.940 118.747 -0.807 18112 10539 1 14 . 1 1 71 71 GLN HA H 71 3.826 3.826 3.837 -0.011 18112 10540 1 14 . 1 1 71 71 GLN C C 71 178.192 178.192 178.534 -0.342 18112 10541 1 14 . 1 1 71 71 GLN CA C 71 57.779 57.779 58.359 -0.580 18112 10542 1 14 . 1 1 71 71 GLN H H 71 7.738 7.738 8.448 -0.710 18112 10543 1 14 . 1 1 72 72 MET N N 72 117.353 117.353 117.900 -0.547 18112 10544 1 14 . 1 1 72 72 MET HA H 72 4.112 4.112 4.269 -0.157 18112 10545 1 14 . 1 1 72 72 MET C C 72 177.203 177.203 178.530 -1.327 18112 10546 1 14 . 1 1 72 72 MET CA C 72 57.272 57.272 56.782 0.490 18112 10547 1 14 . 1 1 72 72 MET H H 72 7.844 7.844 8.077 -0.233 18112 10548 1 14 . 1 1 73 73 GLU N N 73 117.858 117.858 120.308 -2.450 18112 10549 1 14 . 1 1 73 73 GLU HA H 73 3.572 3.572 3.603 -0.031 18112 10550 1 14 . 1 1 73 73 GLU C C 73 177.344 177.344 178.608 -1.264 18112 10551 1 14 . 1 1 73 73 GLU CA C 73 60.324 60.324 59.387 0.937 18112 10552 1 14 . 1 1 73 73 GLU H H 73 7.503 7.503 7.933 -0.430 18112 10553 1 14 . 1 1 74 74 LYS N N 74 118.716 118.716 119.454 -0.738 18112 10554 1 14 . 1 1 74 74 LYS HA H 74 3.867 3.867 4.033 -0.166 18112 10555 1 14 . 1 1 74 74 LYS C C 74 180.077 180.077 179.614 0.463 18112 10556 1 14 . 1 1 74 74 LYS CA C 74 59.754 59.754 58.683 1.071 18112 10557 1 14 . 1 1 74 74 LYS H H 74 7.912 7.912 7.809 0.103 18112 10558 1 14 . 1 1 75 75 TYR N N 75 117.309 117.309 118.773 -1.464 18112 10559 1 14 . 1 1 75 75 TYR HA H 75 4.085 4.085 4.722 -0.637 18112 10560 1 14 . 1 1 75 75 TYR C C 75 178.874 178.874 178.671 0.203 18112 10561 1 14 . 1 1 75 75 TYR CA C 75 63.306 63.306 58.771 4.535 18112 10562 1 14 . 1 1 75 75 TYR H H 75 8.421 8.421 7.989 0.432 18112 10563 1 14 . 1 1 76 76 ALA N N 76 125.392 125.392 122.345 3.047 18112 10564 1 14 . 1 1 76 76 ALA HA H 76 4.221 4.221 4.197 0.024 18112 10565 1 14 . 1 1 76 76 ALA C C 76 178.850 178.850 179.331 -0.481 18112 10566 1 14 . 1 1 76 76 ALA CA C 76 56.280 56.280 55.587 0.693 18112 10567 1 14 . 1 1 76 76 ALA CB C 76 18.687 18.687 18.429 0.258 18112 10568 1 14 . 1 1 76 76 ALA H H 76 8.553 8.553 8.489 0.064 18112 10569 1 14 . 1 1 77 77 ARG N N 77 115.067 115.067 118.592 -3.525 18112 10570 1 14 . 1 1 77 77 ARG HA H 77 3.935 3.935 3.934 0.001 18112 10571 1 14 . 1 1 77 77 ARG C C 77 179.341 179.341 178.216 1.125 18112 10572 1 14 . 1 1 77 77 ARG CA C 77 60.499 60.499 59.058 1.441 18112 10573 1 14 . 1 1 77 77 ARG H H 77 8.471 8.471 8.146 0.325 18112 10574 1 14 . 1 1 78 78 GLN N N 78 120.107 120.107 119.907 0.200 18112 10575 1 14 . 1 1 78 78 GLN HA H 78 3.921 3.921 4.069 -0.148 18112 10576 1 14 . 1 1 78 78 GLN C C 78 177.289 177.289 178.070 -0.781 18112 10577 1 14 . 1 1 78 78 GLN CA C 78 58.619 58.619 59.116 -0.497 18112 10578 1 14 . 1 1 78 78 GLN CB C 78 27.752 27.752 28.659 -0.907 18112 10579 1 14 . 1 1 78 78 GLN H H 78 8.142 8.142 8.333 -0.191 18112 10580 1 14 . 1 1 79 79 ALA N N 79 120.809 120.809 122.405 -1.596 18112 10581 1 14 . 1 1 79 79 ALA HA H 79 4.308 4.308 4.134 0.174 18112 10582 1 14 . 1 1 79 79 ALA C C 79 179.924 179.924 179.868 0.056 18112 10583 1 14 . 1 1 79 79 ALA CA C 79 54.970 54.970 55.271 -0.301 18112 10584 1 14 . 1 1 79 79 ALA CB C 79 17.064 17.064 18.677 -1.613 18112 10585 1 14 . 1 1 79 79 ALA H H 79 7.811 7.811 7.962 -0.151 18112 10586 1 14 . 1 1 80 80 ILE N N 80 118.524 118.524 119.165 -0.641 18112 10587 1 14 . 1 1 80 80 ILE HA H 80 3.894 3.894 3.520 0.374 18112 10588 1 14 . 1 1 80 80 ILE C C 80 181.268 181.268 178.295 2.973 18112 10589 1 14 . 1 1 80 80 ILE CA C 80 64.841 64.841 63.718 1.123 18112 10590 1 14 . 1 1 80 80 ILE CB C 80 37.125 37.125 36.417 0.708 18112 10591 1 14 . 1 1 80 80 ILE H H 80 7.837 7.837 8.072 -0.235 18112 10592 1 14 . 1 1 81 81 ASN N N 81 121.233 121.233 117.280 3.953 18112 10593 1 14 . 1 1 81 81 ASN HA H 81 4.398 4.398 4.416 -0.018 18112 10594 1 14 . 1 1 81 81 ASN C C 81 176.546 176.546 177.619 -1.073 18112 10595 1 14 . 1 1 81 81 ASN CA C 81 55.892 55.892 55.819 0.073 18112 10596 1 14 . 1 1 81 81 ASN CB C 81 37.603 37.603 38.740 -1.137 18112 10597 1 14 . 1 1 81 81 ASN H H 81 8.262 8.262 8.104 0.158 18112 10598 1 14 . 1 1 82 82 ASP N N 82 119.240 119.240 118.421 0.819 18112 10599 1 14 . 1 1 82 82 ASP HA H 82 4.666 4.666 4.499 0.167 18112 10600 1 14 . 1 1 82 82 ASP C C 82 176.767 176.767 177.426 -0.659 18112 10601 1 14 . 1 1 82 82 ASP CA C 82 54.771 54.771 54.899 -0.128 18112 10602 1 14 . 1 1 82 82 ASP CB C 82 40.121 40.121 41.898 -1.777 18112 10603 1 14 . 1 1 82 82 ASP H H 82 8.316 8.316 8.121 0.195 18112 10604 1 14 . 1 1 83 83 GLY N N 83 106.913 106.913 108.124 -1.211 18112 10605 1 14 . 1 1 83 83 GLY C C 83 174.601 174.601 175.631 -1.030 18112 10606 1 14 . 1 1 83 83 GLY CA C 83 45.214 45.214 45.185 0.028 18112 10607 1 14 . 1 1 83 83 GLY H H 83 7.810 7.810 7.908 -0.098 18112 10608 1 14 . 1 1 84 84 VAL N N 84 122.981 122.981 118.638 4.343 18112 10609 1 14 . 1 1 84 84 VAL HA H 84 3.850 3.850 3.824 0.026 18112 10610 1 14 . 1 1 84 84 VAL C C 84 177.265 177.265 177.323 -0.058 18112 10611 1 14 . 1 1 84 84 VAL CA C 84 64.270 64.270 64.624 -0.354 18112 10612 1 14 . 1 1 84 84 VAL CB C 84 30.471 30.471 31.660 -1.189 18112 10613 1 14 . 1 1 84 84 VAL H H 84 8.157 8.157 7.937 0.220 18112 10614 1 14 . 1 1 85 85 THR N N 85 115.232 115.232 111.504 3.728 18112 10615 1 14 . 1 1 85 85 THR HA H 85 4.716 4.716 4.351 0.365 18112 10616 1 14 . 1 1 85 85 THR C C 85 174.489 174.489 172.975 1.514 18112 10617 1 14 . 1 1 85 85 THR CA C 85 61.618 61.618 63.953 -2.335 18112 10618 1 14 . 1 1 85 85 THR CB C 85 70.081 70.081 68.799 1.282 18112 10619 1 14 . 1 1 85 85 THR H H 85 8.890 8.890 8.341 0.549 18112 10620 1 14 . 1 1 86 86 SER N N 86 117.009 117.009 114.630 2.379 18112 10621 1 14 . 1 1 86 86 SER HA H 86 5.046 5.046 4.514 0.532 18112 10622 1 14 . 1 1 86 86 SER C C 86 174.473 174.473 174.581 -0.108 18112 10623 1 14 . 1 1 86 86 SER CA C 86 55.922 55.922 57.482 -1.560 18112 10624 1 14 . 1 1 86 86 SER CB C 86 64.385 64.385 65.100 -0.715 18112 10625 1 14 . 1 1 86 86 SER H H 86 7.704 7.704 7.611 0.093 18112 10626 1 14 . 1 1 87 87 THR N N 87 118.634 118.634 117.010 1.624 18112 10627 1 14 . 1 1 87 87 THR HA H 87 4.065 4.065 3.974 0.091 18112 10628 1 14 . 1 1 87 87 THR C C 87 176.047 176.047 175.812 0.235 18112 10629 1 14 . 1 1 87 87 THR CA C 87 64.983 64.983 64.577 0.406 18112 10630 1 14 . 1 1 87 87 THR CB C 87 68.045 68.045 68.465 -0.420 18112 10631 1 14 . 1 1 87 87 THR H H 87 8.711 8.711 8.519 0.192 18112 10632 1 14 . 1 1 88 88 GLU N N 88 117.889 117.889 120.139 -2.250 18112 10633 1 14 . 1 1 88 88 GLU HA H 88 3.881 3.881 4.049 -0.168 18112 10634 1 14 . 1 1 88 88 GLU C C 88 177.146 177.146 177.193 -0.047 18112 10635 1 14 . 1 1 88 88 GLU CA C 88 57.814 57.814 58.493 -0.679 18112 10636 1 14 . 1 1 88 88 GLU CB C 88 28.050 28.050 28.644 -0.594 18112 10637 1 14 . 1 1 88 88 GLU H H 88 8.152 8.152 8.653 -0.501 18112 10638 1 14 . 1 1 89 89 GLU N N 89 115.617 115.617 117.259 -1.642 18112 10639 1 14 . 1 1 89 89 GLU HA H 89 4.149 4.149 4.250 -0.101 18112 10640 1 14 . 1 1 89 89 GLU C C 89 176.192 176.192 177.362 -1.170 18112 10641 1 14 . 1 1 89 89 GLU CA C 89 56.133 56.133 56.435 -0.302 18112 10642 1 14 . 1 1 89 89 GLU CB C 89 29.415 29.415 30.540 -1.125 18112 10643 1 14 . 1 1 89 89 GLU H H 89 7.311 7.311 7.461 -0.150 18112 10644 1 14 . 1 1 90 90 LEU N N 90 120.870 120.870 120.004 0.866 18112 10645 1 14 . 1 1 90 90 LEU HA H 90 4.439 4.439 4.368 0.071 18112 10646 1 14 . 1 1 90 90 LEU C C 90 175.267 175.267 177.478 -2.211 18112 10647 1 14 . 1 1 90 90 LEU CA C 90 53.504 53.504 54.731 -1.227 18112 10648 1 14 . 1 1 90 90 LEU CB C 90 40.479 40.479 42.658 -2.179 18112 10649 1 14 . 1 1 90 90 LEU H H 90 7.311 7.311 7.557 -0.246 18112 10650 1 14 . 1 1 91 91 SER N N 91 118.376 118.376 115.426 2.950 18112 10651 1 14 . 1 1 91 91 SER HA H 91 4.747 4.747 4.526 0.221 18112 10652 1 14 . 1 1 91 91 SER C C 91 173.332 173.332 173.330 0.002 18112 10653 1 14 . 1 1 91 91 SER CA C 91 56.314 56.314 58.054 -1.740 18112 10654 1 14 . 1 1 91 91 SER CB C 91 64.615 64.615 61.113 3.502 18112 10655 1 14 . 1 1 91 91 SER H H 91 8.221 8.221 8.361 -0.140 18112 10656 1 14 . 1 1 92 92 ILE N N 92 122.247 122.247 121.819 0.428 18112 10657 1 14 . 1 1 92 92 ILE HA H 92 4.537 4.537 4.377 0.160 18112 10658 1 14 . 1 1 92 92 ILE C C 92 174.059 174.059 176.149 -2.090 18112 10659 1 14 . 1 1 92 92 ILE CA C 92 59.881 59.881 58.145 1.736 18112 10660 1 14 . 1 1 92 92 ILE CB C 92 37.820 37.820 40.464 -2.644 18112 10661 1 14 . 1 1 92 92 ILE H H 92 8.570 8.570 7.463 1.107 18112 10662 1 14 . 1 1 93 93 THR N N 93 116.069 116.069 119.631 -3.562 18112 10663 1 14 . 1 1 93 93 THR HA H 93 4.580 4.580 4.142 0.438 18112 10664 1 14 . 1 1 93 93 THR C C 93 175.049 175.049 174.212 0.837 18112 10665 1 14 . 1 1 93 93 THR CA C 93 58.988 58.988 64.188 -5.200 18112 10666 1 14 . 1 1 93 93 THR CB C 93 71.362 71.362 67.835 3.527 18112 10667 1 14 . 1 1 93 93 THR H H 93 7.224 7.224 8.588 -1.363 18112 10668 1 14 . 1 1 94 94 ARG N N 94 116.595 116.595 126.608 -10.013 18112 10669 1 14 . 1 1 94 94 ARG HA H 94 3.077 3.077 4.587 -1.510 18112 10670 1 14 . 1 1 94 94 ARG C C 94 175.076 175.076 174.727 0.349 18112 10671 1 14 . 1 1 94 94 ARG CA C 94 57.119 57.119 53.409 3.710 18112 10672 1 14 . 1 1 94 94 ARG CB C 94 27.838 27.838 30.772 -2.934 18112 10673 1 14 . 1 1 94 94 ARG H H 94 8.596 8.596 7.979 0.617 18112 10674 1 14 . 1 1 95 95 ASP N N 95 113.735 113.735 124.963 -11.228 18112 10675 1 14 . 1 1 95 95 ASP HA H 95 4.765 4.765 3.680 1.085 18112 10676 1 14 . 1 1 95 95 ASP C C 95 175.876 175.876 177.201 -1.325 18112 10677 1 14 . 1 1 95 95 ASP CA C 95 53.156 53.156 56.364 -3.208 18112 10678 1 14 . 1 1 95 95 ASP CB C 95 41.166 41.166 41.013 0.153 18112 10679 1 14 . 1 1 95 95 ASP H H 95 7.607 7.607 8.562 -0.955 18112 10680 1 14 . 1 1 96 96 CYS N N 96 116.012 116.012 120.473 -4.461 18112 10681 1 14 . 1 1 96 96 CYS C C 96 174.361 174.361 175.409 -1.048 18112 10682 1 14 . 1 1 96 96 CYS CA C 96 56.562 56.562 62.703 -6.141 18112 10683 1 14 . 1 1 96 96 CYS CB C 96 29.416 29.416 27.160 2.256 18112 10684 1 14 . 1 1 96 96 CYS H H 96 7.094 7.094 8.403 -1.309 18112 10685 1 14 . 1 1 97 97 GLU N N 97 123.087 123.087 119.933 3.154 18112 10686 1 14 . 1 1 97 97 GLU C C 97 178.748 178.748 178.762 -0.014 18112 10687 1 14 . 1 1 97 97 GLU CA C 97 59.912 59.912 59.400 0.512 18112 10688 1 14 . 1 1 97 97 GLU CB C 97 29.195 29.195 29.715 -0.520 18112 10689 1 14 . 1 1 97 97 GLU H H 97 9.003 9.003 7.648 1.355 18112 10690 1 14 . 1 1 98 98 LEU N N 98 120.942 120.942 120.187 0.755 18112 10691 1 14 . 1 1 98 98 LEU HA H 98 3.614 3.614 4.134 -0.520 18112 10692 1 14 . 1 1 98 98 LEU C C 98 177.796 177.796 178.586 -0.790 18112 10693 1 14 . 1 1 98 98 LEU CA C 98 58.090 58.090 56.899 1.191 18112 10694 1 14 . 1 1 98 98 LEU CB C 98 39.778 39.778 41.837 -2.059 18112 10695 1 14 . 1 1 98 98 LEU H H 98 8.656 8.656 8.094 0.562 18112 10696 1 14 . 1 1 99 99 TYR N N 99 118.313 118.313 118.596 -0.283 18112 10697 1 14 . 1 1 99 99 TYR C C 99 177.077 177.077 178.045 -0.968 18112 10698 1 14 . 1 1 99 99 TYR CA C 99 62.622 62.622 60.879 1.743 18112 10699 1 14 . 1 1 99 99 TYR CB C 99 38.742 38.742 37.677 1.065 18112 10700 1 14 . 1 1 99 99 TYR H H 99 7.522 7.522 7.902 -0.380 18112 10701 1 14 . 1 1 100 100 ARG N N 100 118.101 118.101 116.976 1.125 18112 10702 1 14 . 1 1 100 100 ARG C C 100 178.616 178.616 178.333 0.283 18112 10703 1 14 . 1 1 100 100 ARG CA C 100 59.915 59.915 56.411 3.504 18112 10704 1 14 . 1 1 100 100 ARG CB C 100 29.100 29.100 29.356 -0.256 18112 10705 1 14 . 1 1 100 100 ARG H H 100 8.243 8.243 8.591 -0.348 18112 10706 1 14 . 1 1 101 101 ALA N N 101 120.972 120.972 124.334 -3.362 18112 10707 1 14 . 1 1 101 101 ALA HA H 101 4.145 4.145 4.065 0.080 18112 10708 1 14 . 1 1 101 101 ALA C C 101 181.359 181.359 179.018 2.341 18112 10709 1 14 . 1 1 101 101 ALA CA C 101 55.057 55.057 55.132 -0.075 18112 10710 1 14 . 1 1 101 101 ALA CB C 101 17.543 17.543 18.376 -0.833 18112 10711 1 14 . 1 1 101 101 ALA H H 101 8.352 8.352 8.065 0.287 18112 10712 1 14 . 1 1 102 102 LEU N N 102 115.683 115.683 117.463 -1.780 18112 10713 1 14 . 1 1 102 102 LEU HA H 102 4.333 4.333 3.611 0.722 18112 10714 1 14 . 1 1 102 102 LEU C C 102 178.583 178.583 179.212 -0.629 18112 10715 1 14 . 1 1 102 102 LEU CA C 102 57.634 57.634 57.094 0.540 18112 10716 1 14 . 1 1 102 102 LEU CB C 102 41.716 41.716 41.073 0.643 18112 10717 1 14 . 1 1 102 102 LEU H H 102 7.960 7.960 8.073 -0.113 18112 10718 1 14 . 1 1 103 103 ASN N N 103 118.957 118.957 118.648 0.309 18112 10719 1 14 . 1 1 103 103 ASN C C 103 177.470 177.470 177.404 0.066 18112 10720 1 14 . 1 1 103 103 ASN CA C 103 56.974 56.974 56.346 0.628 18112 10721 1 14 . 1 1 103 103 ASN CB C 103 38.140 38.140 38.418 -0.278 18112 10722 1 14 . 1 1 103 103 ASN H H 103 9.301 9.301 8.038 1.263 18112 10723 1 14 . 1 1 104 104 MET N N 104 113.763 113.763 117.268 -3.505 18112 10724 1 14 . 1 1 104 104 MET CA C 104 57.362 57.362 58.183 -0.821 18112 10725 1 14 . 1 1 104 104 MET CB C 104 31.895 31.895 32.884 -0.989 18112 10726 1 14 . 1 1 104 104 MET H H 104 8.332 8.332 7.824 0.508 18112 10727 1 14 . 1 1 105 105 HIS N N 105 116.024 116.024 117.506 -1.482 18112 10728 1 14 . 1 1 105 105 HIS HA H 105 3.764 3.764 4.497 -0.733 18112 10729 1 14 . 1 1 105 105 HIS C C 105 176.939 176.939 176.431 0.508 18112 10730 1 14 . 1 1 105 105 HIS CA C 105 59.069 59.069 59.134 -0.065 18112 10731 1 14 . 1 1 105 105 HIS H H 105 7.156 7.156 8.190 -1.034 18112 10732 1 14 . 1 1 106 106 TYR N N 106 113.161 113.161 116.615 -3.454 18112 10733 1 14 . 1 1 106 106 TYR C C 106 173.767 173.767 175.981 -2.214 18112 10734 1 14 . 1 1 106 106 TYR CA C 106 58.488 58.488 58.781 -0.293 18112 10735 1 14 . 1 1 106 106 TYR CB C 106 38.225 38.225 39.659 -1.434 18112 10736 1 14 . 1 1 106 106 TYR H H 106 7.204 7.204 8.023 -0.819 18112 10737 1 14 . 1 1 107 107 ASN N N 107 118.875 118.875 116.341 2.534 18112 10738 1 14 . 1 1 107 107 ASN HA H 107 3.922 3.922 5.009 -1.087 18112 10739 1 14 . 1 1 107 107 ASN C C 107 175.815 175.815 174.288 1.527 18112 10740 1 14 . 1 1 107 107 ASN CA C 107 51.233 51.233 51.419 -0.186 18112 10741 1 14 . 1 1 107 107 ASN CB C 107 38.142 38.142 40.533 -2.391 18112 10742 1 14 . 1 1 107 107 ASN H H 107 8.127 8.127 8.084 0.043 18112 10743 1 14 . 1 1 108 108 LYS N N 108 122.850 122.850 119.655 3.195 18112 10744 1 14 . 1 1 108 108 LYS HA H 108 3.954 3.954 4.433 -0.479 18112 10745 1 14 . 1 1 108 108 LYS C C 108 177.586 177.586 176.609 0.977 18112 10746 1 14 . 1 1 108 108 LYS CA C 108 59.749 59.749 57.322 2.427 18112 10747 1 14 . 1 1 108 108 LYS CB C 108 31.498 31.498 32.965 -1.467 18112 10748 1 14 . 1 1 108 108 LYS H H 108 7.772 7.772 8.602 -0.830 18112 10749 1 14 . 1 1 109 109 ALA N N 109 118.054 118.054 120.061 -2.007 18112 10750 1 14 . 1 1 109 109 ALA HA H 109 4.137 4.137 4.478 -0.341 18112 10751 1 14 . 1 1 109 109 ALA C C 109 177.889 177.889 176.977 0.912 18112 10752 1 14 . 1 1 109 109 ALA CA C 109 52.299 52.299 51.408 0.891 18112 10753 1 14 . 1 1 109 109 ALA CB C 109 17.787 17.787 20.489 -2.702 18112 10754 1 14 . 1 1 109 109 ALA H H 109 8.307 8.307 7.837 0.470 18112 10755 1 14 . 1 1 110 110 ASN N N 110 115.542 115.542 117.689 -2.147 18112 10756 1 14 . 1 1 110 110 ASN HA H 110 4.480 4.480 4.508 -0.028 18112 10757 1 14 . 1 1 110 110 ASN C C 110 174.277 174.277 174.652 -0.375 18112 10758 1 14 . 1 1 110 110 ASN CA C 110 53.504 53.504 53.683 -0.179 18112 10759 1 14 . 1 1 110 110 ASN CB C 110 37.283 37.283 37.630 -0.347 18112 10760 1 14 . 1 1 110 110 ASN H H 110 8.353 8.353 8.275 0.078 18112 10761 1 14 . 1 1 111 111 ASP N N 111 114.692 114.692 119.901 -5.209 18112 10762 1 14 . 1 1 111 111 ASP HA H 111 4.485 4.485 4.315 0.170 18112 10763 1 14 . 1 1 111 111 ASP C C 111 174.868 174.868 175.222 -0.354 18112 10764 1 14 . 1 1 111 111 ASP CA C 111 53.227 53.227 55.940 -2.713 18112 10765 1 14 . 1 1 111 111 ASP CB C 111 39.228 39.228 41.114 -1.886 18112 10766 1 14 . 1 1 111 111 ASP H H 111 8.297 8.297 8.674 -0.377 18112 10767 1 14 . 1 1 112 112 PHE N N 112 120.927 120.927 119.324 1.603 18112 10768 1 14 . 1 1 112 112 PHE HA H 112 4.752 4.752 4.657 0.095 18112 10769 1 14 . 1 1 112 112 PHE C C 112 174.633 174.633 174.913 -0.280 18112 10770 1 14 . 1 1 112 112 PHE CA C 112 56.346 56.346 56.847 -0.501 18112 10771 1 14 . 1 1 112 112 PHE H H 112 7.784 7.784 7.829 -0.045 18112 10772 1 14 . 1 1 113 113 GLU N N 113 128.111 128.111 125.231 2.880 18112 10773 1 14 . 1 1 113 113 GLU HA H 113 4.011 4.011 4.369 -0.358 18112 10774 1 14 . 1 1 113 113 GLU C C 113 173.502 173.502 176.341 -2.839 18112 10775 1 14 . 1 1 113 113 GLU CA C 113 55.100 55.100 55.182 -0.082 18112 10776 1 14 . 1 1 113 113 GLU H H 113 7.752 7.752 8.777 -1.025 18112 10777 1 14 . 1 1 114 114 VAL N N 114 129.326 129.326 121.801 7.525 18112 10778 1 14 . 1 1 114 114 VAL HA H 114 3.241 3.241 3.138 0.103 18112 10779 1 14 . 1 1 114 114 VAL CA C 114 60.838 60.838 60.442 0.396 18112 10780 1 14 . 1 1 114 114 VAL CB C 114 32.609 32.609 30.743 1.866 18112 10781 1 14 . 1 1 114 114 VAL H H 114 8.008 8.008 7.492 0.516 18112 10782 1 14 . 1 1 115 115 PRO HA H 115 4.429 4.429 4.622 -0.193 18112 10783 1 14 . 1 1 115 115 PRO C C 115 177.421 177.421 177.617 -0.196 18112 10784 1 14 . 1 1 115 115 PRO CA C 115 61.882 61.882 61.598 0.284 18112 10785 1 14 . 1 1 115 115 PRO CB C 115 30.974 30.974 32.797 -1.823 18112 10786 1 14 . 1 1 116 116 GLU N N 116 123.936 123.936 119.660 4.276 18112 10787 1 14 . 1 1 116 116 GLU C C 116 179.034 179.034 178.933 0.101 18112 10788 1 14 . 1 1 116 116 GLU CA C 116 58.913 58.913 60.306 -1.393 18112 10789 1 14 . 1 1 116 116 GLU CB C 116 28.378 28.378 28.854 -0.476 18112 10790 1 14 . 1 1 116 116 GLU H H 116 8.757 8.757 8.765 -0.008 18112 10791 1 14 . 1 1 117 117 ARG N N 117 116.943 116.943 119.164 -2.221 18112 10792 1 14 . 1 1 117 117 ARG C C 117 177.570 177.570 178.787 -1.217 18112 10793 1 14 . 1 1 117 117 ARG CA C 117 57.033 57.033 59.134 -2.101 18112 10794 1 14 . 1 1 117 117 ARG CB C 117 28.172 28.172 29.027 -0.855 18112 10795 1 14 . 1 1 117 117 ARG H H 117 8.733 8.733 8.352 0.381 18112 10796 1 14 . 1 1 118 118 PHE N N 118 117.528 117.528 118.233 -0.705 18112 10797 1 14 . 1 1 118 118 PHE HA H 118 4.137 4.137 4.397 -0.260 18112 10798 1 14 . 1 1 118 118 PHE C C 118 176.992 176.992 178.177 -1.185 18112 10799 1 14 . 1 1 118 118 PHE CA C 118 61.627 61.627 61.080 0.547 18112 10800 1 14 . 1 1 118 118 PHE CB C 118 37.386 37.386 38.383 -0.997 18112 10801 1 14 . 1 1 118 118 PHE H H 118 7.606 7.606 8.046 -0.440 18112 10802 1 14 . 1 1 119 119 LEU N N 119 118.483 118.483 118.475 0.008 18112 10803 1 14 . 1 1 119 119 LEU HA H 119 3.684 3.684 4.099 -0.415 18112 10804 1 14 . 1 1 119 119 LEU C C 119 178.802 178.802 179.001 -0.199 18112 10805 1 14 . 1 1 119 119 LEU CA C 119 59.875 59.875 56.832 3.043 18112 10806 1 14 . 1 1 119 119 LEU CB C 119 39.453 39.453 40.210 -0.757 18112 10807 1 14 . 1 1 119 119 LEU H H 119 7.248 7.248 7.728 -0.480 18112 10808 1 14 . 1 1 120 120 GLU N N 120 117.870 117.870 121.396 -3.526 18112 10809 1 14 . 1 1 120 120 GLU C C 120 179.932 179.932 179.159 0.773 18112 10810 1 14 . 1 1 120 120 GLU CA C 120 59.150 59.150 59.619 -0.469 18112 10811 1 14 . 1 1 120 120 GLU CB C 120 28.878 28.878 29.891 -1.013 18112 10812 1 14 . 1 1 120 120 GLU H H 120 7.423 7.423 8.409 -0.986 18112 10813 1 14 . 1 1 121 121 VAL N N 121 120.777 120.777 119.893 0.884 18112 10814 1 14 . 1 1 121 121 VAL HA H 121 3.545 3.545 3.770 -0.225 18112 10815 1 14 . 1 1 121 121 VAL C C 121 179.302 179.302 178.414 0.888 18112 10816 1 14 . 1 1 121 121 VAL CA C 121 66.875 66.875 66.044 0.830 18112 10817 1 14 . 1 1 121 121 VAL CB C 121 30.823 30.823 30.969 -0.146 18112 10818 1 14 . 1 1 121 121 VAL H H 121 8.313 8.313 8.196 0.117 18112 10819 1 14 . 1 1 122 122 ALA N N 122 127.029 127.029 122.945 4.084 18112 10820 1 14 . 1 1 122 122 ALA HA H 122 4.251 4.251 4.325 -0.074 18112 10821 1 14 . 1 1 122 122 ALA C C 122 178.366 178.366 179.706 -1.340 18112 10822 1 14 . 1 1 122 122 ALA CA C 122 54.748 54.748 55.421 -0.673 18112 10823 1 14 . 1 1 122 122 ALA CB C 122 16.565 16.565 18.814 -2.249 18112 10824 1 14 . 1 1 122 122 ALA H H 122 8.896 8.896 8.398 0.498 18112 10825 1 14 . 1 1 123 123 GLN N N 123 119.887 119.887 118.253 1.634 18112 10826 1 14 . 1 1 123 123 GLN C C 123 177.908 177.908 178.614 -0.706 18112 10827 1 14 . 1 1 123 123 GLN CA C 123 60.671 60.671 58.578 2.093 18112 10828 1 14 . 1 1 123 123 GLN H H 123 8.349 8.349 8.071 0.278 18112 10829 1 14 . 1 1 124 124 ILE N N 124 120.632 120.632 120.845 -0.213 18112 10830 1 14 . 1 1 124 124 ILE HA H 124 3.651 3.651 3.856 -0.205 18112 10831 1 14 . 1 1 124 124 ILE C C 124 178.703 178.703 178.404 0.299 18112 10832 1 14 . 1 1 124 124 ILE CA C 124 65.945 65.945 64.986 0.959 18112 10833 1 14 . 1 1 124 124 ILE H H 124 8.204 8.204 8.403 -0.199 18112 10834 1 14 . 1 1 125 125 THR N N 125 115.084 115.084 115.921 -0.837 18112 10835 1 14 . 1 1 125 125 THR C C 125 175.568 175.568 176.167 -0.599 18112 10836 1 14 . 1 1 125 125 THR CA C 125 67.872 67.872 66.596 1.276 18112 10837 1 14 . 1 1 125 125 THR H H 125 8.399 8.399 8.091 0.308 18112 10838 1 14 . 1 1 126 126 LEU N N 126 125.011 125.011 122.215 2.796 18112 10839 1 14 . 1 1 126 126 LEU HA H 126 4.085 4.085 4.448 -0.363 18112 10840 1 14 . 1 1 126 126 LEU C C 126 178.559 178.559 178.223 0.336 18112 10841 1 14 . 1 1 126 126 LEU CA C 126 58.843 58.843 58.160 0.683 18112 10842 1 14 . 1 1 126 126 LEU CB C 126 41.421 41.421 41.852 -0.431 18112 10843 1 14 . 1 1 126 126 LEU H H 126 8.728 8.728 8.194 0.534 18112 10844 1 14 . 1 1 127 127 ARG N N 127 117.076 117.076 119.444 -2.368 18112 10845 1 14 . 1 1 127 127 ARG HA H 127 3.929 3.929 3.932 -0.003 18112 10846 1 14 . 1 1 127 127 ARG C C 127 177.984 177.984 178.541 -0.557 18112 10847 1 14 . 1 1 127 127 ARG CA C 127 60.685 60.685 60.064 0.621 18112 10848 1 14 . 1 1 127 127 ARG CB C 127 28.079 28.079 30.046 -1.967 18112 10849 1 14 . 1 1 127 127 ARG H H 127 8.213 8.213 8.130 0.083 18112 10850 1 14 . 1 1 128 128 GLU N N 128 118.617 118.617 119.383 -0.766 18112 10851 1 14 . 1 1 128 128 GLU HA H 128 4.147 4.147 4.171 -0.024 18112 10852 1 14 . 1 1 128 128 GLU C C 128 181.150 181.150 179.443 1.707 18112 10853 1 14 . 1 1 128 128 GLU CA C 128 59.508 59.508 59.328 0.180 18112 10854 1 14 . 1 1 128 128 GLU H H 128 8.478 8.478 8.093 0.385 18112 10855 1 14 . 1 1 129 129 PHE N N 129 119.267 119.267 120.194 -0.927 18112 10856 1 14 . 1 1 129 129 PHE HA H 129 4.104 4.104 4.481 -0.377 18112 10857 1 14 . 1 1 129 129 PHE C C 129 177.170 177.170 177.798 -0.628 18112 10858 1 14 . 1 1 129 129 PHE CA C 129 63.694 63.694 61.148 2.546 18112 10859 1 14 . 1 1 129 129 PHE H H 129 8.570 8.570 8.341 0.229 18112 10860 1 14 . 1 1 130 130 PHE N N 130 118.739 118.739 120.044 -1.305 18112 10861 1 14 . 1 1 130 130 PHE HA H 130 3.884 3.884 3.991 -0.107 18112 10862 1 14 . 1 1 130 130 PHE C C 130 175.860 175.860 177.267 -1.407 18112 10863 1 14 . 1 1 130 130 PHE CA C 130 62.819 62.819 62.221 0.598 18112 10864 1 14 . 1 1 130 130 PHE H H 130 8.740 8.740 8.782 -0.042 18112 10865 1 14 . 1 1 131 131 ASN N N 131 116.028 116.028 117.956 -1.928 18112 10866 1 14 . 1 1 131 131 ASN HA H 131 4.373 4.373 4.431 -0.058 18112 10867 1 14 . 1 1 131 131 ASN C C 131 178.228 178.228 177.698 0.530 18112 10868 1 14 . 1 1 131 131 ASN CA C 131 55.150 55.150 56.596 -1.446 18112 10869 1 14 . 1 1 131 131 ASN H H 131 8.864 8.864 8.469 0.395 18112 10870 1 14 . 1 1 132 132 ALA N N 132 120.922 120.922 123.552 -2.630 18112 10871 1 14 . 1 1 132 132 ALA HA H 132 4.020 4.020 4.113 -0.093 18112 10872 1 14 . 1 1 132 132 ALA C C 132 178.515 178.515 179.809 -1.294 18112 10873 1 14 . 1 1 132 132 ALA CA C 132 54.924 54.924 55.184 -0.260 18112 10874 1 14 . 1 1 132 132 ALA CB C 132 18.441 18.441 18.641 -0.200 18112 10875 1 14 . 1 1 132 132 ALA H H 132 7.745 7.745 7.947 -0.202 18112 10876 1 14 . 1 1 133 133 ILE N N 133 118.200 118.200 120.143 -1.943 18112 10877 1 14 . 1 1 133 133 ILE HA H 133 3.235 3.235 3.867 -0.632 18112 10878 1 14 . 1 1 133 133 ILE C C 133 180.606 180.606 178.351 2.255 18112 10879 1 14 . 1 1 133 133 ILE CA C 133 65.215 65.215 64.549 0.666 18112 10880 1 14 . 1 1 133 133 ILE CB C 133 38.291 38.291 37.687 0.605 18112 10881 1 14 . 1 1 133 133 ILE H H 133 7.999 7.999 7.984 0.015 18112 10882 1 14 . 1 1 134 134 ILE N N 134 122.564 122.564 120.082 2.482 18112 10883 1 14 . 1 1 134 134 ILE HA H 134 3.788 3.788 3.585 0.203 18112 10884 1 14 . 1 1 134 134 ILE C C 134 177.215 177.215 177.013 0.202 18112 10885 1 14 . 1 1 134 134 ILE CA C 134 63.584 63.584 63.856 -0.272 18112 10886 1 14 . 1 1 134 134 ILE CB C 134 35.636 35.636 37.506 -1.870 18112 10887 1 14 . 1 1 134 134 ILE H H 134 8.670 8.670 7.860 0.810 18112 10888 1 14 . 1 1 135 135 ALA N N 135 119.989 119.989 120.675 -0.686 18112 10889 1 14 . 1 1 135 135 ALA HA H 135 4.357 4.357 4.175 0.182 18112 10890 1 14 . 1 1 135 135 ALA C C 135 177.786 177.786 178.281 -0.495 18112 10891 1 14 . 1 1 135 135 ALA CA C 135 51.521 51.521 52.907 -1.386 18112 10892 1 14 . 1 1 135 135 ALA CB C 135 18.839 18.839 19.645 -0.806 18112 10893 1 14 . 1 1 135 135 ALA H H 135 6.898 6.898 7.797 -0.899 18112 10894 1 14 . 1 1 136 136 GLY N N 136 107.682 107.682 106.281 1.401 18112 10895 1 14 . 1 1 136 136 GLY C C 136 176.324 176.324 175.220 1.104 18112 10896 1 14 . 1 1 136 136 GLY CA C 136 45.469 45.469 45.118 0.351 18112 10897 1 14 . 1 1 136 136 GLY H H 136 7.913 7.913 7.806 0.107 18112 10898 1 14 . 1 1 137 137 LYS N N 137 117.213 117.213 120.195 -2.982 18112 10899 1 14 . 1 1 137 137 LYS HA H 137 4.004 4.004 4.374 -0.370 18112 10900 1 14 . 1 1 137 137 LYS C C 137 176.616 176.616 177.292 -0.676 18112 10901 1 14 . 1 1 137 137 LYS CA C 137 57.499 57.499 56.285 1.214 18112 10902 1 14 . 1 1 137 137 LYS CB C 137 30.927 30.927 32.764 -1.837 18112 10903 1 14 . 1 1 137 137 LYS H H 137 8.312 8.312 8.064 0.248 18112 10904 1 14 . 1 1 138 138 ASP N N 138 113.545 113.545 118.289 -4.744 18112 10905 1 14 . 1 1 138 138 ASP HA H 138 3.061 3.061 2.338 0.723 18112 10906 1 14 . 1 1 138 138 ASP C C 138 174.698 174.698 176.175 -1.477 18112 10907 1 14 . 1 1 138 138 ASP CA C 138 53.694 53.694 55.715 -2.021 18112 10908 1 14 . 1 1 138 138 ASP CB C 138 36.008 36.008 39.371 -3.363 18112 10909 1 14 . 1 1 138 138 ASP H H 138 8.465 8.465 7.939 0.526 18112 10910 1 14 . 1 1 139 139 VAL N N 139 115.191 115.191 112.365 2.826 18112 10911 1 14 . 1 1 139 139 VAL HA H 139 3.886 3.886 3.967 -0.081 18112 10912 1 14 . 1 1 139 139 VAL C C 139 175.889 175.889 176.301 -0.412 18112 10913 1 14 . 1 1 139 139 VAL CA C 139 62.793 62.793 62.791 0.002 18112 10914 1 14 . 1 1 139 139 VAL CB C 139 30.662 30.662 31.753 -1.091 18112 10915 1 14 . 1 1 139 139 VAL H H 139 6.610 6.610 7.190 -0.580 18112 10916 1 14 . 1 1 140 140 ASP N N 140 123.363 123.363 122.322 1.041 18112 10917 1 14 . 1 1 140 140 ASP C C 140 175.234 175.234 175.454 -0.220 18112 10918 1 14 . 1 1 140 140 ASP CA C 140 50.221 50.221 51.393 -1.172 18112 10919 1 14 . 1 1 140 140 ASP CB C 140 42.254 42.254 41.735 0.519 18112 10920 1 14 . 1 1 140 140 ASP H H 140 7.553 7.553 7.457 0.096 18112 10921 1 14 . 1 1 141 141 PRO HA H 141 4.682 4.682 4.420 0.262 18112 10922 1 14 . 1 1 141 141 PRO C C 141 178.678 178.678 178.439 0.239 18112 10923 1 14 . 1 1 141 141 PRO CA C 141 64.532 64.532 65.098 -0.566 18112 10924 1 14 . 1 1 141 141 PRO CB C 141 31.331 31.331 31.998 -0.667 18112 10925 1 14 . 1 1 142 142 SER N N 142 114.421 114.421 113.093 1.328 18112 10926 1 14 . 1 1 142 142 SER HA H 142 4.565 4.565 4.407 0.158 18112 10927 1 14 . 1 1 142 142 SER C C 142 176.524 176.524 176.427 0.097 18112 10928 1 14 . 1 1 142 142 SER CA C 142 58.711 58.711 59.749 -1.038 18112 10929 1 14 . 1 1 142 142 SER CB C 142 62.783 62.783 62.731 0.052 18112 10930 1 14 . 1 1 142 142 SER H H 142 8.703 8.703 8.198 0.505 18112 10931 1 14 . 1 1 143 143 TRP N N 143 123.598 123.598 122.770 0.828 18112 10932 1 14 . 1 1 143 143 TRP HA H 143 4.136 4.136 4.369 -0.233 18112 10933 1 14 . 1 1 143 143 TRP C C 143 177.113 177.113 176.966 0.147 18112 10934 1 14 . 1 1 143 143 TRP CA C 143 59.803 59.803 60.203 -0.400 18112 10935 1 14 . 1 1 143 143 TRP CB C 143 26.364 26.364 28.335 -1.971 18112 10936 1 14 . 1 1 143 143 TRP H H 143 8.374 8.374 8.547 -0.173 18112 10937 1 14 . 1 1 144 144 LYS N N 144 119.293 119.293 119.038 0.255 18112 10938 1 14 . 1 1 144 144 LYS HA H 144 2.719 2.719 3.106 -0.387 18112 10939 1 14 . 1 1 144 144 LYS C C 144 177.243 177.243 178.266 -1.023 18112 10940 1 14 . 1 1 144 144 LYS CA C 144 58.851 58.851 59.036 -0.185 18112 10941 1 14 . 1 1 144 144 LYS CB C 144 29.373 29.373 31.290 -1.917 18112 10942 1 14 . 1 1 144 144 LYS H H 144 7.196 7.196 6.988 0.208 18112 10943 1 14 . 1 1 145 145 LYS N N 145 116.440 116.440 119.199 -2.759 18112 10944 1 14 . 1 1 145 145 LYS HA H 145 3.490 3.490 4.178 -0.688 18112 10945 1 14 . 1 1 145 145 LYS C C 145 179.149 179.149 178.679 0.470 18112 10946 1 14 . 1 1 145 145 LYS CA C 145 59.271 59.271 58.246 1.025 18112 10947 1 14 . 1 1 145 145 LYS CB C 145 30.521 30.521 31.836 -1.315 18112 10948 1 14 . 1 1 145 145 LYS H H 145 7.389 7.389 7.929 -0.540 18112 10949 1 14 . 1 1 146 146 ALA N N 146 118.582 118.582 123.016 -4.434 18112 10950 1 14 . 1 1 146 146 ALA HA H 146 3.932 3.932 4.000 -0.068 18112 10951 1 14 . 1 1 146 146 ALA C C 146 179.968 179.968 179.469 0.499 18112 10952 1 14 . 1 1 146 146 ALA CA C 146 54.241 54.241 55.213 -0.972 18112 10953 1 14 . 1 1 146 146 ALA CB C 146 17.689 17.689 18.340 -0.651 18112 10954 1 14 . 1 1 146 146 ALA H H 146 7.112 7.112 7.883 -0.771 18112 10955 1 14 . 1 1 147 147 ILE N N 147 118.537 118.537 119.567 -1.030 18112 10956 1 14 . 1 1 147 147 ILE HA H 147 3.642 3.642 3.501 0.141 18112 10957 1 14 . 1 1 147 147 ILE C C 147 178.919 178.919 177.922 0.997 18112 10958 1 14 . 1 1 147 147 ILE CA C 147 64.418 64.418 64.853 -0.436 18112 10959 1 14 . 1 1 147 147 ILE CB C 147 36.519 36.519 37.184 -0.665 18112 10960 1 14 . 1 1 147 147 ILE H H 147 6.734 6.734 7.801 -1.067 18112 10961 1 14 . 1 1 148 148 TYR N N 148 121.033 121.033 117.921 3.112 18112 10962 1 14 . 1 1 148 148 TYR HA H 148 4.489 4.489 4.095 0.394 18112 10963 1 14 . 1 1 148 148 TYR C C 148 178.348 178.348 178.396 -0.048 18112 10964 1 14 . 1 1 148 148 TYR CA C 148 57.389 57.389 59.735 -2.346 18112 10965 1 14 . 1 1 148 148 TYR CB C 148 35.280 35.280 37.134 -1.854 18112 10966 1 14 . 1 1 148 148 TYR H H 148 8.126 8.126 8.116 0.010 18112 10967 1 14 . 1 1 149 149 LYS N N 149 114.484 114.484 119.205 -4.721 18112 10968 1 14 . 1 1 149 149 LYS C C 149 178.051 178.051 178.913 -0.862 18112 10969 1 14 . 1 1 149 149 LYS CA C 149 59.036 59.036 59.544 -0.508 18112 10970 1 14 . 1 1 149 149 LYS CB C 149 31.575 31.575 32.429 -0.855 18112 10971 1 14 . 1 1 149 149 LYS H H 149 7.364 7.364 8.061 -0.697 18112 10972 1 14 . 1 1 150 150 VAL N N 150 117.812 117.812 118.466 -0.654 18112 10973 1 14 . 1 1 150 150 VAL HA H 150 3.770 3.770 3.772 -0.002 18112 10974 1 14 . 1 1 150 150 VAL C C 150 178.786 178.786 177.747 1.039 18112 10975 1 14 . 1 1 150 150 VAL CA C 150 65.070 65.070 65.627 -0.557 18112 10976 1 14 . 1 1 150 150 VAL CB C 150 29.515 29.515 31.573 -2.058 18112 10977 1 14 . 1 1 150 150 VAL H H 150 7.254 7.254 7.963 -0.709 18112 10978 1 14 . 1 1 151 151 ILE N N 151 117.884 117.884 115.306 2.578 18112 10979 1 14 . 1 1 151 151 ILE C C 151 180.539 180.539 177.453 3.086 18112 10980 1 14 . 1 1 151 151 ILE CA C 151 61.490 61.490 64.204 -2.714 18112 10981 1 14 . 1 1 151 151 ILE CB C 151 33.994 33.994 38.025 -4.031 18112 10982 1 14 . 1 1 151 151 ILE H H 151 8.154 8.154 7.974 0.180 18112 10983 1 14 . 1 1 152 152 CYS N N 152 118.649 118.649 119.550 -0.901 18112 10984 1 14 . 1 1 152 152 CYS HA H 152 4.153 4.153 4.591 -0.438 18112 10985 1 14 . 1 1 152 152 CYS C C 152 174.888 174.888 176.650 -1.762 18112 10986 1 14 . 1 1 152 152 CYS CA C 152 61.052 61.052 60.308 0.744 18112 10987 1 14 . 1 1 152 152 CYS CB C 152 36.364 36.364 26.189 10.175 18112 10988 1 14 . 1 1 152 152 CYS H H 152 8.711 8.711 8.452 0.259 18112 10989 1 14 . 1 1 153 153 LYS N N 153 118.498 118.498 121.205 -2.707 18112 10990 1 14 . 1 1 153 153 LYS C C 153 177.389 177.389 177.745 -0.356 18112 10991 1 14 . 1 1 153 153 LYS CA C 153 56.243 56.243 58.343 -2.100 18112 10992 1 14 . 1 1 153 153 LYS CB C 153 31.343 31.343 32.031 -0.687 18112 10993 1 14 . 1 1 153 153 LYS H H 153 6.782 6.782 7.749 -0.967 18112 10994 1 14 . 1 1 154 154 LEU N N 154 117.318 117.318 117.400 -0.082 18112 10995 1 14 . 1 1 154 154 LEU HA H 154 4.576 4.576 4.122 0.454 18112 10996 1 14 . 1 1 154 154 LEU C C 154 177.161 177.161 177.414 -0.253 18112 10997 1 14 . 1 1 154 154 LEU CA C 154 53.782 53.782 55.934 -2.151 18112 10998 1 14 . 1 1 154 154 LEU CB C 154 40.881 40.881 42.028 -1.147 18112 10999 1 14 . 1 1 154 154 LEU H H 154 7.616 7.616 7.121 0.495 18112 11000 1 14 . 1 1 155 155 ASP N N 155 121.564 121.564 119.460 2.104 18112 11001 1 14 . 1 1 155 155 ASP C C 155 177.094 177.094 176.491 0.603 18112 11002 1 14 . 1 1 155 155 ASP CA C 155 55.732 55.732 55.439 0.293 18112 11003 1 14 . 1 1 155 155 ASP CB C 155 40.139 40.139 40.992 -0.853 18112 11004 1 14 . 1 1 155 155 ASP H H 155 7.582 7.582 7.644 -0.062 18112 11005 1 14 . 1 1 156 156 SER N N 156 117.352 117.352 118.585 -1.233 18112 11006 1 14 . 1 1 156 156 SER HA H 156 4.818 4.818 4.441 0.377 18112 11007 1 14 . 1 1 156 156 SER C C 156 173.409 173.409 173.758 -0.349 18112 11008 1 14 . 1 1 156 156 SER CA C 156 57.073 57.073 60.087 -3.014 18112 11009 1 14 . 1 1 156 156 SER CB C 156 65.150 65.150 63.873 1.277 18112 11010 1 14 . 1 1 156 156 SER H H 156 8.846 8.846 8.549 0.297 18112 11011 1 14 . 1 1 157 157 GLU N N 157 120.688 120.688 115.753 4.935 18112 11012 1 14 . 1 1 157 157 GLU HA H 157 4.038 4.038 4.844 -0.806 18112 11013 1 14 . 1 1 157 157 GLU C C 157 176.332 176.332 174.624 1.708 18112 11014 1 14 . 1 1 157 157 GLU CA C 157 56.464 56.464 55.188 1.276 18112 11015 1 14 . 1 1 157 157 GLU CB C 157 29.206 29.206 32.865 -3.659 18112 11016 1 14 . 1 1 157 157 GLU H H 157 8.356 8.356 7.933 0.423 18112 11017 1 14 . 1 1 158 158 VAL N N 158 126.906 126.906 114.453 12.453 18112 11018 1 14 . 1 1 158 158 VAL HA H 158 3.449 3.449 4.233 -0.784 18112 11019 1 14 . 1 1 158 158 VAL C C 158 176.382 176.382 174.063 2.319 18112 11020 1 14 . 1 1 158 158 VAL CA C 158 59.584 59.584 58.081 1.503 18112 11021 1 14 . 1 1 158 158 VAL CB C 158 31.160 31.160 31.817 -0.657 18112 11022 1 14 . 1 1 158 158 VAL H H 158 8.561 8.561 7.992 0.569 18112 11023 1 14 . 1 1 159 159 PRO HA H 159 4.403 4.403 4.242 0.161 18112 11024 1 14 . 1 1 159 159 PRO C C 159 176.757 176.757 175.831 0.926 18112 11025 1 14 . 1 1 159 159 PRO CA C 159 63.845 63.845 63.278 0.567 18112 11026 1 14 . 1 1 159 159 PRO CB C 159 32.106 32.106 31.302 0.804 18112 11027 1 14 . 1 1 160 160 GLU N N 160 122.904 122.904 123.678 -0.774 18112 11028 1 14 . 1 1 160 160 GLU HA H 160 4.008 4.008 4.149 -0.141 18112 11029 1 14 . 1 1 160 160 GLU C C 160 179.132 179.132 175.954 3.178 18112 11030 1 14 . 1 1 160 160 GLU CA C 160 59.407 59.407 56.974 2.433 18112 11031 1 14 . 1 1 160 160 GLU CB C 160 28.991 28.991 30.213 -1.222 18112 11032 1 14 . 1 1 160 160 GLU H H 160 8.650 8.650 8.639 0.011 18112 11033 1 14 . 1 1 161 161 ILE N N 161 119.782 119.782 118.441 1.341 18112 11034 1 14 . 1 1 161 161 ILE HA H 161 4.146 4.146 4.487 -0.341 18112 11035 1 14 . 1 1 161 161 ILE C C 161 176.176 176.176 174.286 1.890 18112 11036 1 14 . 1 1 161 161 ILE CA C 161 62.034 62.034 60.111 1.923 18112 11037 1 14 . 1 1 161 161 ILE CB C 161 37.113 37.113 39.024 -1.911 18112 11038 1 14 . 1 1 161 161 ILE H H 161 8.448 8.448 7.312 1.136 18112 11039 1 14 . 1 1 162 162 PHE N N 162 117.594 117.594 126.885 -9.291 18112 11040 1 14 . 1 1 162 162 PHE C C 162 176.115 176.115 177.172 -1.057 18112 11041 1 14 . 1 1 162 162 PHE CA C 162 61.009 61.009 59.407 1.602 18112 11042 1 14 . 1 1 162 162 PHE CB C 162 38.394 38.394 38.917 -0.523 18112 11043 1 14 . 1 1 162 162 PHE H H 162 8.145 8.145 8.900 -0.755 18112 11044 1 14 . 1 1 163 163 LYS N N 163 116.083 116.083 120.171 -4.088 18112 11045 1 14 . 1 1 163 163 LYS C C 163 178.196 178.196 176.431 1.765 18112 11046 1 14 . 1 1 163 163 LYS CA C 163 58.136 58.136 58.002 0.134 18112 11047 1 14 . 1 1 163 163 LYS CB C 163 31.694 31.694 32.841 -1.147 18112 11048 1 14 . 1 1 163 163 LYS H H 163 8.232 8.232 7.914 0.318 18112 11049 1 14 . 1 1 164 164 SER N N 164 113.680 113.680 112.374 1.306 18112 11050 1 14 . 1 1 164 164 SER CA C 164 55.205 55.205 56.846 -1.641 18112 11051 1 14 . 1 1 164 164 SER CB C 164 63.265 63.265 63.679 -0.415 18112 11052 1 14 . 1 1 164 164 SER H H 164 7.708 7.708 7.792 -0.084 18112 11053 1 14 . 1 1 165 165 PRO HA H 165 4.580 4.580 4.528 0.052 18112 11054 1 14 . 1 1 165 165 PRO C C 165 177.541 177.541 176.999 0.542 18112 11055 1 14 . 1 1 165 165 PRO CA C 165 63.950 63.950 64.352 -0.402 18112 11056 1 14 . 1 1 165 165 PRO CB C 165 30.686 30.686 31.436 -0.750 18112 11057 1 14 . 1 1 166 166 ASN N N 166 116.304 116.304 117.844 -1.540 18112 11058 1 14 . 1 1 166 166 ASN HA H 166 5.029 5.029 4.334 0.695 18112 11059 1 14 . 1 1 166 166 ASN C C 166 175.811 175.811 176.539 -0.728 18112 11060 1 14 . 1 1 166 166 ASN CA C 166 51.962 51.962 55.073 -3.111 18112 11061 1 14 . 1 1 166 166 ASN CB C 166 37.915 37.915 37.688 0.227 18112 11062 1 14 . 1 1 166 166 ASN H H 166 8.216 8.216 8.914 -0.698 18112 11063 1 14 . 1 1 167 167 CYS N N 167 116.078 116.078 119.891 -3.813 18112 11064 1 14 . 1 1 167 167 CYS HA H 167 4.011 4.011 4.362 -0.351 18112 11065 1 14 . 1 1 167 167 CYS C C 167 175.057 175.057 176.333 -1.276 18112 11066 1 14 . 1 1 167 167 CYS CA C 167 59.816 59.816 60.777 -0.961 18112 11067 1 14 . 1 1 167 167 CYS CB C 167 27.446 27.446 27.075 0.371 18112 11068 1 14 . 1 1 167 167 CYS H H 167 7.246 7.246 8.110 -0.864 18112 11069 1 14 . 1 1 168 168 LEU N N 168 120.082 120.082 120.978 -0.896 18112 11070 1 14 . 1 1 168 168 LEU HA H 168 3.880 3.880 4.239 -0.359 18112 11071 1 14 . 1 1 168 168 LEU C C 168 178.541 178.541 177.720 0.821 18112 11072 1 14 . 1 1 168 168 LEU CA C 168 57.734 57.734 56.761 0.973 18112 11073 1 14 . 1 1 168 168 LEU CB C 168 38.825 38.825 40.261 -1.436 18112 11074 1 14 . 1 1 168 168 LEU H H 168 8.451 8.451 8.204 0.247 18112 11075 1 14 . 1 1 169 169 GLN N N 169 116.700 116.700 120.057 -3.357 18112 11076 1 14 . 1 1 169 169 GLN HA H 169 4.064 4.064 4.118 -0.054 18112 11077 1 14 . 1 1 169 169 GLN C C 169 177.378 177.378 177.617 -0.239 18112 11078 1 14 . 1 1 169 169 GLN CA C 169 57.675 57.675 58.024 -0.349 18112 11079 1 14 . 1 1 169 169 GLN CB C 169 27.710 27.710 28.489 -0.779 18112 11080 1 14 . 1 1 169 169 GLN H H 169 7.665 7.665 7.751 -0.086 18112 11081 1 14 . 1 1 170 170 GLU N N 170 116.701 116.701 116.232 0.469 18112 11082 1 14 . 1 1 170 170 GLU HA H 170 4.214 4.214 3.960 0.254 18112 11083 1 14 . 1 1 170 170 GLU C C 170 177.730 177.730 177.274 0.456 18112 11084 1 14 . 1 1 170 170 GLU CA C 170 56.899 56.899 57.546 -0.647 18112 11085 1 14 . 1 1 170 170 GLU H H 170 7.405 7.405 7.758 -0.353 18112 11086 1 14 . 1 1 171 171 LEU N N 171 118.021 118.021 118.495 -0.474 18112 11087 1 14 . 1 1 171 171 LEU HA H 171 4.209 4.209 4.174 0.035 18112 11088 1 14 . 1 1 171 171 LEU C C 171 177.005 177.005 178.152 -1.147 18112 11089 1 14 . 1 1 171 171 LEU CA C 171 55.870 55.870 56.719 -0.849 18112 11090 1 14 . 1 1 171 171 LEU CB C 171 43.680 43.680 42.483 1.197 18112 11091 1 14 . 1 1 171 171 LEU H H 171 7.823 7.823 7.501 0.322 18112 11092 1 14 . 1 1 172 172 LEU N N 172 117.580 117.580 115.596 1.984 18112 11093 1 14 . 1 1 172 172 LEU HA H 172 4.571 4.571 4.392 0.179 18112 11094 1 14 . 1 1 172 172 LEU C C 172 176.411 176.411 175.540 0.871 18112 11095 1 14 . 1 1 172 172 LEU CA C 172 53.972 53.972 55.043 -1.071 18112 11096 1 14 . 1 1 172 172 LEU CB C 172 40.483 40.483 39.924 0.559 18112 11097 1 14 . 1 1 172 172 LEU H H 172 7.306 7.306 7.458 -0.152 18112 11098 1 14 . 1 1 173 173 HIS N N 173 123.310 123.310 122.009 1.301 18112 11099 1 14 . 1 1 173 173 HIS C C 173 179.022 179.022 173.631 5.391 18112 11100 1 14 . 1 1 173 173 HIS CA C 173 56.693 56.693 55.544 1.149 18112 11101 1 14 . 1 1 173 173 HIS CB C 173 29.371 29.371 33.127 -3.756 18112 11102 1 14 . 1 1 173 173 HIS H H 173 8.028 8.028 7.885 0.143 18112 11103 1 15 . 1 1 12 12 ALA N N 12 125.167 125.167 123.059 2.108 18112 11104 1 15 . 1 1 12 12 ALA C C 12 177.566 177.566 177.514 0.052 18112 11105 1 15 . 1 1 12 12 ALA CA C 12 52.067 52.067 52.074 -0.007 18112 11106 1 15 . 1 1 12 12 ALA CB C 12 18.456 18.456 19.200 -0.744 18112 11107 1 15 . 1 1 12 12 ALA H H 12 8.311 8.311 7.214 1.097 18112 11108 1 15 . 1 1 13 13 MET N N 13 119.278 119.278 121.458 -2.180 18112 11109 1 15 . 1 1 13 13 MET C C 13 176.325 176.325 175.652 0.673 18112 11110 1 15 . 1 1 13 13 MET CA C 13 54.992 54.992 55.237 -0.245 18112 11111 1 15 . 1 1 13 13 MET CB C 13 32.308 32.308 31.013 1.295 18112 11112 1 15 . 1 1 13 13 MET H H 13 8.269 8.269 8.445 -0.176 18112 11113 1 15 . 1 1 14 14 GLN N N 14 120.869 120.869 125.910 -5.041 18112 11114 1 15 . 1 1 14 14 GLN HA H 14 4.399 4.399 4.591 -0.192 18112 11115 1 15 . 1 1 14 14 GLN C C 14 175.644 175.644 173.995 1.649 18112 11116 1 15 . 1 1 14 14 GLN CA C 14 55.139 55.139 55.188 -0.049 18112 11117 1 15 . 1 1 14 14 GLN CB C 14 29.051 29.051 30.154 -1.103 18112 11118 1 15 . 1 1 14 14 GLN H H 14 8.501 8.501 8.108 0.393 18112 11119 1 15 . 1 1 15 15 GLU N N 15 122.042 122.042 124.847 -2.805 18112 11120 1 15 . 1 1 15 15 GLU C C 15 176.242 176.242 176.040 0.202 18112 11121 1 15 . 1 1 15 15 GLU CA C 15 56.064 56.064 54.993 1.071 18112 11122 1 15 . 1 1 15 15 GLU CB C 15 29.302 29.302 31.774 -2.473 18112 11123 1 15 . 1 1 15 15 GLU H H 15 8.547 8.547 8.318 0.229 18112 11124 1 15 . 1 1 16 16 GLY N N 16 108.821 108.821 106.584 2.237 18112 11125 1 15 . 1 1 16 16 GLY C C 16 172.949 172.949 173.742 -0.793 18112 11126 1 15 . 1 1 16 16 GLY CA C 16 44.227 44.227 45.124 -0.897 18112 11127 1 15 . 1 1 16 16 GLY H H 16 8.100 8.100 8.492 -0.393 18112 11128 1 15 . 1 1 17 17 LEU N N 17 120.315 120.315 119.035 1.280 18112 11129 1 15 . 1 1 17 17 LEU C C 17 177.334 177.334 175.502 1.832 18112 11130 1 15 . 1 1 17 17 LEU CA C 17 53.544 53.544 54.708 -1.164 18112 11131 1 15 . 1 1 17 17 LEU CB C 17 42.140 42.140 43.092 -0.952 18112 11132 1 15 . 1 1 17 17 LEU H H 17 8.222 8.222 8.034 0.188 18112 11133 1 15 . 1 1 18 18 SER N N 18 126.547 126.547 112.560 13.987 18112 11134 1 15 . 1 1 18 18 SER CA C 18 56.851 56.851 58.320 -1.469 18112 11135 1 15 . 1 1 18 18 SER CB C 18 64.636 64.636 62.691 1.945 18112 11136 1 15 . 1 1 18 18 SER H H 18 11.627 11.627 7.796 3.831 18112 11137 1 15 . 1 1 19 19 PRO C C 19 175.118 175.118 177.384 -2.266 18112 11138 1 15 . 1 1 20 20 ASN N N 20 121.372 121.372 116.048 5.324 18112 11139 1 15 . 1 1 20 20 ASN H H 20 8.172 8.172 8.861 -0.689 18112 11140 1 15 . 1 1 25 25 ALA CB C 25 18.020 18.020 18.466 -0.446 18112 11141 1 15 . 1 1 26 26 LYS N N 26 118.490 118.490 119.472 -0.982 18112 11142 1 15 . 1 1 26 26 LYS CA C 26 56.146 56.146 59.798 -3.652 18112 11143 1 15 . 1 1 26 26 LYS H H 26 6.794 6.794 7.930 -1.136 18112 11144 1 15 . 1 1 31 31 TYR HA H 31 4.398 4.398 4.027 0.371 18112 11145 1 15 . 1 1 31 31 TYR C C 31 173.714 173.714 177.000 -3.286 18112 11146 1 15 . 1 1 31 31 TYR CA C 31 59.757 59.757 59.581 0.176 18112 11147 1 15 . 1 1 32 32 THR N N 32 111.928 111.928 108.812 3.116 18112 11148 1 15 . 1 1 32 32 THR HA H 32 4.209 4.209 4.283 -0.074 18112 11149 1 15 . 1 1 32 32 THR C C 32 171.061 171.061 175.314 -4.253 18112 11150 1 15 . 1 1 32 32 THR CA C 32 56.905 56.905 63.514 -6.609 18112 11151 1 15 . 1 1 32 32 THR CB C 32 69.707 69.707 68.740 0.966 18112 11152 1 15 . 1 1 32 32 THR H H 32 8.237 8.237 7.931 0.306 18112 11153 1 15 . 1 1 33 33 ARG N N 33 124.856 124.856 118.469 6.387 18112 11154 1 15 . 1 1 33 33 ARG C C 33 176.451 176.451 174.315 2.136 18112 11155 1 15 . 1 1 33 33 ARG CA C 33 55.627 55.627 59.014 -3.387 18112 11156 1 15 . 1 1 33 33 ARG CB C 33 29.861 29.861 29.017 0.844 18112 11157 1 15 . 1 1 33 33 ARG H H 33 9.159 9.159 7.558 1.601 18112 11158 1 15 . 1 1 34 34 TYR N N 34 117.908 117.908 116.217 1.691 18112 11159 1 15 . 1 1 34 34 TYR CA C 34 55.320 55.320 58.774 -3.454 18112 11160 1 15 . 1 1 34 34 TYR H H 34 8.995 8.995 8.004 0.991 18112 11161 1 15 . 1 1 35 35 PRO C C 35 177.280 177.280 177.321 -0.041 18112 11162 1 15 . 1 1 36 36 SER N N 36 116.410 116.410 121.290 -4.880 18112 11163 1 15 . 1 1 36 36 SER C C 36 178.938 178.938 176.025 2.913 18112 11164 1 15 . 1 1 36 36 SER CA C 36 64.815 64.815 62.550 2.265 18112 11165 1 15 . 1 1 36 36 SER H H 36 8.106 8.106 8.189 -0.083 18112 11166 1 15 . 1 1 37 37 SER N N 37 117.488 117.488 117.735 -0.247 18112 11167 1 15 . 1 1 37 37 SER C C 37 177.698 177.698 176.270 1.428 18112 11168 1 15 . 1 1 37 37 SER CA C 37 61.357 61.357 61.267 0.090 18112 11169 1 15 . 1 1 37 37 SER CB C 37 68.118 68.118 62.564 5.554 18112 11170 1 15 . 1 1 37 37 SER H H 37 8.169 8.169 8.606 -0.437 18112 11171 1 15 . 1 1 38 38 ASN N N 38 115.638 115.638 120.388 -4.750 18112 11172 1 15 . 1 1 38 38 ASN HA H 38 4.259 4.259 4.397 -0.138 18112 11173 1 15 . 1 1 38 38 ASN C C 38 177.868 177.868 177.639 0.229 18112 11174 1 15 . 1 1 38 38 ASN CA C 38 55.907 55.907 56.145 -0.238 18112 11175 1 15 . 1 1 38 38 ASN CB C 38 37.230 37.230 37.849 -0.619 18112 11176 1 15 . 1 1 38 38 ASN H H 38 8.284 8.284 7.597 0.687 18112 11177 1 15 . 1 1 39 39 MET N N 39 121.352 121.352 118.637 2.715 18112 11178 1 15 . 1 1 39 39 MET HA H 39 4.170 4.170 3.665 0.505 18112 11179 1 15 . 1 1 39 39 MET C C 39 179.068 179.068 178.312 0.756 18112 11180 1 15 . 1 1 39 39 MET CA C 39 58.751 58.751 57.590 1.161 18112 11181 1 15 . 1 1 39 39 MET CB C 39 31.850 31.850 31.528 0.322 18112 11182 1 15 . 1 1 39 39 MET H H 39 7.857 7.857 7.613 0.244 18112 11183 1 15 . 1 1 40 40 LEU N N 40 118.936 118.936 122.443 -3.507 18112 11184 1 15 . 1 1 40 40 LEU HA H 40 4.139 4.139 4.203 -0.064 18112 11185 1 15 . 1 1 40 40 LEU C C 40 178.700 178.700 178.760 -0.060 18112 11186 1 15 . 1 1 40 40 LEU CA C 40 58.455 58.455 58.524 -0.069 18112 11187 1 15 . 1 1 40 40 LEU CB C 40 40.304 40.304 41.470 -1.166 18112 11188 1 15 . 1 1 40 40 LEU H H 40 8.167 8.167 8.093 0.074 18112 11189 1 15 . 1 1 41 41 LYS N N 41 116.791 116.791 117.718 -0.927 18112 11190 1 15 . 1 1 41 41 LYS HA H 41 3.475 3.475 4.388 -0.913 18112 11191 1 15 . 1 1 41 41 LYS C C 41 178.793 178.793 179.020 -0.227 18112 11192 1 15 . 1 1 41 41 LYS CA C 41 59.161 59.161 58.396 0.765 18112 11193 1 15 . 1 1 41 41 LYS CB C 41 30.992 30.992 31.997 -1.005 18112 11194 1 15 . 1 1 41 41 LYS H H 41 7.632 7.632 7.872 -0.240 18112 11195 1 15 . 1 1 42 42 THR N N 42 112.819 112.819 116.092 -3.273 18112 11196 1 15 . 1 1 42 42 THR HA H 42 4.230 4.230 4.184 0.046 18112 11197 1 15 . 1 1 42 42 THR C C 42 176.142 176.142 177.285 -1.143 18112 11198 1 15 . 1 1 42 42 THR CA C 42 65.107 65.107 66.439 -1.332 18112 11199 1 15 . 1 1 42 42 THR CB C 42 68.306 68.306 69.073 -0.767 18112 11200 1 15 . 1 1 42 42 THR H H 42 7.469 7.469 8.049 -0.580 18112 11201 1 15 . 1 1 43 43 TYR N N 43 118.565 118.565 119.264 -0.699 18112 11202 1 15 . 1 1 43 43 TYR HA H 43 4.204 4.204 4.412 -0.208 18112 11203 1 15 . 1 1 43 43 TYR C C 43 174.240 174.240 176.720 -2.480 18112 11204 1 15 . 1 1 43 43 TYR CA C 43 60.886 60.886 57.755 3.131 18112 11205 1 15 . 1 1 43 43 TYR CB C 43 38.165 38.165 38.504 -0.339 18112 11206 1 15 . 1 1 43 43 TYR H H 43 7.978 7.978 7.671 0.307 18112 11207 1 15 . 1 1 44 44 PHE N N 44 120.980 120.980 116.153 4.827 18112 11208 1 15 . 1 1 44 44 PHE HA H 44 4.920 4.920 4.959 -0.039 18112 11209 1 15 . 1 1 44 44 PHE C C 44 176.436 176.436 176.140 0.296 18112 11210 1 15 . 1 1 44 44 PHE CA C 44 56.672 56.672 55.178 1.494 18112 11211 1 15 . 1 1 44 44 PHE CB C 44 36.570 36.570 37.679 -1.109 18112 11212 1 15 . 1 1 44 44 PHE H H 44 7.955 7.955 7.990 -0.035 18112 11213 1 15 . 1 1 45 45 SER N N 45 113.407 113.407 116.990 -3.583 18112 11214 1 15 . 1 1 45 45 SER HA H 45 4.373 4.373 4.488 -0.115 18112 11215 1 15 . 1 1 45 45 SER C C 45 174.424 174.424 176.082 -1.658 18112 11216 1 15 . 1 1 45 45 SER CA C 45 61.037 61.037 61.264 -0.227 18112 11217 1 15 . 1 1 45 45 SER CB C 45 62.711 62.711 63.368 -0.657 18112 11218 1 15 . 1 1 45 45 SER H H 45 7.932 7.932 7.986 -0.054 18112 11219 1 15 . 1 1 46 46 ASP N N 46 118.099 118.099 120.759 -2.660 18112 11220 1 15 . 1 1 46 46 ASP HA H 46 4.572 4.572 4.647 -0.075 18112 11221 1 15 . 1 1 46 46 ASP C C 46 174.866 174.866 175.940 -1.074 18112 11222 1 15 . 1 1 46 46 ASP CA C 46 53.602 53.602 55.201 -1.599 18112 11223 1 15 . 1 1 46 46 ASP CB C 46 38.992 38.992 40.917 -1.925 18112 11224 1 15 . 1 1 46 46 ASP H H 46 9.889 9.889 8.568 1.321 18112 11225 1 15 . 1 1 47 47 VAL N N 47 121.496 121.496 121.487 0.009 18112 11226 1 15 . 1 1 47 47 VAL HA H 47 4.058 4.058 3.668 0.390 18112 11227 1 15 . 1 1 47 47 VAL C C 47 174.676 174.676 175.157 -0.481 18112 11228 1 15 . 1 1 47 47 VAL CA C 47 61.006 61.006 61.841 -0.835 18112 11229 1 15 . 1 1 47 47 VAL CB C 47 32.110 32.110 30.965 1.145 18112 11230 1 15 . 1 1 47 47 VAL H H 47 7.781 7.781 7.277 0.504 18112 11231 1 15 . 1 1 48 48 LYS N N 48 126.100 126.100 129.564 -3.464 18112 11232 1 15 . 1 1 48 48 LYS HA H 48 4.402 4.402 4.040 0.362 18112 11233 1 15 . 1 1 48 48 LYS C C 48 175.564 175.564 175.980 -0.416 18112 11234 1 15 . 1 1 48 48 LYS CA C 48 54.874 54.874 55.839 -0.965 18112 11235 1 15 . 1 1 48 48 LYS CB C 48 30.189 30.189 31.429 -1.240 18112 11236 1 15 . 1 1 48 48 LYS H H 48 8.245 8.245 8.377 -0.132 18112 11237 1 15 . 1 1 49 49 PHE N N 49 125.341 125.341 126.271 -0.930 18112 11238 1 15 . 1 1 49 49 PHE HA H 49 3.813 3.813 4.342 -0.529 18112 11239 1 15 . 1 1 49 49 PHE C C 49 175.708 175.708 176.167 -0.459 18112 11240 1 15 . 1 1 49 49 PHE CA C 49 60.861 60.861 57.957 2.904 18112 11241 1 15 . 1 1 49 49 PHE CB C 49 38.616 38.616 37.201 1.415 18112 11242 1 15 . 1 1 49 49 PHE H H 49 8.626 8.626 7.904 0.722 18112 11243 1 15 . 1 1 50 50 ASN N N 50 115.408 115.408 122.244 -6.836 18112 11244 1 15 . 1 1 50 50 ASN C C 50 176.072 176.072 175.943 0.129 18112 11245 1 15 . 1 1 50 50 ASN CA C 50 51.730 51.730 51.723 0.007 18112 11246 1 15 . 1 1 50 50 ASN H H 50 7.030 7.030 8.001 -0.971 18112 11247 1 15 . 1 1 51 51 ARG N N 51 122.706 122.706 124.075 -1.369 18112 11248 1 15 . 1 1 51 51 ARG CA C 51 59.534 59.534 60.130 -0.596 18112 11249 1 15 . 1 1 51 51 ARG H H 51 7.790 7.790 9.003 -1.213 18112 11250 1 15 . 1 1 52 52 CYS N N 52 117.340 117.340 115.994 1.346 18112 11251 1 15 . 1 1 52 52 CYS HA H 52 4.108 4.108 4.221 -0.113 18112 11252 1 15 . 1 1 52 52 CYS C C 52 178.200 178.200 176.813 1.387 18112 11253 1 15 . 1 1 52 52 CYS CA C 52 61.143 61.143 61.772 -0.629 18112 11254 1 15 . 1 1 52 52 CYS H H 52 7.681 7.681 8.229 -0.548 18112 11255 1 15 . 1 1 53 53 ILE N N 53 122.321 122.321 122.335 -0.014 18112 11256 1 15 . 1 1 53 53 ILE HA H 53 3.588 3.588 3.880 -0.292 18112 11257 1 15 . 1 1 53 53 ILE C C 53 177.492 177.492 177.315 0.177 18112 11258 1 15 . 1 1 53 53 ILE CA C 53 64.109 64.109 63.858 0.251 18112 11259 1 15 . 1 1 53 53 ILE CB C 53 37.603 37.603 37.730 -0.127 18112 11260 1 15 . 1 1 53 53 ILE H H 53 8.035 8.035 7.583 0.452 18112 11261 1 15 . 1 1 54 54 THR C C 54 175.903 175.903 176.486 -0.583 18112 11262 1 15 . 1 1 54 54 THR CA C 54 67.308 67.308 67.559 -0.251 18112 11263 1 15 . 1 1 55 55 SER N N 55 113.819 113.819 116.072 -2.253 18112 11264 1 15 . 1 1 55 55 SER H H 55 7.844 7.844 7.954 -0.110 18112 11265 1 15 . 1 1 56 56 GLN C C 56 179.792 179.792 178.104 1.688 18112 11266 1 15 . 1 1 57 57 LEU N N 57 116.701 116.701 120.892 -4.191 18112 11267 1 15 . 1 1 57 57 LEU HA H 57 4.519 4.519 2.974 1.545 18112 11268 1 15 . 1 1 57 57 LEU C C 57 178.775 178.775 178.687 0.088 18112 11269 1 15 . 1 1 57 57 LEU CA C 57 55.232 55.232 57.188 -1.956 18112 11270 1 15 . 1 1 57 57 LEU CB C 57 37.131 37.131 41.633 -4.502 18112 11271 1 15 . 1 1 57 57 LEU H H 57 8.267 8.267 7.654 0.613 18112 11272 1 15 . 1 1 58 58 ILE N N 58 122.522 122.522 118.988 3.534 18112 11273 1 15 . 1 1 58 58 ILE HA H 58 4.640 4.640 3.488 1.152 18112 11274 1 15 . 1 1 58 58 ILE C C 58 177.380 177.380 178.063 -0.683 18112 11275 1 15 . 1 1 58 58 ILE CA C 58 62.163 62.163 65.158 -2.995 18112 11276 1 15 . 1 1 58 58 ILE CB C 58 30.657 30.657 37.529 -6.872 18112 11277 1 15 . 1 1 58 58 ILE H H 58 8.111 8.111 8.322 -0.211 18112 11278 1 15 . 1 1 59 59 LYS N N 59 121.002 121.002 120.182 0.820 18112 11279 1 15 . 1 1 59 59 LYS C C 59 177.600 177.600 179.500 -1.900 18112 11280 1 15 . 1 1 59 59 LYS CA C 59 57.570 57.570 58.914 -1.344 18112 11281 1 15 . 1 1 59 59 LYS CB C 59 39.101 39.101 31.914 7.187 18112 11282 1 15 . 1 1 59 59 LYS H H 59 7.432 7.432 7.968 -0.536 18112 11283 1 15 . 1 1 60 60 TRP N N 60 118.679 118.679 120.873 -2.194 18112 11284 1 15 . 1 1 60 60 TRP HA H 60 3.739 3.739 4.561 -0.822 18112 11285 1 15 . 1 1 60 60 TRP C C 60 178.246 178.246 178.929 -0.683 18112 11286 1 15 . 1 1 60 60 TRP CA C 60 59.818 59.818 59.180 0.638 18112 11287 1 15 . 1 1 60 60 TRP CB C 60 31.851 31.851 28.508 3.343 18112 11288 1 15 . 1 1 60 60 TRP H H 60 7.565 7.565 8.189 -0.624 18112 11289 1 15 . 1 1 61 61 PHE N N 61 118.005 118.005 116.519 1.486 18112 11290 1 15 . 1 1 61 61 PHE HA H 61 3.882 3.882 4.158 -0.276 18112 11291 1 15 . 1 1 61 61 PHE CA C 61 60.054 60.054 58.870 1.184 18112 11292 1 15 . 1 1 61 61 PHE H H 61 7.819 7.819 8.552 -0.733 18112 11293 1 15 . 1 1 62 62 SER N N 62 121.144 121.144 115.080 6.064 18112 11294 1 15 . 1 1 62 62 SER C C 62 177.840 177.840 177.079 0.761 18112 11295 1 15 . 1 1 62 62 SER CA C 62 55.892 55.892 61.451 -5.559 18112 11296 1 15 . 1 1 62 62 SER H H 62 8.878 8.878 8.513 0.365 18112 11297 1 15 . 1 1 63 63 ASN N N 63 115.303 115.303 121.902 -6.599 18112 11298 1 15 . 1 1 63 63 ASN C C 63 177.222 177.222 177.611 -0.389 18112 11299 1 15 . 1 1 63 63 ASN CA C 63 60.467 60.467 56.983 3.484 18112 11300 1 15 . 1 1 63 63 ASN H H 63 8.001 8.001 8.195 -0.194 18112 11301 1 15 . 1 1 64 64 PHE N N 64 112.571 112.571 122.155 -9.584 18112 11302 1 15 . 1 1 64 64 PHE CA C 64 56.453 56.453 62.424 -5.971 18112 11303 1 15 . 1 1 64 64 PHE H H 64 7.082 7.082 8.641 -1.559 18112 11304 1 15 . 1 1 65 65 ARG N N 65 116.695 116.695 118.099 -1.404 18112 11305 1 15 . 1 1 65 65 ARG CA C 65 59.590 59.590 59.341 0.249 18112 11306 1 15 . 1 1 65 65 ARG H H 65 8.091 8.091 8.805 -0.714 18112 11307 1 15 . 1 1 66 66 GLU N N 66 121.653 121.653 121.108 0.545 18112 11308 1 15 . 1 1 66 66 GLU HA H 66 4.739 4.739 4.176 0.563 18112 11309 1 15 . 1 1 66 66 GLU C C 66 174.621 174.621 178.909 -4.288 18112 11310 1 15 . 1 1 66 66 GLU CA C 66 59.583 59.583 59.126 0.457 18112 11311 1 15 . 1 1 66 66 GLU H H 66 7.597 7.597 8.333 -0.736 18112 11312 1 15 . 1 1 67 67 PHE N N 67 111.578 111.578 119.625 -8.047 18112 11313 1 15 . 1 1 67 67 PHE C C 67 176.164 176.164 177.743 -1.579 18112 11314 1 15 . 1 1 67 67 PHE CA C 67 61.156 61.156 61.848 -0.692 18112 11315 1 15 . 1 1 67 67 PHE H H 67 7.067 7.067 8.092 -1.025 18112 11316 1 15 . 1 1 68 68 TYR N N 68 119.370 119.370 121.104 -1.734 18112 11317 1 15 . 1 1 68 68 TYR C C 68 176.844 176.844 177.265 -0.421 18112 11318 1 15 . 1 1 68 68 TYR CA C 68 61.758 61.758 61.647 0.111 18112 11319 1 15 . 1 1 68 68 TYR H H 68 7.442 7.442 8.572 -1.130 18112 11320 1 15 . 1 1 69 69 TYR N N 69 116.047 116.047 119.536 -3.489 18112 11321 1 15 . 1 1 69 69 TYR HA H 69 4.086 4.086 4.064 0.022 18112 11322 1 15 . 1 1 69 69 TYR C C 69 180.328 180.328 177.667 2.661 18112 11323 1 15 . 1 1 69 69 TYR CA C 69 61.528 61.528 62.333 -0.805 18112 11324 1 15 . 1 1 69 69 TYR H H 69 9.127 9.127 8.139 0.988 18112 11325 1 15 . 1 1 70 70 ILE N N 70 124.738 124.738 118.978 5.760 18112 11326 1 15 . 1 1 70 70 ILE HA H 70 3.828 3.828 3.454 0.374 18112 11327 1 15 . 1 1 70 70 ILE C C 70 179.585 179.585 178.096 1.489 18112 11328 1 15 . 1 1 70 70 ILE CA C 70 65.787 65.787 65.141 0.646 18112 11329 1 15 . 1 1 70 70 ILE CB C 70 36.435 36.435 37.636 -1.201 18112 11330 1 15 . 1 1 70 70 ILE H H 70 8.631 8.631 8.576 0.055 18112 11331 1 15 . 1 1 71 71 GLN N N 71 117.940 117.940 118.268 -0.328 18112 11332 1 15 . 1 1 71 71 GLN HA H 71 3.826 3.826 3.542 0.284 18112 11333 1 15 . 1 1 71 71 GLN C C 71 178.192 178.192 178.562 -0.370 18112 11334 1 15 . 1 1 71 71 GLN CA C 71 57.779 57.779 58.272 -0.492 18112 11335 1 15 . 1 1 71 71 GLN H H 71 7.738 7.738 7.609 0.129 18112 11336 1 15 . 1 1 72 72 MET N N 72 117.353 117.353 117.852 -0.499 18112 11337 1 15 . 1 1 72 72 MET HA H 72 4.112 4.112 4.062 0.050 18112 11338 1 15 . 1 1 72 72 MET C C 72 177.203 177.203 178.190 -0.987 18112 11339 1 15 . 1 1 72 72 MET CA C 72 57.272 57.272 57.515 -0.243 18112 11340 1 15 . 1 1 72 72 MET H H 72 7.844 7.844 7.785 0.059 18112 11341 1 15 . 1 1 73 73 GLU N N 73 117.858 117.858 119.407 -1.549 18112 11342 1 15 . 1 1 73 73 GLU HA H 73 3.572 3.572 3.136 0.436 18112 11343 1 15 . 1 1 73 73 GLU C C 73 177.344 177.344 178.742 -1.398 18112 11344 1 15 . 1 1 73 73 GLU CA C 73 60.324 60.324 59.131 1.193 18112 11345 1 15 . 1 1 73 73 GLU H H 73 7.503 7.503 7.651 -0.148 18112 11346 1 15 . 1 1 74 74 LYS N N 74 118.716 118.716 118.488 0.228 18112 11347 1 15 . 1 1 74 74 LYS HA H 74 3.867 3.867 4.008 -0.141 18112 11348 1 15 . 1 1 74 74 LYS C C 74 180.077 180.077 179.576 0.501 18112 11349 1 15 . 1 1 74 74 LYS CA C 74 59.754 59.754 57.950 1.804 18112 11350 1 15 . 1 1 74 74 LYS H H 74 7.912 7.912 7.742 0.170 18112 11351 1 15 . 1 1 75 75 TYR N N 75 117.309 117.309 119.757 -2.448 18112 11352 1 15 . 1 1 75 75 TYR HA H 75 4.085 4.085 4.182 -0.097 18112 11353 1 15 . 1 1 75 75 TYR C C 75 178.874 178.874 178.105 0.769 18112 11354 1 15 . 1 1 75 75 TYR CA C 75 63.306 63.306 59.894 3.412 18112 11355 1 15 . 1 1 75 75 TYR H H 75 8.421 8.421 8.010 0.411 18112 11356 1 15 . 1 1 76 76 ALA N N 76 125.392 125.392 122.004 3.388 18112 11357 1 15 . 1 1 76 76 ALA HA H 76 4.221 4.221 4.056 0.165 18112 11358 1 15 . 1 1 76 76 ALA C C 76 178.850 178.850 179.153 -0.303 18112 11359 1 15 . 1 1 76 76 ALA CA C 76 56.280 56.280 55.357 0.923 18112 11360 1 15 . 1 1 76 76 ALA CB C 76 18.687 18.687 18.403 0.284 18112 11361 1 15 . 1 1 76 76 ALA H H 76 8.553 8.553 8.432 0.121 18112 11362 1 15 . 1 1 77 77 ARG N N 77 115.067 115.067 118.369 -3.302 18112 11363 1 15 . 1 1 77 77 ARG HA H 77 3.935 3.935 3.974 -0.039 18112 11364 1 15 . 1 1 77 77 ARG C C 77 179.341 179.341 178.253 1.088 18112 11365 1 15 . 1 1 77 77 ARG CA C 77 60.499 60.499 59.507 0.992 18112 11366 1 15 . 1 1 77 77 ARG H H 77 8.471 8.471 8.179 0.292 18112 11367 1 15 . 1 1 78 78 GLN N N 78 120.107 120.107 118.786 1.321 18112 11368 1 15 . 1 1 78 78 GLN HA H 78 3.921 3.921 4.164 -0.243 18112 11369 1 15 . 1 1 78 78 GLN C C 78 177.289 177.289 177.990 -0.701 18112 11370 1 15 . 1 1 78 78 GLN CA C 78 58.619 58.619 58.100 0.519 18112 11371 1 15 . 1 1 78 78 GLN CB C 78 27.752 27.752 28.192 -0.440 18112 11372 1 15 . 1 1 78 78 GLN H H 78 8.142 8.142 8.053 0.089 18112 11373 1 15 . 1 1 79 79 ALA N N 79 120.809 120.809 123.545 -2.736 18112 11374 1 15 . 1 1 79 79 ALA HA H 79 4.308 4.308 3.993 0.315 18112 11375 1 15 . 1 1 79 79 ALA C C 79 179.924 179.924 179.572 0.352 18112 11376 1 15 . 1 1 79 79 ALA CA C 79 54.970 54.970 55.350 -0.380 18112 11377 1 15 . 1 1 79 79 ALA CB C 79 17.064 17.064 18.345 -1.281 18112 11378 1 15 . 1 1 79 79 ALA H H 79 7.811 7.811 7.824 -0.013 18112 11379 1 15 . 1 1 80 80 ILE N N 80 118.524 118.524 117.627 0.897 18112 11380 1 15 . 1 1 80 80 ILE HA H 80 3.894 3.894 3.826 0.068 18112 11381 1 15 . 1 1 80 80 ILE C C 80 181.268 181.268 178.385 2.883 18112 11382 1 15 . 1 1 80 80 ILE CA C 80 64.841 64.841 62.572 2.269 18112 11383 1 15 . 1 1 80 80 ILE CB C 80 37.125 37.125 36.514 0.611 18112 11384 1 15 . 1 1 80 80 ILE H H 80 7.837 7.837 8.150 -0.313 18112 11385 1 15 . 1 1 81 81 ASN N N 81 121.233 121.233 118.928 2.305 18112 11386 1 15 . 1 1 81 81 ASN HA H 81 4.398 4.398 4.450 -0.052 18112 11387 1 15 . 1 1 81 81 ASN C C 81 176.546 176.546 176.958 -0.412 18112 11388 1 15 . 1 1 81 81 ASN CA C 81 55.892 55.892 55.976 -0.084 18112 11389 1 15 . 1 1 81 81 ASN CB C 81 37.603 37.603 38.792 -1.189 18112 11390 1 15 . 1 1 81 81 ASN H H 81 8.262 8.262 8.173 0.089 18112 11391 1 15 . 1 1 82 82 ASP N N 82 119.240 119.240 117.337 1.903 18112 11392 1 15 . 1 1 82 82 ASP HA H 82 4.666 4.666 4.650 0.016 18112 11393 1 15 . 1 1 82 82 ASP C C 82 176.767 176.767 177.149 -0.382 18112 11394 1 15 . 1 1 82 82 ASP CA C 82 54.771 54.771 54.356 0.415 18112 11395 1 15 . 1 1 82 82 ASP CB C 82 40.121 40.121 41.681 -1.560 18112 11396 1 15 . 1 1 82 82 ASP H H 82 8.316 8.316 7.983 0.333 18112 11397 1 15 . 1 1 83 83 GLY N N 83 106.913 106.913 106.685 0.228 18112 11398 1 15 . 1 1 83 83 GLY C C 83 174.601 174.601 175.220 -0.619 18112 11399 1 15 . 1 1 83 83 GLY CA C 83 45.214 45.214 45.301 -0.087 18112 11400 1 15 . 1 1 83 83 GLY H H 83 7.810 7.810 7.987 -0.177 18112 11401 1 15 . 1 1 84 84 VAL N N 84 122.981 122.981 120.062 2.919 18112 11402 1 15 . 1 1 84 84 VAL HA H 84 3.850 3.850 3.755 0.095 18112 11403 1 15 . 1 1 84 84 VAL C C 84 177.265 177.265 176.813 0.452 18112 11404 1 15 . 1 1 84 84 VAL CA C 84 64.270 64.270 64.436 -0.166 18112 11405 1 15 . 1 1 84 84 VAL CB C 84 30.471 30.471 31.848 -1.377 18112 11406 1 15 . 1 1 84 84 VAL H H 84 8.157 8.157 7.874 0.283 18112 11407 1 15 . 1 1 85 85 THR N N 85 115.232 115.232 107.612 7.620 18112 11408 1 15 . 1 1 85 85 THR HA H 85 4.716 4.716 3.765 0.951 18112 11409 1 15 . 1 1 85 85 THR C C 85 174.489 174.489 172.900 1.589 18112 11410 1 15 . 1 1 85 85 THR CA C 85 61.618 61.618 63.794 -2.176 18112 11411 1 15 . 1 1 85 85 THR CB C 85 70.081 70.081 68.297 1.784 18112 11412 1 15 . 1 1 85 85 THR H H 85 8.890 8.890 7.691 1.199 18112 11413 1 15 . 1 1 86 86 SER N N 86 117.009 117.009 115.717 1.292 18112 11414 1 15 . 1 1 86 86 SER HA H 86 5.046 5.046 4.465 0.581 18112 11415 1 15 . 1 1 86 86 SER C C 86 174.473 174.473 175.038 -0.565 18112 11416 1 15 . 1 1 86 86 SER CA C 86 55.922 55.922 56.465 -0.543 18112 11417 1 15 . 1 1 86 86 SER CB C 86 64.385 64.385 65.792 -1.407 18112 11418 1 15 . 1 1 86 86 SER H H 86 7.704 7.704 7.544 0.160 18112 11419 1 15 . 1 1 87 87 THR N N 87 118.634 118.634 117.504 1.130 18112 11420 1 15 . 1 1 87 87 THR HA H 87 4.065 4.065 3.889 0.176 18112 11421 1 15 . 1 1 87 87 THR C C 87 176.047 176.047 175.809 0.238 18112 11422 1 15 . 1 1 87 87 THR CA C 87 64.983 64.983 65.208 -0.225 18112 11423 1 15 . 1 1 87 87 THR CB C 87 68.045 68.045 68.780 -0.735 18112 11424 1 15 . 1 1 87 87 THR H H 87 8.711 8.711 8.568 0.143 18112 11425 1 15 . 1 1 88 88 GLU N N 88 117.889 117.889 119.092 -1.203 18112 11426 1 15 . 1 1 88 88 GLU HA H 88 3.881 3.881 4.081 -0.200 18112 11427 1 15 . 1 1 88 88 GLU C C 88 177.146 177.146 177.642 -0.496 18112 11428 1 15 . 1 1 88 88 GLU CA C 88 57.814 57.814 58.396 -0.582 18112 11429 1 15 . 1 1 88 88 GLU CB C 88 28.050 28.050 29.135 -1.085 18112 11430 1 15 . 1 1 88 88 GLU H H 88 8.152 8.152 8.542 -0.390 18112 11431 1 15 . 1 1 89 89 GLU N N 89 115.617 115.617 115.967 -0.350 18112 11432 1 15 . 1 1 89 89 GLU HA H 89 4.149 4.149 4.319 -0.170 18112 11433 1 15 . 1 1 89 89 GLU C C 89 176.192 176.192 177.274 -1.082 18112 11434 1 15 . 1 1 89 89 GLU CA C 89 56.133 56.133 57.332 -1.199 18112 11435 1 15 . 1 1 89 89 GLU CB C 89 29.415 29.415 30.438 -1.023 18112 11436 1 15 . 1 1 89 89 GLU H H 89 7.311 7.311 7.650 -0.339 18112 11437 1 15 . 1 1 90 90 LEU N N 90 120.870 120.870 114.721 6.149 18112 11438 1 15 . 1 1 90 90 LEU HA H 90 4.439 4.439 4.603 -0.164 18112 11439 1 15 . 1 1 90 90 LEU C C 90 175.267 175.267 177.146 -1.879 18112 11440 1 15 . 1 1 90 90 LEU CA C 90 53.504 53.504 54.679 -1.175 18112 11441 1 15 . 1 1 90 90 LEU CB C 90 40.479 40.479 43.227 -2.748 18112 11442 1 15 . 1 1 90 90 LEU H H 90 7.311 7.311 7.330 -0.019 18112 11443 1 15 . 1 1 91 91 SER N N 91 118.376 118.376 114.586 3.790 18112 11444 1 15 . 1 1 91 91 SER HA H 91 4.747 4.747 4.672 0.075 18112 11445 1 15 . 1 1 91 91 SER C C 91 173.332 173.332 172.606 0.726 18112 11446 1 15 . 1 1 91 91 SER CA C 91 56.314 56.314 58.296 -1.982 18112 11447 1 15 . 1 1 91 91 SER CB C 91 64.615 64.615 64.913 -0.298 18112 11448 1 15 . 1 1 91 91 SER H H 91 8.221 8.221 7.944 0.277 18112 11449 1 15 . 1 1 92 92 ILE N N 92 122.247 122.247 121.846 0.401 18112 11450 1 15 . 1 1 92 92 ILE HA H 92 4.537 4.537 4.354 0.183 18112 11451 1 15 . 1 1 92 92 ILE C C 92 174.059 174.059 174.651 -0.592 18112 11452 1 15 . 1 1 92 92 ILE CA C 92 59.881 59.881 59.605 0.276 18112 11453 1 15 . 1 1 92 92 ILE CB C 92 37.820 37.820 42.917 -5.097 18112 11454 1 15 . 1 1 92 92 ILE H H 92 8.570 8.570 8.368 0.202 18112 11455 1 15 . 1 1 93 93 THR N N 93 116.069 116.069 120.127 -4.058 18112 11456 1 15 . 1 1 93 93 THR HA H 93 4.580 4.580 4.382 0.198 18112 11457 1 15 . 1 1 93 93 THR C C 93 175.049 175.049 174.466 0.583 18112 11458 1 15 . 1 1 93 93 THR CA C 93 58.988 58.988 63.953 -4.965 18112 11459 1 15 . 1 1 93 93 THR CB C 93 71.362 71.362 67.892 3.470 18112 11460 1 15 . 1 1 93 93 THR H H 93 7.224 7.224 8.655 -1.431 18112 11461 1 15 . 1 1 94 94 ARG N N 94 116.595 116.595 128.911 -12.316 18112 11462 1 15 . 1 1 94 94 ARG HA H 94 3.077 3.077 4.682 -1.605 18112 11463 1 15 . 1 1 94 94 ARG C C 94 175.076 175.076 175.890 -0.814 18112 11464 1 15 . 1 1 94 94 ARG CA C 94 57.119 57.119 54.866 2.253 18112 11465 1 15 . 1 1 94 94 ARG CB C 94 27.838 27.838 30.364 -2.526 18112 11466 1 15 . 1 1 94 94 ARG H H 94 8.596 8.596 8.186 0.410 18112 11467 1 15 . 1 1 95 95 ASP N N 95 113.735 113.735 120.348 -6.613 18112 11468 1 15 . 1 1 95 95 ASP HA H 95 4.765 4.765 3.937 0.828 18112 11469 1 15 . 1 1 95 95 ASP C C 95 175.876 175.876 175.339 0.537 18112 11470 1 15 . 1 1 95 95 ASP CA C 95 53.156 53.156 56.424 -3.268 18112 11471 1 15 . 1 1 95 95 ASP CB C 95 41.166 41.166 39.026 2.140 18112 11472 1 15 . 1 1 95 95 ASP H H 95 7.607 7.607 8.733 -1.126 18112 11473 1 15 . 1 1 96 96 CYS N N 96 116.012 116.012 119.245 -3.233 18112 11474 1 15 . 1 1 96 96 CYS C C 96 174.361 174.361 176.218 -1.857 18112 11475 1 15 . 1 1 96 96 CYS CA C 96 56.562 56.562 59.107 -2.545 18112 11476 1 15 . 1 1 96 96 CYS CB C 96 29.416 29.416 30.407 -0.991 18112 11477 1 15 . 1 1 96 96 CYS H H 96 7.094 7.094 7.817 -0.723 18112 11478 1 15 . 1 1 97 97 GLU N N 97 123.087 123.087 122.848 0.239 18112 11479 1 15 . 1 1 97 97 GLU C C 97 178.748 178.748 178.360 0.388 18112 11480 1 15 . 1 1 97 97 GLU CA C 97 59.912 59.912 60.068 -0.156 18112 11481 1 15 . 1 1 97 97 GLU CB C 97 29.195 29.195 29.694 -0.499 18112 11482 1 15 . 1 1 97 97 GLU H H 97 9.003 9.003 8.122 0.881 18112 11483 1 15 . 1 1 98 98 LEU N N 98 120.942 120.942 119.149 1.793 18112 11484 1 15 . 1 1 98 98 LEU HA H 98 3.614 3.614 4.155 -0.541 18112 11485 1 15 . 1 1 98 98 LEU C C 98 177.796 177.796 178.615 -0.819 18112 11486 1 15 . 1 1 98 98 LEU CA C 98 58.090 58.090 57.114 0.976 18112 11487 1 15 . 1 1 98 98 LEU CB C 98 39.778 39.778 41.955 -2.177 18112 11488 1 15 . 1 1 98 98 LEU H H 98 8.656 8.656 7.669 0.987 18112 11489 1 15 . 1 1 99 99 TYR N N 99 118.313 118.313 118.280 0.033 18112 11490 1 15 . 1 1 99 99 TYR C C 99 177.077 177.077 178.310 -1.233 18112 11491 1 15 . 1 1 99 99 TYR CA C 99 62.622 62.622 62.040 0.582 18112 11492 1 15 . 1 1 99 99 TYR CB C 99 38.742 38.742 37.749 0.993 18112 11493 1 15 . 1 1 99 99 TYR H H 99 7.522 7.522 8.402 -0.880 18112 11494 1 15 . 1 1 100 100 ARG N N 100 118.101 118.101 117.519 0.582 18112 11495 1 15 . 1 1 100 100 ARG C C 100 178.616 178.616 178.511 0.105 18112 11496 1 15 . 1 1 100 100 ARG CA C 100 59.915 59.915 58.780 1.135 18112 11497 1 15 . 1 1 100 100 ARG CB C 100 29.100 29.100 30.127 -1.027 18112 11498 1 15 . 1 1 100 100 ARG H H 100 8.243 8.243 8.498 -0.255 18112 11499 1 15 . 1 1 101 101 ALA N N 101 120.972 120.972 124.822 -3.850 18112 11500 1 15 . 1 1 101 101 ALA HA H 101 4.145 4.145 4.224 -0.079 18112 11501 1 15 . 1 1 101 101 ALA C C 101 181.359 181.359 179.127 2.232 18112 11502 1 15 . 1 1 101 101 ALA CA C 101 55.057 55.057 55.335 -0.278 18112 11503 1 15 . 1 1 101 101 ALA CB C 101 17.543 17.543 18.509 -0.966 18112 11504 1 15 . 1 1 101 101 ALA H H 101 8.352 8.352 8.092 0.260 18112 11505 1 15 . 1 1 102 102 LEU N N 102 115.683 115.683 118.742 -3.059 18112 11506 1 15 . 1 1 102 102 LEU HA H 102 4.333 4.333 4.072 0.261 18112 11507 1 15 . 1 1 102 102 LEU C C 102 178.583 178.583 179.334 -0.751 18112 11508 1 15 . 1 1 102 102 LEU CA C 102 57.634 57.634 58.266 -0.632 18112 11509 1 15 . 1 1 102 102 LEU CB C 102 41.716 41.716 41.580 0.136 18112 11510 1 15 . 1 1 102 102 LEU H H 102 7.960 7.960 8.207 -0.247 18112 11511 1 15 . 1 1 103 103 ASN N N 103 118.957 118.957 118.265 0.692 18112 11512 1 15 . 1 1 103 103 ASN C C 103 177.470 177.470 177.854 -0.384 18112 11513 1 15 . 1 1 103 103 ASN CA C 103 56.974 56.974 56.664 0.310 18112 11514 1 15 . 1 1 103 103 ASN CB C 103 38.140 38.140 38.610 -0.470 18112 11515 1 15 . 1 1 103 103 ASN H H 103 9.301 9.301 8.227 1.074 18112 11516 1 15 . 1 1 104 104 MET N N 104 113.763 113.763 118.705 -4.942 18112 11517 1 15 . 1 1 104 104 MET CA C 104 57.362 57.362 58.392 -1.030 18112 11518 1 15 . 1 1 104 104 MET CB C 104 31.895 31.895 32.833 -0.938 18112 11519 1 15 . 1 1 104 104 MET H H 104 8.332 8.332 7.919 0.413 18112 11520 1 15 . 1 1 105 105 HIS N N 105 116.024 116.024 117.171 -1.147 18112 11521 1 15 . 1 1 105 105 HIS HA H 105 3.764 3.764 4.412 -0.648 18112 11522 1 15 . 1 1 105 105 HIS C C 105 176.939 176.939 177.549 -0.610 18112 11523 1 15 . 1 1 105 105 HIS CA C 105 59.069 59.069 59.305 -0.236 18112 11524 1 15 . 1 1 105 105 HIS H H 105 7.156 7.156 8.104 -0.948 18112 11525 1 15 . 1 1 106 106 TYR N N 106 113.161 113.161 118.104 -4.943 18112 11526 1 15 . 1 1 106 106 TYR C C 106 173.767 173.767 176.005 -2.238 18112 11527 1 15 . 1 1 106 106 TYR CA C 106 58.488 58.488 61.348 -2.860 18112 11528 1 15 . 1 1 106 106 TYR CB C 106 38.225 38.225 39.221 -0.996 18112 11529 1 15 . 1 1 106 106 TYR H H 106 7.204 7.204 8.389 -1.185 18112 11530 1 15 . 1 1 107 107 ASN N N 107 118.875 118.875 114.631 4.244 18112 11531 1 15 . 1 1 107 107 ASN HA H 107 3.922 3.922 4.826 -0.904 18112 11532 1 15 . 1 1 107 107 ASN C C 107 175.815 175.815 175.145 0.670 18112 11533 1 15 . 1 1 107 107 ASN CA C 107 51.233 51.233 52.578 -1.345 18112 11534 1 15 . 1 1 107 107 ASN CB C 107 38.142 38.142 40.631 -2.489 18112 11535 1 15 . 1 1 107 107 ASN H H 107 8.127 8.127 8.184 -0.057 18112 11536 1 15 . 1 1 108 108 LYS N N 108 122.850 122.850 125.976 -3.126 18112 11537 1 15 . 1 1 108 108 LYS HA H 108 3.954 3.954 3.948 0.006 18112 11538 1 15 . 1 1 108 108 LYS C C 108 177.586 177.586 176.850 0.736 18112 11539 1 15 . 1 1 108 108 LYS CA C 108 59.749 59.749 58.804 0.945 18112 11540 1 15 . 1 1 108 108 LYS CB C 108 31.498 31.498 32.602 -1.104 18112 11541 1 15 . 1 1 108 108 LYS H H 108 7.772 7.772 8.751 -0.979 18112 11542 1 15 . 1 1 109 109 ALA N N 109 118.054 118.054 120.220 -2.166 18112 11543 1 15 . 1 1 109 109 ALA HA H 109 4.137 4.137 4.562 -0.425 18112 11544 1 15 . 1 1 109 109 ALA C C 109 177.889 177.889 176.015 1.874 18112 11545 1 15 . 1 1 109 109 ALA CA C 109 52.299 52.299 51.337 0.962 18112 11546 1 15 . 1 1 109 109 ALA CB C 109 17.787 17.787 18.154 -0.367 18112 11547 1 15 . 1 1 109 109 ALA H H 109 8.307 8.307 7.732 0.575 18112 11548 1 15 . 1 1 110 110 ASN N N 110 115.542 115.542 119.242 -3.700 18112 11549 1 15 . 1 1 110 110 ASN HA H 110 4.480 4.480 4.440 0.040 18112 11550 1 15 . 1 1 110 110 ASN C C 110 174.277 174.277 176.057 -1.780 18112 11551 1 15 . 1 1 110 110 ASN CA C 110 53.504 53.504 54.681 -1.177 18112 11552 1 15 . 1 1 110 110 ASN CB C 110 37.283 37.283 39.011 -1.728 18112 11553 1 15 . 1 1 110 110 ASN H H 110 8.353 8.353 8.142 0.211 18112 11554 1 15 . 1 1 111 111 ASP N N 111 114.692 114.692 118.010 -3.318 18112 11555 1 15 . 1 1 111 111 ASP HA H 111 4.485 4.485 4.225 0.260 18112 11556 1 15 . 1 1 111 111 ASP C C 111 174.868 174.868 174.595 0.273 18112 11557 1 15 . 1 1 111 111 ASP CA C 111 53.227 53.227 56.203 -2.976 18112 11558 1 15 . 1 1 111 111 ASP CB C 111 39.228 39.228 39.772 -0.544 18112 11559 1 15 . 1 1 111 111 ASP H H 111 8.297 8.297 7.955 0.342 18112 11560 1 15 . 1 1 112 112 PHE N N 112 120.927 120.927 121.243 -0.316 18112 11561 1 15 . 1 1 112 112 PHE HA H 112 4.752 4.752 4.323 0.429 18112 11562 1 15 . 1 1 112 112 PHE C C 112 174.633 174.633 175.636 -1.003 18112 11563 1 15 . 1 1 112 112 PHE CA C 112 56.346 56.346 58.271 -1.925 18112 11564 1 15 . 1 1 112 112 PHE H H 112 7.784 7.784 7.459 0.325 18112 11565 1 15 . 1 1 113 113 GLU N N 113 128.111 128.111 127.061 1.050 18112 11566 1 15 . 1 1 113 113 GLU HA H 113 4.011 4.011 4.225 -0.214 18112 11567 1 15 . 1 1 113 113 GLU C C 113 173.502 173.502 175.561 -2.059 18112 11568 1 15 . 1 1 113 113 GLU CA C 113 55.100 55.100 55.384 -0.284 18112 11569 1 15 . 1 1 113 113 GLU H H 113 7.752 7.752 7.843 -0.091 18112 11570 1 15 . 1 1 114 114 VAL N N 114 129.326 129.326 119.982 9.344 18112 11571 1 15 . 1 1 114 114 VAL HA H 114 3.241 3.241 4.182 -0.941 18112 11572 1 15 . 1 1 114 114 VAL CA C 114 60.838 60.838 60.449 0.389 18112 11573 1 15 . 1 1 114 114 VAL CB C 114 32.609 32.609 31.099 1.510 18112 11574 1 15 . 1 1 114 114 VAL H H 114 8.008 8.008 7.641 0.367 18112 11575 1 15 . 1 1 115 115 PRO HA H 115 4.429 4.429 4.723 -0.294 18112 11576 1 15 . 1 1 115 115 PRO C C 115 177.421 177.421 177.888 -0.467 18112 11577 1 15 . 1 1 115 115 PRO CA C 115 61.882 61.882 62.117 -0.235 18112 11578 1 15 . 1 1 115 115 PRO CB C 115 30.974 30.974 32.904 -1.930 18112 11579 1 15 . 1 1 116 116 GLU N N 116 123.936 123.936 119.273 4.663 18112 11580 1 15 . 1 1 116 116 GLU C C 116 179.034 179.034 178.906 0.128 18112 11581 1 15 . 1 1 116 116 GLU CA C 116 58.913 58.913 59.735 -0.822 18112 11582 1 15 . 1 1 116 116 GLU CB C 116 28.378 28.378 29.209 -0.831 18112 11583 1 15 . 1 1 116 116 GLU H H 116 8.757 8.757 8.958 -0.201 18112 11584 1 15 . 1 1 117 117 ARG N N 117 116.943 116.943 119.779 -2.836 18112 11585 1 15 . 1 1 117 117 ARG C C 117 177.570 177.570 178.161 -0.591 18112 11586 1 15 . 1 1 117 117 ARG CA C 117 57.033 57.033 58.665 -1.632 18112 11587 1 15 . 1 1 117 117 ARG CB C 117 28.172 28.172 29.761 -1.589 18112 11588 1 15 . 1 1 117 117 ARG H H 117 8.733 8.733 8.635 0.098 18112 11589 1 15 . 1 1 118 118 PHE N N 118 117.528 117.528 120.306 -2.778 18112 11590 1 15 . 1 1 118 118 PHE HA H 118 4.137 4.137 4.208 -0.071 18112 11591 1 15 . 1 1 118 118 PHE C C 118 176.992 176.992 177.156 -0.164 18112 11592 1 15 . 1 1 118 118 PHE CA C 118 61.627 61.627 61.730 -0.103 18112 11593 1 15 . 1 1 118 118 PHE CB C 118 37.386 37.386 38.906 -1.520 18112 11594 1 15 . 1 1 118 118 PHE H H 118 7.606 7.606 8.001 -0.395 18112 11595 1 15 . 1 1 119 119 LEU N N 119 118.483 118.483 117.953 0.530 18112 11596 1 15 . 1 1 119 119 LEU HA H 119 3.684 3.684 4.046 -0.362 18112 11597 1 15 . 1 1 119 119 LEU C C 119 178.802 178.802 179.052 -0.250 18112 11598 1 15 . 1 1 119 119 LEU CA C 119 59.875 59.875 56.783 3.092 18112 11599 1 15 . 1 1 119 119 LEU CB C 119 39.453 39.453 40.354 -0.901 18112 11600 1 15 . 1 1 119 119 LEU H H 119 7.248 7.248 7.694 -0.446 18112 11601 1 15 . 1 1 120 120 GLU N N 120 117.870 117.870 121.169 -3.299 18112 11602 1 15 . 1 1 120 120 GLU C C 120 179.932 179.932 179.495 0.437 18112 11603 1 15 . 1 1 120 120 GLU CA C 120 59.150 59.150 59.198 -0.048 18112 11604 1 15 . 1 1 120 120 GLU CB C 120 28.878 28.878 29.462 -0.584 18112 11605 1 15 . 1 1 120 120 GLU H H 120 7.423 7.423 8.361 -0.938 18112 11606 1 15 . 1 1 121 121 VAL N N 121 120.777 120.777 120.304 0.473 18112 11607 1 15 . 1 1 121 121 VAL HA H 121 3.545 3.545 3.722 -0.177 18112 11608 1 15 . 1 1 121 121 VAL C C 121 179.302 179.302 177.907 1.395 18112 11609 1 15 . 1 1 121 121 VAL CA C 121 66.875 66.875 66.909 -0.034 18112 11610 1 15 . 1 1 121 121 VAL CB C 121 30.823 30.823 31.557 -0.734 18112 11611 1 15 . 1 1 121 121 VAL H H 121 8.313 8.313 8.225 0.088 18112 11612 1 15 . 1 1 122 122 ALA N N 122 127.029 127.029 121.493 5.536 18112 11613 1 15 . 1 1 122 122 ALA HA H 122 4.251 4.251 3.911 0.340 18112 11614 1 15 . 1 1 122 122 ALA C C 122 178.366 178.366 179.312 -0.946 18112 11615 1 15 . 1 1 122 122 ALA CA C 122 54.748 54.748 55.412 -0.664 18112 11616 1 15 . 1 1 122 122 ALA CB C 122 16.565 16.565 17.997 -1.432 18112 11617 1 15 . 1 1 122 122 ALA H H 122 8.896 8.896 7.895 1.001 18112 11618 1 15 . 1 1 123 123 GLN N N 123 119.887 119.887 119.530 0.357 18112 11619 1 15 . 1 1 123 123 GLN C C 123 177.908 177.908 178.551 -0.643 18112 11620 1 15 . 1 1 123 123 GLN CA C 123 60.671 60.671 59.026 1.645 18112 11621 1 15 . 1 1 123 123 GLN H H 123 8.349 8.349 7.789 0.560 18112 11622 1 15 . 1 1 124 124 ILE N N 124 120.632 120.632 118.448 2.184 18112 11623 1 15 . 1 1 124 124 ILE HA H 124 3.651 3.651 3.850 -0.199 18112 11624 1 15 . 1 1 124 124 ILE C C 124 178.703 178.703 178.215 0.488 18112 11625 1 15 . 1 1 124 124 ILE CA C 124 65.945 65.945 64.727 1.218 18112 11626 1 15 . 1 1 124 124 ILE H H 124 8.204 8.204 8.137 0.067 18112 11627 1 15 . 1 1 125 125 THR N N 125 115.084 115.084 116.693 -1.609 18112 11628 1 15 . 1 1 125 125 THR C C 125 175.568 175.568 176.481 -0.913 18112 11629 1 15 . 1 1 125 125 THR CA C 125 67.872 67.872 66.812 1.060 18112 11630 1 15 . 1 1 125 125 THR H H 125 8.399 8.399 8.301 0.098 18112 11631 1 15 . 1 1 126 126 LEU N N 126 125.011 125.011 122.419 2.592 18112 11632 1 15 . 1 1 126 126 LEU HA H 126 4.085 4.085 4.417 -0.332 18112 11633 1 15 . 1 1 126 126 LEU C C 126 178.559 178.559 178.064 0.495 18112 11634 1 15 . 1 1 126 126 LEU CA C 126 58.843 58.843 57.851 0.992 18112 11635 1 15 . 1 1 126 126 LEU CB C 126 41.421 41.421 41.729 -0.308 18112 11636 1 15 . 1 1 126 126 LEU H H 126 8.728 8.728 8.060 0.668 18112 11637 1 15 . 1 1 127 127 ARG N N 127 117.076 117.076 119.838 -2.762 18112 11638 1 15 . 1 1 127 127 ARG HA H 127 3.929 3.929 4.341 -0.412 18112 11639 1 15 . 1 1 127 127 ARG C C 127 177.984 177.984 178.395 -0.411 18112 11640 1 15 . 1 1 127 127 ARG CA C 127 60.685 60.685 60.131 0.554 18112 11641 1 15 . 1 1 127 127 ARG CB C 127 28.079 28.079 30.056 -1.977 18112 11642 1 15 . 1 1 127 127 ARG H H 127 8.213 8.213 8.462 -0.249 18112 11643 1 15 . 1 1 128 128 GLU N N 128 118.617 118.617 118.467 0.150 18112 11644 1 15 . 1 1 128 128 GLU HA H 128 4.147 4.147 3.934 0.213 18112 11645 1 15 . 1 1 128 128 GLU C C 128 181.150 181.150 179.110 2.040 18112 11646 1 15 . 1 1 128 128 GLU CA C 128 59.508 59.508 58.807 0.701 18112 11647 1 15 . 1 1 128 128 GLU H H 128 8.478 8.478 7.884 0.594 18112 11648 1 15 . 1 1 129 129 PHE N N 129 119.267 119.267 119.730 -0.463 18112 11649 1 15 . 1 1 129 129 PHE HA H 129 4.104 4.104 4.230 -0.126 18112 11650 1 15 . 1 1 129 129 PHE C C 129 177.170 177.170 177.845 -0.675 18112 11651 1 15 . 1 1 129 129 PHE CA C 129 63.694 63.694 62.339 1.355 18112 11652 1 15 . 1 1 129 129 PHE H H 129 8.570 8.570 8.388 0.182 18112 11653 1 15 . 1 1 130 130 PHE N N 130 118.739 118.739 118.024 0.715 18112 11654 1 15 . 1 1 130 130 PHE HA H 130 3.884 3.884 4.198 -0.314 18112 11655 1 15 . 1 1 130 130 PHE C C 130 175.860 175.860 177.082 -1.222 18112 11656 1 15 . 1 1 130 130 PHE CA C 130 62.819 62.819 61.051 1.768 18112 11657 1 15 . 1 1 130 130 PHE H H 130 8.740 8.740 8.596 0.144 18112 11658 1 15 . 1 1 131 131 ASN N N 131 116.028 116.028 118.905 -2.877 18112 11659 1 15 . 1 1 131 131 ASN HA H 131 4.373 4.373 3.683 0.690 18112 11660 1 15 . 1 1 131 131 ASN C C 131 178.228 178.228 177.311 0.917 18112 11661 1 15 . 1 1 131 131 ASN CA C 131 55.150 55.150 56.199 -1.049 18112 11662 1 15 . 1 1 131 131 ASN H H 131 8.864 8.864 7.945 0.919 18112 11663 1 15 . 1 1 132 132 ALA N N 132 120.922 120.922 122.133 -1.211 18112 11664 1 15 . 1 1 132 132 ALA HA H 132 4.020 4.020 4.051 -0.031 18112 11665 1 15 . 1 1 132 132 ALA C C 132 178.515 178.515 179.655 -1.140 18112 11666 1 15 . 1 1 132 132 ALA CA C 132 54.924 54.924 54.722 0.202 18112 11667 1 15 . 1 1 132 132 ALA CB C 132 18.441 18.441 18.143 0.298 18112 11668 1 15 . 1 1 132 132 ALA H H 132 7.745 7.745 7.747 -0.002 18112 11669 1 15 . 1 1 133 133 ILE N N 133 118.200 118.200 120.138 -1.938 18112 11670 1 15 . 1 1 133 133 ILE HA H 133 3.235 3.235 4.031 -0.796 18112 11671 1 15 . 1 1 133 133 ILE C C 133 180.606 180.606 178.059 2.547 18112 11672 1 15 . 1 1 133 133 ILE CA C 133 65.215 65.215 65.414 -0.199 18112 11673 1 15 . 1 1 133 133 ILE CB C 133 38.291 38.291 38.240 0.051 18112 11674 1 15 . 1 1 133 133 ILE H H 133 7.999 7.999 8.065 -0.066 18112 11675 1 15 . 1 1 134 134 ILE N N 134 122.564 122.564 119.650 2.914 18112 11676 1 15 . 1 1 134 134 ILE HA H 134 3.788 3.788 3.766 0.022 18112 11677 1 15 . 1 1 134 134 ILE C C 134 177.215 177.215 177.321 -0.106 18112 11678 1 15 . 1 1 134 134 ILE CA C 134 63.584 63.584 64.007 -0.423 18112 11679 1 15 . 1 1 134 134 ILE CB C 134 35.636 35.636 37.765 -2.129 18112 11680 1 15 . 1 1 134 134 ILE H H 134 8.670 8.670 8.110 0.560 18112 11681 1 15 . 1 1 135 135 ALA N N 135 119.989 119.989 121.031 -1.042 18112 11682 1 15 . 1 1 135 135 ALA HA H 135 4.357 4.357 4.152 0.205 18112 11683 1 15 . 1 1 135 135 ALA C C 135 177.786 177.786 178.406 -0.620 18112 11684 1 15 . 1 1 135 135 ALA CA C 135 51.521 51.521 53.618 -2.097 18112 11685 1 15 . 1 1 135 135 ALA CB C 135 18.839 18.839 19.783 -0.944 18112 11686 1 15 . 1 1 135 135 ALA H H 135 6.898 6.898 7.931 -1.033 18112 11687 1 15 . 1 1 136 136 GLY N N 136 107.682 107.682 104.362 3.320 18112 11688 1 15 . 1 1 136 136 GLY C C 136 176.324 176.324 175.248 1.076 18112 11689 1 15 . 1 1 136 136 GLY CA C 136 45.469 45.469 45.147 0.322 18112 11690 1 15 . 1 1 136 136 GLY H H 136 7.913 7.913 7.997 -0.084 18112 11691 1 15 . 1 1 137 137 LYS N N 137 117.213 117.213 120.879 -3.666 18112 11692 1 15 . 1 1 137 137 LYS HA H 137 4.004 4.004 4.477 -0.473 18112 11693 1 15 . 1 1 137 137 LYS C C 137 176.616 176.616 176.702 -0.086 18112 11694 1 15 . 1 1 137 137 LYS CA C 137 57.499 57.499 56.002 1.496 18112 11695 1 15 . 1 1 137 137 LYS CB C 137 30.927 30.927 32.648 -1.722 18112 11696 1 15 . 1 1 137 137 LYS H H 137 8.312 8.312 8.518 -0.206 18112 11697 1 15 . 1 1 138 138 ASP N N 138 113.545 113.545 120.381 -6.836 18112 11698 1 15 . 1 1 138 138 ASP HA H 138 3.061 3.061 4.241 -1.180 18112 11699 1 15 . 1 1 138 138 ASP C C 138 174.698 174.698 176.111 -1.413 18112 11700 1 15 . 1 1 138 138 ASP CA C 138 53.694 53.694 54.428 -0.734 18112 11701 1 15 . 1 1 138 138 ASP CB C 138 36.008 36.008 38.827 -2.819 18112 11702 1 15 . 1 1 138 138 ASP H H 138 8.465 8.465 8.461 0.004 18112 11703 1 15 . 1 1 139 139 VAL N N 139 115.191 115.191 116.127 -0.936 18112 11704 1 15 . 1 1 139 139 VAL HA H 139 3.886 3.886 4.263 -0.377 18112 11705 1 15 . 1 1 139 139 VAL C C 139 175.889 175.889 175.168 0.721 18112 11706 1 15 . 1 1 139 139 VAL CA C 139 62.793 62.793 60.904 1.889 18112 11707 1 15 . 1 1 139 139 VAL CB C 139 30.662 30.662 32.666 -2.004 18112 11708 1 15 . 1 1 139 139 VAL H H 139 6.610 6.610 8.078 -1.468 18112 11709 1 15 . 1 1 140 140 ASP N N 140 123.363 123.363 119.064 4.299 18112 11710 1 15 . 1 1 140 140 ASP C C 140 175.234 175.234 174.855 0.379 18112 11711 1 15 . 1 1 140 140 ASP CA C 140 50.221 50.221 56.844 -6.623 18112 11712 1 15 . 1 1 140 140 ASP CB C 140 42.254 42.254 38.947 3.307 18112 11713 1 15 . 1 1 140 140 ASP H H 140 7.553 7.553 7.798 -0.245 18112 11714 1 15 . 1 1 141 141 PRO HA H 141 4.682 4.682 4.271 0.411 18112 11715 1 15 . 1 1 141 141 PRO C C 141 178.678 178.678 178.471 0.207 18112 11716 1 15 . 1 1 141 141 PRO CA C 141 64.532 64.532 65.308 -0.776 18112 11717 1 15 . 1 1 141 141 PRO CB C 141 31.331 31.331 31.483 -0.152 18112 11718 1 15 . 1 1 142 142 SER N N 142 114.421 114.421 113.434 0.987 18112 11719 1 15 . 1 1 142 142 SER HA H 142 4.565 4.565 4.304 0.261 18112 11720 1 15 . 1 1 142 142 SER C C 142 176.524 176.524 176.930 -0.406 18112 11721 1 15 . 1 1 142 142 SER CA C 142 58.711 58.711 60.285 -1.574 18112 11722 1 15 . 1 1 142 142 SER CB C 142 62.783 62.783 62.184 0.599 18112 11723 1 15 . 1 1 142 142 SER H H 142 8.703 8.703 8.394 0.309 18112 11724 1 15 . 1 1 143 143 TRP N N 143 123.598 123.598 123.030 0.568 18112 11725 1 15 . 1 1 143 143 TRP HA H 143 4.136 4.136 4.074 0.062 18112 11726 1 15 . 1 1 143 143 TRP C C 143 177.113 177.113 177.961 -0.848 18112 11727 1 15 . 1 1 143 143 TRP CA C 143 59.803 59.803 61.444 -1.641 18112 11728 1 15 . 1 1 143 143 TRP CB C 143 26.364 26.364 29.037 -2.672 18112 11729 1 15 . 1 1 143 143 TRP H H 143 8.374 8.374 7.829 0.545 18112 11730 1 15 . 1 1 144 144 LYS N N 144 119.293 119.293 118.261 1.032 18112 11731 1 15 . 1 1 144 144 LYS HA H 144 2.719 2.719 3.502 -0.783 18112 11732 1 15 . 1 1 144 144 LYS C C 144 177.243 177.243 177.827 -0.584 18112 11733 1 15 . 1 1 144 144 LYS CA C 144 58.851 58.851 59.378 -0.527 18112 11734 1 15 . 1 1 144 144 LYS CB C 144 29.373 29.373 31.119 -1.746 18112 11735 1 15 . 1 1 144 144 LYS H H 144 7.196 7.196 8.459 -1.263 18112 11736 1 15 . 1 1 145 145 LYS N N 145 116.440 116.440 119.279 -2.839 18112 11737 1 15 . 1 1 145 145 LYS HA H 145 3.490 3.490 4.042 -0.552 18112 11738 1 15 . 1 1 145 145 LYS C C 145 179.149 179.149 178.905 0.244 18112 11739 1 15 . 1 1 145 145 LYS CA C 145 59.271 59.271 58.777 0.494 18112 11740 1 15 . 1 1 145 145 LYS CB C 145 30.521 30.521 31.613 -1.092 18112 11741 1 15 . 1 1 145 145 LYS H H 145 7.389 7.389 7.735 -0.346 18112 11742 1 15 . 1 1 146 146 ALA N N 146 118.582 118.582 123.099 -4.517 18112 11743 1 15 . 1 1 146 146 ALA HA H 146 3.932 3.932 4.004 -0.072 18112 11744 1 15 . 1 1 146 146 ALA C C 146 179.968 179.968 179.668 0.300 18112 11745 1 15 . 1 1 146 146 ALA CA C 146 54.241 54.241 54.866 -0.625 18112 11746 1 15 . 1 1 146 146 ALA CB C 146 17.689 17.689 18.226 -0.537 18112 11747 1 15 . 1 1 146 146 ALA H H 146 7.112 7.112 8.151 -1.039 18112 11748 1 15 . 1 1 147 147 ILE N N 147 118.537 118.537 118.783 -0.246 18112 11749 1 15 . 1 1 147 147 ILE HA H 147 3.642 3.642 3.539 0.103 18112 11750 1 15 . 1 1 147 147 ILE C C 147 178.919 178.919 178.177 0.742 18112 11751 1 15 . 1 1 147 147 ILE CA C 147 64.418 64.418 63.443 0.975 18112 11752 1 15 . 1 1 147 147 ILE CB C 147 36.519 36.519 36.404 0.115 18112 11753 1 15 . 1 1 147 147 ILE H H 147 6.734 6.734 7.823 -1.089 18112 11754 1 15 . 1 1 148 148 TYR N N 148 121.033 121.033 118.955 2.078 18112 11755 1 15 . 1 1 148 148 TYR HA H 148 4.489 4.489 4.150 0.339 18112 11756 1 15 . 1 1 148 148 TYR C C 148 178.348 178.348 178.551 -0.203 18112 11757 1 15 . 1 1 148 148 TYR CA C 148 57.389 57.389 59.525 -2.136 18112 11758 1 15 . 1 1 148 148 TYR CB C 148 35.280 35.280 36.745 -1.465 18112 11759 1 15 . 1 1 148 148 TYR H H 148 8.126 8.126 8.161 -0.035 18112 11760 1 15 . 1 1 149 149 LYS N N 149 114.484 114.484 119.326 -4.842 18112 11761 1 15 . 1 1 149 149 LYS C C 149 178.051 178.051 178.892 -0.841 18112 11762 1 15 . 1 1 149 149 LYS CA C 149 59.036 59.036 59.706 -0.670 18112 11763 1 15 . 1 1 149 149 LYS CB C 149 31.575 31.575 32.458 -0.883 18112 11764 1 15 . 1 1 149 149 LYS H H 149 7.364 7.364 7.958 -0.594 18112 11765 1 15 . 1 1 150 150 VAL N N 150 117.812 117.812 117.342 0.470 18112 11766 1 15 . 1 1 150 150 VAL HA H 150 3.770 3.770 3.790 -0.020 18112 11767 1 15 . 1 1 150 150 VAL C C 150 178.786 178.786 177.369 1.417 18112 11768 1 15 . 1 1 150 150 VAL CA C 150 65.070 65.070 65.647 -0.577 18112 11769 1 15 . 1 1 150 150 VAL CB C 150 29.515 29.515 31.194 -1.679 18112 11770 1 15 . 1 1 150 150 VAL H H 150 7.254 7.254 7.905 -0.651 18112 11771 1 15 . 1 1 151 151 ILE N N 151 117.884 117.884 112.912 4.972 18112 11772 1 15 . 1 1 151 151 ILE C C 151 180.539 180.539 177.208 3.331 18112 11773 1 15 . 1 1 151 151 ILE CA C 151 61.490 61.490 62.820 -1.330 18112 11774 1 15 . 1 1 151 151 ILE CB C 151 33.994 33.994 38.863 -4.869 18112 11775 1 15 . 1 1 151 151 ILE H H 151 8.154 8.154 7.836 0.318 18112 11776 1 15 . 1 1 152 152 CYS N N 152 118.649 118.649 121.342 -2.693 18112 11777 1 15 . 1 1 152 152 CYS HA H 152 4.153 4.153 4.171 -0.018 18112 11778 1 15 . 1 1 152 152 CYS C C 152 174.888 174.888 176.509 -1.621 18112 11779 1 15 . 1 1 152 152 CYS CA C 152 61.052 61.052 61.370 -0.318 18112 11780 1 15 . 1 1 152 152 CYS CB C 152 36.364 36.364 27.037 9.328 18112 11781 1 15 . 1 1 152 152 CYS H H 152 8.711 8.711 8.201 0.510 18112 11782 1 15 . 1 1 153 153 LYS N N 153 118.498 118.498 118.190 0.308 18112 11783 1 15 . 1 1 153 153 LYS C C 153 177.389 177.389 177.253 0.136 18112 11784 1 15 . 1 1 153 153 LYS CA C 153 56.243 56.243 57.994 -1.751 18112 11785 1 15 . 1 1 153 153 LYS CB C 153 31.343 31.343 32.286 -0.943 18112 11786 1 15 . 1 1 153 153 LYS H H 153 6.782 6.782 7.902 -1.120 18112 11787 1 15 . 1 1 154 154 LEU N N 154 117.318 117.318 117.301 0.017 18112 11788 1 15 . 1 1 154 154 LEU HA H 154 4.576 4.576 4.497 0.079 18112 11789 1 15 . 1 1 154 154 LEU C C 154 177.161 177.161 177.006 0.155 18112 11790 1 15 . 1 1 154 154 LEU CA C 154 53.782 53.782 54.486 -0.704 18112 11791 1 15 . 1 1 154 154 LEU CB C 154 40.881 40.881 43.173 -2.292 18112 11792 1 15 . 1 1 154 154 LEU H H 154 7.616 7.616 7.400 0.216 18112 11793 1 15 . 1 1 155 155 ASP N N 155 121.564 121.564 119.382 2.182 18112 11794 1 15 . 1 1 155 155 ASP C C 155 177.094 177.094 175.835 1.259 18112 11795 1 15 . 1 1 155 155 ASP CA C 155 55.732 55.732 54.785 0.947 18112 11796 1 15 . 1 1 155 155 ASP CB C 155 40.139 40.139 41.561 -1.422 18112 11797 1 15 . 1 1 155 155 ASP H H 155 7.582 7.582 7.573 0.009 18112 11798 1 15 . 1 1 156 156 SER N N 156 117.352 117.352 114.256 3.096 18112 11799 1 15 . 1 1 156 156 SER HA H 156 4.818 4.818 4.587 0.231 18112 11800 1 15 . 1 1 156 156 SER C C 156 173.409 173.409 174.090 -0.681 18112 11801 1 15 . 1 1 156 156 SER CA C 156 57.073 57.073 58.850 -1.777 18112 11802 1 15 . 1 1 156 156 SER CB C 156 65.150 65.150 65.216 -0.066 18112 11803 1 15 . 1 1 156 156 SER H H 156 8.846 8.846 8.791 0.055 18112 11804 1 15 . 1 1 157 157 GLU N N 157 120.688 120.688 117.938 2.750 18112 11805 1 15 . 1 1 157 157 GLU HA H 157 4.038 4.038 4.366 -0.328 18112 11806 1 15 . 1 1 157 157 GLU C C 157 176.332 176.332 174.480 1.852 18112 11807 1 15 . 1 1 157 157 GLU CA C 157 56.464 56.464 55.833 0.631 18112 11808 1 15 . 1 1 157 157 GLU CB C 157 29.206 29.206 30.262 -1.056 18112 11809 1 15 . 1 1 157 157 GLU H H 157 8.356 8.356 7.869 0.487 18112 11810 1 15 . 1 1 158 158 VAL N N 158 126.906 126.906 115.565 11.341 18112 11811 1 15 . 1 1 158 158 VAL HA H 158 3.449 3.449 4.430 -0.981 18112 11812 1 15 . 1 1 158 158 VAL C C 158 176.382 176.382 174.298 2.084 18112 11813 1 15 . 1 1 158 158 VAL CA C 158 59.584 59.584 59.591 -0.007 18112 11814 1 15 . 1 1 158 158 VAL CB C 158 31.160 31.160 31.634 -0.474 18112 11815 1 15 . 1 1 158 158 VAL H H 158 8.561 8.561 8.318 0.243 18112 11816 1 15 . 1 1 159 159 PRO HA H 159 4.403 4.403 4.302 0.101 18112 11817 1 15 . 1 1 159 159 PRO C C 159 176.757 176.757 175.804 0.953 18112 11818 1 15 . 1 1 159 159 PRO CA C 159 63.845 63.845 62.344 1.501 18112 11819 1 15 . 1 1 159 159 PRO CB C 159 32.106 32.106 31.120 0.986 18112 11820 1 15 . 1 1 160 160 GLU N N 160 122.904 122.904 121.155 1.749 18112 11821 1 15 . 1 1 160 160 GLU HA H 160 4.008 4.008 3.818 0.190 18112 11822 1 15 . 1 1 160 160 GLU C C 160 179.132 179.132 175.641 3.491 18112 11823 1 15 . 1 1 160 160 GLU CA C 160 59.407 59.407 58.834 0.573 18112 11824 1 15 . 1 1 160 160 GLU CB C 160 28.991 28.991 29.967 -0.976 18112 11825 1 15 . 1 1 160 160 GLU H H 160 8.650 8.650 8.407 0.243 18112 11826 1 15 . 1 1 161 161 ILE N N 161 119.782 119.782 117.667 2.115 18112 11827 1 15 . 1 1 161 161 ILE HA H 161 4.146 4.146 4.212 -0.066 18112 11828 1 15 . 1 1 161 161 ILE C C 161 176.176 176.176 174.977 1.199 18112 11829 1 15 . 1 1 161 161 ILE CA C 161 62.034 62.034 60.232 1.802 18112 11830 1 15 . 1 1 161 161 ILE CB C 161 37.113 37.113 38.400 -1.286 18112 11831 1 15 . 1 1 161 161 ILE H H 161 8.448 8.448 7.570 0.878 18112 11832 1 15 . 1 1 162 162 PHE N N 162 117.594 117.594 125.918 -8.324 18112 11833 1 15 . 1 1 162 162 PHE C C 162 176.115 176.115 177.335 -1.220 18112 11834 1 15 . 1 1 162 162 PHE CA C 162 61.009 61.009 60.770 0.239 18112 11835 1 15 . 1 1 162 162 PHE CB C 162 38.394 38.394 39.250 -0.856 18112 11836 1 15 . 1 1 162 162 PHE H H 162 8.145 8.145 8.832 -0.687 18112 11837 1 15 . 1 1 163 163 LYS N N 163 116.083 116.083 119.025 -2.942 18112 11838 1 15 . 1 1 163 163 LYS C C 163 178.196 178.196 177.142 1.054 18112 11839 1 15 . 1 1 163 163 LYS CA C 163 58.136 58.136 58.438 -0.302 18112 11840 1 15 . 1 1 163 163 LYS CB C 163 31.694 31.694 32.812 -1.118 18112 11841 1 15 . 1 1 163 163 LYS H H 163 8.232 8.232 8.096 0.136 18112 11842 1 15 . 1 1 164 164 SER N N 164 113.680 113.680 112.197 1.483 18112 11843 1 15 . 1 1 164 164 SER CA C 164 55.205 55.205 56.023 -0.818 18112 11844 1 15 . 1 1 164 164 SER CB C 164 63.265 63.265 63.789 -0.524 18112 11845 1 15 . 1 1 164 164 SER H H 164 7.708 7.708 7.791 -0.083 18112 11846 1 15 . 1 1 165 165 PRO HA H 165 4.580 4.580 4.496 0.084 18112 11847 1 15 . 1 1 165 165 PRO C C 165 177.541 177.541 176.907 0.634 18112 11848 1 15 . 1 1 165 165 PRO CA C 165 63.950 63.950 64.777 -0.827 18112 11849 1 15 . 1 1 165 165 PRO CB C 165 30.686 30.686 32.194 -1.508 18112 11850 1 15 . 1 1 166 166 ASN N N 166 116.304 116.304 113.154 3.150 18112 11851 1 15 . 1 1 166 166 ASN HA H 166 5.029 5.029 4.847 0.182 18112 11852 1 15 . 1 1 166 166 ASN C C 166 175.811 175.811 176.438 -0.627 18112 11853 1 15 . 1 1 166 166 ASN CA C 166 51.962 51.962 53.513 -1.551 18112 11854 1 15 . 1 1 166 166 ASN CB C 166 37.915 37.915 38.955 -1.040 18112 11855 1 15 . 1 1 166 166 ASN H H 166 8.216 8.216 8.469 -0.253 18112 11856 1 15 . 1 1 167 167 CYS N N 167 116.078 116.078 121.238 -5.160 18112 11857 1 15 . 1 1 167 167 CYS HA H 167 4.011 4.011 4.349 -0.338 18112 11858 1 15 . 1 1 167 167 CYS C C 167 175.057 175.057 175.972 -0.915 18112 11859 1 15 . 1 1 167 167 CYS CA C 167 59.816 59.816 60.743 -0.927 18112 11860 1 15 . 1 1 167 167 CYS CB C 167 27.446 27.446 26.986 0.460 18112 11861 1 15 . 1 1 167 167 CYS H H 167 7.246 7.246 7.972 -0.726 18112 11862 1 15 . 1 1 168 168 LEU N N 168 120.082 120.082 121.383 -1.301 18112 11863 1 15 . 1 1 168 168 LEU HA H 168 3.880 3.880 4.171 -0.291 18112 11864 1 15 . 1 1 168 168 LEU C C 168 178.541 178.541 177.674 0.867 18112 11865 1 15 . 1 1 168 168 LEU CA C 168 57.734 57.734 56.767 0.967 18112 11866 1 15 . 1 1 168 168 LEU CB C 168 38.825 38.825 39.984 -1.159 18112 11867 1 15 . 1 1 168 168 LEU H H 168 8.451 8.451 7.912 0.539 18112 11868 1 15 . 1 1 169 169 GLN N N 169 116.700 116.700 119.508 -2.808 18112 11869 1 15 . 1 1 169 169 GLN HA H 169 4.064 4.064 3.982 0.082 18112 11870 1 15 . 1 1 169 169 GLN C C 169 177.378 177.378 177.474 -0.096 18112 11871 1 15 . 1 1 169 169 GLN CA C 169 57.675 57.675 58.781 -1.106 18112 11872 1 15 . 1 1 169 169 GLN CB C 169 27.710 27.710 28.548 -0.838 18112 11873 1 15 . 1 1 169 169 GLN H H 169 7.665 7.665 7.583 0.082 18112 11874 1 15 . 1 1 170 170 GLU N N 170 116.701 116.701 115.507 1.194 18112 11875 1 15 . 1 1 170 170 GLU HA H 170 4.214 4.214 4.237 -0.023 18112 11876 1 15 . 1 1 170 170 GLU C C 170 177.730 177.730 177.868 -0.138 18112 11877 1 15 . 1 1 170 170 GLU CA C 170 56.899 56.899 56.674 0.225 18112 11878 1 15 . 1 1 170 170 GLU H H 170 7.405 7.405 7.812 -0.407 18112 11879 1 15 . 1 1 171 171 LEU N N 171 118.021 118.021 118.941 -0.920 18112 11880 1 15 . 1 1 171 171 LEU HA H 171 4.209 4.209 4.162 0.047 18112 11881 1 15 . 1 1 171 171 LEU C C 171 177.005 177.005 178.295 -1.290 18112 11882 1 15 . 1 1 171 171 LEU CA C 171 55.870 55.870 57.063 -1.193 18112 11883 1 15 . 1 1 171 171 LEU CB C 171 43.680 43.680 42.288 1.392 18112 11884 1 15 . 1 1 171 171 LEU H H 171 7.823 7.823 7.665 0.158 18112 11885 1 15 . 1 1 172 172 LEU N N 172 117.580 117.580 114.861 2.719 18112 11886 1 15 . 1 1 172 172 LEU HA H 172 4.571 4.571 4.457 0.114 18112 11887 1 15 . 1 1 172 172 LEU C C 172 176.411 176.411 175.857 0.554 18112 11888 1 15 . 1 1 172 172 LEU CA C 172 53.972 53.972 54.551 -0.579 18112 11889 1 15 . 1 1 172 172 LEU CB C 172 40.483 40.483 39.574 0.909 18112 11890 1 15 . 1 1 172 172 LEU H H 172 7.306 7.306 7.477 -0.171 18112 11891 1 15 . 1 1 173 173 HIS N N 173 123.310 123.310 120.753 2.557 18112 11892 1 15 . 1 1 173 173 HIS C C 173 179.022 179.022 173.921 5.101 18112 11893 1 15 . 1 1 173 173 HIS CA C 173 56.693 56.693 55.713 0.980 18112 11894 1 15 . 1 1 173 173 HIS CB C 173 29.371 29.371 32.853 -3.482 18112 11895 1 15 . 1 1 173 173 HIS H H 173 8.028 8.028 7.852 0.176 18112 11896 1 16 . 1 1 12 12 ALA N N 12 125.167 125.167 128.665 -3.498 18112 11897 1 16 . 1 1 12 12 ALA C C 12 177.566 177.566 176.143 1.423 18112 11898 1 16 . 1 1 12 12 ALA CA C 12 52.067 52.067 50.726 1.341 18112 11899 1 16 . 1 1 12 12 ALA CB C 12 18.456 18.456 20.556 -2.100 18112 11900 1 16 . 1 1 12 12 ALA H H 12 8.311 8.311 7.815 0.496 18112 11901 1 16 . 1 1 13 13 MET N N 13 119.278 119.278 119.410 -0.132 18112 11902 1 16 . 1 1 13 13 MET C C 13 176.325 176.325 176.768 -0.443 18112 11903 1 16 . 1 1 13 13 MET CA C 13 54.992 54.992 54.941 0.052 18112 11904 1 16 . 1 1 13 13 MET CB C 13 32.308 32.308 32.465 -0.157 18112 11905 1 16 . 1 1 13 13 MET H H 13 8.269 8.269 8.295 -0.026 18112 11906 1 16 . 1 1 14 14 GLN N N 14 120.869 120.869 125.336 -4.467 18112 11907 1 16 . 1 1 14 14 GLN HA H 14 4.399 4.399 4.285 0.114 18112 11908 1 16 . 1 1 14 14 GLN C C 14 175.644 175.644 174.739 0.905 18112 11909 1 16 . 1 1 14 14 GLN CA C 14 55.139 55.139 55.507 -0.368 18112 11910 1 16 . 1 1 14 14 GLN CB C 14 29.051 29.051 26.628 2.423 18112 11911 1 16 . 1 1 14 14 GLN H H 14 8.501 8.501 8.973 -0.472 18112 11912 1 16 . 1 1 15 15 GLU N N 15 122.042 122.042 120.373 1.669 18112 11913 1 16 . 1 1 15 15 GLU C C 15 176.242 176.242 176.463 -0.221 18112 11914 1 16 . 1 1 15 15 GLU CA C 15 56.064 56.064 55.972 0.092 18112 11915 1 16 . 1 1 15 15 GLU CB C 15 29.302 29.302 28.921 0.381 18112 11916 1 16 . 1 1 15 15 GLU H H 15 8.547 8.547 7.702 0.845 18112 11917 1 16 . 1 1 16 16 GLY N N 16 108.821 108.821 112.151 -3.330 18112 11918 1 16 . 1 1 16 16 GLY C C 16 172.949 172.949 173.907 -0.958 18112 11919 1 16 . 1 1 16 16 GLY CA C 16 44.227 44.227 45.188 -0.961 18112 11920 1 16 . 1 1 16 16 GLY H H 16 8.100 8.100 8.408 -0.308 18112 11921 1 16 . 1 1 17 17 LEU N N 17 120.315 120.315 120.694 -0.379 18112 11922 1 16 . 1 1 17 17 LEU C C 17 177.334 177.334 177.953 -0.619 18112 11923 1 16 . 1 1 17 17 LEU CA C 17 53.544 53.544 53.933 -0.389 18112 11924 1 16 . 1 1 17 17 LEU CB C 17 42.140 42.140 42.893 -0.753 18112 11925 1 16 . 1 1 17 17 LEU H H 17 8.222 8.222 7.542 0.680 18112 11926 1 16 . 1 1 18 18 SER N N 18 126.547 126.547 117.065 9.482 18112 11927 1 16 . 1 1 18 18 SER CA C 18 56.851 56.851 60.845 -3.994 18112 11928 1 16 . 1 1 18 18 SER CB C 18 64.636 64.636 62.258 2.378 18112 11929 1 16 . 1 1 18 18 SER H H 18 11.627 11.627 7.936 3.691 18112 11930 1 16 . 1 1 19 19 PRO C C 19 175.118 175.118 176.723 -1.605 18112 11931 1 16 . 1 1 20 20 ASN N N 20 121.372 121.372 118.936 2.436 18112 11932 1 16 . 1 1 20 20 ASN H H 20 8.172 8.172 8.603 -0.431 18112 11933 1 16 . 1 1 25 25 ALA CB C 25 18.020 18.020 18.436 -0.416 18112 11934 1 16 . 1 1 26 26 LYS N N 26 118.490 118.490 119.481 -0.991 18112 11935 1 16 . 1 1 26 26 LYS CA C 26 56.146 56.146 58.406 -2.260 18112 11936 1 16 . 1 1 26 26 LYS H H 26 6.794 6.794 7.836 -1.042 18112 11937 1 16 . 1 1 31 31 TYR HA H 31 4.398 4.398 3.869 0.529 18112 11938 1 16 . 1 1 31 31 TYR C C 31 173.714 173.714 173.412 0.302 18112 11939 1 16 . 1 1 31 31 TYR CA C 31 59.757 59.757 56.566 3.191 18112 11940 1 16 . 1 1 32 32 THR N N 32 111.928 111.928 112.262 -0.334 18112 11941 1 16 . 1 1 32 32 THR HA H 32 4.209 4.209 4.430 -0.221 18112 11942 1 16 . 1 1 32 32 THR C C 32 171.061 171.061 174.252 -3.191 18112 11943 1 16 . 1 1 32 32 THR CA C 32 56.905 56.905 61.952 -5.047 18112 11944 1 16 . 1 1 32 32 THR CB C 32 69.707 69.707 69.851 -0.144 18112 11945 1 16 . 1 1 32 32 THR H H 32 8.237 8.237 7.533 0.704 18112 11946 1 16 . 1 1 33 33 ARG N N 33 124.856 124.856 123.901 0.955 18112 11947 1 16 . 1 1 33 33 ARG C C 33 176.451 176.451 175.180 1.271 18112 11948 1 16 . 1 1 33 33 ARG CA C 33 55.627 55.627 56.749 -1.122 18112 11949 1 16 . 1 1 33 33 ARG CB C 33 29.861 29.861 31.140 -1.279 18112 11950 1 16 . 1 1 33 33 ARG H H 33 9.159 9.159 8.546 0.613 18112 11951 1 16 . 1 1 34 34 TYR N N 34 117.908 117.908 118.600 -0.692 18112 11952 1 16 . 1 1 34 34 TYR CA C 34 55.320 55.320 57.219 -1.899 18112 11953 1 16 . 1 1 34 34 TYR H H 34 8.995 8.995 8.444 0.551 18112 11954 1 16 . 1 1 35 35 PRO C C 35 177.280 177.280 177.417 -0.137 18112 11955 1 16 . 1 1 36 36 SER N N 36 116.410 116.410 119.093 -2.683 18112 11956 1 16 . 1 1 36 36 SER C C 36 178.938 178.938 176.426 2.512 18112 11957 1 16 . 1 1 36 36 SER CA C 36 64.815 64.815 61.709 3.106 18112 11958 1 16 . 1 1 36 36 SER H H 36 8.106 8.106 8.688 -0.582 18112 11959 1 16 . 1 1 37 37 SER N N 37 117.488 117.488 117.882 -0.394 18112 11960 1 16 . 1 1 37 37 SER C C 37 177.698 177.698 176.864 0.834 18112 11961 1 16 . 1 1 37 37 SER CA C 37 61.357 61.357 61.122 0.235 18112 11962 1 16 . 1 1 37 37 SER CB C 37 68.118 68.118 62.520 5.598 18112 11963 1 16 . 1 1 37 37 SER H H 37 8.169 8.169 8.272 -0.103 18112 11964 1 16 . 1 1 38 38 ASN N N 38 115.638 115.638 121.246 -5.608 18112 11965 1 16 . 1 1 38 38 ASN HA H 38 4.259 4.259 4.329 -0.070 18112 11966 1 16 . 1 1 38 38 ASN C C 38 177.868 177.868 177.492 0.376 18112 11967 1 16 . 1 1 38 38 ASN CA C 38 55.907 55.907 55.809 0.098 18112 11968 1 16 . 1 1 38 38 ASN CB C 38 37.230 37.230 38.481 -1.251 18112 11969 1 16 . 1 1 38 38 ASN H H 38 8.284 8.284 7.791 0.493 18112 11970 1 16 . 1 1 39 39 MET N N 39 121.352 121.352 119.877 1.475 18112 11971 1 16 . 1 1 39 39 MET HA H 39 4.170 4.170 3.729 0.441 18112 11972 1 16 . 1 1 39 39 MET C C 39 179.068 179.068 177.925 1.143 18112 11973 1 16 . 1 1 39 39 MET CA C 39 58.751 58.751 58.154 0.597 18112 11974 1 16 . 1 1 39 39 MET CB C 39 31.850 31.850 31.804 0.046 18112 11975 1 16 . 1 1 39 39 MET H H 39 7.857 7.857 7.511 0.346 18112 11976 1 16 . 1 1 40 40 LEU N N 40 118.936 118.936 120.158 -1.222 18112 11977 1 16 . 1 1 40 40 LEU HA H 40 4.139 4.139 4.433 -0.294 18112 11978 1 16 . 1 1 40 40 LEU C C 40 178.700 178.700 178.858 -0.158 18112 11979 1 16 . 1 1 40 40 LEU CA C 40 58.455 58.455 58.909 -0.454 18112 11980 1 16 . 1 1 40 40 LEU CB C 40 40.304 40.304 41.769 -1.465 18112 11981 1 16 . 1 1 40 40 LEU H H 40 8.167 8.167 8.253 -0.086 18112 11982 1 16 . 1 1 41 41 LYS N N 41 116.791 116.791 117.223 -0.432 18112 11983 1 16 . 1 1 41 41 LYS HA H 41 3.475 3.475 4.026 -0.551 18112 11984 1 16 . 1 1 41 41 LYS C C 41 178.793 178.793 178.308 0.485 18112 11985 1 16 . 1 1 41 41 LYS CA C 41 59.161 59.161 58.108 1.052 18112 11986 1 16 . 1 1 41 41 LYS CB C 41 30.992 30.992 31.909 -0.917 18112 11987 1 16 . 1 1 41 41 LYS H H 41 7.632 7.632 8.007 -0.375 18112 11988 1 16 . 1 1 42 42 THR N N 42 112.819 112.819 114.889 -2.070 18112 11989 1 16 . 1 1 42 42 THR HA H 42 4.230 4.230 4.148 0.082 18112 11990 1 16 . 1 1 42 42 THR C C 42 176.142 176.142 176.190 -0.048 18112 11991 1 16 . 1 1 42 42 THR CA C 42 65.107 65.107 65.779 -0.672 18112 11992 1 16 . 1 1 42 42 THR CB C 42 68.306 68.306 68.843 -0.537 18112 11993 1 16 . 1 1 42 42 THR H H 42 7.469 7.469 7.816 -0.347 18112 11994 1 16 . 1 1 43 43 TYR N N 43 118.565 118.565 118.438 0.127 18112 11995 1 16 . 1 1 43 43 TYR HA H 43 4.204 4.204 4.459 -0.255 18112 11996 1 16 . 1 1 43 43 TYR C C 43 174.240 174.240 176.975 -2.735 18112 11997 1 16 . 1 1 43 43 TYR CA C 43 60.886 60.886 57.591 3.295 18112 11998 1 16 . 1 1 43 43 TYR CB C 43 38.165 38.165 38.602 -0.437 18112 11999 1 16 . 1 1 43 43 TYR H H 43 7.978 7.978 7.485 0.493 18112 12000 1 16 . 1 1 44 44 PHE N N 44 120.980 120.980 119.357 1.623 18112 12001 1 16 . 1 1 44 44 PHE HA H 44 4.920 4.920 4.789 0.131 18112 12002 1 16 . 1 1 44 44 PHE C C 44 176.436 176.436 176.207 0.229 18112 12003 1 16 . 1 1 44 44 PHE CA C 44 56.672 56.672 58.232 -1.560 18112 12004 1 16 . 1 1 44 44 PHE CB C 44 36.570 36.570 37.108 -0.538 18112 12005 1 16 . 1 1 44 44 PHE H H 44 7.955 7.955 8.045 -0.090 18112 12006 1 16 . 1 1 45 45 SER N N 45 113.407 113.407 117.742 -4.335 18112 12007 1 16 . 1 1 45 45 SER HA H 45 4.373 4.373 4.580 -0.207 18112 12008 1 16 . 1 1 45 45 SER C C 45 174.424 174.424 175.283 -0.859 18112 12009 1 16 . 1 1 45 45 SER CA C 45 61.037 61.037 59.603 1.434 18112 12010 1 16 . 1 1 45 45 SER CB C 45 62.711 62.711 63.858 -1.147 18112 12011 1 16 . 1 1 45 45 SER H H 45 7.932 7.932 8.178 -0.246 18112 12012 1 16 . 1 1 46 46 ASP N N 46 118.099 118.099 120.302 -2.203 18112 12013 1 16 . 1 1 46 46 ASP HA H 46 4.572 4.572 4.512 0.060 18112 12014 1 16 . 1 1 46 46 ASP C C 46 174.866 174.866 175.813 -0.947 18112 12015 1 16 . 1 1 46 46 ASP CA C 46 53.602 53.602 55.145 -1.543 18112 12016 1 16 . 1 1 46 46 ASP CB C 46 38.992 38.992 40.694 -1.702 18112 12017 1 16 . 1 1 46 46 ASP H H 46 9.889 9.889 8.787 1.102 18112 12018 1 16 . 1 1 47 47 VAL N N 47 121.496 121.496 119.749 1.747 18112 12019 1 16 . 1 1 47 47 VAL HA H 47 4.058 4.058 3.724 0.334 18112 12020 1 16 . 1 1 47 47 VAL C C 47 174.676 174.676 175.121 -0.445 18112 12021 1 16 . 1 1 47 47 VAL CA C 47 61.006 61.006 61.631 -0.625 18112 12022 1 16 . 1 1 47 47 VAL CB C 47 32.110 32.110 31.219 0.891 18112 12023 1 16 . 1 1 47 47 VAL H H 47 7.781 7.781 7.356 0.424 18112 12024 1 16 . 1 1 48 48 LYS N N 48 126.100 126.100 128.042 -1.942 18112 12025 1 16 . 1 1 48 48 LYS HA H 48 4.402 4.402 4.137 0.265 18112 12026 1 16 . 1 1 48 48 LYS C C 48 175.564 175.564 176.601 -1.037 18112 12027 1 16 . 1 1 48 48 LYS CA C 48 54.874 54.874 57.625 -2.751 18112 12028 1 16 . 1 1 48 48 LYS CB C 48 30.189 30.189 33.067 -2.878 18112 12029 1 16 . 1 1 48 48 LYS H H 48 8.245 8.245 8.578 -0.333 18112 12030 1 16 . 1 1 49 49 PHE N N 49 125.341 125.341 114.258 11.083 18112 12031 1 16 . 1 1 49 49 PHE HA H 49 3.813 3.813 4.161 -0.348 18112 12032 1 16 . 1 1 49 49 PHE C C 49 175.708 175.708 174.421 1.287 18112 12033 1 16 . 1 1 49 49 PHE CA C 49 60.861 60.861 58.495 2.366 18112 12034 1 16 . 1 1 49 49 PHE CB C 49 38.616 38.616 35.873 2.743 18112 12035 1 16 . 1 1 49 49 PHE H H 49 8.626 8.626 8.191 0.435 18112 12036 1 16 . 1 1 50 50 ASN N N 50 115.408 115.408 118.926 -3.518 18112 12037 1 16 . 1 1 50 50 ASN C C 50 176.072 176.072 175.995 0.077 18112 12038 1 16 . 1 1 50 50 ASN CA C 50 51.730 51.730 52.830 -1.100 18112 12039 1 16 . 1 1 50 50 ASN H H 50 7.030 7.030 8.192 -1.162 18112 12040 1 16 . 1 1 51 51 ARG N N 51 122.706 122.706 122.527 0.179 18112 12041 1 16 . 1 1 51 51 ARG CA C 51 59.534 59.534 60.572 -1.038 18112 12042 1 16 . 1 1 51 51 ARG H H 51 7.790 7.790 9.021 -1.231 18112 12043 1 16 . 1 1 52 52 CYS N N 52 117.340 117.340 116.298 1.042 18112 12044 1 16 . 1 1 52 52 CYS HA H 52 4.108 4.108 4.081 0.027 18112 12045 1 16 . 1 1 52 52 CYS C C 52 178.200 178.200 177.181 1.019 18112 12046 1 16 . 1 1 52 52 CYS CA C 52 61.143 61.143 63.456 -2.313 18112 12047 1 16 . 1 1 52 52 CYS H H 52 7.681 7.681 8.330 -0.649 18112 12048 1 16 . 1 1 53 53 ILE N N 53 122.321 122.321 117.000 5.321 18112 12049 1 16 . 1 1 53 53 ILE HA H 53 3.588 3.588 3.587 0.001 18112 12050 1 16 . 1 1 53 53 ILE C C 53 177.492 177.492 177.431 0.061 18112 12051 1 16 . 1 1 53 53 ILE CA C 53 64.109 64.109 64.326 -0.217 18112 12052 1 16 . 1 1 53 53 ILE CB C 53 37.603 37.603 37.026 0.577 18112 12053 1 16 . 1 1 53 53 ILE H H 53 8.035 8.035 7.803 0.232 18112 12054 1 16 . 1 1 54 54 THR C C 54 175.903 175.903 176.776 -0.873 18112 12055 1 16 . 1 1 54 54 THR CA C 54 67.308 67.308 67.034 0.274 18112 12056 1 16 . 1 1 55 55 SER N N 55 113.819 113.819 116.964 -3.145 18112 12057 1 16 . 1 1 55 55 SER H H 55 7.844 7.844 7.988 -0.144 18112 12058 1 16 . 1 1 56 56 GLN C C 56 179.792 179.792 177.772 2.020 18112 12059 1 16 . 1 1 57 57 LEU N N 57 116.701 116.701 120.995 -4.294 18112 12060 1 16 . 1 1 57 57 LEU HA H 57 4.519 4.519 3.155 1.365 18112 12061 1 16 . 1 1 57 57 LEU C C 57 178.775 178.775 178.471 0.304 18112 12062 1 16 . 1 1 57 57 LEU CA C 57 55.232 55.232 57.333 -2.101 18112 12063 1 16 . 1 1 57 57 LEU CB C 57 37.131 37.131 41.613 -4.482 18112 12064 1 16 . 1 1 57 57 LEU H H 57 8.267 8.267 7.586 0.681 18112 12065 1 16 . 1 1 58 58 ILE N N 58 122.522 122.522 118.689 3.833 18112 12066 1 16 . 1 1 58 58 ILE HA H 58 4.640 4.640 3.381 1.259 18112 12067 1 16 . 1 1 58 58 ILE C C 58 177.380 177.380 177.895 -0.515 18112 12068 1 16 . 1 1 58 58 ILE CA C 58 62.163 62.163 65.024 -2.861 18112 12069 1 16 . 1 1 58 58 ILE CB C 58 30.657 30.657 37.408 -6.751 18112 12070 1 16 . 1 1 58 58 ILE H H 58 8.111 8.111 8.012 0.099 18112 12071 1 16 . 1 1 59 59 LYS N N 59 121.002 121.002 120.627 0.375 18112 12072 1 16 . 1 1 59 59 LYS C C 59 177.600 177.600 179.375 -1.775 18112 12073 1 16 . 1 1 59 59 LYS CA C 59 57.570 57.570 58.757 -1.187 18112 12074 1 16 . 1 1 59 59 LYS CB C 59 39.101 39.101 31.713 7.388 18112 12075 1 16 . 1 1 59 59 LYS H H 59 7.432 7.432 7.728 -0.296 18112 12076 1 16 . 1 1 60 60 TRP N N 60 118.679 118.679 120.423 -1.744 18112 12077 1 16 . 1 1 60 60 TRP HA H 60 3.739 3.739 4.488 -0.749 18112 12078 1 16 . 1 1 60 60 TRP C C 60 178.246 178.246 179.387 -1.141 18112 12079 1 16 . 1 1 60 60 TRP CA C 60 59.818 59.818 59.219 0.599 18112 12080 1 16 . 1 1 60 60 TRP CB C 60 31.851 31.851 28.564 3.287 18112 12081 1 16 . 1 1 60 60 TRP H H 60 7.565 7.565 7.894 -0.329 18112 12082 1 16 . 1 1 61 61 PHE N N 61 118.005 118.005 118.088 -0.083 18112 12083 1 16 . 1 1 61 61 PHE HA H 61 3.882 3.882 4.131 -0.249 18112 12084 1 16 . 1 1 61 61 PHE CA C 61 60.054 60.054 59.282 0.772 18112 12085 1 16 . 1 1 61 61 PHE H H 61 7.819 7.819 8.304 -0.485 18112 12086 1 16 . 1 1 62 62 SER N N 62 121.144 121.144 116.050 5.094 18112 12087 1 16 . 1 1 62 62 SER C C 62 177.840 177.840 176.981 0.859 18112 12088 1 16 . 1 1 62 62 SER CA C 62 55.892 55.892 62.128 -6.236 18112 12089 1 16 . 1 1 62 62 SER H H 62 8.878 8.878 8.522 0.356 18112 12090 1 16 . 1 1 63 63 ASN N N 63 115.303 115.303 122.149 -6.846 18112 12091 1 16 . 1 1 63 63 ASN C C 63 177.222 177.222 177.689 -0.467 18112 12092 1 16 . 1 1 63 63 ASN CA C 63 60.467 60.467 57.130 3.337 18112 12093 1 16 . 1 1 63 63 ASN H H 63 8.001 8.001 8.283 -0.282 18112 12094 1 16 . 1 1 64 64 PHE N N 64 112.571 112.571 121.381 -8.810 18112 12095 1 16 . 1 1 64 64 PHE CA C 64 56.453 56.453 61.597 -5.144 18112 12096 1 16 . 1 1 64 64 PHE H H 64 7.082 7.082 8.603 -1.521 18112 12097 1 16 . 1 1 65 65 ARG N N 65 116.695 116.695 118.356 -1.661 18112 12098 1 16 . 1 1 65 65 ARG CA C 65 59.590 59.590 59.486 0.104 18112 12099 1 16 . 1 1 65 65 ARG H H 65 8.091 8.091 8.459 -0.368 18112 12100 1 16 . 1 1 66 66 GLU N N 66 121.653 121.653 121.077 0.576 18112 12101 1 16 . 1 1 66 66 GLU HA H 66 4.739 4.739 4.182 0.557 18112 12102 1 16 . 1 1 66 66 GLU C C 66 174.621 174.621 178.348 -3.727 18112 12103 1 16 . 1 1 66 66 GLU CA C 66 59.583 59.583 59.367 0.216 18112 12104 1 16 . 1 1 66 66 GLU H H 66 7.597 7.597 8.372 -0.775 18112 12105 1 16 . 1 1 67 67 PHE N N 67 111.578 111.578 120.784 -9.206 18112 12106 1 16 . 1 1 67 67 PHE C C 67 176.164 176.164 177.130 -0.966 18112 12107 1 16 . 1 1 67 67 PHE CA C 67 61.156 61.156 61.192 -0.036 18112 12108 1 16 . 1 1 67 67 PHE H H 67 7.067 7.067 8.178 -1.111 18112 12109 1 16 . 1 1 68 68 TYR N N 68 119.370 119.370 120.784 -1.414 18112 12110 1 16 . 1 1 68 68 TYR C C 68 176.844 176.844 177.371 -0.527 18112 12111 1 16 . 1 1 68 68 TYR CA C 68 61.758 61.758 61.371 0.387 18112 12112 1 16 . 1 1 68 68 TYR H H 68 7.442 7.442 8.795 -1.353 18112 12113 1 16 . 1 1 69 69 TYR N N 69 116.047 116.047 119.750 -3.703 18112 12114 1 16 . 1 1 69 69 TYR HA H 69 4.086 4.086 3.940 0.146 18112 12115 1 16 . 1 1 69 69 TYR C C 69 180.328 180.328 177.563 2.765 18112 12116 1 16 . 1 1 69 69 TYR CA C 69 61.528 61.528 61.269 0.259 18112 12117 1 16 . 1 1 69 69 TYR H H 69 9.127 9.127 8.135 0.992 18112 12118 1 16 . 1 1 70 70 ILE N N 70 124.738 124.738 118.124 6.614 18112 12119 1 16 . 1 1 70 70 ILE HA H 70 3.828 3.828 3.477 0.351 18112 12120 1 16 . 1 1 70 70 ILE C C 70 179.585 179.585 178.294 1.291 18112 12121 1 16 . 1 1 70 70 ILE CA C 70 65.787 65.787 62.969 2.818 18112 12122 1 16 . 1 1 70 70 ILE CB C 70 36.435 36.435 36.240 0.195 18112 12123 1 16 . 1 1 70 70 ILE H H 70 8.631 8.631 8.307 0.324 18112 12124 1 16 . 1 1 71 71 GLN N N 71 117.940 117.940 119.061 -1.121 18112 12125 1 16 . 1 1 71 71 GLN HA H 71 3.826 3.826 3.467 0.359 18112 12126 1 16 . 1 1 71 71 GLN C C 71 178.192 178.192 178.370 -0.178 18112 12127 1 16 . 1 1 71 71 GLN CA C 71 57.779 57.779 58.412 -0.633 18112 12128 1 16 . 1 1 71 71 GLN H H 71 7.738 7.738 7.764 -0.026 18112 12129 1 16 . 1 1 72 72 MET N N 72 117.353 117.353 116.906 0.447 18112 12130 1 16 . 1 1 72 72 MET HA H 72 4.112 4.112 4.284 -0.172 18112 12131 1 16 . 1 1 72 72 MET C C 72 177.203 177.203 178.560 -1.357 18112 12132 1 16 . 1 1 72 72 MET CA C 72 57.272 57.272 56.348 0.924 18112 12133 1 16 . 1 1 72 72 MET H H 72 7.844 7.844 7.887 -0.043 18112 12134 1 16 . 1 1 73 73 GLU N N 73 117.858 117.858 118.993 -1.135 18112 12135 1 16 . 1 1 73 73 GLU HA H 73 3.572 3.572 3.705 -0.133 18112 12136 1 16 . 1 1 73 73 GLU C C 73 177.344 177.344 178.369 -1.025 18112 12137 1 16 . 1 1 73 73 GLU CA C 73 60.324 60.324 58.990 1.334 18112 12138 1 16 . 1 1 73 73 GLU H H 73 7.503 7.503 8.017 -0.514 18112 12139 1 16 . 1 1 74 74 LYS N N 74 118.716 118.716 121.509 -2.793 18112 12140 1 16 . 1 1 74 74 LYS HA H 74 3.867 3.867 3.880 -0.013 18112 12141 1 16 . 1 1 74 74 LYS C C 74 180.077 180.077 178.904 1.173 18112 12142 1 16 . 1 1 74 74 LYS CA C 74 59.754 59.754 58.452 1.302 18112 12143 1 16 . 1 1 74 74 LYS H H 74 7.912 7.912 7.500 0.412 18112 12144 1 16 . 1 1 75 75 TYR N N 75 117.309 117.309 118.738 -1.429 18112 12145 1 16 . 1 1 75 75 TYR HA H 75 4.085 4.085 4.403 -0.318 18112 12146 1 16 . 1 1 75 75 TYR C C 75 178.874 178.874 178.715 0.159 18112 12147 1 16 . 1 1 75 75 TYR CA C 75 63.306 63.306 59.470 3.836 18112 12148 1 16 . 1 1 75 75 TYR H H 75 8.421 8.421 7.689 0.732 18112 12149 1 16 . 1 1 76 76 ALA N N 76 125.392 125.392 121.548 3.844 18112 12150 1 16 . 1 1 76 76 ALA HA H 76 4.221 4.221 4.209 0.012 18112 12151 1 16 . 1 1 76 76 ALA C C 76 178.850 178.850 179.416 -0.566 18112 12152 1 16 . 1 1 76 76 ALA CA C 76 56.280 56.280 55.426 0.854 18112 12153 1 16 . 1 1 76 76 ALA CB C 76 18.687 18.687 18.376 0.311 18112 12154 1 16 . 1 1 76 76 ALA H H 76 8.553 8.553 8.275 0.278 18112 12155 1 16 . 1 1 77 77 ARG N N 77 115.067 115.067 117.675 -2.608 18112 12156 1 16 . 1 1 77 77 ARG HA H 77 3.935 3.935 3.895 0.040 18112 12157 1 16 . 1 1 77 77 ARG C C 77 179.341 179.341 178.293 1.048 18112 12158 1 16 . 1 1 77 77 ARG CA C 77 60.499 60.499 58.885 1.614 18112 12159 1 16 . 1 1 77 77 ARG H H 77 8.471 8.471 8.120 0.351 18112 12160 1 16 . 1 1 78 78 GLN N N 78 120.107 120.107 120.427 -0.320 18112 12161 1 16 . 1 1 78 78 GLN HA H 78 3.921 3.921 4.084 -0.163 18112 12162 1 16 . 1 1 78 78 GLN C C 78 177.289 177.289 178.059 -0.770 18112 12163 1 16 . 1 1 78 78 GLN CA C 78 58.619 58.619 58.703 -0.084 18112 12164 1 16 . 1 1 78 78 GLN CB C 78 27.752 27.752 28.666 -0.914 18112 12165 1 16 . 1 1 78 78 GLN H H 78 8.142 8.142 8.337 -0.195 18112 12166 1 16 . 1 1 79 79 ALA N N 79 120.809 120.809 122.767 -1.958 18112 12167 1 16 . 1 1 79 79 ALA HA H 79 4.308 4.308 4.080 0.229 18112 12168 1 16 . 1 1 79 79 ALA C C 79 179.924 179.924 179.860 0.064 18112 12169 1 16 . 1 1 79 79 ALA CA C 79 54.970 54.970 55.257 -0.287 18112 12170 1 16 . 1 1 79 79 ALA CB C 79 17.064 17.064 18.625 -1.561 18112 12171 1 16 . 1 1 79 79 ALA H H 79 7.811 7.811 7.902 -0.091 18112 12172 1 16 . 1 1 80 80 ILE N N 80 118.524 118.524 118.230 0.294 18112 12173 1 16 . 1 1 80 80 ILE HA H 80 3.894 3.894 3.581 0.313 18112 12174 1 16 . 1 1 80 80 ILE C C 80 181.268 181.268 178.041 3.227 18112 12175 1 16 . 1 1 80 80 ILE CA C 80 64.841 64.841 64.448 0.393 18112 12176 1 16 . 1 1 80 80 ILE CB C 80 37.125 37.125 37.645 -0.520 18112 12177 1 16 . 1 1 80 80 ILE H H 80 7.837 7.837 7.933 -0.096 18112 12178 1 16 . 1 1 81 81 ASN N N 81 121.233 121.233 116.914 4.319 18112 12179 1 16 . 1 1 81 81 ASN HA H 81 4.398 4.398 4.458 -0.060 18112 12180 1 16 . 1 1 81 81 ASN C C 81 176.546 176.546 176.747 -0.201 18112 12181 1 16 . 1 1 81 81 ASN CA C 81 55.892 55.892 55.534 0.358 18112 12182 1 16 . 1 1 81 81 ASN CB C 81 37.603 37.603 38.811 -1.208 18112 12183 1 16 . 1 1 81 81 ASN H H 81 8.262 8.262 7.956 0.306 18112 12184 1 16 . 1 1 82 82 ASP N N 82 119.240 119.240 117.387 1.853 18112 12185 1 16 . 1 1 82 82 ASP HA H 82 4.666 4.666 4.725 -0.059 18112 12186 1 16 . 1 1 82 82 ASP C C 82 176.767 176.767 177.018 -0.251 18112 12187 1 16 . 1 1 82 82 ASP CA C 82 54.771 54.771 54.240 0.530 18112 12188 1 16 . 1 1 82 82 ASP CB C 82 40.121 40.121 41.798 -1.677 18112 12189 1 16 . 1 1 82 82 ASP H H 82 8.316 8.316 8.165 0.151 18112 12190 1 16 . 1 1 83 83 GLY N N 83 106.913 106.913 107.140 -0.227 18112 12191 1 16 . 1 1 83 83 GLY C C 83 174.601 174.601 175.997 -1.396 18112 12192 1 16 . 1 1 83 83 GLY CA C 83 45.214 45.214 45.571 -0.357 18112 12193 1 16 . 1 1 83 83 GLY H H 83 7.810 7.810 8.036 -0.226 18112 12194 1 16 . 1 1 84 84 VAL N N 84 122.981 122.981 122.237 0.744 18112 12195 1 16 . 1 1 84 84 VAL HA H 84 3.850 3.850 3.667 0.183 18112 12196 1 16 . 1 1 84 84 VAL C C 84 177.265 177.265 177.070 0.195 18112 12197 1 16 . 1 1 84 84 VAL CA C 84 64.270 64.270 66.026 -1.756 18112 12198 1 16 . 1 1 84 84 VAL CB C 84 30.471 30.471 31.818 -1.347 18112 12199 1 16 . 1 1 84 84 VAL H H 84 8.157 8.157 7.761 0.396 18112 12200 1 16 . 1 1 85 85 THR N N 85 115.232 115.232 107.385 7.847 18112 12201 1 16 . 1 1 85 85 THR HA H 85 4.716 4.716 4.265 0.451 18112 12202 1 16 . 1 1 85 85 THR C C 85 174.489 174.489 173.646 0.843 18112 12203 1 16 . 1 1 85 85 THR CA C 85 61.618 61.618 64.037 -2.418 18112 12204 1 16 . 1 1 85 85 THR CB C 85 70.081 70.081 68.498 1.583 18112 12205 1 16 . 1 1 85 85 THR H H 85 8.890 8.890 7.956 0.934 18112 12206 1 16 . 1 1 86 86 SER N N 86 117.009 117.009 115.716 1.293 18112 12207 1 16 . 1 1 86 86 SER HA H 86 5.046 5.046 4.604 0.442 18112 12208 1 16 . 1 1 86 86 SER C C 86 174.473 174.473 174.974 -0.501 18112 12209 1 16 . 1 1 86 86 SER CA C 86 55.922 55.922 57.334 -1.412 18112 12210 1 16 . 1 1 86 86 SER CB C 86 64.385 64.385 64.708 -0.323 18112 12211 1 16 . 1 1 86 86 SER H H 86 7.704 7.704 7.875 -0.171 18112 12212 1 16 . 1 1 87 87 THR N N 87 118.634 118.634 120.744 -2.110 18112 12213 1 16 . 1 1 87 87 THR HA H 87 4.065 4.065 3.743 0.322 18112 12214 1 16 . 1 1 87 87 THR C C 87 176.047 176.047 175.599 0.448 18112 12215 1 16 . 1 1 87 87 THR CA C 87 64.983 64.983 65.608 -0.625 18112 12216 1 16 . 1 1 87 87 THR CB C 87 68.045 68.045 68.155 -0.110 18112 12217 1 16 . 1 1 87 87 THR H H 87 8.711 8.711 8.372 0.339 18112 12218 1 16 . 1 1 88 88 GLU N N 88 117.889 117.889 120.436 -2.547 18112 12219 1 16 . 1 1 88 88 GLU HA H 88 3.881 3.881 3.934 -0.053 18112 12220 1 16 . 1 1 88 88 GLU C C 88 177.146 177.146 178.597 -1.451 18112 12221 1 16 . 1 1 88 88 GLU CA C 88 57.814 57.814 59.028 -1.214 18112 12222 1 16 . 1 1 88 88 GLU CB C 88 28.050 28.050 28.799 -0.750 18112 12223 1 16 . 1 1 88 88 GLU H H 88 8.152 8.152 8.681 -0.529 18112 12224 1 16 . 1 1 89 89 GLU N N 89 115.617 115.617 118.178 -2.561 18112 12225 1 16 . 1 1 89 89 GLU HA H 89 4.149 4.149 4.103 0.046 18112 12226 1 16 . 1 1 89 89 GLU C C 89 176.192 176.192 178.215 -2.023 18112 12227 1 16 . 1 1 89 89 GLU CA C 89 56.133 56.133 57.643 -1.510 18112 12228 1 16 . 1 1 89 89 GLU CB C 89 29.415 29.415 29.638 -0.223 18112 12229 1 16 . 1 1 89 89 GLU H H 89 7.311 7.311 7.655 -0.344 18112 12230 1 16 . 1 1 90 90 LEU N N 90 120.870 120.870 118.242 2.628 18112 12231 1 16 . 1 1 90 90 LEU HA H 90 4.439 4.439 4.107 0.332 18112 12232 1 16 . 1 1 90 90 LEU C C 90 175.267 175.267 177.696 -2.429 18112 12233 1 16 . 1 1 90 90 LEU CA C 90 53.504 53.504 56.456 -2.952 18112 12234 1 16 . 1 1 90 90 LEU CB C 90 40.479 40.479 42.852 -2.373 18112 12235 1 16 . 1 1 90 90 LEU H H 90 7.311 7.311 7.315 -0.004 18112 12236 1 16 . 1 1 91 91 SER N N 91 118.376 118.376 111.965 6.411 18112 12237 1 16 . 1 1 91 91 SER HA H 91 4.747 4.747 4.390 0.357 18112 12238 1 16 . 1 1 91 91 SER C C 91 173.332 173.332 172.564 0.768 18112 12239 1 16 . 1 1 91 91 SER CA C 91 56.314 56.314 58.141 -1.827 18112 12240 1 16 . 1 1 91 91 SER CB C 91 64.615 64.615 63.582 1.033 18112 12241 1 16 . 1 1 91 91 SER H H 91 8.221 8.221 7.523 0.698 18112 12242 1 16 . 1 1 92 92 ILE N N 92 122.247 122.247 121.545 0.702 18112 12243 1 16 . 1 1 92 92 ILE HA H 92 4.537 4.537 4.382 0.155 18112 12244 1 16 . 1 1 92 92 ILE C C 92 174.059 174.059 175.881 -1.822 18112 12245 1 16 . 1 1 92 92 ILE CA C 92 59.881 59.881 58.689 1.192 18112 12246 1 16 . 1 1 92 92 ILE CB C 92 37.820 37.820 40.036 -2.216 18112 12247 1 16 . 1 1 92 92 ILE H H 92 8.570 8.570 7.422 1.148 18112 12248 1 16 . 1 1 93 93 THR N N 93 116.069 116.069 120.687 -4.618 18112 12249 1 16 . 1 1 93 93 THR HA H 93 4.580 4.580 4.184 0.396 18112 12250 1 16 . 1 1 93 93 THR C C 93 175.049 175.049 174.546 0.503 18112 12251 1 16 . 1 1 93 93 THR CA C 93 58.988 58.988 64.085 -5.096 18112 12252 1 16 . 1 1 93 93 THR CB C 93 71.362 71.362 69.129 2.233 18112 12253 1 16 . 1 1 93 93 THR H H 93 7.224 7.224 8.453 -1.229 18112 12254 1 16 . 1 1 94 94 ARG N N 94 116.595 116.595 129.473 -12.878 18112 12255 1 16 . 1 1 94 94 ARG HA H 94 3.077 3.077 4.538 -1.461 18112 12256 1 16 . 1 1 94 94 ARG C C 94 175.076 175.076 175.822 -0.746 18112 12257 1 16 . 1 1 94 94 ARG CA C 94 57.119 57.119 54.934 2.185 18112 12258 1 16 . 1 1 94 94 ARG CB C 94 27.838 27.838 30.541 -2.703 18112 12259 1 16 . 1 1 94 94 ARG H H 94 8.596 8.596 8.683 -0.087 18112 12260 1 16 . 1 1 95 95 ASP N N 95 113.735 113.735 122.844 -9.109 18112 12261 1 16 . 1 1 95 95 ASP HA H 95 4.765 4.765 3.949 0.816 18112 12262 1 16 . 1 1 95 95 ASP C C 95 175.876 175.876 174.858 1.018 18112 12263 1 16 . 1 1 95 95 ASP CA C 95 53.156 53.156 56.645 -3.489 18112 12264 1 16 . 1 1 95 95 ASP CB C 95 41.166 41.166 38.699 2.467 18112 12265 1 16 . 1 1 95 95 ASP H H 95 7.607 7.607 9.049 -1.442 18112 12266 1 16 . 1 1 96 96 CYS N N 96 116.012 116.012 119.814 -3.802 18112 12267 1 16 . 1 1 96 96 CYS C C 96 174.361 174.361 175.898 -1.537 18112 12268 1 16 . 1 1 96 96 CYS CA C 96 56.562 56.562 59.373 -2.811 18112 12269 1 16 . 1 1 96 96 CYS CB C 96 29.416 29.416 30.372 -0.956 18112 12270 1 16 . 1 1 96 96 CYS H H 96 7.094 7.094 7.721 -0.627 18112 12271 1 16 . 1 1 97 97 GLU N N 97 123.087 123.087 122.371 0.716 18112 12272 1 16 . 1 1 97 97 GLU C C 97 178.748 178.748 178.832 -0.084 18112 12273 1 16 . 1 1 97 97 GLU CA C 97 59.912 59.912 59.873 0.038 18112 12274 1 16 . 1 1 97 97 GLU CB C 97 29.195 29.195 29.419 -0.224 18112 12275 1 16 . 1 1 97 97 GLU H H 97 9.003 9.003 7.905 1.098 18112 12276 1 16 . 1 1 98 98 LEU N N 98 120.942 120.942 119.901 1.041 18112 12277 1 16 . 1 1 98 98 LEU HA H 98 3.614 3.614 4.165 -0.551 18112 12278 1 16 . 1 1 98 98 LEU C C 98 177.796 177.796 178.560 -0.764 18112 12279 1 16 . 1 1 98 98 LEU CA C 98 58.090 58.090 57.109 0.981 18112 12280 1 16 . 1 1 98 98 LEU CB C 98 39.778 39.778 41.948 -2.170 18112 12281 1 16 . 1 1 98 98 LEU H H 98 8.656 8.656 7.794 0.862 18112 12282 1 16 . 1 1 99 99 TYR N N 99 118.313 118.313 118.376 -0.063 18112 12283 1 16 . 1 1 99 99 TYR C C 99 177.077 177.077 178.253 -1.176 18112 12284 1 16 . 1 1 99 99 TYR CA C 99 62.622 62.622 61.465 1.157 18112 12285 1 16 . 1 1 99 99 TYR CB C 99 38.742 38.742 37.456 1.286 18112 12286 1 16 . 1 1 99 99 TYR H H 99 7.522 7.522 7.938 -0.416 18112 12287 1 16 . 1 1 100 100 ARG N N 100 118.101 118.101 118.469 -0.368 18112 12288 1 16 . 1 1 100 100 ARG C C 100 178.616 178.616 178.874 -0.258 18112 12289 1 16 . 1 1 100 100 ARG CA C 100 59.915 59.915 59.793 0.122 18112 12290 1 16 . 1 1 100 100 ARG CB C 100 29.100 29.100 29.943 -0.843 18112 12291 1 16 . 1 1 100 100 ARG H H 100 8.243 8.243 8.449 -0.206 18112 12292 1 16 . 1 1 101 101 ALA N N 101 120.972 120.972 123.688 -2.716 18112 12293 1 16 . 1 1 101 101 ALA HA H 101 4.145 4.145 4.207 -0.062 18112 12294 1 16 . 1 1 101 101 ALA C C 101 181.359 181.359 179.463 1.896 18112 12295 1 16 . 1 1 101 101 ALA CA C 101 55.057 55.057 55.222 -0.165 18112 12296 1 16 . 1 1 101 101 ALA CB C 101 17.543 17.543 18.563 -1.020 18112 12297 1 16 . 1 1 101 101 ALA H H 101 8.352 8.352 7.862 0.490 18112 12298 1 16 . 1 1 102 102 LEU N N 102 115.683 115.683 118.561 -2.878 18112 12299 1 16 . 1 1 102 102 LEU HA H 102 4.333 4.333 4.230 0.103 18112 12300 1 16 . 1 1 102 102 LEU C C 102 178.583 178.583 179.738 -1.155 18112 12301 1 16 . 1 1 102 102 LEU CA C 102 57.634 57.634 58.187 -0.553 18112 12302 1 16 . 1 1 102 102 LEU CB C 102 41.716 41.716 41.705 0.011 18112 12303 1 16 . 1 1 102 102 LEU H H 102 7.960 7.960 8.297 -0.338 18112 12304 1 16 . 1 1 103 103 ASN N N 103 118.957 118.957 118.658 0.299 18112 12305 1 16 . 1 1 103 103 ASN C C 103 177.470 177.470 178.163 -0.693 18112 12306 1 16 . 1 1 103 103 ASN CA C 103 56.974 56.974 56.001 0.973 18112 12307 1 16 . 1 1 103 103 ASN CB C 103 38.140 38.140 38.216 -0.076 18112 12308 1 16 . 1 1 103 103 ASN H H 103 9.301 9.301 8.513 0.788 18112 12309 1 16 . 1 1 104 104 MET N N 104 113.763 113.763 118.734 -4.971 18112 12310 1 16 . 1 1 104 104 MET CA C 104 57.362 57.362 57.439 -0.077 18112 12311 1 16 . 1 1 104 104 MET CB C 104 31.895 31.895 32.599 -0.704 18112 12312 1 16 . 1 1 104 104 MET H H 104 8.332 8.332 8.166 0.166 18112 12313 1 16 . 1 1 105 105 HIS N N 105 116.024 116.024 116.034 -0.010 18112 12314 1 16 . 1 1 105 105 HIS HA H 105 3.764 3.764 4.549 -0.785 18112 12315 1 16 . 1 1 105 105 HIS C C 105 176.939 176.939 176.550 0.389 18112 12316 1 16 . 1 1 105 105 HIS CA C 105 59.069 59.069 58.469 0.600 18112 12317 1 16 . 1 1 105 105 HIS H H 105 7.156 7.156 8.272 -1.116 18112 12318 1 16 . 1 1 106 106 TYR N N 106 113.161 113.161 117.882 -4.721 18112 12319 1 16 . 1 1 106 106 TYR C C 106 173.767 173.767 175.965 -2.198 18112 12320 1 16 . 1 1 106 106 TYR CA C 106 58.488 58.488 60.419 -1.931 18112 12321 1 16 . 1 1 106 106 TYR CB C 106 38.225 38.225 40.535 -2.310 18112 12322 1 16 . 1 1 106 106 TYR H H 106 7.204 7.204 8.755 -1.551 18112 12323 1 16 . 1 1 107 107 ASN N N 107 118.875 118.875 114.119 4.756 18112 12324 1 16 . 1 1 107 107 ASN HA H 107 3.922 3.922 4.772 -0.850 18112 12325 1 16 . 1 1 107 107 ASN C C 107 175.815 175.815 173.269 2.546 18112 12326 1 16 . 1 1 107 107 ASN CA C 107 51.233 51.233 52.791 -1.558 18112 12327 1 16 . 1 1 107 107 ASN CB C 107 38.142 38.142 40.387 -2.245 18112 12328 1 16 . 1 1 107 107 ASN H H 107 8.127 8.127 8.296 -0.169 18112 12329 1 16 . 1 1 108 108 LYS N N 108 122.850 122.850 123.728 -0.878 18112 12330 1 16 . 1 1 108 108 LYS HA H 108 3.954 3.954 4.354 -0.400 18112 12331 1 16 . 1 1 108 108 LYS C C 108 177.586 177.586 176.164 1.422 18112 12332 1 16 . 1 1 108 108 LYS CA C 108 59.749 59.749 56.095 3.654 18112 12333 1 16 . 1 1 108 108 LYS CB C 108 31.498 31.498 30.332 1.166 18112 12334 1 16 . 1 1 108 108 LYS H H 108 7.772 7.772 8.675 -0.903 18112 12335 1 16 . 1 1 109 109 ALA N N 109 118.054 118.054 125.801 -7.747 18112 12336 1 16 . 1 1 109 109 ALA HA H 109 4.137 4.137 4.111 0.026 18112 12337 1 16 . 1 1 109 109 ALA C C 109 177.889 177.889 177.804 0.085 18112 12338 1 16 . 1 1 109 109 ALA CA C 109 52.299 52.299 52.708 -0.409 18112 12339 1 16 . 1 1 109 109 ALA CB C 109 17.787 17.787 16.966 0.821 18112 12340 1 16 . 1 1 109 109 ALA H H 109 8.307 8.307 8.466 -0.159 18112 12341 1 16 . 1 1 110 110 ASN N N 110 115.542 115.542 117.877 -2.335 18112 12342 1 16 . 1 1 110 110 ASN HA H 110 4.480 4.480 4.425 0.055 18112 12343 1 16 . 1 1 110 110 ASN C C 110 174.277 174.277 176.418 -2.141 18112 12344 1 16 . 1 1 110 110 ASN CA C 110 53.504 53.504 55.903 -2.399 18112 12345 1 16 . 1 1 110 110 ASN CB C 110 37.283 37.283 39.095 -1.812 18112 12346 1 16 . 1 1 110 110 ASN H H 110 8.353 8.353 7.943 0.410 18112 12347 1 16 . 1 1 111 111 ASP N N 111 114.692 114.692 120.065 -5.373 18112 12348 1 16 . 1 1 111 111 ASP HA H 111 4.485 4.485 4.379 0.106 18112 12349 1 16 . 1 1 111 111 ASP C C 111 174.868 174.868 174.862 0.006 18112 12350 1 16 . 1 1 111 111 ASP CA C 111 53.227 53.227 54.319 -1.092 18112 12351 1 16 . 1 1 111 111 ASP CB C 111 39.228 39.228 38.880 0.348 18112 12352 1 16 . 1 1 111 111 ASP H H 111 8.297 8.297 8.398 -0.101 18112 12353 1 16 . 1 1 112 112 PHE N N 112 120.927 120.927 117.081 3.846 18112 12354 1 16 . 1 1 112 112 PHE HA H 112 4.752 4.752 4.090 0.662 18112 12355 1 16 . 1 1 112 112 PHE C C 112 174.633 174.633 175.095 -0.462 18112 12356 1 16 . 1 1 112 112 PHE CA C 112 56.346 56.346 58.308 -1.962 18112 12357 1 16 . 1 1 112 112 PHE H H 112 7.784 7.784 8.101 -0.317 18112 12358 1 16 . 1 1 113 113 GLU N N 113 128.111 128.111 118.053 10.058 18112 12359 1 16 . 1 1 113 113 GLU HA H 113 4.011 4.011 3.971 0.040 18112 12360 1 16 . 1 1 113 113 GLU C C 113 173.502 173.502 175.621 -2.119 18112 12361 1 16 . 1 1 113 113 GLU CA C 113 55.100 55.100 57.187 -2.087 18112 12362 1 16 . 1 1 113 113 GLU H H 113 7.752 7.752 8.014 -0.262 18112 12363 1 16 . 1 1 114 114 VAL N N 114 129.326 129.326 111.027 18.299 18112 12364 1 16 . 1 1 114 114 VAL HA H 114 3.241 3.241 3.775 -0.534 18112 12365 1 16 . 1 1 114 114 VAL CA C 114 60.838 60.838 62.190 -1.352 18112 12366 1 16 . 1 1 114 114 VAL CB C 114 32.609 32.609 29.983 2.626 18112 12367 1 16 . 1 1 114 114 VAL H H 114 8.008 8.008 7.958 0.050 18112 12368 1 16 . 1 1 115 115 PRO HA H 115 4.429 4.429 4.798 -0.369 18112 12369 1 16 . 1 1 115 115 PRO C C 115 177.421 177.421 178.022 -0.601 18112 12370 1 16 . 1 1 115 115 PRO CA C 115 61.882 61.882 62.326 -0.444 18112 12371 1 16 . 1 1 115 115 PRO CB C 115 30.974 30.974 32.794 -1.820 18112 12372 1 16 . 1 1 116 116 GLU N N 116 123.936 123.936 118.959 4.977 18112 12373 1 16 . 1 1 116 116 GLU C C 116 179.034 179.034 178.529 0.505 18112 12374 1 16 . 1 1 116 116 GLU CA C 116 58.913 58.913 59.975 -1.062 18112 12375 1 16 . 1 1 116 116 GLU CB C 116 28.378 28.378 28.545 -0.167 18112 12376 1 16 . 1 1 116 116 GLU H H 116 8.757 8.757 8.773 -0.016 18112 12377 1 16 . 1 1 117 117 ARG N N 117 116.943 116.943 118.098 -1.155 18112 12378 1 16 . 1 1 117 117 ARG C C 117 177.570 177.570 178.727 -1.157 18112 12379 1 16 . 1 1 117 117 ARG CA C 117 57.033 57.033 58.374 -1.341 18112 12380 1 16 . 1 1 117 117 ARG CB C 117 28.172 28.172 29.119 -0.947 18112 12381 1 16 . 1 1 117 117 ARG H H 117 8.733 8.733 8.583 0.150 18112 12382 1 16 . 1 1 118 118 PHE N N 118 117.528 117.528 121.104 -3.576 18112 12383 1 16 . 1 1 118 118 PHE HA H 118 4.137 4.137 4.667 -0.530 18112 12384 1 16 . 1 1 118 118 PHE C C 118 176.992 176.992 177.619 -0.627 18112 12385 1 16 . 1 1 118 118 PHE CA C 118 61.627 61.627 61.594 0.032 18112 12386 1 16 . 1 1 118 118 PHE CB C 118 37.386 37.386 39.369 -1.983 18112 12387 1 16 . 1 1 118 118 PHE H H 118 7.606 7.606 7.825 -0.219 18112 12388 1 16 . 1 1 119 119 LEU N N 119 118.483 118.483 118.182 0.301 18112 12389 1 16 . 1 1 119 119 LEU HA H 119 3.684 3.684 4.008 -0.324 18112 12390 1 16 . 1 1 119 119 LEU C C 119 178.802 178.802 179.214 -0.412 18112 12391 1 16 . 1 1 119 119 LEU CA C 119 59.875 59.875 56.804 3.071 18112 12392 1 16 . 1 1 119 119 LEU CB C 119 39.453 39.453 40.324 -0.871 18112 12393 1 16 . 1 1 119 119 LEU H H 119 7.248 7.248 7.763 -0.515 18112 12394 1 16 . 1 1 120 120 GLU N N 120 117.870 117.870 120.604 -2.734 18112 12395 1 16 . 1 1 120 120 GLU C C 120 179.932 179.932 179.483 0.449 18112 12396 1 16 . 1 1 120 120 GLU CA C 120 59.150 59.150 58.818 0.332 18112 12397 1 16 . 1 1 120 120 GLU CB C 120 28.878 28.878 29.440 -0.562 18112 12398 1 16 . 1 1 120 120 GLU H H 120 7.423 7.423 8.406 -0.983 18112 12399 1 16 . 1 1 121 121 VAL N N 121 120.777 120.777 119.758 1.019 18112 12400 1 16 . 1 1 121 121 VAL HA H 121 3.545 3.545 3.630 -0.085 18112 12401 1 16 . 1 1 121 121 VAL C C 121 179.302 179.302 177.875 1.427 18112 12402 1 16 . 1 1 121 121 VAL CA C 121 66.875 66.875 65.886 0.989 18112 12403 1 16 . 1 1 121 121 VAL CB C 121 30.823 30.823 30.772 0.051 18112 12404 1 16 . 1 1 121 121 VAL H H 121 8.313 8.313 8.385 -0.072 18112 12405 1 16 . 1 1 122 122 ALA N N 122 127.029 127.029 122.303 4.726 18112 12406 1 16 . 1 1 122 122 ALA HA H 122 4.251 4.251 3.822 0.429 18112 12407 1 16 . 1 1 122 122 ALA C C 122 178.366 178.366 179.139 -0.773 18112 12408 1 16 . 1 1 122 122 ALA CA C 122 54.748 54.748 55.252 -0.503 18112 12409 1 16 . 1 1 122 122 ALA CB C 122 16.565 16.565 17.915 -1.350 18112 12410 1 16 . 1 1 122 122 ALA H H 122 8.896 8.896 7.833 1.063 18112 12411 1 16 . 1 1 123 123 GLN N N 123 119.887 119.887 119.420 0.467 18112 12412 1 16 . 1 1 123 123 GLN C C 123 177.908 177.908 178.396 -0.488 18112 12413 1 16 . 1 1 123 123 GLN CA C 123 60.671 60.671 58.999 1.672 18112 12414 1 16 . 1 1 123 123 GLN H H 123 8.349 8.349 7.768 0.581 18112 12415 1 16 . 1 1 124 124 ILE N N 124 120.632 120.632 119.017 1.615 18112 12416 1 16 . 1 1 124 124 ILE HA H 124 3.651 3.651 3.737 -0.086 18112 12417 1 16 . 1 1 124 124 ILE C C 124 178.703 178.703 178.052 0.651 18112 12418 1 16 . 1 1 124 124 ILE CA C 124 65.945 65.945 65.230 0.715 18112 12419 1 16 . 1 1 124 124 ILE H H 124 8.204 8.204 8.160 0.044 18112 12420 1 16 . 1 1 125 125 THR N N 125 115.084 115.084 115.681 -0.597 18112 12421 1 16 . 1 1 125 125 THR C C 125 175.568 175.568 176.623 -1.055 18112 12422 1 16 . 1 1 125 125 THR CA C 125 67.872 67.872 66.385 1.487 18112 12423 1 16 . 1 1 125 125 THR H H 125 8.399 8.399 7.947 0.452 18112 12424 1 16 . 1 1 126 126 LEU N N 126 125.011 125.011 122.025 2.986 18112 12425 1 16 . 1 1 126 126 LEU HA H 126 4.085 4.085 4.290 -0.205 18112 12426 1 16 . 1 1 126 126 LEU C C 126 178.559 178.559 177.840 0.719 18112 12427 1 16 . 1 1 126 126 LEU CA C 126 58.843 58.843 58.141 0.702 18112 12428 1 16 . 1 1 126 126 LEU CB C 126 41.421 41.421 41.800 -0.379 18112 12429 1 16 . 1 1 126 126 LEU H H 126 8.728 8.728 7.941 0.787 18112 12430 1 16 . 1 1 127 127 ARG N N 127 117.076 117.076 117.908 -0.832 18112 12431 1 16 . 1 1 127 127 ARG HA H 127 3.929 3.929 3.978 -0.049 18112 12432 1 16 . 1 1 127 127 ARG C C 127 177.984 177.984 178.663 -0.679 18112 12433 1 16 . 1 1 127 127 ARG CA C 127 60.685 60.685 59.240 1.445 18112 12434 1 16 . 1 1 127 127 ARG CB C 127 28.079 28.079 29.613 -1.534 18112 12435 1 16 . 1 1 127 127 ARG H H 127 8.213 8.213 8.197 0.016 18112 12436 1 16 . 1 1 128 128 GLU N N 128 118.617 118.617 120.269 -1.652 18112 12437 1 16 . 1 1 128 128 GLU HA H 128 4.147 4.147 4.251 -0.104 18112 12438 1 16 . 1 1 128 128 GLU C C 128 181.150 181.150 179.040 2.110 18112 12439 1 16 . 1 1 128 128 GLU CA C 128 59.508 59.508 58.417 1.091 18112 12440 1 16 . 1 1 128 128 GLU H H 128 8.478 8.478 8.139 0.339 18112 12441 1 16 . 1 1 129 129 PHE N N 129 119.267 119.267 120.717 -1.450 18112 12442 1 16 . 1 1 129 129 PHE HA H 129 4.104 4.104 4.449 -0.345 18112 12443 1 16 . 1 1 129 129 PHE C C 129 177.170 177.170 177.905 -0.735 18112 12444 1 16 . 1 1 129 129 PHE CA C 129 63.694 63.694 60.739 2.955 18112 12445 1 16 . 1 1 129 129 PHE H H 129 8.570 8.570 8.109 0.461 18112 12446 1 16 . 1 1 130 130 PHE N N 130 118.739 118.739 119.664 -0.925 18112 12447 1 16 . 1 1 130 130 PHE HA H 130 3.884 3.884 3.990 -0.106 18112 12448 1 16 . 1 1 130 130 PHE C C 130 175.860 175.860 177.061 -1.201 18112 12449 1 16 . 1 1 130 130 PHE CA C 130 62.819 62.819 62.180 0.639 18112 12450 1 16 . 1 1 130 130 PHE H H 130 8.740 8.740 9.092 -0.352 18112 12451 1 16 . 1 1 131 131 ASN N N 131 116.028 116.028 117.947 -1.919 18112 12452 1 16 . 1 1 131 131 ASN HA H 131 4.373 4.373 4.374 -0.001 18112 12453 1 16 . 1 1 131 131 ASN C C 131 178.228 178.228 177.259 0.969 18112 12454 1 16 . 1 1 131 131 ASN CA C 131 55.150 55.150 56.246 -1.096 18112 12455 1 16 . 1 1 131 131 ASN H H 131 8.864 8.864 8.267 0.597 18112 12456 1 16 . 1 1 132 132 ALA N N 132 120.922 120.922 123.082 -2.160 18112 12457 1 16 . 1 1 132 132 ALA HA H 132 4.020 4.020 4.051 -0.031 18112 12458 1 16 . 1 1 132 132 ALA C C 132 178.515 178.515 179.805 -1.290 18112 12459 1 16 . 1 1 132 132 ALA CA C 132 54.924 54.924 55.038 -0.114 18112 12460 1 16 . 1 1 132 132 ALA CB C 132 18.441 18.441 18.516 -0.075 18112 12461 1 16 . 1 1 132 132 ALA H H 132 7.745 7.745 7.852 -0.107 18112 12462 1 16 . 1 1 133 133 ILE N N 133 118.200 118.200 119.424 -1.224 18112 12463 1 16 . 1 1 133 133 ILE HA H 133 3.235 3.235 3.449 -0.214 18112 12464 1 16 . 1 1 133 133 ILE C C 133 180.606 180.606 177.931 2.675 18112 12465 1 16 . 1 1 133 133 ILE CA C 133 65.215 65.215 64.563 0.652 18112 12466 1 16 . 1 1 133 133 ILE CB C 133 38.291 38.291 37.571 0.720 18112 12467 1 16 . 1 1 133 133 ILE H H 133 7.999 7.999 7.839 0.160 18112 12468 1 16 . 1 1 134 134 ILE N N 134 122.564 122.564 118.755 3.809 18112 12469 1 16 . 1 1 134 134 ILE HA H 134 3.788 3.788 3.580 0.208 18112 12470 1 16 . 1 1 134 134 ILE C C 134 177.215 177.215 177.510 -0.295 18112 12471 1 16 . 1 1 134 134 ILE CA C 134 63.584 63.584 63.460 0.124 18112 12472 1 16 . 1 1 134 134 ILE CB C 134 35.636 35.636 37.317 -1.681 18112 12473 1 16 . 1 1 134 134 ILE H H 134 8.670 8.670 7.834 0.836 18112 12474 1 16 . 1 1 135 135 ALA N N 135 119.989 119.989 120.893 -0.904 18112 12475 1 16 . 1 1 135 135 ALA HA H 135 4.357 4.357 4.077 0.280 18112 12476 1 16 . 1 1 135 135 ALA C C 135 177.786 177.786 177.945 -0.159 18112 12477 1 16 . 1 1 135 135 ALA CA C 135 51.521 51.521 53.903 -2.382 18112 12478 1 16 . 1 1 135 135 ALA CB C 135 18.839 18.839 19.553 -0.714 18112 12479 1 16 . 1 1 135 135 ALA H H 135 6.898 6.898 7.927 -1.029 18112 12480 1 16 . 1 1 136 136 GLY N N 136 107.682 107.682 103.979 3.703 18112 12481 1 16 . 1 1 136 136 GLY C C 136 176.324 176.324 174.762 1.562 18112 12482 1 16 . 1 1 136 136 GLY CA C 136 45.469 45.469 44.713 0.756 18112 12483 1 16 . 1 1 136 136 GLY H H 136 7.913 7.913 7.667 0.246 18112 12484 1 16 . 1 1 137 137 LYS N N 137 117.213 117.213 117.647 -0.434 18112 12485 1 16 . 1 1 137 137 LYS HA H 137 4.004 4.004 3.373 0.631 18112 12486 1 16 . 1 1 137 137 LYS C C 137 176.616 176.616 175.315 1.301 18112 12487 1 16 . 1 1 137 137 LYS CA C 137 57.499 57.499 58.784 -1.285 18112 12488 1 16 . 1 1 137 137 LYS CB C 137 30.927 30.927 31.226 -0.299 18112 12489 1 16 . 1 1 137 137 LYS H H 137 8.312 8.312 8.086 0.226 18112 12490 1 16 . 1 1 138 138 ASP N N 138 113.545 113.545 118.025 -4.480 18112 12491 1 16 . 1 1 138 138 ASP HA H 138 3.061 3.061 4.599 -1.538 18112 12492 1 16 . 1 1 138 138 ASP C C 138 174.698 174.698 177.802 -3.104 18112 12493 1 16 . 1 1 138 138 ASP CA C 138 53.694 53.694 55.143 -1.449 18112 12494 1 16 . 1 1 138 138 ASP CB C 138 36.008 36.008 40.237 -4.229 18112 12495 1 16 . 1 1 138 138 ASP H H 138 8.465 8.465 8.223 0.242 18112 12496 1 16 . 1 1 139 139 VAL N N 139 115.191 115.191 116.777 -1.586 18112 12497 1 16 . 1 1 139 139 VAL HA H 139 3.886 3.886 3.912 -0.026 18112 12498 1 16 . 1 1 139 139 VAL C C 139 175.889 175.889 174.871 1.018 18112 12499 1 16 . 1 1 139 139 VAL CA C 139 62.793 62.793 61.929 0.864 18112 12500 1 16 . 1 1 139 139 VAL CB C 139 30.662 30.662 29.266 1.396 18112 12501 1 16 . 1 1 139 139 VAL H H 139 6.610 6.610 7.737 -1.127 18112 12502 1 16 . 1 1 140 140 ASP N N 140 123.363 123.363 120.071 3.292 18112 12503 1 16 . 1 1 140 140 ASP C C 140 175.234 175.234 175.504 -0.270 18112 12504 1 16 . 1 1 140 140 ASP CA C 140 50.221 50.221 55.837 -5.616 18112 12505 1 16 . 1 1 140 140 ASP CB C 140 42.254 42.254 40.432 1.822 18112 12506 1 16 . 1 1 140 140 ASP H H 140 7.553 7.553 7.795 -0.242 18112 12507 1 16 . 1 1 141 141 PRO HA H 141 4.682 4.682 4.619 0.063 18112 12508 1 16 . 1 1 141 141 PRO C C 141 178.678 178.678 177.582 1.096 18112 12509 1 16 . 1 1 141 141 PRO CA C 141 64.532 64.532 64.868 -0.337 18112 12510 1 16 . 1 1 141 141 PRO CB C 141 31.331 31.331 32.156 -0.825 18112 12511 1 16 . 1 1 142 142 SER N N 142 114.421 114.421 114.084 0.337 18112 12512 1 16 . 1 1 142 142 SER HA H 142 4.565 4.565 4.395 0.170 18112 12513 1 16 . 1 1 142 142 SER C C 142 176.524 176.524 176.388 0.136 18112 12514 1 16 . 1 1 142 142 SER CA C 142 58.711 58.711 60.306 -1.595 18112 12515 1 16 . 1 1 142 142 SER CB C 142 62.783 62.783 62.039 0.744 18112 12516 1 16 . 1 1 142 142 SER H H 142 8.703 8.703 8.407 0.296 18112 12517 1 16 . 1 1 143 143 TRP N N 143 123.598 123.598 123.038 0.560 18112 12518 1 16 . 1 1 143 143 TRP HA H 143 4.136 4.136 4.259 -0.123 18112 12519 1 16 . 1 1 143 143 TRP C C 143 177.113 177.113 177.229 -0.116 18112 12520 1 16 . 1 1 143 143 TRP CA C 143 59.803 59.803 60.393 -0.590 18112 12521 1 16 . 1 1 143 143 TRP CB C 143 26.364 26.364 27.864 -1.500 18112 12522 1 16 . 1 1 143 143 TRP H H 143 8.374 8.374 7.881 0.493 18112 12523 1 16 . 1 1 144 144 LYS N N 144 119.293 119.293 120.163 -0.870 18112 12524 1 16 . 1 1 144 144 LYS HA H 144 2.719 2.719 3.507 -0.788 18112 12525 1 16 . 1 1 144 144 LYS C C 144 177.243 177.243 178.331 -1.088 18112 12526 1 16 . 1 1 144 144 LYS CA C 144 58.851 58.851 59.057 -0.206 18112 12527 1 16 . 1 1 144 144 LYS CB C 144 29.373 29.373 30.921 -1.548 18112 12528 1 16 . 1 1 144 144 LYS H H 144 7.196 7.196 7.050 0.146 18112 12529 1 16 . 1 1 145 145 LYS N N 145 116.440 116.440 118.470 -2.030 18112 12530 1 16 . 1 1 145 145 LYS HA H 145 3.490 3.490 3.783 -0.293 18112 12531 1 16 . 1 1 145 145 LYS C C 145 179.149 179.149 178.689 0.460 18112 12532 1 16 . 1 1 145 145 LYS CA C 145 59.271 59.271 58.671 0.600 18112 12533 1 16 . 1 1 145 145 LYS CB C 145 30.521 30.521 31.664 -1.143 18112 12534 1 16 . 1 1 145 145 LYS H H 145 7.389 7.389 7.798 -0.409 18112 12535 1 16 . 1 1 146 146 ALA N N 146 118.582 118.582 123.343 -4.761 18112 12536 1 16 . 1 1 146 146 ALA HA H 146 3.932 3.932 4.075 -0.143 18112 12537 1 16 . 1 1 146 146 ALA C C 146 179.968 179.968 179.670 0.298 18112 12538 1 16 . 1 1 146 146 ALA CA C 146 54.241 54.241 54.834 -0.592 18112 12539 1 16 . 1 1 146 146 ALA CB C 146 17.689 17.689 18.186 -0.497 18112 12540 1 16 . 1 1 146 146 ALA H H 146 7.112 7.112 7.834 -0.722 18112 12541 1 16 . 1 1 147 147 ILE N N 147 118.537 118.537 119.845 -1.308 18112 12542 1 16 . 1 1 147 147 ILE HA H 147 3.642 3.642 3.540 0.102 18112 12543 1 16 . 1 1 147 147 ILE C C 147 178.919 178.919 177.915 1.004 18112 12544 1 16 . 1 1 147 147 ILE CA C 147 64.418 64.418 64.691 -0.273 18112 12545 1 16 . 1 1 147 147 ILE CB C 147 36.519 36.519 36.990 -0.471 18112 12546 1 16 . 1 1 147 147 ILE H H 147 6.734 6.734 7.918 -1.184 18112 12547 1 16 . 1 1 148 148 TYR N N 148 121.033 121.033 117.668 3.365 18112 12548 1 16 . 1 1 148 148 TYR HA H 148 4.489 4.489 4.185 0.304 18112 12549 1 16 . 1 1 148 148 TYR C C 148 178.348 178.348 178.484 -0.136 18112 12550 1 16 . 1 1 148 148 TYR CA C 148 57.389 57.389 58.971 -1.582 18112 12551 1 16 . 1 1 148 148 TYR CB C 148 35.280 35.280 37.190 -1.910 18112 12552 1 16 . 1 1 148 148 TYR H H 148 8.126 8.126 8.147 -0.021 18112 12553 1 16 . 1 1 149 149 LYS N N 149 114.484 114.484 120.054 -5.570 18112 12554 1 16 . 1 1 149 149 LYS C C 149 178.051 178.051 179.145 -1.094 18112 12555 1 16 . 1 1 149 149 LYS CA C 149 59.036 59.036 58.605 0.431 18112 12556 1 16 . 1 1 149 149 LYS CB C 149 31.575 31.575 32.280 -0.705 18112 12557 1 16 . 1 1 149 149 LYS H H 149 7.364 7.364 7.884 -0.520 18112 12558 1 16 . 1 1 150 150 VAL N N 150 117.812 117.812 116.920 0.892 18112 12559 1 16 . 1 1 150 150 VAL HA H 150 3.770 3.770 3.841 -0.071 18112 12560 1 16 . 1 1 150 150 VAL C C 150 178.786 178.786 177.510 1.276 18112 12561 1 16 . 1 1 150 150 VAL CA C 150 65.070 65.070 65.755 -0.686 18112 12562 1 16 . 1 1 150 150 VAL CB C 150 29.515 29.515 31.030 -1.515 18112 12563 1 16 . 1 1 150 150 VAL H H 150 7.254 7.254 7.891 -0.637 18112 12564 1 16 . 1 1 151 151 ILE N N 151 117.884 117.884 114.806 3.078 18112 12565 1 16 . 1 1 151 151 ILE C C 151 180.539 180.539 178.199 2.340 18112 12566 1 16 . 1 1 151 151 ILE CA C 151 61.490 61.490 63.416 -1.926 18112 12567 1 16 . 1 1 151 151 ILE CB C 151 33.994 33.994 38.456 -4.462 18112 12568 1 16 . 1 1 151 151 ILE H H 151 8.154 8.154 7.931 0.223 18112 12569 1 16 . 1 1 152 152 CYS N N 152 118.649 118.649 119.594 -0.945 18112 12570 1 16 . 1 1 152 152 CYS HA H 152 4.153 4.153 4.815 -0.662 18112 12571 1 16 . 1 1 152 152 CYS C C 152 174.888 174.888 176.957 -2.069 18112 12572 1 16 . 1 1 152 152 CYS CA C 152 61.052 61.052 60.201 0.851 18112 12573 1 16 . 1 1 152 152 CYS CB C 152 36.364 36.364 28.328 8.036 18112 12574 1 16 . 1 1 152 152 CYS H H 152 8.711 8.711 8.318 0.393 18112 12575 1 16 . 1 1 153 153 LYS N N 153 118.498 118.498 121.273 -2.775 18112 12576 1 16 . 1 1 153 153 LYS C C 153 177.389 177.389 176.966 0.423 18112 12577 1 16 . 1 1 153 153 LYS CA C 153 56.243 56.243 58.495 -2.252 18112 12578 1 16 . 1 1 153 153 LYS CB C 153 31.343 31.343 32.144 -0.801 18112 12579 1 16 . 1 1 153 153 LYS H H 153 6.782 6.782 7.961 -1.179 18112 12580 1 16 . 1 1 154 154 LEU N N 154 117.318 117.318 117.406 -0.088 18112 12581 1 16 . 1 1 154 154 LEU HA H 154 4.576 4.576 4.235 0.341 18112 12582 1 16 . 1 1 154 154 LEU C C 154 177.161 177.161 176.598 0.563 18112 12583 1 16 . 1 1 154 154 LEU CA C 154 53.782 53.782 54.650 -0.868 18112 12584 1 16 . 1 1 154 154 LEU CB C 154 40.881 40.881 41.658 -0.777 18112 12585 1 16 . 1 1 154 154 LEU H H 154 7.616 7.616 7.325 0.291 18112 12586 1 16 . 1 1 155 155 ASP N N 155 121.564 121.564 120.841 0.723 18112 12587 1 16 . 1 1 155 155 ASP C C 155 177.094 177.094 175.995 1.099 18112 12588 1 16 . 1 1 155 155 ASP CA C 155 55.732 55.732 54.843 0.889 18112 12589 1 16 . 1 1 155 155 ASP CB C 155 40.139 40.139 41.658 -1.519 18112 12590 1 16 . 1 1 155 155 ASP H H 155 7.582 7.582 7.501 0.081 18112 12591 1 16 . 1 1 156 156 SER N N 156 117.352 117.352 119.070 -1.718 18112 12592 1 16 . 1 1 156 156 SER HA H 156 4.818 4.818 4.558 0.260 18112 12593 1 16 . 1 1 156 156 SER C C 156 173.409 173.409 173.848 -0.439 18112 12594 1 16 . 1 1 156 156 SER CA C 156 57.073 57.073 57.657 -0.584 18112 12595 1 16 . 1 1 156 156 SER CB C 156 65.150 65.150 62.729 2.421 18112 12596 1 16 . 1 1 156 156 SER H H 156 8.846 8.846 8.576 0.270 18112 12597 1 16 . 1 1 157 157 GLU N N 157 120.688 120.688 118.708 1.980 18112 12598 1 16 . 1 1 157 157 GLU HA H 157 4.038 4.038 4.041 -0.003 18112 12599 1 16 . 1 1 157 157 GLU C C 157 176.332 176.332 174.343 1.989 18112 12600 1 16 . 1 1 157 157 GLU CA C 157 56.464 56.464 56.970 -0.506 18112 12601 1 16 . 1 1 157 157 GLU CB C 157 29.206 29.206 29.112 0.094 18112 12602 1 16 . 1 1 157 157 GLU H H 157 8.356 8.356 7.556 0.800 18112 12603 1 16 . 1 1 158 158 VAL N N 158 126.906 126.906 114.365 12.541 18112 12604 1 16 . 1 1 158 158 VAL HA H 158 3.449 3.449 4.342 -0.893 18112 12605 1 16 . 1 1 158 158 VAL C C 158 176.382 176.382 173.972 2.410 18112 12606 1 16 . 1 1 158 158 VAL CA C 158 59.584 59.584 58.835 0.749 18112 12607 1 16 . 1 1 158 158 VAL CB C 158 31.160 31.160 31.386 -0.226 18112 12608 1 16 . 1 1 158 158 VAL H H 158 8.561 8.561 7.867 0.694 18112 12609 1 16 . 1 1 159 159 PRO HA H 159 4.403 4.403 4.156 0.247 18112 12610 1 16 . 1 1 159 159 PRO C C 159 176.757 176.757 175.811 0.946 18112 12611 1 16 . 1 1 159 159 PRO CA C 159 63.845 63.845 63.334 0.511 18112 12612 1 16 . 1 1 159 159 PRO CB C 159 32.106 32.106 30.846 1.260 18112 12613 1 16 . 1 1 160 160 GLU N N 160 122.904 122.904 122.362 0.542 18112 12614 1 16 . 1 1 160 160 GLU HA H 160 4.008 4.008 4.126 -0.118 18112 12615 1 16 . 1 1 160 160 GLU C C 160 179.132 179.132 176.861 2.271 18112 12616 1 16 . 1 1 160 160 GLU CA C 160 59.407 59.407 57.077 2.330 18112 12617 1 16 . 1 1 160 160 GLU CB C 160 28.991 28.991 29.959 -0.968 18112 12618 1 16 . 1 1 160 160 GLU H H 160 8.650 8.650 8.393 0.257 18112 12619 1 16 . 1 1 161 161 ILE N N 161 119.782 119.782 118.546 1.236 18112 12620 1 16 . 1 1 161 161 ILE HA H 161 4.146 4.146 4.239 -0.093 18112 12621 1 16 . 1 1 161 161 ILE C C 161 176.176 176.176 174.313 1.863 18112 12622 1 16 . 1 1 161 161 ILE CA C 161 62.034 62.034 60.683 1.351 18112 12623 1 16 . 1 1 161 161 ILE CB C 161 37.113 37.113 38.803 -1.690 18112 12624 1 16 . 1 1 161 161 ILE H H 161 8.448 8.448 7.206 1.242 18112 12625 1 16 . 1 1 162 162 PHE N N 162 117.594 117.594 126.382 -8.788 18112 12626 1 16 . 1 1 162 162 PHE C C 162 176.115 176.115 176.695 -0.580 18112 12627 1 16 . 1 1 162 162 PHE CA C 162 61.009 61.009 59.915 1.094 18112 12628 1 16 . 1 1 162 162 PHE CB C 162 38.394 38.394 39.095 -0.701 18112 12629 1 16 . 1 1 162 162 PHE H H 162 8.145 8.145 8.773 -0.628 18112 12630 1 16 . 1 1 163 163 LYS N N 163 116.083 116.083 119.577 -3.494 18112 12631 1 16 . 1 1 163 163 LYS C C 163 178.196 178.196 176.832 1.364 18112 12632 1 16 . 1 1 163 163 LYS CA C 163 58.136 58.136 57.974 0.162 18112 12633 1 16 . 1 1 163 163 LYS CB C 163 31.694 31.694 32.835 -1.141 18112 12634 1 16 . 1 1 163 163 LYS H H 163 8.232 8.232 7.991 0.241 18112 12635 1 16 . 1 1 164 164 SER N N 164 113.680 113.680 113.388 0.292 18112 12636 1 16 . 1 1 164 164 SER CA C 164 55.205 55.205 56.653 -1.448 18112 12637 1 16 . 1 1 164 164 SER CB C 164 63.265 63.265 63.997 -0.732 18112 12638 1 16 . 1 1 164 164 SER H H 164 7.708 7.708 7.711 -0.003 18112 12639 1 16 . 1 1 165 165 PRO HA H 165 4.580 4.580 4.566 0.014 18112 12640 1 16 . 1 1 165 165 PRO C C 165 177.541 177.541 176.376 1.165 18112 12641 1 16 . 1 1 165 165 PRO CA C 165 63.950 63.950 63.776 0.174 18112 12642 1 16 . 1 1 165 165 PRO CB C 165 30.686 30.686 32.046 -1.360 18112 12643 1 16 . 1 1 166 166 ASN N N 166 116.304 116.304 116.302 0.002 18112 12644 1 16 . 1 1 166 166 ASN HA H 166 5.029 5.029 4.392 0.637 18112 12645 1 16 . 1 1 166 166 ASN C C 166 175.811 175.811 176.439 -0.628 18112 12646 1 16 . 1 1 166 166 ASN CA C 166 51.962 51.962 54.932 -2.970 18112 12647 1 16 . 1 1 166 166 ASN CB C 166 37.915 37.915 37.083 0.832 18112 12648 1 16 . 1 1 166 166 ASN H H 166 8.216 8.216 8.831 -0.615 18112 12649 1 16 . 1 1 167 167 CYS N N 167 116.078 116.078 120.981 -4.903 18112 12650 1 16 . 1 1 167 167 CYS HA H 167 4.011 4.011 4.340 -0.329 18112 12651 1 16 . 1 1 167 167 CYS C C 167 175.057 175.057 175.937 -0.880 18112 12652 1 16 . 1 1 167 167 CYS CA C 167 59.816 59.816 60.998 -1.182 18112 12653 1 16 . 1 1 167 167 CYS CB C 167 27.446 27.446 26.885 0.561 18112 12654 1 16 . 1 1 167 167 CYS H H 167 7.246 7.246 7.854 -0.608 18112 12655 1 16 . 1 1 168 168 LEU N N 168 120.082 120.082 118.490 1.592 18112 12656 1 16 . 1 1 168 168 LEU HA H 168 3.880 3.880 4.381 -0.501 18112 12657 1 16 . 1 1 168 168 LEU C C 168 178.541 178.541 178.235 0.306 18112 12658 1 16 . 1 1 168 168 LEU CA C 168 57.734 57.734 56.265 1.469 18112 12659 1 16 . 1 1 168 168 LEU CB C 168 38.825 38.825 39.664 -0.839 18112 12660 1 16 . 1 1 168 168 LEU H H 168 8.451 8.451 8.249 0.202 18112 12661 1 16 . 1 1 169 169 GLN N N 169 116.700 116.700 119.759 -3.059 18112 12662 1 16 . 1 1 169 169 GLN HA H 169 4.064 4.064 3.966 0.098 18112 12663 1 16 . 1 1 169 169 GLN C C 169 177.378 177.378 176.746 0.632 18112 12664 1 16 . 1 1 169 169 GLN CA C 169 57.675 57.675 58.414 -0.739 18112 12665 1 16 . 1 1 169 169 GLN CB C 169 27.710 27.710 28.347 -0.637 18112 12666 1 16 . 1 1 169 169 GLN H H 169 7.665 7.665 7.643 0.022 18112 12667 1 16 . 1 1 170 170 GLU N N 170 116.701 116.701 117.652 -0.951 18112 12668 1 16 . 1 1 170 170 GLU HA H 170 4.214 4.214 4.107 0.107 18112 12669 1 16 . 1 1 170 170 GLU C C 170 177.730 177.730 178.480 -0.750 18112 12670 1 16 . 1 1 170 170 GLU CA C 170 56.899 56.899 58.276 -1.377 18112 12671 1 16 . 1 1 170 170 GLU H H 170 7.405 7.405 7.626 -0.221 18112 12672 1 16 . 1 1 171 171 LEU N N 171 118.021 118.021 118.095 -0.074 18112 12673 1 16 . 1 1 171 171 LEU HA H 171 4.209 4.209 4.195 0.014 18112 12674 1 16 . 1 1 171 171 LEU C C 171 177.005 177.005 177.999 -0.994 18112 12675 1 16 . 1 1 171 171 LEU CA C 171 55.870 55.870 56.297 -0.427 18112 12676 1 16 . 1 1 171 171 LEU CB C 171 43.680 43.680 42.536 1.144 18112 12677 1 16 . 1 1 171 171 LEU H H 171 7.823 7.823 7.490 0.333 18112 12678 1 16 . 1 1 172 172 LEU N N 172 117.580 117.580 117.276 0.304 18112 12679 1 16 . 1 1 172 172 LEU HA H 172 4.571 4.571 4.345 0.226 18112 12680 1 16 . 1 1 172 172 LEU C C 172 176.411 176.411 175.667 0.744 18112 12681 1 16 . 1 1 172 172 LEU CA C 172 53.972 53.972 54.575 -0.603 18112 12682 1 16 . 1 1 172 172 LEU CB C 172 40.483 40.483 38.894 1.589 18112 12683 1 16 . 1 1 172 172 LEU H H 172 7.306 7.306 7.557 -0.251 18112 12684 1 16 . 1 1 173 173 HIS N N 173 123.310 123.310 121.485 1.825 18112 12685 1 16 . 1 1 173 173 HIS C C 173 179.022 179.022 174.126 4.896 18112 12686 1 16 . 1 1 173 173 HIS CA C 173 56.693 56.693 55.213 1.480 18112 12687 1 16 . 1 1 173 173 HIS CB C 173 29.371 29.371 32.316 -2.945 18112 12688 1 16 . 1 1 173 173 HIS H H 173 8.028 8.028 8.076 -0.048 18112 12689 1 17 . 1 1 12 12 ALA N N 12 125.167 125.167 121.832 3.335 18112 12690 1 17 . 1 1 12 12 ALA C C 12 177.566 177.566 177.609 -0.043 18112 12691 1 17 . 1 1 12 12 ALA CA C 12 52.067 52.067 51.886 0.181 18112 12692 1 17 . 1 1 12 12 ALA CB C 12 18.456 18.456 19.687 -1.231 18112 12693 1 17 . 1 1 12 12 ALA H H 12 8.311 8.311 7.992 0.319 18112 12694 1 17 . 1 1 13 13 MET N N 13 119.278 119.278 120.255 -0.977 18112 12695 1 17 . 1 1 13 13 MET C C 13 176.325 176.325 175.609 0.716 18112 12696 1 17 . 1 1 13 13 MET CA C 13 54.992 54.992 55.843 -0.851 18112 12697 1 17 . 1 1 13 13 MET CB C 13 32.308 32.308 30.247 2.061 18112 12698 1 17 . 1 1 13 13 MET H H 13 8.269 8.269 8.453 -0.184 18112 12699 1 17 . 1 1 14 14 GLN N N 14 120.869 120.869 121.485 -0.616 18112 12700 1 17 . 1 1 14 14 GLN HA H 14 4.399 4.399 4.561 -0.162 18112 12701 1 17 . 1 1 14 14 GLN C C 14 175.644 175.644 175.402 0.242 18112 12702 1 17 . 1 1 14 14 GLN CA C 14 55.139 55.139 55.248 -0.109 18112 12703 1 17 . 1 1 14 14 GLN CB C 14 29.051 29.051 31.613 -2.562 18112 12704 1 17 . 1 1 14 14 GLN H H 14 8.501 8.501 7.910 0.591 18112 12705 1 17 . 1 1 15 15 GLU N N 15 122.042 122.042 121.685 0.357 18112 12706 1 17 . 1 1 15 15 GLU C C 15 176.242 176.242 177.279 -1.037 18112 12707 1 17 . 1 1 15 15 GLU CA C 15 56.064 56.064 56.508 -0.444 18112 12708 1 17 . 1 1 15 15 GLU CB C 15 29.302 29.302 29.673 -0.371 18112 12709 1 17 . 1 1 15 15 GLU H H 15 8.547 8.547 8.799 -0.252 18112 12710 1 17 . 1 1 16 16 GLY N N 16 108.821 108.821 108.734 0.087 18112 12711 1 17 . 1 1 16 16 GLY C C 16 172.949 172.949 174.041 -1.092 18112 12712 1 17 . 1 1 16 16 GLY CA C 16 44.227 44.227 44.940 -0.713 18112 12713 1 17 . 1 1 16 16 GLY H H 16 8.100 8.100 8.209 -0.109 18112 12714 1 17 . 1 1 17 17 LEU N N 17 120.315 120.315 118.666 1.649 18112 12715 1 17 . 1 1 17 17 LEU C C 17 177.334 177.334 176.673 0.661 18112 12716 1 17 . 1 1 17 17 LEU CA C 17 53.544 53.544 55.704 -2.160 18112 12717 1 17 . 1 1 17 17 LEU CB C 17 42.140 42.140 39.963 2.177 18112 12718 1 17 . 1 1 17 17 LEU H H 17 8.222 8.222 8.146 0.076 18112 12719 1 17 . 1 1 18 18 SER N N 18 126.547 126.547 111.869 14.678 18112 12720 1 17 . 1 1 18 18 SER CA C 18 56.851 56.851 59.374 -2.523 18112 12721 1 17 . 1 1 18 18 SER CB C 18 64.636 64.636 62.635 2.001 18112 12722 1 17 . 1 1 18 18 SER H H 18 11.627 11.627 8.439 3.188 18112 12723 1 17 . 1 1 19 19 PRO C C 19 175.118 175.118 177.261 -2.143 18112 12724 1 17 . 1 1 20 20 ASN N N 20 121.372 121.372 115.488 5.884 18112 12725 1 17 . 1 1 20 20 ASN H H 20 8.172 8.172 8.548 -0.376 18112 12726 1 17 . 1 1 25 25 ALA CB C 25 18.020 18.020 18.032 -0.012 18112 12727 1 17 . 1 1 26 26 LYS N N 26 118.490 118.490 118.201 0.289 18112 12728 1 17 . 1 1 26 26 LYS CA C 26 56.146 56.146 57.799 -1.653 18112 12729 1 17 . 1 1 26 26 LYS H H 26 6.794 6.794 7.359 -0.565 18112 12730 1 17 . 1 1 31 31 TYR HA H 31 4.398 4.398 5.007 -0.609 18112 12731 1 17 . 1 1 31 31 TYR C C 31 173.714 173.714 176.170 -2.456 18112 12732 1 17 . 1 1 31 31 TYR CA C 31 59.757 59.757 56.986 2.771 18112 12733 1 17 . 1 1 32 32 THR N N 32 111.928 111.928 118.882 -6.954 18112 12734 1 17 . 1 1 32 32 THR HA H 32 4.209 4.209 4.136 0.073 18112 12735 1 17 . 1 1 32 32 THR C C 32 171.061 171.061 174.751 -3.690 18112 12736 1 17 . 1 1 32 32 THR CA C 32 56.905 56.905 63.056 -6.151 18112 12737 1 17 . 1 1 32 32 THR CB C 32 69.707 69.707 69.573 0.134 18112 12738 1 17 . 1 1 32 32 THR H H 32 8.237 8.237 7.646 0.591 18112 12739 1 17 . 1 1 33 33 ARG N N 33 124.856 124.856 126.281 -1.425 18112 12740 1 17 . 1 1 33 33 ARG C C 33 176.451 176.451 175.964 0.487 18112 12741 1 17 . 1 1 33 33 ARG CA C 33 55.627 55.627 54.486 1.141 18112 12742 1 17 . 1 1 33 33 ARG CB C 33 29.861 29.861 31.333 -1.472 18112 12743 1 17 . 1 1 33 33 ARG H H 33 9.159 9.159 8.708 0.451 18112 12744 1 17 . 1 1 34 34 TYR N N 34 117.908 117.908 112.865 5.043 18112 12745 1 17 . 1 1 34 34 TYR CA C 34 55.320 55.320 58.045 -2.725 18112 12746 1 17 . 1 1 34 34 TYR H H 34 8.995 8.995 8.589 0.406 18112 12747 1 17 . 1 1 35 35 PRO C C 35 177.280 177.280 177.866 -0.586 18112 12748 1 17 . 1 1 36 36 SER N N 36 116.410 116.410 117.762 -1.352 18112 12749 1 17 . 1 1 36 36 SER C C 36 178.938 178.938 176.080 2.858 18112 12750 1 17 . 1 1 36 36 SER CA C 36 64.815 64.815 62.305 2.510 18112 12751 1 17 . 1 1 36 36 SER H H 36 8.106 8.106 8.549 -0.443 18112 12752 1 17 . 1 1 37 37 SER N N 37 117.488 117.488 116.225 1.263 18112 12753 1 17 . 1 1 37 37 SER C C 37 177.698 177.698 176.648 1.050 18112 12754 1 17 . 1 1 37 37 SER CA C 37 61.357 61.357 61.308 0.049 18112 12755 1 17 . 1 1 37 37 SER CB C 37 68.118 68.118 62.496 5.622 18112 12756 1 17 . 1 1 37 37 SER H H 37 8.169 8.169 8.136 0.033 18112 12757 1 17 . 1 1 38 38 ASN N N 38 115.638 115.638 119.987 -4.349 18112 12758 1 17 . 1 1 38 38 ASN HA H 38 4.259 4.259 4.266 -0.007 18112 12759 1 17 . 1 1 38 38 ASN C C 38 177.868 177.868 177.145 0.723 18112 12760 1 17 . 1 1 38 38 ASN CA C 38 55.907 55.907 55.764 0.143 18112 12761 1 17 . 1 1 38 38 ASN CB C 38 37.230 37.230 38.294 -1.064 18112 12762 1 17 . 1 1 38 38 ASN H H 38 8.284 8.284 7.491 0.793 18112 12763 1 17 . 1 1 39 39 MET N N 39 121.352 121.352 120.695 0.657 18112 12764 1 17 . 1 1 39 39 MET HA H 39 4.170 4.170 3.545 0.625 18112 12765 1 17 . 1 1 39 39 MET C C 39 179.068 179.068 177.486 1.582 18112 12766 1 17 . 1 1 39 39 MET CA C 39 58.751 58.751 57.540 1.211 18112 12767 1 17 . 1 1 39 39 MET CB C 39 31.850 31.850 31.864 -0.014 18112 12768 1 17 . 1 1 39 39 MET H H 39 7.857 7.857 7.632 0.225 18112 12769 1 17 . 1 1 40 40 LEU N N 40 118.936 118.936 120.028 -1.092 18112 12770 1 17 . 1 1 40 40 LEU HA H 40 4.139 4.139 4.119 0.020 18112 12771 1 17 . 1 1 40 40 LEU C C 40 178.700 178.700 178.549 0.151 18112 12772 1 17 . 1 1 40 40 LEU CA C 40 58.455 58.455 58.861 -0.406 18112 12773 1 17 . 1 1 40 40 LEU CB C 40 40.304 40.304 41.662 -1.358 18112 12774 1 17 . 1 1 40 40 LEU H H 40 8.167 8.167 7.981 0.186 18112 12775 1 17 . 1 1 41 41 LYS N N 41 116.791 116.791 116.896 -0.105 18112 12776 1 17 . 1 1 41 41 LYS HA H 41 3.475 3.475 4.166 -0.691 18112 12777 1 17 . 1 1 41 41 LYS C C 41 178.793 178.793 178.529 0.264 18112 12778 1 17 . 1 1 41 41 LYS CA C 41 59.161 59.161 58.123 1.038 18112 12779 1 17 . 1 1 41 41 LYS CB C 41 30.992 30.992 31.881 -0.889 18112 12780 1 17 . 1 1 41 41 LYS H H 41 7.632 7.632 7.850 -0.218 18112 12781 1 17 . 1 1 42 42 THR N N 42 112.819 112.819 115.367 -2.548 18112 12782 1 17 . 1 1 42 42 THR HA H 42 4.230 4.230 4.025 0.205 18112 12783 1 17 . 1 1 42 42 THR C C 42 176.142 176.142 176.951 -0.809 18112 12784 1 17 . 1 1 42 42 THR CA C 42 65.107 65.107 66.121 -1.014 18112 12785 1 17 . 1 1 42 42 THR CB C 42 68.306 68.306 68.539 -0.233 18112 12786 1 17 . 1 1 42 42 THR H H 42 7.469 7.469 7.753 -0.284 18112 12787 1 17 . 1 1 43 43 TYR N N 43 118.565 118.565 118.542 0.023 18112 12788 1 17 . 1 1 43 43 TYR HA H 43 4.204 4.204 4.458 -0.254 18112 12789 1 17 . 1 1 43 43 TYR C C 43 174.240 174.240 177.050 -2.810 18112 12790 1 17 . 1 1 43 43 TYR CA C 43 60.886 60.886 58.520 2.365 18112 12791 1 17 . 1 1 43 43 TYR CB C 43 38.165 38.165 38.533 -0.368 18112 12792 1 17 . 1 1 43 43 TYR H H 43 7.978 7.978 7.689 0.289 18112 12793 1 17 . 1 1 44 44 PHE N N 44 120.980 120.980 116.139 4.841 18112 12794 1 17 . 1 1 44 44 PHE HA H 44 4.920 4.920 4.858 0.062 18112 12795 1 17 . 1 1 44 44 PHE C C 44 176.436 176.436 176.670 -0.234 18112 12796 1 17 . 1 1 44 44 PHE CA C 44 56.672 56.672 55.231 1.441 18112 12797 1 17 . 1 1 44 44 PHE CB C 44 36.570 36.570 37.489 -0.919 18112 12798 1 17 . 1 1 44 44 PHE H H 44 7.955 7.955 8.154 -0.199 18112 12799 1 17 . 1 1 45 45 SER N N 45 113.407 113.407 116.769 -3.362 18112 12800 1 17 . 1 1 45 45 SER HA H 45 4.373 4.373 4.385 -0.012 18112 12801 1 17 . 1 1 45 45 SER C C 45 174.424 174.424 175.623 -1.199 18112 12802 1 17 . 1 1 45 45 SER CA C 45 61.037 61.037 60.844 0.193 18112 12803 1 17 . 1 1 45 45 SER CB C 45 62.711 62.711 63.170 -0.459 18112 12804 1 17 . 1 1 45 45 SER H H 45 7.932 7.932 8.094 -0.162 18112 12805 1 17 . 1 1 46 46 ASP N N 46 118.099 118.099 120.033 -1.934 18112 12806 1 17 . 1 1 46 46 ASP HA H 46 4.572 4.572 4.533 0.039 18112 12807 1 17 . 1 1 46 46 ASP C C 46 174.866 174.866 176.150 -1.284 18112 12808 1 17 . 1 1 46 46 ASP CA C 46 53.602 53.602 55.576 -1.974 18112 12809 1 17 . 1 1 46 46 ASP CB C 46 38.992 38.992 41.514 -2.522 18112 12810 1 17 . 1 1 46 46 ASP H H 46 9.889 9.889 8.443 1.446 18112 12811 1 17 . 1 1 47 47 VAL N N 47 121.496 121.496 120.640 0.856 18112 12812 1 17 . 1 1 47 47 VAL HA H 47 4.058 4.058 3.518 0.540 18112 12813 1 17 . 1 1 47 47 VAL C C 47 174.676 174.676 175.220 -0.544 18112 12814 1 17 . 1 1 47 47 VAL CA C 47 61.006 61.006 63.245 -2.239 18112 12815 1 17 . 1 1 47 47 VAL CB C 47 32.110 32.110 31.529 0.581 18112 12816 1 17 . 1 1 47 47 VAL H H 47 7.781 7.781 7.327 0.454 18112 12817 1 17 . 1 1 48 48 LYS N N 48 126.100 126.100 128.624 -2.524 18112 12818 1 17 . 1 1 48 48 LYS HA H 48 4.402 4.402 4.168 0.234 18112 12819 1 17 . 1 1 48 48 LYS C C 48 175.564 175.564 175.838 -0.274 18112 12820 1 17 . 1 1 48 48 LYS CA C 48 54.874 54.874 54.686 0.188 18112 12821 1 17 . 1 1 48 48 LYS CB C 48 30.189 30.189 29.763 0.426 18112 12822 1 17 . 1 1 48 48 LYS H H 48 8.245 8.245 8.580 -0.335 18112 12823 1 17 . 1 1 49 49 PHE N N 49 125.341 125.341 123.100 2.241 18112 12824 1 17 . 1 1 49 49 PHE HA H 49 3.813 3.813 4.212 -0.399 18112 12825 1 17 . 1 1 49 49 PHE C C 49 175.708 175.708 176.373 -0.665 18112 12826 1 17 . 1 1 49 49 PHE CA C 49 60.861 60.861 58.477 2.384 18112 12827 1 17 . 1 1 49 49 PHE CB C 49 38.616 38.616 37.594 1.022 18112 12828 1 17 . 1 1 49 49 PHE H H 49 8.626 8.626 7.754 0.872 18112 12829 1 17 . 1 1 50 50 ASN N N 50 115.408 115.408 123.002 -7.594 18112 12830 1 17 . 1 1 50 50 ASN C C 50 176.072 176.072 175.887 0.185 18112 12831 1 17 . 1 1 50 50 ASN CA C 50 51.730 51.730 51.344 0.386 18112 12832 1 17 . 1 1 50 50 ASN H H 50 7.030 7.030 7.937 -0.907 18112 12833 1 17 . 1 1 51 51 ARG N N 51 122.706 122.706 123.645 -0.939 18112 12834 1 17 . 1 1 51 51 ARG CA C 51 59.534 59.534 59.898 -0.364 18112 12835 1 17 . 1 1 51 51 ARG H H 51 7.790 7.790 9.014 -1.224 18112 12836 1 17 . 1 1 52 52 CYS N N 52 117.340 117.340 116.429 0.911 18112 12837 1 17 . 1 1 52 52 CYS HA H 52 4.108 4.108 4.114 -0.006 18112 12838 1 17 . 1 1 52 52 CYS C C 52 178.200 178.200 177.018 1.182 18112 12839 1 17 . 1 1 52 52 CYS CA C 52 61.143 61.143 62.227 -1.084 18112 12840 1 17 . 1 1 52 52 CYS H H 52 7.681 7.681 7.803 -0.122 18112 12841 1 17 . 1 1 53 53 ILE N N 53 122.321 122.321 119.116 3.205 18112 12842 1 17 . 1 1 53 53 ILE HA H 53 3.588 3.588 3.992 -0.404 18112 12843 1 17 . 1 1 53 53 ILE C C 53 177.492 177.492 177.648 -0.156 18112 12844 1 17 . 1 1 53 53 ILE CA C 53 64.109 64.109 63.408 0.701 18112 12845 1 17 . 1 1 53 53 ILE CB C 53 37.603 37.603 37.523 0.080 18112 12846 1 17 . 1 1 53 53 ILE H H 53 8.035 8.035 7.528 0.507 18112 12847 1 17 . 1 1 54 54 THR C C 54 175.903 175.903 176.844 -0.941 18112 12848 1 17 . 1 1 54 54 THR CA C 54 67.308 67.308 67.027 0.281 18112 12849 1 17 . 1 1 55 55 SER N N 55 113.819 113.819 117.094 -3.275 18112 12850 1 17 . 1 1 55 55 SER H H 55 7.844 7.844 8.085 -0.241 18112 12851 1 17 . 1 1 56 56 GLN C C 56 179.792 179.792 177.863 1.929 18112 12852 1 17 . 1 1 57 57 LEU N N 57 116.701 116.701 120.197 -3.496 18112 12853 1 17 . 1 1 57 57 LEU HA H 57 4.519 4.519 3.279 1.240 18112 12854 1 17 . 1 1 57 57 LEU C C 57 178.775 178.775 178.982 -0.207 18112 12855 1 17 . 1 1 57 57 LEU CA C 57 55.232 55.232 57.430 -2.198 18112 12856 1 17 . 1 1 57 57 LEU CB C 57 37.131 37.131 42.150 -5.019 18112 12857 1 17 . 1 1 57 57 LEU H H 57 8.267 8.267 7.783 0.484 18112 12858 1 17 . 1 1 58 58 ILE N N 58 122.522 122.522 118.473 4.049 18112 12859 1 17 . 1 1 58 58 ILE HA H 58 4.640 4.640 3.868 0.772 18112 12860 1 17 . 1 1 58 58 ILE C C 58 177.380 177.380 178.137 -0.757 18112 12861 1 17 . 1 1 58 58 ILE CA C 58 62.163 62.163 64.968 -2.805 18112 12862 1 17 . 1 1 58 58 ILE CB C 58 30.657 30.657 37.549 -6.892 18112 12863 1 17 . 1 1 58 58 ILE H H 58 8.111 8.111 8.207 -0.096 18112 12864 1 17 . 1 1 59 59 LYS N N 59 121.002 121.002 121.851 -0.849 18112 12865 1 17 . 1 1 59 59 LYS C C 59 177.600 177.600 178.788 -1.188 18112 12866 1 17 . 1 1 59 59 LYS CA C 59 57.570 57.570 59.596 -2.026 18112 12867 1 17 . 1 1 59 59 LYS CB C 59 39.101 39.101 32.213 6.888 18112 12868 1 17 . 1 1 59 59 LYS H H 59 7.432 7.432 8.071 -0.639 18112 12869 1 17 . 1 1 60 60 TRP N N 60 118.679 118.679 120.130 -1.451 18112 12870 1 17 . 1 1 60 60 TRP HA H 60 3.739 3.739 4.515 -0.776 18112 12871 1 17 . 1 1 60 60 TRP C C 60 178.246 178.246 179.432 -1.186 18112 12872 1 17 . 1 1 60 60 TRP CA C 60 59.818 59.818 59.695 0.123 18112 12873 1 17 . 1 1 60 60 TRP CB C 60 31.851 31.851 28.619 3.232 18112 12874 1 17 . 1 1 60 60 TRP H H 60 7.565 7.565 8.184 -0.619 18112 12875 1 17 . 1 1 61 61 PHE N N 61 118.005 118.005 117.131 0.874 18112 12876 1 17 . 1 1 61 61 PHE HA H 61 3.882 3.882 4.151 -0.269 18112 12877 1 17 . 1 1 61 61 PHE CA C 61 60.054 60.054 62.001 -1.947 18112 12878 1 17 . 1 1 61 61 PHE H H 61 7.819 7.819 8.753 -0.934 18112 12879 1 17 . 1 1 62 62 SER N N 62 121.144 121.144 116.011 5.133 18112 12880 1 17 . 1 1 62 62 SER C C 62 177.840 177.840 176.595 1.245 18112 12881 1 17 . 1 1 62 62 SER CA C 62 55.892 55.892 61.835 -5.943 18112 12882 1 17 . 1 1 62 62 SER H H 62 8.878 8.878 8.305 0.573 18112 12883 1 17 . 1 1 63 63 ASN N N 63 115.303 115.303 120.423 -5.120 18112 12884 1 17 . 1 1 63 63 ASN C C 63 177.222 177.222 177.852 -0.630 18112 12885 1 17 . 1 1 63 63 ASN CA C 63 60.467 60.467 56.102 4.365 18112 12886 1 17 . 1 1 63 63 ASN H H 63 8.001 8.001 8.322 -0.321 18112 12887 1 17 . 1 1 64 64 PHE N N 64 112.571 112.571 121.972 -9.401 18112 12888 1 17 . 1 1 64 64 PHE CA C 64 56.453 56.453 61.903 -5.450 18112 12889 1 17 . 1 1 64 64 PHE H H 64 7.082 7.082 8.633 -1.551 18112 12890 1 17 . 1 1 65 65 ARG N N 65 116.695 116.695 119.143 -2.448 18112 12891 1 17 . 1 1 65 65 ARG CA C 65 59.590 59.590 59.340 0.250 18112 12892 1 17 . 1 1 65 65 ARG H H 65 8.091 8.091 8.331 -0.240 18112 12893 1 17 . 1 1 66 66 GLU N N 66 121.653 121.653 120.264 1.389 18112 12894 1 17 . 1 1 66 66 GLU HA H 66 4.739 4.739 4.202 0.537 18112 12895 1 17 . 1 1 66 66 GLU C C 66 174.621 174.621 178.862 -4.241 18112 12896 1 17 . 1 1 66 66 GLU CA C 66 59.583 59.583 59.527 0.056 18112 12897 1 17 . 1 1 66 66 GLU H H 66 7.597 7.597 8.170 -0.573 18112 12898 1 17 . 1 1 67 67 PHE N N 67 111.578 111.578 121.634 -10.056 18112 12899 1 17 . 1 1 67 67 PHE C C 67 176.164 176.164 177.237 -1.073 18112 12900 1 17 . 1 1 67 67 PHE CA C 67 61.156 61.156 60.975 0.181 18112 12901 1 17 . 1 1 67 67 PHE H H 67 7.067 7.067 8.308 -1.241 18112 12902 1 17 . 1 1 68 68 TYR N N 68 119.370 119.370 121.526 -2.156 18112 12903 1 17 . 1 1 68 68 TYR C C 68 176.844 176.844 177.420 -0.576 18112 12904 1 17 . 1 1 68 68 TYR CA C 68 61.758 61.758 61.491 0.267 18112 12905 1 17 . 1 1 68 68 TYR H H 68 7.442 7.442 8.780 -1.338 18112 12906 1 17 . 1 1 69 69 TYR N N 69 116.047 116.047 120.092 -4.045 18112 12907 1 17 . 1 1 69 69 TYR HA H 69 4.086 4.086 4.122 -0.036 18112 12908 1 17 . 1 1 69 69 TYR C C 69 180.328 180.328 177.393 2.935 18112 12909 1 17 . 1 1 69 69 TYR CA C 69 61.528 61.528 61.754 -0.226 18112 12910 1 17 . 1 1 69 69 TYR H H 69 9.127 9.127 8.275 0.852 18112 12911 1 17 . 1 1 70 70 ILE N N 70 124.738 124.738 118.144 6.594 18112 12912 1 17 . 1 1 70 70 ILE HA H 70 3.828 3.828 3.419 0.409 18112 12913 1 17 . 1 1 70 70 ILE C C 70 179.585 179.585 178.128 1.457 18112 12914 1 17 . 1 1 70 70 ILE CA C 70 65.787 65.787 64.086 1.701 18112 12915 1 17 . 1 1 70 70 ILE CB C 70 36.435 36.435 36.256 0.179 18112 12916 1 17 . 1 1 70 70 ILE H H 70 8.631 8.631 8.448 0.183 18112 12917 1 17 . 1 1 71 71 GLN N N 71 117.940 117.940 118.311 -0.371 18112 12918 1 17 . 1 1 71 71 GLN HA H 71 3.826 3.826 3.276 0.550 18112 12919 1 17 . 1 1 71 71 GLN C C 71 178.192 178.192 177.974 0.218 18112 12920 1 17 . 1 1 71 71 GLN CA C 71 57.779 57.779 57.829 -0.050 18112 12921 1 17 . 1 1 71 71 GLN H H 71 7.738 7.738 7.526 0.212 18112 12922 1 17 . 1 1 72 72 MET N N 72 117.353 117.353 117.812 -0.459 18112 12923 1 17 . 1 1 72 72 MET HA H 72 4.112 4.112 4.049 0.063 18112 12924 1 17 . 1 1 72 72 MET C C 72 177.203 177.203 178.290 -1.087 18112 12925 1 17 . 1 1 72 72 MET CA C 72 57.272 57.272 56.974 0.298 18112 12926 1 17 . 1 1 72 72 MET H H 72 7.844 7.844 7.676 0.168 18112 12927 1 17 . 1 1 73 73 GLU N N 73 117.858 117.858 119.397 -1.539 18112 12928 1 17 . 1 1 73 73 GLU HA H 73 3.572 3.572 3.217 0.355 18112 12929 1 17 . 1 1 73 73 GLU C C 73 177.344 177.344 178.424 -1.080 18112 12930 1 17 . 1 1 73 73 GLU CA C 73 60.324 60.324 59.221 1.103 18112 12931 1 17 . 1 1 73 73 GLU H H 73 7.503 7.503 7.552 -0.049 18112 12932 1 17 . 1 1 74 74 LYS N N 74 118.716 118.716 119.496 -0.780 18112 12933 1 17 . 1 1 74 74 LYS HA H 74 3.867 3.867 3.856 0.011 18112 12934 1 17 . 1 1 74 74 LYS C C 74 180.077 180.077 179.250 0.827 18112 12935 1 17 . 1 1 74 74 LYS CA C 74 59.754 59.754 59.413 0.341 18112 12936 1 17 . 1 1 74 74 LYS H H 74 7.912 7.912 7.414 0.498 18112 12937 1 17 . 1 1 75 75 TYR N N 75 117.309 117.309 118.388 -1.079 18112 12938 1 17 . 1 1 75 75 TYR HA H 75 4.085 4.085 4.163 -0.078 18112 12939 1 17 . 1 1 75 75 TYR C C 75 178.874 178.874 178.214 0.660 18112 12940 1 17 . 1 1 75 75 TYR CA C 75 63.306 63.306 59.666 3.639 18112 12941 1 17 . 1 1 75 75 TYR H H 75 8.421 8.421 7.743 0.678 18112 12942 1 17 . 1 1 76 76 ALA N N 76 125.392 125.392 122.096 3.296 18112 12943 1 17 . 1 1 76 76 ALA HA H 76 4.221 4.221 4.089 0.132 18112 12944 1 17 . 1 1 76 76 ALA C C 76 178.850 178.850 179.321 -0.471 18112 12945 1 17 . 1 1 76 76 ALA CA C 76 56.280 56.280 55.323 0.957 18112 12946 1 17 . 1 1 76 76 ALA CB C 76 18.687 18.687 18.526 0.161 18112 12947 1 17 . 1 1 76 76 ALA H H 76 8.553 8.553 8.207 0.346 18112 12948 1 17 . 1 1 77 77 ARG N N 77 115.067 115.067 117.570 -2.503 18112 12949 1 17 . 1 1 77 77 ARG HA H 77 3.935 3.935 3.897 0.038 18112 12950 1 17 . 1 1 77 77 ARG C C 77 179.341 179.341 178.243 1.098 18112 12951 1 17 . 1 1 77 77 ARG CA C 77 60.499 60.499 59.068 1.431 18112 12952 1 17 . 1 1 77 77 ARG H H 77 8.471 8.471 8.268 0.203 18112 12953 1 17 . 1 1 78 78 GLN N N 78 120.107 120.107 120.089 0.018 18112 12954 1 17 . 1 1 78 78 GLN HA H 78 3.921 3.921 4.174 -0.253 18112 12955 1 17 . 1 1 78 78 GLN C C 78 177.289 177.289 178.107 -0.818 18112 12956 1 17 . 1 1 78 78 GLN CA C 78 58.619 58.619 58.398 0.221 18112 12957 1 17 . 1 1 78 78 GLN CB C 78 27.752 27.752 28.703 -0.951 18112 12958 1 17 . 1 1 78 78 GLN H H 78 8.142 8.142 8.284 -0.142 18112 12959 1 17 . 1 1 79 79 ALA N N 79 120.809 120.809 123.444 -2.635 18112 12960 1 17 . 1 1 79 79 ALA HA H 79 4.308 4.308 4.098 0.210 18112 12961 1 17 . 1 1 79 79 ALA C C 79 179.924 179.924 179.601 0.323 18112 12962 1 17 . 1 1 79 79 ALA CA C 79 54.970 54.970 55.394 -0.424 18112 12963 1 17 . 1 1 79 79 ALA CB C 79 17.064 17.064 18.630 -1.566 18112 12964 1 17 . 1 1 79 79 ALA H H 79 7.811 7.811 8.049 -0.238 18112 12965 1 17 . 1 1 80 80 ILE N N 80 118.524 118.524 118.611 -0.087 18112 12966 1 17 . 1 1 80 80 ILE HA H 80 3.894 3.894 3.534 0.360 18112 12967 1 17 . 1 1 80 80 ILE C C 80 181.268 181.268 178.146 3.122 18112 12968 1 17 . 1 1 80 80 ILE CA C 80 64.841 64.841 63.666 1.175 18112 12969 1 17 . 1 1 80 80 ILE CB C 80 37.125 37.125 36.385 0.740 18112 12970 1 17 . 1 1 80 80 ILE H H 80 7.837 7.837 8.116 -0.279 18112 12971 1 17 . 1 1 81 81 ASN N N 81 121.233 121.233 118.081 3.152 18112 12972 1 17 . 1 1 81 81 ASN HA H 81 4.398 4.398 4.414 -0.016 18112 12973 1 17 . 1 1 81 81 ASN C C 81 176.546 176.546 176.999 -0.453 18112 12974 1 17 . 1 1 81 81 ASN CA C 81 55.892 55.892 55.857 0.035 18112 12975 1 17 . 1 1 81 81 ASN CB C 81 37.603 37.603 38.850 -1.247 18112 12976 1 17 . 1 1 81 81 ASN H H 81 8.262 8.262 8.043 0.219 18112 12977 1 17 . 1 1 82 82 ASP N N 82 119.240 119.240 118.350 0.890 18112 12978 1 17 . 1 1 82 82 ASP HA H 82 4.666 4.666 4.579 0.087 18112 12979 1 17 . 1 1 82 82 ASP C C 82 176.767 176.767 177.022 -0.255 18112 12980 1 17 . 1 1 82 82 ASP CA C 82 54.771 54.771 54.627 0.145 18112 12981 1 17 . 1 1 82 82 ASP CB C 82 40.121 40.121 41.578 -1.457 18112 12982 1 17 . 1 1 82 82 ASP H H 82 8.316 8.316 7.940 0.376 18112 12983 1 17 . 1 1 83 83 GLY N N 83 106.913 106.913 107.354 -0.441 18112 12984 1 17 . 1 1 83 83 GLY C C 83 174.601 174.601 175.578 -0.977 18112 12985 1 17 . 1 1 83 83 GLY CA C 83 45.214 45.214 45.471 -0.258 18112 12986 1 17 . 1 1 83 83 GLY H H 83 7.810 7.810 7.860 -0.050 18112 12987 1 17 . 1 1 84 84 VAL N N 84 122.981 122.981 119.441 3.540 18112 12988 1 17 . 1 1 84 84 VAL HA H 84 3.850 3.850 3.700 0.150 18112 12989 1 17 . 1 1 84 84 VAL C C 84 177.265 177.265 178.413 -1.148 18112 12990 1 17 . 1 1 84 84 VAL CA C 84 64.270 64.270 65.131 -0.861 18112 12991 1 17 . 1 1 84 84 VAL CB C 84 30.471 30.471 31.924 -1.454 18112 12992 1 17 . 1 1 84 84 VAL H H 84 8.157 8.157 7.875 0.282 18112 12993 1 17 . 1 1 85 85 THR N N 85 115.232 115.232 111.149 4.083 18112 12994 1 17 . 1 1 85 85 THR HA H 85 4.716 4.716 4.370 0.346 18112 12995 1 17 . 1 1 85 85 THR C C 85 174.489 174.489 173.449 1.040 18112 12996 1 17 . 1 1 85 85 THR CA C 85 61.618 61.618 63.615 -1.997 18112 12997 1 17 . 1 1 85 85 THR CB C 85 70.081 70.081 68.503 1.578 18112 12998 1 17 . 1 1 85 85 THR H H 85 8.890 8.890 8.167 0.723 18112 12999 1 17 . 1 1 86 86 SER N N 86 117.009 117.009 115.606 1.403 18112 13000 1 17 . 1 1 86 86 SER HA H 86 5.046 5.046 4.580 0.466 18112 13001 1 17 . 1 1 86 86 SER C C 86 174.473 174.473 175.128 -0.655 18112 13002 1 17 . 1 1 86 86 SER CA C 86 55.922 55.922 56.950 -1.028 18112 13003 1 17 . 1 1 86 86 SER CB C 86 64.385 64.385 65.100 -0.715 18112 13004 1 17 . 1 1 86 86 SER H H 86 7.704 7.704 7.848 -0.144 18112 13005 1 17 . 1 1 87 87 THR N N 87 118.634 118.634 118.778 -0.144 18112 13006 1 17 . 1 1 87 87 THR HA H 87 4.065 4.065 3.891 0.174 18112 13007 1 17 . 1 1 87 87 THR C C 87 176.047 176.047 175.912 0.135 18112 13008 1 17 . 1 1 87 87 THR CA C 87 64.983 64.983 65.069 -0.086 18112 13009 1 17 . 1 1 87 87 THR CB C 87 68.045 68.045 68.754 -0.709 18112 13010 1 17 . 1 1 87 87 THR H H 87 8.711 8.711 8.616 0.095 18112 13011 1 17 . 1 1 88 88 GLU N N 88 117.889 117.889 118.650 -0.761 18112 13012 1 17 . 1 1 88 88 GLU HA H 88 3.881 3.881 4.078 -0.197 18112 13013 1 17 . 1 1 88 88 GLU C C 88 177.146 177.146 177.192 -0.046 18112 13014 1 17 . 1 1 88 88 GLU CA C 88 57.814 57.814 58.177 -0.363 18112 13015 1 17 . 1 1 88 88 GLU CB C 88 28.050 28.050 28.802 -0.752 18112 13016 1 17 . 1 1 88 88 GLU H H 88 8.152 8.152 8.504 -0.352 18112 13017 1 17 . 1 1 89 89 GLU N N 89 115.617 115.617 117.843 -2.226 18112 13018 1 17 . 1 1 89 89 GLU HA H 89 4.149 4.149 4.264 -0.115 18112 13019 1 17 . 1 1 89 89 GLU C C 89 176.192 176.192 177.267 -1.075 18112 13020 1 17 . 1 1 89 89 GLU CA C 89 56.133 56.133 57.132 -0.999 18112 13021 1 17 . 1 1 89 89 GLU CB C 89 29.415 29.415 30.982 -1.567 18112 13022 1 17 . 1 1 89 89 GLU H H 89 7.311 7.311 7.625 -0.314 18112 13023 1 17 . 1 1 90 90 LEU N N 90 120.870 120.870 116.009 4.861 18112 13024 1 17 . 1 1 90 90 LEU HA H 90 4.439 4.439 5.086 -0.647 18112 13025 1 17 . 1 1 90 90 LEU C C 90 175.267 175.267 177.321 -2.054 18112 13026 1 17 . 1 1 90 90 LEU CA C 90 53.504 53.504 53.559 -0.055 18112 13027 1 17 . 1 1 90 90 LEU CB C 90 40.479 40.479 43.040 -2.561 18112 13028 1 17 . 1 1 90 90 LEU H H 90 7.311 7.311 7.373 -0.062 18112 13029 1 17 . 1 1 91 91 SER N N 91 118.376 118.376 115.637 2.739 18112 13030 1 17 . 1 1 91 91 SER HA H 91 4.747 4.747 4.133 0.614 18112 13031 1 17 . 1 1 91 91 SER C C 91 173.332 173.332 173.546 -0.214 18112 13032 1 17 . 1 1 91 91 SER CA C 91 56.314 56.314 59.747 -3.433 18112 13033 1 17 . 1 1 91 91 SER CB C 91 64.615 64.615 60.828 3.787 18112 13034 1 17 . 1 1 91 91 SER H H 91 8.221 8.221 8.205 0.016 18112 13035 1 17 . 1 1 92 92 ILE N N 92 122.247 122.247 121.399 0.848 18112 13036 1 17 . 1 1 92 92 ILE HA H 92 4.537 4.537 4.413 0.124 18112 13037 1 17 . 1 1 92 92 ILE C C 92 174.059 174.059 176.310 -2.251 18112 13038 1 17 . 1 1 92 92 ILE CA C 92 59.881 59.881 58.721 1.160 18112 13039 1 17 . 1 1 92 92 ILE CB C 92 37.820 37.820 41.478 -3.658 18112 13040 1 17 . 1 1 92 92 ILE H H 92 8.570 8.570 7.572 0.998 18112 13041 1 17 . 1 1 93 93 THR N N 93 116.069 116.069 115.919 0.150 18112 13042 1 17 . 1 1 93 93 THR HA H 93 4.580 4.580 4.445 0.135 18112 13043 1 17 . 1 1 93 93 THR C C 93 175.049 175.049 174.806 0.243 18112 13044 1 17 . 1 1 93 93 THR CA C 93 58.988 58.988 63.493 -4.505 18112 13045 1 17 . 1 1 93 93 THR CB C 93 71.362 71.362 69.544 1.818 18112 13046 1 17 . 1 1 93 93 THR H H 93 7.224 7.224 8.608 -1.384 18112 13047 1 17 . 1 1 94 94 ARG N N 94 116.595 116.595 121.073 -4.478 18112 13048 1 17 . 1 1 94 94 ARG HA H 94 3.077 3.077 3.970 -0.893 18112 13049 1 17 . 1 1 94 94 ARG C C 94 175.076 175.076 175.312 -0.236 18112 13050 1 17 . 1 1 94 94 ARG CA C 94 57.119 57.119 56.272 0.847 18112 13051 1 17 . 1 1 94 94 ARG CB C 94 27.838 27.838 28.099 -0.261 18112 13052 1 17 . 1 1 94 94 ARG H H 94 8.596 8.596 8.506 0.090 18112 13053 1 17 . 1 1 95 95 ASP N N 95 113.735 113.735 116.803 -3.068 18112 13054 1 17 . 1 1 95 95 ASP HA H 95 4.765 4.765 3.232 1.533 18112 13055 1 17 . 1 1 95 95 ASP C C 95 175.876 175.876 176.444 -0.568 18112 13056 1 17 . 1 1 95 95 ASP CA C 95 53.156 53.156 56.446 -3.290 18112 13057 1 17 . 1 1 95 95 ASP CB C 95 41.166 41.166 39.652 1.514 18112 13058 1 17 . 1 1 95 95 ASP H H 95 7.607 7.607 8.085 -0.478 18112 13059 1 17 . 1 1 96 96 CYS N N 96 116.012 116.012 120.456 -4.444 18112 13060 1 17 . 1 1 96 96 CYS C C 96 174.361 174.361 176.780 -2.419 18112 13061 1 17 . 1 1 96 96 CYS CA C 96 56.562 56.562 60.879 -4.317 18112 13062 1 17 . 1 1 96 96 CYS CB C 96 29.416 29.416 26.575 2.841 18112 13063 1 17 . 1 1 96 96 CYS H H 96 7.094 7.094 7.987 -0.893 18112 13064 1 17 . 1 1 97 97 GLU N N 97 123.087 123.087 120.805 2.282 18112 13065 1 17 . 1 1 97 97 GLU C C 97 178.748 178.748 179.087 -0.339 18112 13066 1 17 . 1 1 97 97 GLU CA C 97 59.912 59.912 59.454 0.458 18112 13067 1 17 . 1 1 97 97 GLU CB C 97 29.195 29.195 29.388 -0.193 18112 13068 1 17 . 1 1 97 97 GLU H H 97 9.003 9.003 8.435 0.568 18112 13069 1 17 . 1 1 98 98 LEU N N 98 120.942 120.942 120.159 0.783 18112 13070 1 17 . 1 1 98 98 LEU HA H 98 3.614 3.614 4.074 -0.460 18112 13071 1 17 . 1 1 98 98 LEU C C 98 177.796 177.796 178.867 -1.071 18112 13072 1 17 . 1 1 98 98 LEU CA C 98 58.090 58.090 58.678 -0.588 18112 13073 1 17 . 1 1 98 98 LEU CB C 98 39.778 39.778 41.766 -1.988 18112 13074 1 17 . 1 1 98 98 LEU H H 98 8.656 8.656 8.023 0.633 18112 13075 1 17 . 1 1 99 99 TYR N N 99 118.313 118.313 116.787 1.526 18112 13076 1 17 . 1 1 99 99 TYR C C 99 177.077 177.077 178.503 -1.426 18112 13077 1 17 . 1 1 99 99 TYR CA C 99 62.622 62.622 59.327 3.296 18112 13078 1 17 . 1 1 99 99 TYR CB C 99 38.742 38.742 37.177 1.565 18112 13079 1 17 . 1 1 99 99 TYR H H 99 7.522 7.522 7.854 -0.332 18112 13080 1 17 . 1 1 100 100 ARG N N 100 118.101 118.101 120.358 -2.257 18112 13081 1 17 . 1 1 100 100 ARG C C 100 178.616 178.616 178.591 0.025 18112 13082 1 17 . 1 1 100 100 ARG CA C 100 59.915 59.915 58.858 1.057 18112 13083 1 17 . 1 1 100 100 ARG CB C 100 29.100 29.100 29.669 -0.569 18112 13084 1 17 . 1 1 100 100 ARG H H 100 8.243 8.243 8.344 -0.101 18112 13085 1 17 . 1 1 101 101 ALA N N 101 120.972 120.972 122.186 -1.214 18112 13086 1 17 . 1 1 101 101 ALA HA H 101 4.145 4.145 4.237 -0.092 18112 13087 1 17 . 1 1 101 101 ALA C C 101 181.359 181.359 180.241 1.118 18112 13088 1 17 . 1 1 101 101 ALA CA C 101 55.057 55.057 55.233 -0.176 18112 13089 1 17 . 1 1 101 101 ALA CB C 101 17.543 17.543 18.279 -0.736 18112 13090 1 17 . 1 1 101 101 ALA H H 101 8.352 8.352 8.144 0.208 18112 13091 1 17 . 1 1 102 102 LEU N N 102 115.683 115.683 118.833 -3.150 18112 13092 1 17 . 1 1 102 102 LEU HA H 102 4.333 4.333 4.403 -0.070 18112 13093 1 17 . 1 1 102 102 LEU C C 102 178.583 178.583 179.779 -1.196 18112 13094 1 17 . 1 1 102 102 LEU CA C 102 57.634 57.634 58.492 -0.858 18112 13095 1 17 . 1 1 102 102 LEU CB C 102 41.716 41.716 41.688 0.028 18112 13096 1 17 . 1 1 102 102 LEU H H 102 7.960 7.960 8.470 -0.510 18112 13097 1 17 . 1 1 103 103 ASN N N 103 118.957 118.957 118.663 0.294 18112 13098 1 17 . 1 1 103 103 ASN C C 103 177.470 177.470 178.147 -0.677 18112 13099 1 17 . 1 1 103 103 ASN CA C 103 56.974 56.974 56.215 0.759 18112 13100 1 17 . 1 1 103 103 ASN CB C 103 38.140 38.140 38.515 -0.375 18112 13101 1 17 . 1 1 103 103 ASN H H 103 9.301 9.301 8.490 0.811 18112 13102 1 17 . 1 1 104 104 MET N N 104 113.763 113.763 119.023 -5.260 18112 13103 1 17 . 1 1 104 104 MET CA C 104 57.362 57.362 57.712 -0.350 18112 13104 1 17 . 1 1 104 104 MET CB C 104 31.895 31.895 32.150 -0.255 18112 13105 1 17 . 1 1 104 104 MET H H 104 8.332 8.332 8.228 0.104 18112 13106 1 17 . 1 1 105 105 HIS N N 105 116.024 116.024 116.761 -0.737 18112 13107 1 17 . 1 1 105 105 HIS HA H 105 3.764 3.764 4.576 -0.812 18112 13108 1 17 . 1 1 105 105 HIS C C 105 176.939 176.939 177.310 -0.371 18112 13109 1 17 . 1 1 105 105 HIS CA C 105 59.069 59.069 59.099 -0.030 18112 13110 1 17 . 1 1 105 105 HIS H H 105 7.156 7.156 8.352 -1.196 18112 13111 1 17 . 1 1 106 106 TYR N N 106 113.161 113.161 116.470 -3.309 18112 13112 1 17 . 1 1 106 106 TYR C C 106 173.767 173.767 175.689 -1.922 18112 13113 1 17 . 1 1 106 106 TYR CA C 106 58.488 58.488 59.280 -0.792 18112 13114 1 17 . 1 1 106 106 TYR CB C 106 38.225 38.225 39.076 -0.851 18112 13115 1 17 . 1 1 106 106 TYR H H 106 7.204 7.204 8.494 -1.290 18112 13116 1 17 . 1 1 107 107 ASN N N 107 118.875 118.875 117.824 1.051 18112 13117 1 17 . 1 1 107 107 ASN HA H 107 3.922 3.922 4.518 -0.596 18112 13118 1 17 . 1 1 107 107 ASN C C 107 175.815 175.815 174.158 1.657 18112 13119 1 17 . 1 1 107 107 ASN CA C 107 51.233 51.233 53.988 -2.755 18112 13120 1 17 . 1 1 107 107 ASN CB C 107 38.142 38.142 37.392 0.750 18112 13121 1 17 . 1 1 107 107 ASN H H 107 8.127 8.127 8.153 -0.026 18112 13122 1 17 . 1 1 108 108 LYS N N 108 122.850 122.850 123.333 -0.483 18112 13123 1 17 . 1 1 108 108 LYS HA H 108 3.954 3.954 4.435 -0.481 18112 13124 1 17 . 1 1 108 108 LYS C C 108 177.586 177.586 174.919 2.667 18112 13125 1 17 . 1 1 108 108 LYS CA C 108 59.749 59.749 55.551 4.198 18112 13126 1 17 . 1 1 108 108 LYS CB C 108 31.498 31.498 34.449 -2.950 18112 13127 1 17 . 1 1 108 108 LYS H H 108 7.772 7.772 7.811 -0.039 18112 13128 1 17 . 1 1 109 109 ALA N N 109 118.054 118.054 129.795 -11.741 18112 13129 1 17 . 1 1 109 109 ALA HA H 109 4.137 4.137 4.368 -0.231 18112 13130 1 17 . 1 1 109 109 ALA C C 109 177.889 177.889 176.912 0.977 18112 13131 1 17 . 1 1 109 109 ALA CA C 109 52.299 52.299 51.261 1.038 18112 13132 1 17 . 1 1 109 109 ALA CB C 109 17.787 17.787 18.011 -0.224 18112 13133 1 17 . 1 1 109 109 ALA H H 109 8.307 8.307 8.511 -0.204 18112 13134 1 17 . 1 1 110 110 ASN N N 110 115.542 115.542 123.051 -7.509 18112 13135 1 17 . 1 1 110 110 ASN HA H 110 4.480 4.480 4.134 0.346 18112 13136 1 17 . 1 1 110 110 ASN C C 110 174.277 174.277 175.481 -1.204 18112 13137 1 17 . 1 1 110 110 ASN CA C 110 53.504 53.504 54.229 -0.725 18112 13138 1 17 . 1 1 110 110 ASN CB C 110 37.283 37.283 38.607 -1.324 18112 13139 1 17 . 1 1 110 110 ASN H H 110 8.353 8.353 8.269 0.084 18112 13140 1 17 . 1 1 111 111 ASP N N 111 114.692 114.692 123.808 -9.116 18112 13141 1 17 . 1 1 111 111 ASP HA H 111 4.485 4.485 4.507 -0.022 18112 13142 1 17 . 1 1 111 111 ASP C C 111 174.868 174.868 176.379 -1.511 18112 13143 1 17 . 1 1 111 111 ASP CA C 111 53.227 53.227 55.228 -2.001 18112 13144 1 17 . 1 1 111 111 ASP CB C 111 39.228 39.228 41.457 -2.229 18112 13145 1 17 . 1 1 111 111 ASP H H 111 8.297 8.297 8.205 0.092 18112 13146 1 17 . 1 1 112 112 PHE N N 112 120.927 120.927 118.554 2.373 18112 13147 1 17 . 1 1 112 112 PHE HA H 112 4.752 4.752 4.369 0.383 18112 13148 1 17 . 1 1 112 112 PHE C C 112 174.633 174.633 176.621 -1.988 18112 13149 1 17 . 1 1 112 112 PHE CA C 112 56.346 56.346 58.113 -1.767 18112 13150 1 17 . 1 1 112 112 PHE H H 112 7.784 7.784 7.761 0.023 18112 13151 1 17 . 1 1 113 113 GLU N N 113 128.111 128.111 124.123 3.988 18112 13152 1 17 . 1 1 113 113 GLU HA H 113 4.011 4.011 4.221 -0.210 18112 13153 1 17 . 1 1 113 113 GLU C C 113 173.502 173.502 175.955 -2.453 18112 13154 1 17 . 1 1 113 113 GLU CA C 113 55.100 55.100 56.162 -1.062 18112 13155 1 17 . 1 1 113 113 GLU H H 113 7.752 7.752 8.593 -0.841 18112 13156 1 17 . 1 1 114 114 VAL N N 114 129.326 129.326 111.821 17.505 18112 13157 1 17 . 1 1 114 114 VAL HA H 114 3.241 3.241 3.809 -0.568 18112 13158 1 17 . 1 1 114 114 VAL CA C 114 60.838 60.838 61.578 -0.740 18112 13159 1 17 . 1 1 114 114 VAL CB C 114 32.609 32.609 30.823 1.786 18112 13160 1 17 . 1 1 114 114 VAL H H 114 8.008 8.008 7.533 0.475 18112 13161 1 17 . 1 1 115 115 PRO HA H 115 4.429 4.429 4.436 -0.008 18112 13162 1 17 . 1 1 115 115 PRO C C 115 177.421 177.421 178.131 -0.710 18112 13163 1 17 . 1 1 115 115 PRO CA C 115 61.882 61.882 62.438 -0.556 18112 13164 1 17 . 1 1 115 115 PRO CB C 115 30.974 30.974 32.636 -1.662 18112 13165 1 17 . 1 1 116 116 GLU N N 116 123.936 123.936 120.766 3.170 18112 13166 1 17 . 1 1 116 116 GLU C C 116 179.034 179.034 179.054 -0.020 18112 13167 1 17 . 1 1 116 116 GLU CA C 116 58.913 58.913 60.250 -1.337 18112 13168 1 17 . 1 1 116 116 GLU CB C 116 28.378 28.378 29.439 -1.061 18112 13169 1 17 . 1 1 116 116 GLU H H 116 8.757 8.757 9.006 -0.249 18112 13170 1 17 . 1 1 117 117 ARG N N 117 116.943 116.943 118.956 -2.013 18112 13171 1 17 . 1 1 117 117 ARG C C 117 177.570 177.570 178.793 -1.223 18112 13172 1 17 . 1 1 117 117 ARG CA C 117 57.033 57.033 58.774 -1.741 18112 13173 1 17 . 1 1 117 117 ARG CB C 117 28.172 28.172 29.739 -1.567 18112 13174 1 17 . 1 1 117 117 ARG H H 117 8.733 8.733 8.378 0.355 18112 13175 1 17 . 1 1 118 118 PHE N N 118 117.528 117.528 121.551 -4.023 18112 13176 1 17 . 1 1 118 118 PHE HA H 118 4.137 4.137 4.366 -0.229 18112 13177 1 17 . 1 1 118 118 PHE C C 118 176.992 176.992 177.047 -0.055 18112 13178 1 17 . 1 1 118 118 PHE CA C 118 61.627 61.627 61.252 0.375 18112 13179 1 17 . 1 1 118 118 PHE CB C 118 37.386 37.386 39.137 -1.751 18112 13180 1 17 . 1 1 118 118 PHE H H 118 7.606 7.606 7.859 -0.253 18112 13181 1 17 . 1 1 119 119 LEU N N 119 118.483 118.483 118.390 0.093 18112 13182 1 17 . 1 1 119 119 LEU HA H 119 3.684 3.684 3.857 -0.173 18112 13183 1 17 . 1 1 119 119 LEU C C 119 178.802 178.802 179.236 -0.434 18112 13184 1 17 . 1 1 119 119 LEU CA C 119 59.875 59.875 57.090 2.785 18112 13185 1 17 . 1 1 119 119 LEU CB C 119 39.453 39.453 40.366 -0.913 18112 13186 1 17 . 1 1 119 119 LEU H H 119 7.248 7.248 7.888 -0.640 18112 13187 1 17 . 1 1 120 120 GLU N N 120 117.870 117.870 120.664 -2.794 18112 13188 1 17 . 1 1 120 120 GLU C C 120 179.932 179.932 179.110 0.822 18112 13189 1 17 . 1 1 120 120 GLU CA C 120 59.150 59.150 59.656 -0.506 18112 13190 1 17 . 1 1 120 120 GLU CB C 120 28.878 28.878 29.644 -0.766 18112 13191 1 17 . 1 1 120 120 GLU H H 120 7.423 7.423 8.150 -0.727 18112 13192 1 17 . 1 1 121 121 VAL N N 121 120.777 120.777 120.561 0.216 18112 13193 1 17 . 1 1 121 121 VAL HA H 121 3.545 3.545 3.601 -0.056 18112 13194 1 17 . 1 1 121 121 VAL C C 121 179.302 179.302 177.741 1.561 18112 13195 1 17 . 1 1 121 121 VAL CA C 121 66.875 66.875 66.541 0.334 18112 13196 1 17 . 1 1 121 121 VAL CB C 121 30.823 30.823 31.420 -0.597 18112 13197 1 17 . 1 1 121 121 VAL H H 121 8.313 8.313 7.993 0.320 18112 13198 1 17 . 1 1 122 122 ALA N N 122 127.029 127.029 121.811 5.218 18112 13199 1 17 . 1 1 122 122 ALA HA H 122 4.251 4.251 3.952 0.299 18112 13200 1 17 . 1 1 122 122 ALA C C 122 178.366 178.366 179.707 -1.341 18112 13201 1 17 . 1 1 122 122 ALA CA C 122 54.748 54.748 55.155 -0.407 18112 13202 1 17 . 1 1 122 122 ALA CB C 122 16.565 16.565 18.336 -1.771 18112 13203 1 17 . 1 1 122 122 ALA H H 122 8.896 8.896 8.068 0.828 18112 13204 1 17 . 1 1 123 123 GLN N N 123 119.887 119.887 117.597 2.290 18112 13205 1 17 . 1 1 123 123 GLN C C 123 177.908 177.908 178.528 -0.620 18112 13206 1 17 . 1 1 123 123 GLN CA C 123 60.671 60.671 58.447 2.224 18112 13207 1 17 . 1 1 123 123 GLN H H 123 8.349 8.349 7.983 0.366 18112 13208 1 17 . 1 1 124 124 ILE N N 124 120.632 120.632 121.625 -0.993 18112 13209 1 17 . 1 1 124 124 ILE HA H 124 3.651 3.651 3.717 -0.066 18112 13210 1 17 . 1 1 124 124 ILE C C 124 178.703 178.703 178.200 0.503 18112 13211 1 17 . 1 1 124 124 ILE CA C 124 65.945 65.945 65.213 0.732 18112 13212 1 17 . 1 1 124 124 ILE H H 124 8.204 8.204 8.276 -0.072 18112 13213 1 17 . 1 1 125 125 THR N N 125 115.084 115.084 115.761 -0.677 18112 13214 1 17 . 1 1 125 125 THR C C 125 175.568 175.568 176.795 -1.227 18112 13215 1 17 . 1 1 125 125 THR CA C 125 67.872 67.872 66.709 1.163 18112 13216 1 17 . 1 1 125 125 THR H H 125 8.399 8.399 8.253 0.146 18112 13217 1 17 . 1 1 126 126 LEU N N 126 125.011 125.011 122.537 2.474 18112 13218 1 17 . 1 1 126 126 LEU HA H 126 4.085 4.085 4.427 -0.342 18112 13219 1 17 . 1 1 126 126 LEU C C 126 178.559 178.559 178.304 0.255 18112 13220 1 17 . 1 1 126 126 LEU CA C 126 58.843 58.843 57.847 0.996 18112 13221 1 17 . 1 1 126 126 LEU CB C 126 41.421 41.421 41.847 -0.426 18112 13222 1 17 . 1 1 126 126 LEU H H 126 8.728 8.728 8.155 0.573 18112 13223 1 17 . 1 1 127 127 ARG N N 127 117.076 117.076 119.600 -2.524 18112 13224 1 17 . 1 1 127 127 ARG HA H 127 3.929 3.929 3.928 0.001 18112 13225 1 17 . 1 1 127 127 ARG C C 127 177.984 177.984 178.455 -0.471 18112 13226 1 17 . 1 1 127 127 ARG CA C 127 60.685 60.685 60.068 0.617 18112 13227 1 17 . 1 1 127 127 ARG CB C 127 28.079 28.079 30.059 -1.980 18112 13228 1 17 . 1 1 127 127 ARG H H 127 8.213 8.213 8.180 0.033 18112 13229 1 17 . 1 1 128 128 GLU N N 128 118.617 118.617 119.142 -0.525 18112 13230 1 17 . 1 1 128 128 GLU HA H 128 4.147 4.147 4.218 -0.071 18112 13231 1 17 . 1 1 128 128 GLU C C 128 181.150 181.150 179.284 1.866 18112 13232 1 17 . 1 1 128 128 GLU CA C 128 59.508 59.508 58.611 0.897 18112 13233 1 17 . 1 1 128 128 GLU H H 128 8.478 8.478 8.146 0.332 18112 13234 1 17 . 1 1 129 129 PHE N N 129 119.267 119.267 120.240 -0.973 18112 13235 1 17 . 1 1 129 129 PHE HA H 129 4.104 4.104 4.361 -0.257 18112 13236 1 17 . 1 1 129 129 PHE C C 129 177.170 177.170 177.539 -0.369 18112 13237 1 17 . 1 1 129 129 PHE CA C 129 63.694 63.694 61.448 2.246 18112 13238 1 17 . 1 1 129 129 PHE H H 129 8.570 8.570 8.365 0.205 18112 13239 1 17 . 1 1 130 130 PHE N N 130 118.739 118.739 120.439 -1.700 18112 13240 1 17 . 1 1 130 130 PHE HA H 130 3.884 3.884 4.027 -0.143 18112 13241 1 17 . 1 1 130 130 PHE C C 130 175.860 175.860 177.155 -1.295 18112 13242 1 17 . 1 1 130 130 PHE CA C 130 62.819 62.819 62.117 0.702 18112 13243 1 17 . 1 1 130 130 PHE H H 130 8.740 8.740 8.687 0.053 18112 13244 1 17 . 1 1 131 131 ASN N N 131 116.028 116.028 117.953 -1.925 18112 13245 1 17 . 1 1 131 131 ASN HA H 131 4.373 4.373 4.420 -0.047 18112 13246 1 17 . 1 1 131 131 ASN C C 131 178.228 178.228 177.620 0.608 18112 13247 1 17 . 1 1 131 131 ASN CA C 131 55.150 55.150 56.145 -0.995 18112 13248 1 17 . 1 1 131 131 ASN H H 131 8.864 8.864 8.524 0.340 18112 13249 1 17 . 1 1 132 132 ALA N N 132 120.922 120.922 123.317 -2.395 18112 13250 1 17 . 1 1 132 132 ALA HA H 132 4.020 4.020 4.039 -0.019 18112 13251 1 17 . 1 1 132 132 ALA C C 132 178.515 178.515 179.746 -1.231 18112 13252 1 17 . 1 1 132 132 ALA CA C 132 54.924 54.924 55.205 -0.281 18112 13253 1 17 . 1 1 132 132 ALA CB C 132 18.441 18.441 18.747 -0.306 18112 13254 1 17 . 1 1 132 132 ALA H H 132 7.745 7.745 7.794 -0.049 18112 13255 1 17 . 1 1 133 133 ILE N N 133 118.200 118.200 119.486 -1.286 18112 13256 1 17 . 1 1 133 133 ILE HA H 133 3.235 3.235 3.990 -0.755 18112 13257 1 17 . 1 1 133 133 ILE C C 133 180.606 180.606 178.336 2.270 18112 13258 1 17 . 1 1 133 133 ILE CA C 133 65.215 65.215 64.188 1.027 18112 13259 1 17 . 1 1 133 133 ILE CB C 133 38.291 38.291 37.732 0.559 18112 13260 1 17 . 1 1 133 133 ILE H H 133 7.999 7.999 7.925 0.074 18112 13261 1 17 . 1 1 134 134 ILE N N 134 122.564 122.564 120.103 2.461 18112 13262 1 17 . 1 1 134 134 ILE HA H 134 3.788 3.788 3.623 0.165 18112 13263 1 17 . 1 1 134 134 ILE C C 134 177.215 177.215 176.795 0.420 18112 13264 1 17 . 1 1 134 134 ILE CA C 134 63.584 63.584 63.745 -0.161 18112 13265 1 17 . 1 1 134 134 ILE CB C 134 35.636 35.636 37.725 -2.090 18112 13266 1 17 . 1 1 134 134 ILE H H 134 8.670 8.670 7.888 0.782 18112 13267 1 17 . 1 1 135 135 ALA N N 135 119.989 119.989 120.408 -0.419 18112 13268 1 17 . 1 1 135 135 ALA HA H 135 4.357 4.357 4.278 0.079 18112 13269 1 17 . 1 1 135 135 ALA C C 135 177.786 177.786 177.684 0.102 18112 13270 1 17 . 1 1 135 135 ALA CA C 135 51.521 51.521 52.527 -1.006 18112 13271 1 17 . 1 1 135 135 ALA CB C 135 18.839 18.839 20.244 -1.405 18112 13272 1 17 . 1 1 135 135 ALA H H 135 6.898 6.898 7.885 -0.987 18112 13273 1 17 . 1 1 136 136 GLY N N 136 107.682 107.682 105.797 1.885 18112 13274 1 17 . 1 1 136 136 GLY C C 136 176.324 176.324 174.447 1.877 18112 13275 1 17 . 1 1 136 136 GLY CA C 136 45.469 45.469 44.911 0.558 18112 13276 1 17 . 1 1 136 136 GLY H H 136 7.913 7.913 7.904 0.009 18112 13277 1 17 . 1 1 137 137 LYS N N 137 117.213 117.213 120.238 -3.025 18112 13278 1 17 . 1 1 137 137 LYS HA H 137 4.004 4.004 4.385 -0.381 18112 13279 1 17 . 1 1 137 137 LYS C C 137 176.616 176.616 177.853 -1.237 18112 13280 1 17 . 1 1 137 137 LYS CA C 137 57.499 57.499 57.499 0.000 18112 13281 1 17 . 1 1 137 137 LYS CB C 137 30.927 30.927 32.759 -1.832 18112 13282 1 17 . 1 1 137 137 LYS H H 137 8.312 8.312 8.264 0.048 18112 13283 1 17 . 1 1 138 138 ASP N N 138 113.545 113.545 119.076 -5.531 18112 13284 1 17 . 1 1 138 138 ASP HA H 138 3.061 3.061 2.412 0.649 18112 13285 1 17 . 1 1 138 138 ASP C C 138 174.698 174.698 176.561 -1.863 18112 13286 1 17 . 1 1 138 138 ASP CA C 138 53.694 53.694 56.089 -2.394 18112 13287 1 17 . 1 1 138 138 ASP CB C 138 36.008 36.008 39.406 -3.398 18112 13288 1 17 . 1 1 138 138 ASP H H 138 8.465 8.465 7.643 0.822 18112 13289 1 17 . 1 1 139 139 VAL N N 139 115.191 115.191 111.833 3.358 18112 13290 1 17 . 1 1 139 139 VAL HA H 139 3.886 3.886 3.992 -0.106 18112 13291 1 17 . 1 1 139 139 VAL C C 139 175.889 175.889 176.148 -0.259 18112 13292 1 17 . 1 1 139 139 VAL CA C 139 62.793 62.793 62.837 -0.044 18112 13293 1 17 . 1 1 139 139 VAL CB C 139 30.662 30.662 31.924 -1.262 18112 13294 1 17 . 1 1 139 139 VAL H H 139 6.610 6.610 7.175 -0.565 18112 13295 1 17 . 1 1 140 140 ASP N N 140 123.363 123.363 121.524 1.839 18112 13296 1 17 . 1 1 140 140 ASP C C 140 175.234 175.234 175.130 0.104 18112 13297 1 17 . 1 1 140 140 ASP CA C 140 50.221 50.221 50.923 -0.702 18112 13298 1 17 . 1 1 140 140 ASP CB C 140 42.254 42.254 43.193 -0.939 18112 13299 1 17 . 1 1 140 140 ASP H H 140 7.553 7.553 7.583 -0.030 18112 13300 1 17 . 1 1 141 141 PRO HA H 141 4.682 4.682 4.484 0.198 18112 13301 1 17 . 1 1 141 141 PRO C C 141 178.678 178.678 177.887 0.791 18112 13302 1 17 . 1 1 141 141 PRO CA C 141 64.532 64.532 64.882 -0.350 18112 13303 1 17 . 1 1 141 141 PRO CB C 141 31.331 31.331 32.179 -0.848 18112 13304 1 17 . 1 1 142 142 SER N N 142 114.421 114.421 113.781 0.640 18112 13305 1 17 . 1 1 142 142 SER HA H 142 4.565 4.565 4.329 0.236 18112 13306 1 17 . 1 1 142 142 SER C C 142 176.524 176.524 176.286 0.238 18112 13307 1 17 . 1 1 142 142 SER CA C 142 58.711 58.711 61.292 -2.581 18112 13308 1 17 . 1 1 142 142 SER CB C 142 62.783 62.783 62.884 -0.101 18112 13309 1 17 . 1 1 142 142 SER H H 142 8.703 8.703 7.996 0.707 18112 13310 1 17 . 1 1 143 143 TRP N N 143 123.598 123.598 121.765 1.833 18112 13311 1 17 . 1 1 143 143 TRP HA H 143 4.136 4.136 4.290 -0.154 18112 13312 1 17 . 1 1 143 143 TRP C C 143 177.113 177.113 177.027 0.086 18112 13313 1 17 . 1 1 143 143 TRP CA C 143 59.803 59.803 59.718 0.085 18112 13314 1 17 . 1 1 143 143 TRP CB C 143 26.364 26.364 28.117 -1.753 18112 13315 1 17 . 1 1 143 143 TRP H H 143 8.374 8.374 8.192 0.182 18112 13316 1 17 . 1 1 144 144 LYS N N 144 119.293 119.293 119.230 0.063 18112 13317 1 17 . 1 1 144 144 LYS HA H 144 2.719 2.719 3.199 -0.480 18112 13318 1 17 . 1 1 144 144 LYS C C 144 177.243 177.243 178.035 -0.792 18112 13319 1 17 . 1 1 144 144 LYS CA C 144 58.851 58.851 58.669 0.182 18112 13320 1 17 . 1 1 144 144 LYS CB C 144 29.373 29.373 30.990 -1.617 18112 13321 1 17 . 1 1 144 144 LYS H H 144 7.196 7.196 6.780 0.416 18112 13322 1 17 . 1 1 145 145 LYS N N 145 116.440 116.440 120.451 -4.011 18112 13323 1 17 . 1 1 145 145 LYS HA H 145 3.490 3.490 4.002 -0.512 18112 13324 1 17 . 1 1 145 145 LYS C C 145 179.149 179.149 178.671 0.478 18112 13325 1 17 . 1 1 145 145 LYS CA C 145 59.271 59.271 59.002 0.269 18112 13326 1 17 . 1 1 145 145 LYS CB C 145 30.521 30.521 32.273 -1.752 18112 13327 1 17 . 1 1 145 145 LYS H H 145 7.389 7.389 7.574 -0.185 18112 13328 1 17 . 1 1 146 146 ALA N N 146 118.582 118.582 122.231 -3.649 18112 13329 1 17 . 1 1 146 146 ALA HA H 146 3.932 3.932 4.058 -0.126 18112 13330 1 17 . 1 1 146 146 ALA C C 146 179.968 179.968 179.746 0.222 18112 13331 1 17 . 1 1 146 146 ALA CA C 146 54.241 54.241 55.037 -0.796 18112 13332 1 17 . 1 1 146 146 ALA CB C 146 17.689 17.689 18.142 -0.453 18112 13333 1 17 . 1 1 146 146 ALA H H 146 7.112 7.112 7.835 -0.723 18112 13334 1 17 . 1 1 147 147 ILE N N 147 118.537 118.537 118.951 -0.414 18112 13335 1 17 . 1 1 147 147 ILE HA H 147 3.642 3.642 3.517 0.125 18112 13336 1 17 . 1 1 147 147 ILE C C 147 178.919 178.919 178.065 0.854 18112 13337 1 17 . 1 1 147 147 ILE CA C 147 64.418 64.418 63.431 0.987 18112 13338 1 17 . 1 1 147 147 ILE CB C 147 36.519 36.519 35.891 0.628 18112 13339 1 17 . 1 1 147 147 ILE H H 147 6.734 6.734 7.733 -0.999 18112 13340 1 17 . 1 1 148 148 TYR N N 148 121.033 121.033 118.390 2.643 18112 13341 1 17 . 1 1 148 148 TYR HA H 148 4.489 4.489 4.062 0.427 18112 13342 1 17 . 1 1 148 148 TYR C C 148 178.348 178.348 178.188 0.160 18112 13343 1 17 . 1 1 148 148 TYR CA C 148 57.389 57.389 59.632 -2.243 18112 13344 1 17 . 1 1 148 148 TYR CB C 148 35.280 35.280 36.787 -1.507 18112 13345 1 17 . 1 1 148 148 TYR H H 148 8.126 8.126 7.979 0.147 18112 13346 1 17 . 1 1 149 149 LYS N N 149 114.484 114.484 119.987 -5.503 18112 13347 1 17 . 1 1 149 149 LYS C C 149 178.051 178.051 178.780 -0.729 18112 13348 1 17 . 1 1 149 149 LYS CA C 149 59.036 59.036 59.644 -0.608 18112 13349 1 17 . 1 1 149 149 LYS CB C 149 31.575 31.575 32.499 -0.924 18112 13350 1 17 . 1 1 149 149 LYS H H 149 7.364 7.364 7.834 -0.470 18112 13351 1 17 . 1 1 150 150 VAL N N 150 117.812 117.812 115.615 2.197 18112 13352 1 17 . 1 1 150 150 VAL HA H 150 3.770 3.770 3.744 0.026 18112 13353 1 17 . 1 1 150 150 VAL C C 150 178.786 178.786 177.462 1.324 18112 13354 1 17 . 1 1 150 150 VAL CA C 150 65.070 65.070 65.569 -0.499 18112 13355 1 17 . 1 1 150 150 VAL CB C 150 29.515 29.515 31.760 -2.245 18112 13356 1 17 . 1 1 150 150 VAL H H 150 7.254 7.254 7.944 -0.690 18112 13357 1 17 . 1 1 151 151 ILE N N 151 117.884 117.884 114.399 3.485 18112 13358 1 17 . 1 1 151 151 ILE C C 151 180.539 180.539 177.800 2.739 18112 13359 1 17 . 1 1 151 151 ILE CA C 151 61.490 61.490 63.101 -1.611 18112 13360 1 17 . 1 1 151 151 ILE CB C 151 33.994 33.994 38.430 -4.436 18112 13361 1 17 . 1 1 151 151 ILE H H 151 8.154 8.154 7.924 0.230 18112 13362 1 17 . 1 1 152 152 CYS N N 152 118.649 118.649 121.795 -3.146 18112 13363 1 17 . 1 1 152 152 CYS HA H 152 4.153 4.153 4.091 0.062 18112 13364 1 17 . 1 1 152 152 CYS C C 152 174.888 174.888 176.473 -1.585 18112 13365 1 17 . 1 1 152 152 CYS CA C 152 61.052 61.052 61.534 -0.482 18112 13366 1 17 . 1 1 152 152 CYS CB C 152 36.364 36.364 26.976 9.388 18112 13367 1 17 . 1 1 152 152 CYS H H 152 8.711 8.711 8.207 0.504 18112 13368 1 17 . 1 1 153 153 LYS N N 153 118.498 118.498 120.134 -1.636 18112 13369 1 17 . 1 1 153 153 LYS C C 153 177.389 177.389 178.218 -0.829 18112 13370 1 17 . 1 1 153 153 LYS CA C 153 56.243 56.243 58.522 -2.279 18112 13371 1 17 . 1 1 153 153 LYS CB C 153 31.343 31.343 31.701 -0.358 18112 13372 1 17 . 1 1 153 153 LYS H H 153 6.782 6.782 7.898 -1.116 18112 13373 1 17 . 1 1 154 154 LEU N N 154 117.318 117.318 118.116 -0.798 18112 13374 1 17 . 1 1 154 154 LEU HA H 154 4.576 4.576 4.169 0.407 18112 13375 1 17 . 1 1 154 154 LEU C C 154 177.161 177.161 177.241 -0.080 18112 13376 1 17 . 1 1 154 154 LEU CA C 154 53.782 53.782 56.251 -2.469 18112 13377 1 17 . 1 1 154 154 LEU CB C 154 40.881 40.881 42.071 -1.190 18112 13378 1 17 . 1 1 154 154 LEU H H 154 7.616 7.616 7.409 0.207 18112 13379 1 17 . 1 1 155 155 ASP N N 155 121.564 121.564 117.934 3.630 18112 13380 1 17 . 1 1 155 155 ASP C C 155 177.094 177.094 175.808 1.286 18112 13381 1 17 . 1 1 155 155 ASP CA C 155 55.732 55.732 53.601 2.131 18112 13382 1 17 . 1 1 155 155 ASP CB C 155 40.139 40.139 42.072 -1.933 18112 13383 1 17 . 1 1 155 155 ASP H H 155 7.582 7.582 7.527 0.055 18112 13384 1 17 . 1 1 156 156 SER N N 156 117.352 117.352 118.069 -0.717 18112 13385 1 17 . 1 1 156 156 SER HA H 156 4.818 4.818 4.337 0.481 18112 13386 1 17 . 1 1 156 156 SER C C 156 173.409 173.409 175.121 -1.712 18112 13387 1 17 . 1 1 156 156 SER CA C 156 57.073 57.073 60.194 -3.121 18112 13388 1 17 . 1 1 156 156 SER CB C 156 65.150 65.150 63.790 1.360 18112 13389 1 17 . 1 1 156 156 SER H H 156 8.846 8.846 8.772 0.074 18112 13390 1 17 . 1 1 157 157 GLU N N 157 120.688 120.688 118.800 1.888 18112 13391 1 17 . 1 1 157 157 GLU HA H 157 4.038 4.038 4.867 -0.829 18112 13392 1 17 . 1 1 157 157 GLU C C 157 176.332 176.332 174.572 1.760 18112 13393 1 17 . 1 1 157 157 GLU CA C 157 56.464 56.464 55.465 0.999 18112 13394 1 17 . 1 1 157 157 GLU CB C 157 29.206 29.206 32.489 -3.283 18112 13395 1 17 . 1 1 157 157 GLU H H 157 8.356 8.356 8.137 0.219 18112 13396 1 17 . 1 1 158 158 VAL N N 158 126.906 126.906 117.205 9.701 18112 13397 1 17 . 1 1 158 158 VAL HA H 158 3.449 3.449 4.555 -1.106 18112 13398 1 17 . 1 1 158 158 VAL C C 158 176.382 176.382 173.919 2.463 18112 13399 1 17 . 1 1 158 158 VAL CA C 158 59.584 59.584 58.095 1.489 18112 13400 1 17 . 1 1 158 158 VAL CB C 158 31.160 31.160 32.331 -1.171 18112 13401 1 17 . 1 1 158 158 VAL H H 158 8.561 8.561 7.911 0.650 18112 13402 1 17 . 1 1 159 159 PRO HA H 159 4.403 4.403 4.591 -0.188 18112 13403 1 17 . 1 1 159 159 PRO C C 159 176.757 176.757 176.047 0.710 18112 13404 1 17 . 1 1 159 159 PRO CA C 159 63.845 63.845 63.609 0.236 18112 13405 1 17 . 1 1 159 159 PRO CB C 159 32.106 32.106 32.617 -0.511 18112 13406 1 17 . 1 1 160 160 GLU N N 160 122.904 122.904 122.193 0.711 18112 13407 1 17 . 1 1 160 160 GLU HA H 160 4.008 4.008 4.074 -0.066 18112 13408 1 17 . 1 1 160 160 GLU C C 160 179.132 179.132 175.842 3.290 18112 13409 1 17 . 1 1 160 160 GLU CA C 160 59.407 59.407 57.516 1.891 18112 13410 1 17 . 1 1 160 160 GLU CB C 160 28.991 28.991 30.410 -1.419 18112 13411 1 17 . 1 1 160 160 GLU H H 160 8.650 8.650 8.540 0.110 18112 13412 1 17 . 1 1 161 161 ILE N N 161 119.782 119.782 118.488 1.294 18112 13413 1 17 . 1 1 161 161 ILE HA H 161 4.146 4.146 3.968 0.178 18112 13414 1 17 . 1 1 161 161 ILE C C 161 176.176 176.176 175.211 0.965 18112 13415 1 17 . 1 1 161 161 ILE CA C 161 62.034 62.034 60.046 1.988 18112 13416 1 17 . 1 1 161 161 ILE CB C 161 37.113 37.113 39.659 -2.546 18112 13417 1 17 . 1 1 161 161 ILE H H 161 8.448 8.448 7.705 0.743 18112 13418 1 17 . 1 1 162 162 PHE N N 162 117.594 117.594 125.452 -7.858 18112 13419 1 17 . 1 1 162 162 PHE C C 162 176.115 176.115 177.803 -1.688 18112 13420 1 17 . 1 1 162 162 PHE CA C 162 61.009 61.009 59.182 1.827 18112 13421 1 17 . 1 1 162 162 PHE CB C 162 38.394 38.394 39.036 -0.642 18112 13422 1 17 . 1 1 162 162 PHE H H 162 8.145 8.145 8.361 -0.216 18112 13423 1 17 . 1 1 163 163 LYS N N 163 116.083 116.083 119.769 -3.686 18112 13424 1 17 . 1 1 163 163 LYS C C 163 178.196 178.196 176.548 1.648 18112 13425 1 17 . 1 1 163 163 LYS CA C 163 58.136 58.136 58.510 -0.374 18112 13426 1 17 . 1 1 163 163 LYS CB C 163 31.694 31.694 32.843 -1.149 18112 13427 1 17 . 1 1 163 163 LYS H H 163 8.232 8.232 8.068 0.164 18112 13428 1 17 . 1 1 164 164 SER N N 164 113.680 113.680 108.919 4.761 18112 13429 1 17 . 1 1 164 164 SER CA C 164 55.205 55.205 56.603 -1.398 18112 13430 1 17 . 1 1 164 164 SER CB C 164 63.265 63.265 64.673 -1.408 18112 13431 1 17 . 1 1 164 164 SER H H 164 7.708 7.708 7.595 0.113 18112 13432 1 17 . 1 1 165 165 PRO HA H 165 4.580 4.580 4.717 -0.137 18112 13433 1 17 . 1 1 165 165 PRO C C 165 177.541 177.541 175.957 1.584 18112 13434 1 17 . 1 1 165 165 PRO CA C 165 63.950 63.950 63.809 0.141 18112 13435 1 17 . 1 1 165 165 PRO CB C 165 30.686 30.686 31.878 -1.192 18112 13436 1 17 . 1 1 166 166 ASN N N 166 116.304 116.304 117.105 -0.801 18112 13437 1 17 . 1 1 166 166 ASN HA H 166 5.029 5.029 4.770 0.259 18112 13438 1 17 . 1 1 166 166 ASN C C 166 175.811 175.811 176.671 -0.860 18112 13439 1 17 . 1 1 166 166 ASN CA C 166 51.962 51.962 53.961 -1.999 18112 13440 1 17 . 1 1 166 166 ASN CB C 166 37.915 37.915 39.090 -1.175 18112 13441 1 17 . 1 1 166 166 ASN H H 166 8.216 8.216 8.027 0.189 18112 13442 1 17 . 1 1 167 167 CYS N N 167 116.078 116.078 118.695 -2.617 18112 13443 1 17 . 1 1 167 167 CYS HA H 167 4.011 4.011 4.332 -0.321 18112 13444 1 17 . 1 1 167 167 CYS C C 167 175.057 175.057 177.033 -1.976 18112 13445 1 17 . 1 1 167 167 CYS CA C 167 59.816 59.816 61.883 -2.067 18112 13446 1 17 . 1 1 167 167 CYS CB C 167 27.446 27.446 27.317 0.129 18112 13447 1 17 . 1 1 167 167 CYS H H 167 7.246 7.246 7.439 -0.193 18112 13448 1 17 . 1 1 168 168 LEU N N 168 120.082 120.082 119.839 0.243 18112 13449 1 17 . 1 1 168 168 LEU HA H 168 3.880 3.880 4.114 -0.234 18112 13450 1 17 . 1 1 168 168 LEU C C 168 178.541 178.541 178.212 0.329 18112 13451 1 17 . 1 1 168 168 LEU CA C 168 57.734 57.734 57.170 0.563 18112 13452 1 17 . 1 1 168 168 LEU CB C 168 38.825 38.825 40.534 -1.709 18112 13453 1 17 . 1 1 168 168 LEU H H 168 8.451 8.451 7.417 1.034 18112 13454 1 17 . 1 1 169 169 GLN N N 169 116.700 116.700 118.887 -2.187 18112 13455 1 17 . 1 1 169 169 GLN HA H 169 4.064 4.064 3.963 0.101 18112 13456 1 17 . 1 1 169 169 GLN C C 169 177.378 177.378 177.310 0.068 18112 13457 1 17 . 1 1 169 169 GLN CA C 169 57.675 57.675 58.539 -0.864 18112 13458 1 17 . 1 1 169 169 GLN CB C 169 27.710 27.710 28.248 -0.538 18112 13459 1 17 . 1 1 169 169 GLN H H 169 7.665 7.665 8.192 -0.527 18112 13460 1 17 . 1 1 170 170 GLU N N 170 116.701 116.701 117.573 -0.872 18112 13461 1 17 . 1 1 170 170 GLU HA H 170 4.214 4.214 4.216 -0.002 18112 13462 1 17 . 1 1 170 170 GLU C C 170 177.730 177.730 177.825 -0.095 18112 13463 1 17 . 1 1 170 170 GLU CA C 170 56.899 56.899 57.802 -0.903 18112 13464 1 17 . 1 1 170 170 GLU H H 170 7.405 7.405 7.777 -0.372 18112 13465 1 17 . 1 1 171 171 LEU N N 171 118.021 118.021 113.497 4.524 18112 13466 1 17 . 1 1 171 171 LEU HA H 171 4.209 4.209 4.699 -0.490 18112 13467 1 17 . 1 1 171 171 LEU C C 171 177.005 177.005 177.054 -0.049 18112 13468 1 17 . 1 1 171 171 LEU CA C 171 55.870 55.870 53.857 2.013 18112 13469 1 17 . 1 1 171 171 LEU CB C 171 43.680 43.680 42.401 1.279 18112 13470 1 17 . 1 1 171 171 LEU H H 171 7.823 7.823 7.404 0.419 18112 13471 1 17 . 1 1 172 172 LEU N N 172 117.580 117.580 122.373 -4.793 18112 13472 1 17 . 1 1 172 172 LEU HA H 172 4.571 4.571 4.370 0.201 18112 13473 1 17 . 1 1 172 172 LEU C C 172 176.411 176.411 175.872 0.539 18112 13474 1 17 . 1 1 172 172 LEU CA C 172 53.972 53.972 54.887 -0.915 18112 13475 1 17 . 1 1 172 172 LEU CB C 172 40.483 40.483 41.757 -1.274 18112 13476 1 17 . 1 1 172 172 LEU H H 172 7.306 7.306 7.376 -0.070 18112 13477 1 17 . 1 1 173 173 HIS N N 173 123.310 123.310 126.576 -3.266 18112 13478 1 17 . 1 1 173 173 HIS C C 173 179.022 179.022 174.802 4.220 18112 13479 1 17 . 1 1 173 173 HIS CA C 173 56.693 56.693 55.513 1.180 18112 13480 1 17 . 1 1 173 173 HIS CB C 173 29.371 29.371 31.270 -1.899 18112 13481 1 17 . 1 1 173 173 HIS H H 173 8.028 8.028 8.653 -0.625 18112 13482 1 18 . 1 1 12 12 ALA N N 12 125.167 125.167 128.242 -3.075 18112 13483 1 18 . 1 1 12 12 ALA C C 12 177.566 177.566 177.234 0.332 18112 13484 1 18 . 1 1 12 12 ALA CA C 12 52.067 52.067 52.193 -0.126 18112 13485 1 18 . 1 1 12 12 ALA CB C 12 18.456 18.456 19.379 -0.923 18112 13486 1 18 . 1 1 12 12 ALA H H 12 8.311 8.311 8.121 0.190 18112 13487 1 18 . 1 1 13 13 MET N N 13 119.278 119.278 116.496 2.782 18112 13488 1 18 . 1 1 13 13 MET C C 13 176.325 176.325 174.671 1.654 18112 13489 1 18 . 1 1 13 13 MET CA C 13 54.992 54.992 55.798 -0.806 18112 13490 1 18 . 1 1 13 13 MET CB C 13 32.308 32.308 30.930 1.378 18112 13491 1 18 . 1 1 13 13 MET H H 13 8.269 8.269 8.164 0.105 18112 13492 1 18 . 1 1 14 14 GLN N N 14 120.869 120.869 117.063 3.806 18112 13493 1 18 . 1 1 14 14 GLN HA H 14 4.399 4.399 4.696 -0.297 18112 13494 1 18 . 1 1 14 14 GLN C C 14 175.644 175.644 174.353 1.291 18112 13495 1 18 . 1 1 14 14 GLN CA C 14 55.139 55.139 55.021 0.118 18112 13496 1 18 . 1 1 14 14 GLN CB C 14 29.051 29.051 30.958 -1.907 18112 13497 1 18 . 1 1 14 14 GLN H H 14 8.501 8.501 7.979 0.522 18112 13498 1 18 . 1 1 15 15 GLU N N 15 122.042 122.042 123.822 -1.780 18112 13499 1 18 . 1 1 15 15 GLU C C 15 176.242 176.242 176.860 -0.618 18112 13500 1 18 . 1 1 15 15 GLU CA C 15 56.064 56.064 56.455 -0.391 18112 13501 1 18 . 1 1 15 15 GLU CB C 15 29.302 29.302 30.491 -1.189 18112 13502 1 18 . 1 1 15 15 GLU H H 15 8.547 8.547 8.450 0.097 18112 13503 1 18 . 1 1 16 16 GLY N N 16 108.821 108.821 108.446 0.375 18112 13504 1 18 . 1 1 16 16 GLY C C 16 172.949 172.949 174.130 -1.181 18112 13505 1 18 . 1 1 16 16 GLY CA C 16 44.227 44.227 45.822 -1.595 18112 13506 1 18 . 1 1 16 16 GLY H H 16 8.100 8.100 8.130 -0.030 18112 13507 1 18 . 1 1 17 17 LEU N N 17 120.315 120.315 123.109 -2.794 18112 13508 1 18 . 1 1 17 17 LEU C C 17 177.334 177.334 176.498 0.836 18112 13509 1 18 . 1 1 17 17 LEU CA C 17 53.544 53.544 54.108 -0.564 18112 13510 1 18 . 1 1 17 17 LEU CB C 17 42.140 42.140 42.414 -0.274 18112 13511 1 18 . 1 1 17 17 LEU H H 17 8.222 8.222 7.566 0.656 18112 13512 1 18 . 1 1 18 18 SER N N 18 126.547 126.547 117.924 8.623 18112 13513 1 18 . 1 1 18 18 SER CA C 18 56.851 56.851 56.653 0.198 18112 13514 1 18 . 1 1 18 18 SER CB C 18 64.636 64.636 63.237 1.399 18112 13515 1 18 . 1 1 18 18 SER H H 18 11.627 11.627 8.437 3.190 18112 13516 1 18 . 1 1 19 19 PRO C C 19 175.118 175.118 178.249 -3.131 18112 13517 1 18 . 1 1 20 20 ASN N N 20 121.372 121.372 116.006 5.366 18112 13518 1 18 . 1 1 20 20 ASN H H 20 8.172 8.172 8.898 -0.726 18112 13519 1 18 . 1 1 25 25 ALA CB C 25 18.020 18.020 18.537 -0.517 18112 13520 1 18 . 1 1 26 26 LYS N N 26 118.490 118.490 119.078 -0.588 18112 13521 1 18 . 1 1 26 26 LYS CA C 26 56.146 56.146 59.298 -3.152 18112 13522 1 18 . 1 1 26 26 LYS H H 26 6.794 6.794 7.913 -1.119 18112 13523 1 18 . 1 1 31 31 TYR HA H 31 4.398 4.398 4.338 0.060 18112 13524 1 18 . 1 1 31 31 TYR C C 31 173.714 173.714 175.106 -1.392 18112 13525 1 18 . 1 1 31 31 TYR CA C 31 59.757 59.757 57.959 1.798 18112 13526 1 18 . 1 1 32 32 THR N N 32 111.928 111.928 118.373 -6.445 18112 13527 1 18 . 1 1 32 32 THR HA H 32 4.209 4.209 3.128 1.081 18112 13528 1 18 . 1 1 32 32 THR C C 32 171.061 171.061 172.857 -1.796 18112 13529 1 18 . 1 1 32 32 THR CA C 32 56.905 56.905 63.486 -6.581 18112 13530 1 18 . 1 1 32 32 THR CB C 32 69.707 69.707 68.761 0.946 18112 13531 1 18 . 1 1 32 32 THR H H 32 8.237 8.237 7.837 0.400 18112 13532 1 18 . 1 1 33 33 ARG N N 33 124.856 124.856 125.631 -0.775 18112 13533 1 18 . 1 1 33 33 ARG C C 33 176.451 176.451 175.477 0.974 18112 13534 1 18 . 1 1 33 33 ARG CA C 33 55.627 55.627 53.842 1.785 18112 13535 1 18 . 1 1 33 33 ARG CB C 33 29.861 29.861 30.782 -0.921 18112 13536 1 18 . 1 1 33 33 ARG H H 33 9.159 9.159 6.934 2.225 18112 13537 1 18 . 1 1 34 34 TYR N N 34 117.908 117.908 119.628 -1.720 18112 13538 1 18 . 1 1 34 34 TYR CA C 34 55.320 55.320 56.142 -0.822 18112 13539 1 18 . 1 1 34 34 TYR H H 34 8.995 8.995 7.609 1.386 18112 13540 1 18 . 1 1 35 35 PRO C C 35 177.280 177.280 178.038 -0.758 18112 13541 1 18 . 1 1 36 36 SER N N 36 116.410 116.410 122.292 -5.882 18112 13542 1 18 . 1 1 36 36 SER C C 36 178.938 178.938 176.402 2.536 18112 13543 1 18 . 1 1 36 36 SER CA C 36 64.815 64.815 62.778 2.037 18112 13544 1 18 . 1 1 36 36 SER H H 36 8.106 8.106 9.022 -0.916 18112 13545 1 18 . 1 1 37 37 SER N N 37 117.488 117.488 116.715 0.773 18112 13546 1 18 . 1 1 37 37 SER C C 37 177.698 177.698 176.493 1.205 18112 13547 1 18 . 1 1 37 37 SER CA C 37 61.357 61.357 61.372 -0.015 18112 13548 1 18 . 1 1 37 37 SER CB C 37 68.118 68.118 62.544 5.574 18112 13549 1 18 . 1 1 37 37 SER H H 37 8.169 8.169 8.452 -0.283 18112 13550 1 18 . 1 1 38 38 ASN N N 38 115.638 115.638 121.070 -5.432 18112 13551 1 18 . 1 1 38 38 ASN HA H 38 4.259 4.259 4.363 -0.104 18112 13552 1 18 . 1 1 38 38 ASN C C 38 177.868 177.868 177.506 0.362 18112 13553 1 18 . 1 1 38 38 ASN CA C 38 55.907 55.907 55.606 0.301 18112 13554 1 18 . 1 1 38 38 ASN CB C 38 37.230 37.230 37.842 -0.612 18112 13555 1 18 . 1 1 38 38 ASN H H 38 8.284 8.284 7.825 0.459 18112 13556 1 18 . 1 1 39 39 MET N N 39 121.352 121.352 120.304 1.048 18112 13557 1 18 . 1 1 39 39 MET HA H 39 4.170 4.170 3.818 0.352 18112 13558 1 18 . 1 1 39 39 MET C C 39 179.068 179.068 178.029 1.039 18112 13559 1 18 . 1 1 39 39 MET CA C 39 58.751 58.751 58.307 0.444 18112 13560 1 18 . 1 1 39 39 MET CB C 39 31.850 31.850 32.220 -0.370 18112 13561 1 18 . 1 1 39 39 MET H H 39 7.857 7.857 7.987 -0.130 18112 13562 1 18 . 1 1 40 40 LEU N N 40 118.936 118.936 119.124 -0.188 18112 13563 1 18 . 1 1 40 40 LEU HA H 40 4.139 4.139 4.088 0.051 18112 13564 1 18 . 1 1 40 40 LEU C C 40 178.700 178.700 179.169 -0.469 18112 13565 1 18 . 1 1 40 40 LEU CA C 40 58.455 58.455 58.047 0.409 18112 13566 1 18 . 1 1 40 40 LEU CB C 40 40.304 40.304 41.676 -1.373 18112 13567 1 18 . 1 1 40 40 LEU H H 40 8.167 8.167 8.372 -0.205 18112 13568 1 18 . 1 1 41 41 LYS N N 41 116.791 116.791 118.290 -1.499 18112 13569 1 18 . 1 1 41 41 LYS HA H 41 3.475 3.475 4.155 -0.680 18112 13570 1 18 . 1 1 41 41 LYS C C 41 178.793 178.793 178.398 0.395 18112 13571 1 18 . 1 1 41 41 LYS CA C 41 59.161 59.161 59.182 -0.021 18112 13572 1 18 . 1 1 41 41 LYS CB C 41 30.992 30.992 32.343 -1.351 18112 13573 1 18 . 1 1 41 41 LYS H H 41 7.632 7.632 7.886 -0.254 18112 13574 1 18 . 1 1 42 42 THR N N 42 112.819 112.819 113.867 -1.048 18112 13575 1 18 . 1 1 42 42 THR HA H 42 4.230 4.230 4.148 0.082 18112 13576 1 18 . 1 1 42 42 THR C C 42 176.142 176.142 176.230 -0.088 18112 13577 1 18 . 1 1 42 42 THR CA C 42 65.107 65.107 65.526 -0.419 18112 13578 1 18 . 1 1 42 42 THR CB C 42 68.306 68.306 69.071 -0.765 18112 13579 1 18 . 1 1 42 42 THR H H 42 7.469 7.469 7.892 -0.423 18112 13580 1 18 . 1 1 43 43 TYR N N 43 118.565 118.565 117.667 0.898 18112 13581 1 18 . 1 1 43 43 TYR HA H 43 4.204 4.204 4.446 -0.242 18112 13582 1 18 . 1 1 43 43 TYR C C 43 174.240 174.240 176.542 -2.302 18112 13583 1 18 . 1 1 43 43 TYR CA C 43 60.886 60.886 57.887 2.999 18112 13584 1 18 . 1 1 43 43 TYR CB C 43 38.165 38.165 38.764 -0.599 18112 13585 1 18 . 1 1 43 43 TYR H H 43 7.978 7.978 7.504 0.474 18112 13586 1 18 . 1 1 44 44 PHE N N 44 120.980 120.980 119.208 1.772 18112 13587 1 18 . 1 1 44 44 PHE HA H 44 4.920 4.920 4.945 -0.025 18112 13588 1 18 . 1 1 44 44 PHE C C 44 176.436 176.436 176.038 0.398 18112 13589 1 18 . 1 1 44 44 PHE CA C 44 56.672 56.672 55.792 0.880 18112 13590 1 18 . 1 1 44 44 PHE CB C 44 36.570 36.570 38.309 -1.739 18112 13591 1 18 . 1 1 44 44 PHE H H 44 7.955 7.955 7.965 -0.010 18112 13592 1 18 . 1 1 45 45 SER N N 45 113.407 113.407 119.138 -5.731 18112 13593 1 18 . 1 1 45 45 SER HA H 45 4.373 4.373 4.483 -0.110 18112 13594 1 18 . 1 1 45 45 SER C C 45 174.424 174.424 175.080 -0.656 18112 13595 1 18 . 1 1 45 45 SER CA C 45 61.037 61.037 59.509 1.528 18112 13596 1 18 . 1 1 45 45 SER CB C 45 62.711 62.711 64.106 -1.395 18112 13597 1 18 . 1 1 45 45 SER H H 45 7.932 7.932 8.652 -0.720 18112 13598 1 18 . 1 1 46 46 ASP N N 46 118.099 118.099 121.636 -3.537 18112 13599 1 18 . 1 1 46 46 ASP HA H 46 4.572 4.572 4.597 -0.025 18112 13600 1 18 . 1 1 46 46 ASP C C 46 174.866 174.866 175.972 -1.106 18112 13601 1 18 . 1 1 46 46 ASP CA C 46 53.602 53.602 55.918 -2.316 18112 13602 1 18 . 1 1 46 46 ASP CB C 46 38.992 38.992 40.874 -1.882 18112 13603 1 18 . 1 1 46 46 ASP H H 46 9.889 9.889 8.526 1.363 18112 13604 1 18 . 1 1 47 47 VAL N N 47 121.496 121.496 119.762 1.734 18112 13605 1 18 . 1 1 47 47 VAL HA H 47 4.058 4.058 3.664 0.394 18112 13606 1 18 . 1 1 47 47 VAL C C 47 174.676 174.676 174.958 -0.282 18112 13607 1 18 . 1 1 47 47 VAL CA C 47 61.006 61.006 62.263 -1.257 18112 13608 1 18 . 1 1 47 47 VAL CB C 47 32.110 32.110 31.459 0.651 18112 13609 1 18 . 1 1 47 47 VAL H H 47 7.781 7.781 7.585 0.196 18112 13610 1 18 . 1 1 48 48 LYS N N 48 126.100 126.100 128.817 -2.717 18112 13611 1 18 . 1 1 48 48 LYS HA H 48 4.402 4.402 4.260 0.142 18112 13612 1 18 . 1 1 48 48 LYS C C 48 175.564 175.564 175.782 -0.218 18112 13613 1 18 . 1 1 48 48 LYS CA C 48 54.874 54.874 55.281 -0.406 18112 13614 1 18 . 1 1 48 48 LYS CB C 48 30.189 30.189 31.225 -1.036 18112 13615 1 18 . 1 1 48 48 LYS H H 48 8.245 8.245 8.217 0.028 18112 13616 1 18 . 1 1 49 49 PHE N N 49 125.341 125.341 123.149 2.192 18112 13617 1 18 . 1 1 49 49 PHE HA H 49 3.813 3.813 4.294 -0.481 18112 13618 1 18 . 1 1 49 49 PHE C C 49 175.708 175.708 176.264 -0.556 18112 13619 1 18 . 1 1 49 49 PHE CA C 49 60.861 60.861 58.923 1.938 18112 13620 1 18 . 1 1 49 49 PHE CB C 49 38.616 38.616 38.717 -0.101 18112 13621 1 18 . 1 1 49 49 PHE H H 49 8.626 8.626 8.215 0.411 18112 13622 1 18 . 1 1 50 50 ASN N N 50 115.408 115.408 120.821 -5.413 18112 13623 1 18 . 1 1 50 50 ASN C C 50 176.072 176.072 175.097 0.975 18112 13624 1 18 . 1 1 50 50 ASN CA C 50 51.730 51.730 51.838 -0.108 18112 13625 1 18 . 1 1 50 50 ASN H H 50 7.030 7.030 7.981 -0.951 18112 13626 1 18 . 1 1 51 51 ARG N N 51 122.706 122.706 121.840 0.866 18112 13627 1 18 . 1 1 51 51 ARG CA C 51 59.534 59.534 59.604 -0.070 18112 13628 1 18 . 1 1 51 51 ARG H H 51 7.790 7.790 8.678 -0.888 18112 13629 1 18 . 1 1 52 52 CYS N N 52 117.340 117.340 117.002 0.338 18112 13630 1 18 . 1 1 52 52 CYS HA H 52 4.108 4.108 4.107 0.001 18112 13631 1 18 . 1 1 52 52 CYS C C 52 178.200 178.200 177.152 1.048 18112 13632 1 18 . 1 1 52 52 CYS CA C 52 61.143 61.143 62.457 -1.314 18112 13633 1 18 . 1 1 52 52 CYS H H 52 7.681 7.681 8.258 -0.577 18112 13634 1 18 . 1 1 53 53 ILE N N 53 122.321 122.321 119.959 2.362 18112 13635 1 18 . 1 1 53 53 ILE HA H 53 3.588 3.588 3.727 -0.139 18112 13636 1 18 . 1 1 53 53 ILE C C 53 177.492 177.492 177.558 -0.066 18112 13637 1 18 . 1 1 53 53 ILE CA C 53 64.109 64.109 64.454 -0.345 18112 13638 1 18 . 1 1 53 53 ILE CB C 53 37.603 37.603 37.853 -0.250 18112 13639 1 18 . 1 1 53 53 ILE H H 53 8.035 8.035 7.980 0.055 18112 13640 1 18 . 1 1 54 54 THR C C 54 175.903 175.903 176.858 -0.955 18112 13641 1 18 . 1 1 54 54 THR CA C 54 67.308 67.308 66.955 0.353 18112 13642 1 18 . 1 1 55 55 SER N N 55 113.819 113.819 118.090 -4.271 18112 13643 1 18 . 1 1 55 55 SER H H 55 7.844 7.844 8.029 -0.185 18112 13644 1 18 . 1 1 56 56 GLN C C 56 179.792 179.792 177.418 2.374 18112 13645 1 18 . 1 1 57 57 LEU N N 57 116.701 116.701 120.864 -4.163 18112 13646 1 18 . 1 1 57 57 LEU HA H 57 4.519 4.519 2.891 1.628 18112 13647 1 18 . 1 1 57 57 LEU C C 57 178.775 178.775 178.174 0.601 18112 13648 1 18 . 1 1 57 57 LEU CA C 57 55.232 55.232 57.379 -2.147 18112 13649 1 18 . 1 1 57 57 LEU CB C 57 37.131 37.131 41.652 -4.521 18112 13650 1 18 . 1 1 57 57 LEU H H 57 8.267 8.267 7.527 0.740 18112 13651 1 18 . 1 1 58 58 ILE N N 58 122.522 122.522 117.386 5.136 18112 13652 1 18 . 1 1 58 58 ILE HA H 58 4.640 4.640 3.604 1.036 18112 13653 1 18 . 1 1 58 58 ILE C C 58 177.380 177.380 177.973 -0.593 18112 13654 1 18 . 1 1 58 58 ILE CA C 58 62.163 62.163 62.895 -0.733 18112 13655 1 18 . 1 1 58 58 ILE CB C 58 30.657 30.657 36.427 -5.770 18112 13656 1 18 . 1 1 58 58 ILE H H 58 8.111 8.111 7.981 0.130 18112 13657 1 18 . 1 1 59 59 LYS N N 59 121.002 121.002 121.839 -0.837 18112 13658 1 18 . 1 1 59 59 LYS C C 59 177.600 177.600 179.182 -1.582 18112 13659 1 18 . 1 1 59 59 LYS CA C 59 57.570 57.570 60.066 -2.496 18112 13660 1 18 . 1 1 59 59 LYS CB C 59 39.101 39.101 32.281 6.820 18112 13661 1 18 . 1 1 59 59 LYS H H 59 7.432 7.432 7.600 -0.168 18112 13662 1 18 . 1 1 60 60 TRP N N 60 118.679 118.679 119.575 -0.896 18112 13663 1 18 . 1 1 60 60 TRP HA H 60 3.739 3.739 4.525 -0.786 18112 13664 1 18 . 1 1 60 60 TRP C C 60 178.246 178.246 179.493 -1.247 18112 13665 1 18 . 1 1 60 60 TRP CA C 60 59.818 59.818 59.163 0.655 18112 13666 1 18 . 1 1 60 60 TRP CB C 60 31.851 31.851 28.674 3.178 18112 13667 1 18 . 1 1 60 60 TRP H H 60 7.565 7.565 8.029 -0.464 18112 13668 1 18 . 1 1 61 61 PHE N N 61 118.005 118.005 117.079 0.926 18112 13669 1 18 . 1 1 61 61 PHE HA H 61 3.882 3.882 4.375 -0.493 18112 13670 1 18 . 1 1 61 61 PHE CA C 61 60.054 60.054 59.357 0.697 18112 13671 1 18 . 1 1 61 61 PHE H H 61 7.819 7.819 8.569 -0.750 18112 13672 1 18 . 1 1 62 62 SER N N 62 121.144 121.144 116.075 5.069 18112 13673 1 18 . 1 1 62 62 SER C C 62 177.840 177.840 176.662 1.178 18112 13674 1 18 . 1 1 62 62 SER CA C 62 55.892 55.892 61.910 -6.018 18112 13675 1 18 . 1 1 62 62 SER H H 62 8.878 8.878 8.210 0.668 18112 13676 1 18 . 1 1 63 63 ASN N N 63 115.303 115.303 120.725 -5.422 18112 13677 1 18 . 1 1 63 63 ASN C C 63 177.222 177.222 177.671 -0.449 18112 13678 1 18 . 1 1 63 63 ASN CA C 63 60.467 60.467 56.789 3.678 18112 13679 1 18 . 1 1 63 63 ASN H H 63 8.001 8.001 8.419 -0.418 18112 13680 1 18 . 1 1 64 64 PHE N N 64 112.571 112.571 121.098 -8.527 18112 13681 1 18 . 1 1 64 64 PHE CA C 64 56.453 56.453 61.836 -5.383 18112 13682 1 18 . 1 1 64 64 PHE H H 64 7.082 7.082 8.566 -1.484 18112 13683 1 18 . 1 1 65 65 ARG N N 65 116.695 116.695 119.401 -2.706 18112 13684 1 18 . 1 1 65 65 ARG CA C 65 59.590 59.590 59.353 0.237 18112 13685 1 18 . 1 1 65 65 ARG H H 65 8.091 8.091 8.569 -0.478 18112 13686 1 18 . 1 1 66 66 GLU N N 66 121.653 121.653 119.911 1.742 18112 13687 1 18 . 1 1 66 66 GLU HA H 66 4.739 4.739 4.365 0.374 18112 13688 1 18 . 1 1 66 66 GLU C C 66 174.621 174.621 178.276 -3.655 18112 13689 1 18 . 1 1 66 66 GLU CA C 66 59.583 59.583 58.337 1.246 18112 13690 1 18 . 1 1 66 66 GLU H H 66 7.597 7.597 8.460 -0.863 18112 13691 1 18 . 1 1 67 67 PHE N N 67 111.578 111.578 122.207 -10.629 18112 13692 1 18 . 1 1 67 67 PHE C C 67 176.164 176.164 177.142 -0.978 18112 13693 1 18 . 1 1 67 67 PHE CA C 67 61.156 61.156 61.607 -0.451 18112 13694 1 18 . 1 1 67 67 PHE H H 67 7.067 7.067 8.270 -1.203 18112 13695 1 18 . 1 1 68 68 TYR N N 68 119.370 119.370 120.865 -1.495 18112 13696 1 18 . 1 1 68 68 TYR C C 68 176.844 176.844 177.463 -0.619 18112 13697 1 18 . 1 1 68 68 TYR CA C 68 61.758 61.758 60.842 0.916 18112 13698 1 18 . 1 1 68 68 TYR H H 68 7.442 7.442 8.875 -1.433 18112 13699 1 18 . 1 1 69 69 TYR N N 69 116.047 116.047 120.335 -4.288 18112 13700 1 18 . 1 1 69 69 TYR HA H 69 4.086 4.086 4.052 0.034 18112 13701 1 18 . 1 1 69 69 TYR C C 69 180.328 180.328 177.141 3.187 18112 13702 1 18 . 1 1 69 69 TYR CA C 69 61.528 61.528 61.871 -0.343 18112 13703 1 18 . 1 1 69 69 TYR H H 69 9.127 9.127 8.137 0.990 18112 13704 1 18 . 1 1 70 70 ILE N N 70 124.738 124.738 118.808 5.930 18112 13705 1 18 . 1 1 70 70 ILE HA H 70 3.828 3.828 3.367 0.461 18112 13706 1 18 . 1 1 70 70 ILE C C 70 179.585 179.585 178.005 1.580 18112 13707 1 18 . 1 1 70 70 ILE CA C 70 65.787 65.787 64.136 1.651 18112 13708 1 18 . 1 1 70 70 ILE CB C 70 36.435 36.435 37.389 -0.954 18112 13709 1 18 . 1 1 70 70 ILE H H 70 8.631 8.631 8.153 0.478 18112 13710 1 18 . 1 1 71 71 GLN N N 71 117.940 117.940 117.920 0.020 18112 13711 1 18 . 1 1 71 71 GLN HA H 71 3.826 3.826 3.302 0.524 18112 13712 1 18 . 1 1 71 71 GLN C C 71 178.192 178.192 177.955 0.237 18112 13713 1 18 . 1 1 71 71 GLN CA C 71 57.779 57.779 58.161 -0.382 18112 13714 1 18 . 1 1 71 71 GLN H H 71 7.738 7.738 7.627 0.111 18112 13715 1 18 . 1 1 72 72 MET N N 72 117.353 117.353 117.300 0.053 18112 13716 1 18 . 1 1 72 72 MET HA H 72 4.112 4.112 3.997 0.115 18112 13717 1 18 . 1 1 72 72 MET C C 72 177.203 177.203 178.274 -1.071 18112 13718 1 18 . 1 1 72 72 MET CA C 72 57.272 57.272 58.130 -0.859 18112 13719 1 18 . 1 1 72 72 MET H H 72 7.844 7.844 7.853 -0.009 18112 13720 1 18 . 1 1 73 73 GLU N N 73 117.858 117.858 116.939 0.919 18112 13721 1 18 . 1 1 73 73 GLU HA H 73 3.572 3.572 3.701 -0.129 18112 13722 1 18 . 1 1 73 73 GLU C C 73 177.344 177.344 178.482 -1.138 18112 13723 1 18 . 1 1 73 73 GLU CA C 73 60.324 60.324 58.489 1.835 18112 13724 1 18 . 1 1 73 73 GLU H H 73 7.503 7.503 7.883 -0.380 18112 13725 1 18 . 1 1 74 74 LYS N N 74 118.716 118.716 120.531 -1.815 18112 13726 1 18 . 1 1 74 74 LYS HA H 74 3.867 3.867 3.994 -0.127 18112 13727 1 18 . 1 1 74 74 LYS C C 74 180.077 180.077 178.988 1.089 18112 13728 1 18 . 1 1 74 74 LYS CA C 74 59.754 59.754 58.832 0.922 18112 13729 1 18 . 1 1 74 74 LYS H H 74 7.912 7.912 7.518 0.394 18112 13730 1 18 . 1 1 75 75 TYR N N 75 117.309 117.309 119.531 -2.222 18112 13731 1 18 . 1 1 75 75 TYR HA H 75 4.085 4.085 4.412 -0.327 18112 13732 1 18 . 1 1 75 75 TYR C C 75 178.874 178.874 178.460 0.414 18112 13733 1 18 . 1 1 75 75 TYR CA C 75 63.306 63.306 58.427 4.879 18112 13734 1 18 . 1 1 75 75 TYR H H 75 8.421 8.421 7.844 0.577 18112 13735 1 18 . 1 1 76 76 ALA N N 76 125.392 125.392 122.040 3.352 18112 13736 1 18 . 1 1 76 76 ALA HA H 76 4.221 4.221 4.147 0.074 18112 13737 1 18 . 1 1 76 76 ALA C C 76 178.850 178.850 179.795 -0.945 18112 13738 1 18 . 1 1 76 76 ALA CA C 76 56.280 56.280 55.474 0.806 18112 13739 1 18 . 1 1 76 76 ALA CB C 76 18.687 18.687 18.353 0.334 18112 13740 1 18 . 1 1 76 76 ALA H H 76 8.553 8.553 8.404 0.149 18112 13741 1 18 . 1 1 77 77 ARG N N 77 115.067 115.067 118.194 -3.127 18112 13742 1 18 . 1 1 77 77 ARG HA H 77 3.935 3.935 4.053 -0.118 18112 13743 1 18 . 1 1 77 77 ARG C C 77 179.341 179.341 178.671 0.670 18112 13744 1 18 . 1 1 77 77 ARG CA C 77 60.499 60.499 58.655 1.844 18112 13745 1 18 . 1 1 77 77 ARG H H 77 8.471 8.471 7.973 0.498 18112 13746 1 18 . 1 1 78 78 GLN N N 78 120.107 120.107 119.982 0.125 18112 13747 1 18 . 1 1 78 78 GLN HA H 78 3.921 3.921 4.140 -0.219 18112 13748 1 18 . 1 1 78 78 GLN C C 78 177.289 177.289 178.027 -0.738 18112 13749 1 18 . 1 1 78 78 GLN CA C 78 58.619 58.619 59.007 -0.388 18112 13750 1 18 . 1 1 78 78 GLN CB C 78 27.752 27.752 28.738 -0.986 18112 13751 1 18 . 1 1 78 78 GLN H H 78 8.142 8.142 8.025 0.117 18112 13752 1 18 . 1 1 79 79 ALA N N 79 120.809 120.809 123.016 -2.207 18112 13753 1 18 . 1 1 79 79 ALA HA H 79 4.308 4.308 4.125 0.183 18112 13754 1 18 . 1 1 79 79 ALA C C 79 179.924 179.924 179.787 0.137 18112 13755 1 18 . 1 1 79 79 ALA CA C 79 54.970 54.970 55.479 -0.509 18112 13756 1 18 . 1 1 79 79 ALA CB C 79 17.064 17.064 18.727 -1.663 18112 13757 1 18 . 1 1 79 79 ALA H H 79 7.811 7.811 8.187 -0.376 18112 13758 1 18 . 1 1 80 80 ILE N N 80 118.524 118.524 118.012 0.512 18112 13759 1 18 . 1 1 80 80 ILE HA H 80 3.894 3.894 3.722 0.172 18112 13760 1 18 . 1 1 80 80 ILE C C 80 181.268 181.268 178.130 3.138 18112 13761 1 18 . 1 1 80 80 ILE CA C 80 64.841 64.841 63.610 1.231 18112 13762 1 18 . 1 1 80 80 ILE CB C 80 37.125 37.125 36.497 0.628 18112 13763 1 18 . 1 1 80 80 ILE H H 80 7.837 7.837 8.196 -0.359 18112 13764 1 18 . 1 1 81 81 ASN N N 81 121.233 121.233 118.540 2.693 18112 13765 1 18 . 1 1 81 81 ASN HA H 81 4.398 4.398 4.475 -0.077 18112 13766 1 18 . 1 1 81 81 ASN C C 81 176.546 176.546 177.063 -0.517 18112 13767 1 18 . 1 1 81 81 ASN CA C 81 55.892 55.892 55.670 0.222 18112 13768 1 18 . 1 1 81 81 ASN CB C 81 37.603 37.603 38.730 -1.127 18112 13769 1 18 . 1 1 81 81 ASN H H 81 8.262 8.262 8.063 0.199 18112 13770 1 18 . 1 1 82 82 ASP N N 82 119.240 119.240 117.695 1.545 18112 13771 1 18 . 1 1 82 82 ASP HA H 82 4.666 4.666 4.617 0.049 18112 13772 1 18 . 1 1 82 82 ASP C C 82 176.767 176.767 177.179 -0.412 18112 13773 1 18 . 1 1 82 82 ASP CA C 82 54.771 54.771 54.533 0.238 18112 13774 1 18 . 1 1 82 82 ASP CB C 82 40.121 40.121 41.652 -1.531 18112 13775 1 18 . 1 1 82 82 ASP H H 82 8.316 8.316 8.067 0.249 18112 13776 1 18 . 1 1 83 83 GLY N N 83 106.913 106.913 107.056 -0.143 18112 13777 1 18 . 1 1 83 83 GLY C C 83 174.601 174.601 174.775 -0.174 18112 13778 1 18 . 1 1 83 83 GLY CA C 83 45.214 45.214 44.958 0.256 18112 13779 1 18 . 1 1 83 83 GLY H H 83 7.810 7.810 7.979 -0.169 18112 13780 1 18 . 1 1 84 84 VAL N N 84 122.981 122.981 120.380 2.601 18112 13781 1 18 . 1 1 84 84 VAL HA H 84 3.850 3.850 4.157 -0.307 18112 13782 1 18 . 1 1 84 84 VAL C C 84 177.265 177.265 176.240 1.025 18112 13783 1 18 . 1 1 84 84 VAL CA C 84 64.270 64.270 62.785 1.485 18112 13784 1 18 . 1 1 84 84 VAL CB C 84 30.471 30.471 32.170 -1.699 18112 13785 1 18 . 1 1 84 84 VAL H H 84 8.157 8.157 7.824 0.333 18112 13786 1 18 . 1 1 85 85 THR N N 85 115.232 115.232 115.580 -0.348 18112 13787 1 18 . 1 1 85 85 THR HA H 85 4.716 4.716 4.653 0.063 18112 13788 1 18 . 1 1 85 85 THR C C 85 174.489 174.489 174.566 -0.077 18112 13789 1 18 . 1 1 85 85 THR CA C 85 61.618 61.618 62.556 -0.938 18112 13790 1 18 . 1 1 85 85 THR CB C 85 70.081 70.081 69.759 0.322 18112 13791 1 18 . 1 1 85 85 THR H H 85 8.890 8.890 8.177 0.713 18112 13792 1 18 . 1 1 86 86 SER N N 86 117.009 117.009 118.155 -1.146 18112 13793 1 18 . 1 1 86 86 SER HA H 86 5.046 5.046 4.550 0.496 18112 13794 1 18 . 1 1 86 86 SER C C 86 174.473 174.473 174.976 -0.503 18112 13795 1 18 . 1 1 86 86 SER CA C 86 55.922 55.922 57.204 -1.282 18112 13796 1 18 . 1 1 86 86 SER CB C 86 64.385 64.385 64.887 -0.502 18112 13797 1 18 . 1 1 86 86 SER H H 86 7.704 7.704 7.706 -0.002 18112 13798 1 18 . 1 1 87 87 THR N N 87 118.634 118.634 117.806 0.828 18112 13799 1 18 . 1 1 87 87 THR HA H 87 4.065 4.065 3.892 0.173 18112 13800 1 18 . 1 1 87 87 THR C C 87 176.047 176.047 175.390 0.657 18112 13801 1 18 . 1 1 87 87 THR CA C 87 64.983 64.983 64.775 0.208 18112 13802 1 18 . 1 1 87 87 THR CB C 87 68.045 68.045 68.528 -0.482 18112 13803 1 18 . 1 1 87 87 THR H H 87 8.711 8.711 8.672 0.039 18112 13804 1 18 . 1 1 88 88 GLU N N 88 117.889 117.889 117.655 0.234 18112 13805 1 18 . 1 1 88 88 GLU HA H 88 3.881 3.881 4.127 -0.246 18112 13806 1 18 . 1 1 88 88 GLU C C 88 177.146 177.146 177.355 -0.209 18112 13807 1 18 . 1 1 88 88 GLU CA C 88 57.814 57.814 57.889 -0.075 18112 13808 1 18 . 1 1 88 88 GLU CB C 88 28.050 28.050 28.425 -0.375 18112 13809 1 18 . 1 1 88 88 GLU H H 88 8.152 8.152 8.406 -0.254 18112 13810 1 18 . 1 1 89 89 GLU N N 89 115.617 115.617 118.645 -3.028 18112 13811 1 18 . 1 1 89 89 GLU HA H 89 4.149 4.149 4.276 -0.127 18112 13812 1 18 . 1 1 89 89 GLU C C 89 176.192 176.192 177.370 -1.178 18112 13813 1 18 . 1 1 89 89 GLU CA C 89 56.133 56.133 57.512 -1.379 18112 13814 1 18 . 1 1 89 89 GLU CB C 89 29.415 29.415 30.128 -0.713 18112 13815 1 18 . 1 1 89 89 GLU H H 89 7.311 7.311 7.539 -0.228 18112 13816 1 18 . 1 1 90 90 LEU N N 90 120.870 120.870 113.195 7.675 18112 13817 1 18 . 1 1 90 90 LEU HA H 90 4.439 4.439 4.638 -0.199 18112 13818 1 18 . 1 1 90 90 LEU C C 90 175.267 175.267 176.069 -0.802 18112 13819 1 18 . 1 1 90 90 LEU CA C 90 53.504 53.504 55.077 -1.573 18112 13820 1 18 . 1 1 90 90 LEU CB C 90 40.479 40.479 43.679 -3.200 18112 13821 1 18 . 1 1 90 90 LEU H H 90 7.311 7.311 7.280 0.031 18112 13822 1 18 . 1 1 91 91 SER N N 91 118.376 118.376 114.631 3.745 18112 13823 1 18 . 1 1 91 91 SER HA H 91 4.747 4.747 4.606 0.141 18112 13824 1 18 . 1 1 91 91 SER C C 91 173.332 173.332 172.168 1.164 18112 13825 1 18 . 1 1 91 91 SER CA C 91 56.314 56.314 58.516 -2.201 18112 13826 1 18 . 1 1 91 91 SER CB C 91 64.615 64.615 64.945 -0.330 18112 13827 1 18 . 1 1 91 91 SER H H 91 8.221 8.221 7.868 0.353 18112 13828 1 18 . 1 1 92 92 ILE N N 92 122.247 122.247 123.318 -1.071 18112 13829 1 18 . 1 1 92 92 ILE HA H 92 4.537 4.537 4.347 0.190 18112 13830 1 18 . 1 1 92 92 ILE C C 92 174.059 174.059 174.798 -0.739 18112 13831 1 18 . 1 1 92 92 ILE CA C 92 59.881 59.881 59.913 -0.032 18112 13832 1 18 . 1 1 92 92 ILE CB C 92 37.820 37.820 41.287 -3.467 18112 13833 1 18 . 1 1 92 92 ILE H H 92 8.570 8.570 8.252 0.318 18112 13834 1 18 . 1 1 93 93 THR N N 93 116.069 116.069 116.348 -0.279 18112 13835 1 18 . 1 1 93 93 THR HA H 93 4.580 4.580 4.615 -0.035 18112 13836 1 18 . 1 1 93 93 THR C C 93 175.049 175.049 175.749 -0.700 18112 13837 1 18 . 1 1 93 93 THR CA C 93 58.988 58.988 64.109 -5.121 18112 13838 1 18 . 1 1 93 93 THR CB C 93 71.362 71.362 69.223 2.139 18112 13839 1 18 . 1 1 93 93 THR H H 93 7.224 7.224 8.570 -1.346 18112 13840 1 18 . 1 1 94 94 ARG N N 94 116.595 116.595 118.353 -1.758 18112 13841 1 18 . 1 1 94 94 ARG HA H 94 3.077 3.077 3.934 -0.857 18112 13842 1 18 . 1 1 94 94 ARG C C 94 175.076 175.076 174.294 0.782 18112 13843 1 18 . 1 1 94 94 ARG CA C 94 57.119 57.119 56.527 0.592 18112 13844 1 18 . 1 1 94 94 ARG CB C 94 27.838 27.838 28.473 -0.635 18112 13845 1 18 . 1 1 94 94 ARG H H 94 8.596 8.596 8.911 -0.315 18112 13846 1 18 . 1 1 95 95 ASP N N 95 113.735 113.735 114.767 -1.032 18112 13847 1 18 . 1 1 95 95 ASP HA H 95 4.765 4.765 2.278 2.487 18112 13848 1 18 . 1 1 95 95 ASP C C 95 175.876 175.876 175.391 0.485 18112 13849 1 18 . 1 1 95 95 ASP CA C 95 53.156 53.156 54.651 -1.495 18112 13850 1 18 . 1 1 95 95 ASP CB C 95 41.166 41.166 38.810 2.356 18112 13851 1 18 . 1 1 95 95 ASP H H 95 7.607 7.607 7.468 0.139 18112 13852 1 18 . 1 1 96 96 CYS N N 96 116.012 116.012 116.492 -0.480 18112 13853 1 18 . 1 1 96 96 CYS C C 96 174.361 174.361 176.457 -2.096 18112 13854 1 18 . 1 1 96 96 CYS CA C 96 56.562 56.562 58.085 -1.523 18112 13855 1 18 . 1 1 96 96 CYS CB C 96 29.416 29.416 29.572 -0.155 18112 13856 1 18 . 1 1 96 96 CYS H H 96 7.094 7.094 7.364 -0.270 18112 13857 1 18 . 1 1 97 97 GLU N N 97 123.087 123.087 120.960 2.127 18112 13858 1 18 . 1 1 97 97 GLU C C 97 178.748 178.748 178.369 0.379 18112 13859 1 18 . 1 1 97 97 GLU CA C 97 59.912 59.912 59.209 0.703 18112 13860 1 18 . 1 1 97 97 GLU CB C 97 29.195 29.195 29.062 0.133 18112 13861 1 18 . 1 1 97 97 GLU H H 97 9.003 9.003 8.824 0.179 18112 13862 1 18 . 1 1 98 98 LEU N N 98 120.942 120.942 120.870 0.072 18112 13863 1 18 . 1 1 98 98 LEU HA H 98 3.614 3.614 4.104 -0.490 18112 13864 1 18 . 1 1 98 98 LEU C C 98 177.796 177.796 178.526 -0.730 18112 13865 1 18 . 1 1 98 98 LEU CA C 98 58.090 58.090 58.091 -0.001 18112 13866 1 18 . 1 1 98 98 LEU CB C 98 39.778 39.778 41.767 -1.989 18112 13867 1 18 . 1 1 98 98 LEU H H 98 8.656 8.656 8.085 0.572 18112 13868 1 18 . 1 1 99 99 TYR N N 99 118.313 118.313 117.921 0.392 18112 13869 1 18 . 1 1 99 99 TYR C C 99 177.077 177.077 178.403 -1.326 18112 13870 1 18 . 1 1 99 99 TYR CA C 99 62.622 62.622 61.408 1.214 18112 13871 1 18 . 1 1 99 99 TYR CB C 99 38.742 38.742 37.390 1.352 18112 13872 1 18 . 1 1 99 99 TYR H H 99 7.522 7.522 7.842 -0.320 18112 13873 1 18 . 1 1 100 100 ARG N N 100 118.101 118.101 119.410 -1.309 18112 13874 1 18 . 1 1 100 100 ARG C C 100 178.616 178.616 178.092 0.524 18112 13875 1 18 . 1 1 100 100 ARG CA C 100 59.915 59.915 58.762 1.153 18112 13876 1 18 . 1 1 100 100 ARG CB C 100 29.100 29.100 29.615 -0.515 18112 13877 1 18 . 1 1 100 100 ARG H H 100 8.243 8.243 8.146 0.097 18112 13878 1 18 . 1 1 101 101 ALA N N 101 120.972 120.972 121.929 -0.957 18112 13879 1 18 . 1 1 101 101 ALA HA H 101 4.145 4.145 3.991 0.154 18112 13880 1 18 . 1 1 101 101 ALA C C 101 181.359 181.359 179.952 1.407 18112 13881 1 18 . 1 1 101 101 ALA CA C 101 55.057 55.057 54.910 0.147 18112 13882 1 18 . 1 1 101 101 ALA CB C 101 17.543 17.543 18.303 -0.760 18112 13883 1 18 . 1 1 101 101 ALA H H 101 8.352 8.352 7.770 0.582 18112 13884 1 18 . 1 1 102 102 LEU N N 102 115.683 115.683 119.315 -3.632 18112 13885 1 18 . 1 1 102 102 LEU HA H 102 4.333 4.333 4.165 0.168 18112 13886 1 18 . 1 1 102 102 LEU C C 102 178.583 178.583 179.483 -0.900 18112 13887 1 18 . 1 1 102 102 LEU CA C 102 57.634 57.634 58.266 -0.632 18112 13888 1 18 . 1 1 102 102 LEU CB C 102 41.716 41.716 41.593 0.123 18112 13889 1 18 . 1 1 102 102 LEU H H 102 7.960 7.960 8.514 -0.554 18112 13890 1 18 . 1 1 103 103 ASN N N 103 118.957 118.957 117.945 1.012 18112 13891 1 18 . 1 1 103 103 ASN C C 103 177.470 177.470 177.874 -0.404 18112 13892 1 18 . 1 1 103 103 ASN CA C 103 56.974 56.974 56.221 0.753 18112 13893 1 18 . 1 1 103 103 ASN CB C 103 38.140 38.140 39.108 -0.968 18112 13894 1 18 . 1 1 103 103 ASN H H 103 9.301 9.301 8.304 0.997 18112 13895 1 18 . 1 1 104 104 MET N N 104 113.763 113.763 115.399 -1.636 18112 13896 1 18 . 1 1 104 104 MET CA C 104 57.362 57.362 56.841 0.521 18112 13897 1 18 . 1 1 104 104 MET CB C 104 31.895 31.895 31.785 0.111 18112 13898 1 18 . 1 1 104 104 MET H H 104 8.332 8.332 7.951 0.381 18112 13899 1 18 . 1 1 105 105 HIS N N 105 116.024 116.024 116.649 -0.625 18112 13900 1 18 . 1 1 105 105 HIS HA H 105 3.764 3.764 4.347 -0.583 18112 13901 1 18 . 1 1 105 105 HIS C C 105 176.939 176.939 176.767 0.172 18112 13902 1 18 . 1 1 105 105 HIS CA C 105 59.069 59.069 58.358 0.711 18112 13903 1 18 . 1 1 105 105 HIS H H 105 7.156 7.156 7.901 -0.745 18112 13904 1 18 . 1 1 106 106 TYR N N 106 113.161 113.161 114.735 -1.574 18112 13905 1 18 . 1 1 106 106 TYR C C 106 173.767 173.767 175.950 -2.183 18112 13906 1 18 . 1 1 106 106 TYR CA C 106 58.488 58.488 59.540 -1.052 18112 13907 1 18 . 1 1 106 106 TYR CB C 106 38.225 38.225 39.280 -1.055 18112 13908 1 18 . 1 1 106 106 TYR H H 106 7.204 7.204 7.834 -0.630 18112 13909 1 18 . 1 1 107 107 ASN N N 107 118.875 118.875 116.906 1.969 18112 13910 1 18 . 1 1 107 107 ASN HA H 107 3.922 3.922 5.049 -1.127 18112 13911 1 18 . 1 1 107 107 ASN C C 107 175.815 175.815 174.451 1.364 18112 13912 1 18 . 1 1 107 107 ASN CA C 107 51.233 51.233 52.537 -1.304 18112 13913 1 18 . 1 1 107 107 ASN CB C 107 38.142 38.142 41.068 -2.926 18112 13914 1 18 . 1 1 107 107 ASN H H 107 8.127 8.127 8.165 -0.038 18112 13915 1 18 . 1 1 108 108 LYS N N 108 122.850 122.850 121.705 1.145 18112 13916 1 18 . 1 1 108 108 LYS HA H 108 3.954 3.954 4.446 -0.492 18112 13917 1 18 . 1 1 108 108 LYS C C 108 177.586 177.586 176.915 0.671 18112 13918 1 18 . 1 1 108 108 LYS CA C 108 59.749 59.749 57.709 2.040 18112 13919 1 18 . 1 1 108 108 LYS CB C 108 31.498 31.498 32.495 -0.997 18112 13920 1 18 . 1 1 108 108 LYS H H 108 7.772 7.772 8.600 -0.828 18112 13921 1 18 . 1 1 109 109 ALA N N 109 118.054 118.054 121.758 -3.704 18112 13922 1 18 . 1 1 109 109 ALA HA H 109 4.137 4.137 4.456 -0.319 18112 13923 1 18 . 1 1 109 109 ALA C C 109 177.889 177.889 176.772 1.117 18112 13924 1 18 . 1 1 109 109 ALA CA C 109 52.299 52.299 52.452 -0.153 18112 13925 1 18 . 1 1 109 109 ALA CB C 109 17.787 17.787 18.173 -0.386 18112 13926 1 18 . 1 1 109 109 ALA H H 109 8.307 8.307 7.955 0.352 18112 13927 1 18 . 1 1 110 110 ASN N N 110 115.542 115.542 113.857 1.685 18112 13928 1 18 . 1 1 110 110 ASN HA H 110 4.480 4.480 4.657 -0.177 18112 13929 1 18 . 1 1 110 110 ASN C C 110 174.277 174.277 174.848 -0.571 18112 13930 1 18 . 1 1 110 110 ASN CA C 110 53.504 53.504 54.225 -0.721 18112 13931 1 18 . 1 1 110 110 ASN CB C 110 37.283 37.283 36.495 0.788 18112 13932 1 18 . 1 1 110 110 ASN H H 110 8.353 8.353 8.333 0.020 18112 13933 1 18 . 1 1 111 111 ASP N N 111 114.692 114.692 120.057 -5.365 18112 13934 1 18 . 1 1 111 111 ASP HA H 111 4.485 4.485 4.422 0.063 18112 13935 1 18 . 1 1 111 111 ASP C C 111 174.868 174.868 176.025 -1.157 18112 13936 1 18 . 1 1 111 111 ASP CA C 111 53.227 53.227 56.586 -3.359 18112 13937 1 18 . 1 1 111 111 ASP CB C 111 39.228 39.228 41.285 -2.057 18112 13938 1 18 . 1 1 111 111 ASP H H 111 8.297 8.297 8.364 -0.067 18112 13939 1 18 . 1 1 112 112 PHE N N 112 120.927 120.927 120.513 0.414 18112 13940 1 18 . 1 1 112 112 PHE HA H 112 4.752 4.752 4.473 0.279 18112 13941 1 18 . 1 1 112 112 PHE C C 112 174.633 174.633 175.333 -0.700 18112 13942 1 18 . 1 1 112 112 PHE CA C 112 56.346 56.346 58.169 -1.823 18112 13943 1 18 . 1 1 112 112 PHE H H 112 7.784 7.784 8.272 -0.488 18112 13944 1 18 . 1 1 113 113 GLU N N 113 128.111 128.111 124.683 3.428 18112 13945 1 18 . 1 1 113 113 GLU HA H 113 4.011 4.011 4.378 -0.367 18112 13946 1 18 . 1 1 113 113 GLU C C 113 173.502 173.502 175.757 -2.255 18112 13947 1 18 . 1 1 113 113 GLU CA C 113 55.100 55.100 55.523 -0.423 18112 13948 1 18 . 1 1 113 113 GLU H H 113 7.752 7.752 8.821 -1.069 18112 13949 1 18 . 1 1 114 114 VAL N N 114 129.326 129.326 115.197 14.129 18112 13950 1 18 . 1 1 114 114 VAL HA H 114 3.241 3.241 3.516 -0.275 18112 13951 1 18 . 1 1 114 114 VAL CA C 114 60.838 60.838 61.448 -0.610 18112 13952 1 18 . 1 1 114 114 VAL CB C 114 32.609 32.609 30.439 2.170 18112 13953 1 18 . 1 1 114 114 VAL H H 114 8.008 8.008 7.702 0.306 18112 13954 1 18 . 1 1 115 115 PRO HA H 115 4.429 4.429 4.605 -0.176 18112 13955 1 18 . 1 1 115 115 PRO C C 115 177.421 177.421 177.982 -0.561 18112 13956 1 18 . 1 1 115 115 PRO CA C 115 61.882 61.882 62.274 -0.392 18112 13957 1 18 . 1 1 115 115 PRO CB C 115 30.974 30.974 32.887 -1.913 18112 13958 1 18 . 1 1 116 116 GLU N N 116 123.936 123.936 120.729 3.207 18112 13959 1 18 . 1 1 116 116 GLU C C 116 179.034 179.034 179.097 -0.063 18112 13960 1 18 . 1 1 116 116 GLU CA C 116 58.913 58.913 60.343 -1.430 18112 13961 1 18 . 1 1 116 116 GLU CB C 116 28.378 28.378 28.884 -0.506 18112 13962 1 18 . 1 1 116 116 GLU H H 116 8.757 8.757 8.866 -0.109 18112 13963 1 18 . 1 1 117 117 ARG N N 117 116.943 116.943 119.288 -2.345 18112 13964 1 18 . 1 1 117 117 ARG C C 117 177.570 177.570 178.547 -0.977 18112 13965 1 18 . 1 1 117 117 ARG CA C 117 57.033 57.033 58.950 -1.917 18112 13966 1 18 . 1 1 117 117 ARG CB C 117 28.172 28.172 29.303 -1.131 18112 13967 1 18 . 1 1 117 117 ARG H H 117 8.733 8.733 8.457 0.276 18112 13968 1 18 . 1 1 118 118 PHE N N 118 117.528 117.528 116.241 1.287 18112 13969 1 18 . 1 1 118 118 PHE HA H 118 4.137 4.137 4.188 -0.051 18112 13970 1 18 . 1 1 118 118 PHE C C 118 176.992 176.992 177.683 -0.691 18112 13971 1 18 . 1 1 118 118 PHE CA C 118 61.627 61.627 61.244 0.383 18112 13972 1 18 . 1 1 118 118 PHE CB C 118 37.386 37.386 38.545 -1.159 18112 13973 1 18 . 1 1 118 118 PHE H H 118 7.606 7.606 7.988 -0.382 18112 13974 1 18 . 1 1 119 119 LEU N N 119 118.483 118.483 119.138 -0.655 18112 13975 1 18 . 1 1 119 119 LEU HA H 119 3.684 3.684 4.188 -0.504 18112 13976 1 18 . 1 1 119 119 LEU C C 119 178.802 178.802 178.715 0.087 18112 13977 1 18 . 1 1 119 119 LEU CA C 119 59.875 59.875 56.039 3.836 18112 13978 1 18 . 1 1 119 119 LEU CB C 119 39.453 39.453 40.542 -1.089 18112 13979 1 18 . 1 1 119 119 LEU H H 119 7.248 7.248 7.604 -0.356 18112 13980 1 18 . 1 1 120 120 GLU N N 120 117.870 117.870 122.079 -4.209 18112 13981 1 18 . 1 1 120 120 GLU C C 120 179.932 179.932 178.945 0.987 18112 13982 1 18 . 1 1 120 120 GLU CA C 120 59.150 59.150 59.910 -0.760 18112 13983 1 18 . 1 1 120 120 GLU CB C 120 28.878 28.878 29.775 -0.897 18112 13984 1 18 . 1 1 120 120 GLU H H 120 7.423 7.423 8.219 -0.796 18112 13985 1 18 . 1 1 121 121 VAL N N 121 120.777 120.777 119.703 1.074 18112 13986 1 18 . 1 1 121 121 VAL HA H 121 3.545 3.545 3.499 0.046 18112 13987 1 18 . 1 1 121 121 VAL C C 121 179.302 179.302 177.521 1.781 18112 13988 1 18 . 1 1 121 121 VAL CA C 121 66.875 66.875 66.833 0.042 18112 13989 1 18 . 1 1 121 121 VAL CB C 121 30.823 30.823 31.215 -0.392 18112 13990 1 18 . 1 1 121 121 VAL H H 121 8.313 8.313 7.962 0.351 18112 13991 1 18 . 1 1 122 122 ALA N N 122 127.029 127.029 121.621 5.408 18112 13992 1 18 . 1 1 122 122 ALA HA H 122 4.251 4.251 4.103 0.148 18112 13993 1 18 . 1 1 122 122 ALA C C 122 178.366 178.366 179.711 -1.345 18112 13994 1 18 . 1 1 122 122 ALA CA C 122 54.748 54.748 55.088 -0.340 18112 13995 1 18 . 1 1 122 122 ALA CB C 122 16.565 16.565 18.363 -1.798 18112 13996 1 18 . 1 1 122 122 ALA H H 122 8.896 8.896 7.831 1.065 18112 13997 1 18 . 1 1 123 123 GLN N N 123 119.887 119.887 119.511 0.376 18112 13998 1 18 . 1 1 123 123 GLN C C 123 177.908 177.908 178.459 -0.551 18112 13999 1 18 . 1 1 123 123 GLN CA C 123 60.671 60.671 59.014 1.657 18112 14000 1 18 . 1 1 123 123 GLN H H 123 8.349 8.349 7.822 0.527 18112 14001 1 18 . 1 1 124 124 ILE N N 124 120.632 120.632 118.587 2.045 18112 14002 1 18 . 1 1 124 124 ILE HA H 124 3.651 3.651 3.758 -0.107 18112 14003 1 18 . 1 1 124 124 ILE C C 124 178.703 178.703 178.269 0.434 18112 14004 1 18 . 1 1 124 124 ILE CA C 124 65.945 65.945 65.104 0.841 18112 14005 1 18 . 1 1 124 124 ILE H H 124 8.204 8.204 8.058 0.146 18112 14006 1 18 . 1 1 125 125 THR N N 125 115.084 115.084 115.317 -0.233 18112 14007 1 18 . 1 1 125 125 THR C C 125 175.568 175.568 176.233 -0.665 18112 14008 1 18 . 1 1 125 125 THR CA C 125 67.872 67.872 66.467 1.405 18112 14009 1 18 . 1 1 125 125 THR H H 125 8.399 8.399 8.292 0.107 18112 14010 1 18 . 1 1 126 126 LEU N N 126 125.011 125.011 122.469 2.542 18112 14011 1 18 . 1 1 126 126 LEU HA H 126 4.085 4.085 4.409 -0.324 18112 14012 1 18 . 1 1 126 126 LEU C C 126 178.559 178.559 178.079 0.480 18112 14013 1 18 . 1 1 126 126 LEU CA C 126 58.843 58.843 58.192 0.651 18112 14014 1 18 . 1 1 126 126 LEU CB C 126 41.421 41.421 41.893 -0.472 18112 14015 1 18 . 1 1 126 126 LEU H H 126 8.728 8.728 8.063 0.665 18112 14016 1 18 . 1 1 127 127 ARG N N 127 117.076 117.076 119.429 -2.353 18112 14017 1 18 . 1 1 127 127 ARG HA H 127 3.929 3.929 4.025 -0.096 18112 14018 1 18 . 1 1 127 127 ARG C C 127 177.984 177.984 178.753 -0.769 18112 14019 1 18 . 1 1 127 127 ARG CA C 127 60.685 60.685 59.816 0.869 18112 14020 1 18 . 1 1 127 127 ARG CB C 127 28.079 28.079 30.051 -1.972 18112 14021 1 18 . 1 1 127 127 ARG H H 127 8.213 8.213 8.199 0.014 18112 14022 1 18 . 1 1 128 128 GLU N N 128 118.617 118.617 119.409 -0.792 18112 14023 1 18 . 1 1 128 128 GLU HA H 128 4.147 4.147 4.192 -0.045 18112 14024 1 18 . 1 1 128 128 GLU C C 128 181.150 181.150 179.298 1.852 18112 14025 1 18 . 1 1 128 128 GLU CA C 128 59.508 59.508 58.824 0.684 18112 14026 1 18 . 1 1 128 128 GLU H H 128 8.478 8.478 8.168 0.310 18112 14027 1 18 . 1 1 129 129 PHE N N 129 119.267 119.267 120.876 -1.609 18112 14028 1 18 . 1 1 129 129 PHE HA H 129 4.104 4.104 4.409 -0.305 18112 14029 1 18 . 1 1 129 129 PHE C C 129 177.170 177.170 177.626 -0.456 18112 14030 1 18 . 1 1 129 129 PHE CA C 129 63.694 63.694 60.571 3.123 18112 14031 1 18 . 1 1 129 129 PHE H H 129 8.570 8.570 8.275 0.295 18112 14032 1 18 . 1 1 130 130 PHE N N 130 118.739 118.739 119.539 -0.800 18112 14033 1 18 . 1 1 130 130 PHE HA H 130 3.884 3.884 3.982 -0.098 18112 14034 1 18 . 1 1 130 130 PHE C C 130 175.860 175.860 177.236 -1.376 18112 14035 1 18 . 1 1 130 130 PHE CA C 130 62.819 62.819 62.104 0.715 18112 14036 1 18 . 1 1 130 130 PHE H H 130 8.740 8.740 9.032 -0.292 18112 14037 1 18 . 1 1 131 131 ASN N N 131 116.028 116.028 117.847 -1.819 18112 14038 1 18 . 1 1 131 131 ASN HA H 131 4.373 4.373 4.366 0.007 18112 14039 1 18 . 1 1 131 131 ASN C C 131 178.228 178.228 177.565 0.663 18112 14040 1 18 . 1 1 131 131 ASN CA C 131 55.150 55.150 56.560 -1.410 18112 14041 1 18 . 1 1 131 131 ASN H H 131 8.864 8.864 8.357 0.507 18112 14042 1 18 . 1 1 132 132 ALA N N 132 120.922 120.922 123.314 -2.392 18112 14043 1 18 . 1 1 132 132 ALA HA H 132 4.020 4.020 4.095 -0.075 18112 14044 1 18 . 1 1 132 132 ALA C C 132 178.515 178.515 179.784 -1.269 18112 14045 1 18 . 1 1 132 132 ALA CA C 132 54.924 54.924 55.127 -0.203 18112 14046 1 18 . 1 1 132 132 ALA CB C 132 18.441 18.441 18.611 -0.170 18112 14047 1 18 . 1 1 132 132 ALA H H 132 7.745 7.745 7.927 -0.182 18112 14048 1 18 . 1 1 133 133 ILE N N 133 118.200 118.200 120.188 -1.988 18112 14049 1 18 . 1 1 133 133 ILE HA H 133 3.235 3.235 3.873 -0.638 18112 14050 1 18 . 1 1 133 133 ILE C C 133 180.606 180.606 178.181 2.425 18112 14051 1 18 . 1 1 133 133 ILE CA C 133 65.215 65.215 64.305 0.910 18112 14052 1 18 . 1 1 133 133 ILE CB C 133 38.291 38.291 37.706 0.585 18112 14053 1 18 . 1 1 133 133 ILE H H 133 7.999 7.999 8.061 -0.062 18112 14054 1 18 . 1 1 134 134 ILE N N 134 122.564 122.564 119.961 2.603 18112 14055 1 18 . 1 1 134 134 ILE HA H 134 3.788 3.788 3.603 0.185 18112 14056 1 18 . 1 1 134 134 ILE C C 134 177.215 177.215 176.919 0.296 18112 14057 1 18 . 1 1 134 134 ILE CA C 134 63.584 63.584 63.722 -0.138 18112 14058 1 18 . 1 1 134 134 ILE CB C 134 35.636 35.636 37.526 -1.890 18112 14059 1 18 . 1 1 134 134 ILE H H 134 8.670 8.670 7.786 0.884 18112 14060 1 18 . 1 1 135 135 ALA N N 135 119.989 119.989 119.897 0.092 18112 14061 1 18 . 1 1 135 135 ALA HA H 135 4.357 4.357 4.274 0.083 18112 14062 1 18 . 1 1 135 135 ALA C C 135 177.786 177.786 177.591 0.195 18112 14063 1 18 . 1 1 135 135 ALA CA C 135 51.521 51.521 52.536 -1.015 18112 14064 1 18 . 1 1 135 135 ALA CB C 135 18.839 18.839 20.127 -1.288 18112 14065 1 18 . 1 1 135 135 ALA H H 135 6.898 6.898 7.910 -1.012 18112 14066 1 18 . 1 1 136 136 GLY N N 136 107.682 107.682 105.125 2.557 18112 14067 1 18 . 1 1 136 136 GLY C C 136 176.324 176.324 175.206 1.118 18112 14068 1 18 . 1 1 136 136 GLY CA C 136 45.469 45.469 45.343 0.126 18112 14069 1 18 . 1 1 136 136 GLY H H 136 7.913 7.913 7.805 0.108 18112 14070 1 18 . 1 1 137 137 LYS N N 137 117.213 117.213 119.101 -1.888 18112 14071 1 18 . 1 1 137 137 LYS HA H 137 4.004 4.004 4.360 -0.356 18112 14072 1 18 . 1 1 137 137 LYS C C 137 176.616 176.616 176.279 0.337 18112 14073 1 18 . 1 1 137 137 LYS CA C 137 57.499 57.499 55.405 2.094 18112 14074 1 18 . 1 1 137 137 LYS CB C 137 30.927 30.927 32.486 -1.559 18112 14075 1 18 . 1 1 137 137 LYS H H 137 8.312 8.312 8.115 0.197 18112 14076 1 18 . 1 1 138 138 ASP N N 138 113.545 113.545 118.634 -5.089 18112 14077 1 18 . 1 1 138 138 ASP HA H 138 3.061 3.061 2.570 0.491 18112 14078 1 18 . 1 1 138 138 ASP C C 138 174.698 174.698 175.767 -1.069 18112 14079 1 18 . 1 1 138 138 ASP CA C 138 53.694 53.694 53.796 -0.102 18112 14080 1 18 . 1 1 138 138 ASP CB C 138 36.008 36.008 39.313 -3.305 18112 14081 1 18 . 1 1 138 138 ASP H H 138 8.465 8.465 7.735 0.730 18112 14082 1 18 . 1 1 139 139 VAL N N 139 115.191 115.191 117.074 -1.883 18112 14083 1 18 . 1 1 139 139 VAL HA H 139 3.886 3.886 3.802 0.084 18112 14084 1 18 . 1 1 139 139 VAL C C 139 175.889 175.889 176.204 -0.315 18112 14085 1 18 . 1 1 139 139 VAL CA C 139 62.793 62.793 63.032 -0.239 18112 14086 1 18 . 1 1 139 139 VAL CB C 139 30.662 30.662 31.522 -0.860 18112 14087 1 18 . 1 1 139 139 VAL H H 139 6.610 6.610 7.239 -0.629 18112 14088 1 18 . 1 1 140 140 ASP N N 140 123.363 123.363 116.502 6.861 18112 14089 1 18 . 1 1 140 140 ASP C C 140 175.234 175.234 174.846 0.388 18112 14090 1 18 . 1 1 140 140 ASP CA C 140 50.221 50.221 54.648 -4.427 18112 14091 1 18 . 1 1 140 140 ASP CB C 140 42.254 42.254 40.631 1.623 18112 14092 1 18 . 1 1 140 140 ASP H H 140 7.553 7.553 8.146 -0.593 18112 14093 1 18 . 1 1 141 141 PRO HA H 141 4.682 4.682 4.651 0.031 18112 14094 1 18 . 1 1 141 141 PRO C C 141 178.678 178.678 177.910 0.768 18112 14095 1 18 . 1 1 141 141 PRO CA C 141 64.532 64.532 62.802 1.730 18112 14096 1 18 . 1 1 141 141 PRO CB C 141 31.331 31.331 32.411 -1.081 18112 14097 1 18 . 1 1 142 142 SER N N 142 114.421 114.421 114.473 -0.052 18112 14098 1 18 . 1 1 142 142 SER HA H 142 4.565 4.565 4.428 0.137 18112 14099 1 18 . 1 1 142 142 SER C C 142 176.524 176.524 176.544 -0.020 18112 14100 1 18 . 1 1 142 142 SER CA C 142 58.711 58.711 60.435 -1.724 18112 14101 1 18 . 1 1 142 142 SER CB C 142 62.783 62.783 62.604 0.179 18112 14102 1 18 . 1 1 142 142 SER H H 142 8.703 8.703 8.648 0.055 18112 14103 1 18 . 1 1 143 143 TRP N N 143 123.598 123.598 122.140 1.458 18112 14104 1 18 . 1 1 143 143 TRP HA H 143 4.136 4.136 4.305 -0.169 18112 14105 1 18 . 1 1 143 143 TRP C C 143 177.113 177.113 177.047 0.066 18112 14106 1 18 . 1 1 143 143 TRP CA C 143 59.803 59.803 59.018 0.785 18112 14107 1 18 . 1 1 143 143 TRP CB C 143 26.364 26.364 28.153 -1.789 18112 14108 1 18 . 1 1 143 143 TRP H H 143 8.374 8.374 8.392 -0.018 18112 14109 1 18 . 1 1 144 144 LYS N N 144 119.293 119.293 119.600 -0.307 18112 14110 1 18 . 1 1 144 144 LYS HA H 144 2.719 2.719 3.161 -0.442 18112 14111 1 18 . 1 1 144 144 LYS C C 144 177.243 177.243 178.246 -1.003 18112 14112 1 18 . 1 1 144 144 LYS CA C 144 58.851 58.851 59.264 -0.413 18112 14113 1 18 . 1 1 144 144 LYS CB C 144 29.373 29.373 31.486 -2.114 18112 14114 1 18 . 1 1 144 144 LYS H H 144 7.196 7.196 7.021 0.175 18112 14115 1 18 . 1 1 145 145 LYS N N 145 116.440 116.440 118.736 -2.296 18112 14116 1 18 . 1 1 145 145 LYS HA H 145 3.490 3.490 3.965 -0.475 18112 14117 1 18 . 1 1 145 145 LYS C C 145 179.149 179.149 178.741 0.408 18112 14118 1 18 . 1 1 145 145 LYS CA C 145 59.271 59.271 58.695 0.576 18112 14119 1 18 . 1 1 145 145 LYS CB C 145 30.521 30.521 31.771 -1.250 18112 14120 1 18 . 1 1 145 145 LYS H H 145 7.389 7.389 7.817 -0.428 18112 14121 1 18 . 1 1 146 146 ALA N N 146 118.582 118.582 123.035 -4.453 18112 14122 1 18 . 1 1 146 146 ALA HA H 146 3.932 3.932 4.073 -0.141 18112 14123 1 18 . 1 1 146 146 ALA C C 146 179.968 179.968 179.724 0.244 18112 14124 1 18 . 1 1 146 146 ALA CA C 146 54.241 54.241 54.826 -0.585 18112 14125 1 18 . 1 1 146 146 ALA CB C 146 17.689 17.689 18.226 -0.537 18112 14126 1 18 . 1 1 146 146 ALA H H 146 7.112 7.112 8.037 -0.925 18112 14127 1 18 . 1 1 147 147 ILE N N 147 118.537 118.537 119.588 -1.051 18112 14128 1 18 . 1 1 147 147 ILE HA H 147 3.642 3.642 3.572 0.070 18112 14129 1 18 . 1 1 147 147 ILE C C 147 178.919 178.919 177.882 1.037 18112 14130 1 18 . 1 1 147 147 ILE CA C 147 64.418 64.418 64.557 -0.139 18112 14131 1 18 . 1 1 147 147 ILE CB C 147 36.519 36.519 37.274 -0.755 18112 14132 1 18 . 1 1 147 147 ILE H H 147 6.734 6.734 7.838 -1.104 18112 14133 1 18 . 1 1 148 148 TYR N N 148 121.033 121.033 117.824 3.209 18112 14134 1 18 . 1 1 148 148 TYR HA H 148 4.489 4.489 4.130 0.359 18112 14135 1 18 . 1 1 148 148 TYR C C 148 178.348 178.348 178.532 -0.184 18112 14136 1 18 . 1 1 148 148 TYR CA C 148 57.389 57.389 59.105 -1.716 18112 14137 1 18 . 1 1 148 148 TYR CB C 148 35.280 35.280 36.853 -1.573 18112 14138 1 18 . 1 1 148 148 TYR H H 148 8.126 8.126 7.976 0.150 18112 14139 1 18 . 1 1 149 149 LYS N N 149 114.484 114.484 119.861 -5.377 18112 14140 1 18 . 1 1 149 149 LYS C C 149 178.051 178.051 178.920 -0.869 18112 14141 1 18 . 1 1 149 149 LYS CA C 149 59.036 59.036 59.694 -0.658 18112 14142 1 18 . 1 1 149 149 LYS CB C 149 31.575 31.575 32.536 -0.961 18112 14143 1 18 . 1 1 149 149 LYS H H 149 7.364 7.364 7.943 -0.579 18112 14144 1 18 . 1 1 150 150 VAL N N 150 117.812 117.812 117.960 -0.148 18112 14145 1 18 . 1 1 150 150 VAL HA H 150 3.770 3.770 3.784 -0.014 18112 14146 1 18 . 1 1 150 150 VAL C C 150 178.786 178.786 177.419 1.367 18112 14147 1 18 . 1 1 150 150 VAL CA C 150 65.070 65.070 65.890 -0.820 18112 14148 1 18 . 1 1 150 150 VAL CB C 150 29.515 29.515 31.517 -2.002 18112 14149 1 18 . 1 1 150 150 VAL H H 150 7.254 7.254 7.809 -0.555 18112 14150 1 18 . 1 1 151 151 ILE N N 151 117.884 117.884 114.344 3.540 18112 14151 1 18 . 1 1 151 151 ILE C C 151 180.539 180.539 177.272 3.267 18112 14152 1 18 . 1 1 151 151 ILE CA C 151 61.490 61.490 63.722 -2.232 18112 14153 1 18 . 1 1 151 151 ILE CB C 151 33.994 33.994 38.238 -4.244 18112 14154 1 18 . 1 1 151 151 ILE H H 151 8.154 8.154 7.892 0.262 18112 14155 1 18 . 1 1 152 152 CYS N N 152 118.649 118.649 120.796 -2.147 18112 14156 1 18 . 1 1 152 152 CYS HA H 152 4.153 4.153 4.308 -0.155 18112 14157 1 18 . 1 1 152 152 CYS C C 152 174.888 174.888 176.633 -1.745 18112 14158 1 18 . 1 1 152 152 CYS CA C 152 61.052 61.052 61.961 -0.909 18112 14159 1 18 . 1 1 152 152 CYS CB C 152 36.364 36.364 27.342 9.022 18112 14160 1 18 . 1 1 152 152 CYS H H 152 8.711 8.711 8.242 0.469 18112 14161 1 18 . 1 1 153 153 LYS N N 153 118.498 118.498 119.931 -1.433 18112 14162 1 18 . 1 1 153 153 LYS C C 153 177.389 177.389 177.877 -0.488 18112 14163 1 18 . 1 1 153 153 LYS CA C 153 56.243 56.243 58.773 -2.530 18112 14164 1 18 . 1 1 153 153 LYS CB C 153 31.343 31.343 32.342 -0.999 18112 14165 1 18 . 1 1 153 153 LYS H H 153 6.782 6.782 7.837 -1.055 18112 14166 1 18 . 1 1 154 154 LEU N N 154 117.318 117.318 118.161 -0.843 18112 14167 1 18 . 1 1 154 154 LEU HA H 154 4.576 4.576 4.138 0.438 18112 14168 1 18 . 1 1 154 154 LEU C C 154 177.161 177.161 177.837 -0.676 18112 14169 1 18 . 1 1 154 154 LEU CA C 154 53.782 53.782 56.671 -2.889 18112 14170 1 18 . 1 1 154 154 LEU CB C 154 40.881 40.881 42.424 -1.543 18112 14171 1 18 . 1 1 154 154 LEU H H 154 7.616 7.616 7.453 0.163 18112 14172 1 18 . 1 1 155 155 ASP N N 155 121.564 121.564 116.302 5.262 18112 14173 1 18 . 1 1 155 155 ASP C C 155 177.094 177.094 174.627 2.467 18112 14174 1 18 . 1 1 155 155 ASP CA C 155 55.732 55.732 54.233 1.499 18112 14175 1 18 . 1 1 155 155 ASP CB C 155 40.139 40.139 42.192 -2.053 18112 14176 1 18 . 1 1 155 155 ASP H H 155 7.582 7.582 7.780 -0.198 18112 14177 1 18 . 1 1 156 156 SER N N 156 117.352 117.352 119.016 -1.664 18112 14178 1 18 . 1 1 156 156 SER HA H 156 4.818 4.818 4.459 0.359 18112 14179 1 18 . 1 1 156 156 SER C C 156 173.409 173.409 173.145 0.264 18112 14180 1 18 . 1 1 156 156 SER CA C 156 57.073 57.073 57.460 -0.387 18112 14181 1 18 . 1 1 156 156 SER CB C 156 65.150 65.150 63.473 1.677 18112 14182 1 18 . 1 1 156 156 SER H H 156 8.846 8.846 8.116 0.730 18112 14183 1 18 . 1 1 157 157 GLU N N 157 120.688 120.688 123.140 -2.452 18112 14184 1 18 . 1 1 157 157 GLU HA H 157 4.038 4.038 4.477 -0.439 18112 14185 1 18 . 1 1 157 157 GLU C C 157 176.332 176.332 176.809 -0.477 18112 14186 1 18 . 1 1 157 157 GLU CA C 157 56.464 56.464 55.945 0.519 18112 14187 1 18 . 1 1 157 157 GLU CB C 157 29.206 29.206 30.532 -1.326 18112 14188 1 18 . 1 1 157 157 GLU H H 157 8.356 8.356 7.685 0.671 18112 14189 1 18 . 1 1 158 158 VAL N N 158 126.906 126.906 122.204 4.702 18112 14190 1 18 . 1 1 158 158 VAL HA H 158 3.449 3.449 4.132 -0.683 18112 14191 1 18 . 1 1 158 158 VAL C C 158 176.382 176.382 174.048 2.334 18112 14192 1 18 . 1 1 158 158 VAL CA C 158 59.584 59.584 59.379 0.205 18112 14193 1 18 . 1 1 158 158 VAL CB C 158 31.160 31.160 31.204 -0.044 18112 14194 1 18 . 1 1 158 158 VAL H H 158 8.561 8.561 7.952 0.609 18112 14195 1 18 . 1 1 159 159 PRO HA H 159 4.403 4.403 4.297 0.106 18112 14196 1 18 . 1 1 159 159 PRO C C 159 176.757 176.757 175.369 1.388 18112 14197 1 18 . 1 1 159 159 PRO CA C 159 63.845 63.845 63.124 0.721 18112 14198 1 18 . 1 1 159 159 PRO CB C 159 32.106 32.106 31.130 0.976 18112 14199 1 18 . 1 1 160 160 GLU N N 160 122.904 122.904 122.829 0.075 18112 14200 1 18 . 1 1 160 160 GLU HA H 160 4.008 4.008 3.951 0.057 18112 14201 1 18 . 1 1 160 160 GLU C C 160 179.132 179.132 175.315 3.817 18112 14202 1 18 . 1 1 160 160 GLU CA C 160 59.407 59.407 57.079 2.328 18112 14203 1 18 . 1 1 160 160 GLU CB C 160 28.991 28.991 30.394 -1.403 18112 14204 1 18 . 1 1 160 160 GLU H H 160 8.650 8.650 8.402 0.248 18112 14205 1 18 . 1 1 161 161 ILE N N 161 119.782 119.782 116.947 2.835 18112 14206 1 18 . 1 1 161 161 ILE HA H 161 4.146 4.146 4.252 -0.106 18112 14207 1 18 . 1 1 161 161 ILE C C 161 176.176 176.176 174.315 1.861 18112 14208 1 18 . 1 1 161 161 ILE CA C 161 62.034 62.034 60.311 1.723 18112 14209 1 18 . 1 1 161 161 ILE CB C 161 37.113 37.113 39.045 -1.932 18112 14210 1 18 . 1 1 161 161 ILE H H 161 8.448 8.448 7.615 0.833 18112 14211 1 18 . 1 1 162 162 PHE N N 162 117.594 117.594 126.750 -9.156 18112 14212 1 18 . 1 1 162 162 PHE C C 162 176.115 176.115 176.359 -0.244 18112 14213 1 18 . 1 1 162 162 PHE CA C 162 61.009 61.009 59.321 1.688 18112 14214 1 18 . 1 1 162 162 PHE CB C 162 38.394 38.394 39.213 -0.819 18112 14215 1 18 . 1 1 162 162 PHE H H 162 8.145 8.145 8.738 -0.593 18112 14216 1 18 . 1 1 163 163 LYS N N 163 116.083 116.083 119.867 -3.784 18112 14217 1 18 . 1 1 163 163 LYS C C 163 178.196 178.196 176.833 1.363 18112 14218 1 18 . 1 1 163 163 LYS CA C 163 58.136 58.136 57.733 0.403 18112 14219 1 18 . 1 1 163 163 LYS CB C 163 31.694 31.694 32.913 -1.218 18112 14220 1 18 . 1 1 163 163 LYS H H 163 8.232 8.232 7.951 0.281 18112 14221 1 18 . 1 1 164 164 SER N N 164 113.680 113.680 112.579 1.101 18112 14222 1 18 . 1 1 164 164 SER CA C 164 55.205 55.205 55.877 -0.672 18112 14223 1 18 . 1 1 164 164 SER CB C 164 63.265 63.265 63.885 -0.619 18112 14224 1 18 . 1 1 164 164 SER H H 164 7.708 7.708 7.746 -0.038 18112 14225 1 18 . 1 1 165 165 PRO HA H 165 4.580 4.580 4.299 0.281 18112 14226 1 18 . 1 1 165 165 PRO C C 165 177.541 177.541 177.370 0.171 18112 14227 1 18 . 1 1 165 165 PRO CA C 165 63.950 63.950 64.775 -0.824 18112 14228 1 18 . 1 1 165 165 PRO CB C 165 30.686 30.686 31.930 -1.244 18112 14229 1 18 . 1 1 166 166 ASN N N 166 116.304 116.304 116.078 0.226 18112 14230 1 18 . 1 1 166 166 ASN HA H 166 5.029 5.029 4.750 0.279 18112 14231 1 18 . 1 1 166 166 ASN C C 166 175.811 175.811 175.464 0.347 18112 14232 1 18 . 1 1 166 166 ASN CA C 166 51.962 51.962 54.090 -2.128 18112 14233 1 18 . 1 1 166 166 ASN CB C 166 37.915 37.915 38.728 -0.813 18112 14234 1 18 . 1 1 166 166 ASN H H 166 8.216 8.216 8.368 -0.152 18112 14235 1 18 . 1 1 167 167 CYS N N 167 116.078 116.078 118.595 -2.517 18112 14236 1 18 . 1 1 167 167 CYS HA H 167 4.011 4.011 4.590 -0.579 18112 14237 1 18 . 1 1 167 167 CYS C C 167 175.057 175.057 175.830 -0.773 18112 14238 1 18 . 1 1 167 167 CYS CA C 167 59.816 59.816 58.527 1.289 18112 14239 1 18 . 1 1 167 167 CYS CB C 167 27.446 27.446 29.371 -1.925 18112 14240 1 18 . 1 1 167 167 CYS H H 167 7.246 7.246 7.730 -0.484 18112 14241 1 18 . 1 1 168 168 LEU N N 168 120.082 120.082 122.384 -2.302 18112 14242 1 18 . 1 1 168 168 LEU HA H 168 3.880 3.880 4.230 -0.350 18112 14243 1 18 . 1 1 168 168 LEU C C 168 178.541 178.541 178.363 0.178 18112 14244 1 18 . 1 1 168 168 LEU CA C 168 57.734 57.734 57.239 0.495 18112 14245 1 18 . 1 1 168 168 LEU CB C 168 38.825 38.825 41.282 -2.457 18112 14246 1 18 . 1 1 168 168 LEU H H 168 8.451 8.451 7.611 0.840 18112 14247 1 18 . 1 1 169 169 GLN N N 169 116.700 116.700 121.067 -4.367 18112 14248 1 18 . 1 1 169 169 GLN HA H 169 4.064 4.064 4.018 0.046 18112 14249 1 18 . 1 1 169 169 GLN C C 169 177.378 177.378 178.176 -0.798 18112 14250 1 18 . 1 1 169 169 GLN CA C 169 57.675 57.675 58.762 -1.087 18112 14251 1 18 . 1 1 169 169 GLN CB C 169 27.710 27.710 28.168 -0.458 18112 14252 1 18 . 1 1 169 169 GLN H H 169 7.665 7.665 8.500 -0.835 18112 14253 1 18 . 1 1 170 170 GLU N N 170 116.701 116.701 118.865 -2.164 18112 14254 1 18 . 1 1 170 170 GLU HA H 170 4.214 4.214 4.253 -0.039 18112 14255 1 18 . 1 1 170 170 GLU C C 170 177.730 177.730 177.976 -0.246 18112 14256 1 18 . 1 1 170 170 GLU CA C 170 56.899 56.899 57.987 -1.088 18112 14257 1 18 . 1 1 170 170 GLU H H 170 7.405 7.405 7.764 -0.359 18112 14258 1 18 . 1 1 171 171 LEU N N 171 118.021 118.021 118.261 -0.240 18112 14259 1 18 . 1 1 171 171 LEU HA H 171 4.209 4.209 4.168 0.041 18112 14260 1 18 . 1 1 171 171 LEU C C 171 177.005 177.005 177.274 -0.269 18112 14261 1 18 . 1 1 171 171 LEU CA C 171 55.870 55.870 56.095 -0.225 18112 14262 1 18 . 1 1 171 171 LEU CB C 171 43.680 43.680 42.362 1.318 18112 14263 1 18 . 1 1 171 171 LEU H H 171 7.823 7.823 7.489 0.334 18112 14264 1 18 . 1 1 172 172 LEU N N 172 117.580 117.580 118.983 -1.403 18112 14265 1 18 . 1 1 172 172 LEU HA H 172 4.571 4.571 4.350 0.221 18112 14266 1 18 . 1 1 172 172 LEU C C 172 176.411 176.411 175.961 0.450 18112 14267 1 18 . 1 1 172 172 LEU CA C 172 53.972 53.972 54.771 -0.799 18112 14268 1 18 . 1 1 172 172 LEU CB C 172 40.483 40.483 40.569 -0.086 18112 14269 1 18 . 1 1 172 172 LEU H H 172 7.306 7.306 7.409 -0.103 18112 14270 1 18 . 1 1 173 173 HIS N N 173 123.310 123.310 124.555 -1.245 18112 14271 1 18 . 1 1 173 173 HIS C C 173 179.022 179.022 174.525 4.497 18112 14272 1 18 . 1 1 173 173 HIS CA C 173 56.693 56.693 55.340 1.353 18112 14273 1 18 . 1 1 173 173 HIS CB C 173 29.371 29.371 31.352 -1.981 18112 14274 1 18 . 1 1 173 173 HIS H H 173 8.028 8.028 8.289 -0.261 18112 14275 1 19 . 1 1 12 12 ALA N N 12 125.167 125.167 125.397 -0.230 18112 14276 1 19 . 1 1 12 12 ALA C C 12 177.566 177.566 176.942 0.624 18112 14277 1 19 . 1 1 12 12 ALA CA C 12 52.067 52.067 51.046 1.021 18112 14278 1 19 . 1 1 12 12 ALA CB C 12 18.456 18.456 18.794 -0.338 18112 14279 1 19 . 1 1 12 12 ALA H H 12 8.311 8.311 8.126 0.185 18112 14280 1 19 . 1 1 13 13 MET N N 13 119.278 119.278 123.098 -3.820 18112 14281 1 19 . 1 1 13 13 MET C C 13 176.325 176.325 175.527 0.798 18112 14282 1 19 . 1 1 13 13 MET CA C 13 54.992 54.992 54.456 0.536 18112 14283 1 19 . 1 1 13 13 MET CB C 13 32.308 32.308 30.739 1.569 18112 14284 1 19 . 1 1 13 13 MET H H 13 8.269 8.269 8.273 -0.004 18112 14285 1 19 . 1 1 14 14 GLN N N 14 120.869 120.869 124.519 -3.650 18112 14286 1 19 . 1 1 14 14 GLN HA H 14 4.399 4.399 4.632 -0.233 18112 14287 1 19 . 1 1 14 14 GLN C C 14 175.644 175.644 174.822 0.822 18112 14288 1 19 . 1 1 14 14 GLN CA C 14 55.139 55.139 54.550 0.589 18112 14289 1 19 . 1 1 14 14 GLN CB C 14 29.051 29.051 31.855 -2.804 18112 14290 1 19 . 1 1 14 14 GLN H H 14 8.501 8.501 8.570 -0.069 18112 14291 1 19 . 1 1 15 15 GLU N N 15 122.042 122.042 120.681 1.361 18112 14292 1 19 . 1 1 15 15 GLU C C 15 176.242 176.242 176.949 -0.707 18112 14293 1 19 . 1 1 15 15 GLU CA C 15 56.064 56.064 56.423 -0.359 18112 14294 1 19 . 1 1 15 15 GLU CB C 15 29.302 29.302 30.503 -1.201 18112 14295 1 19 . 1 1 15 15 GLU H H 15 8.547 8.547 8.644 -0.097 18112 14296 1 19 . 1 1 16 16 GLY N N 16 108.821 108.821 106.994 1.827 18112 14297 1 19 . 1 1 16 16 GLY C C 16 172.949 172.949 173.687 -0.738 18112 14298 1 19 . 1 1 16 16 GLY CA C 16 44.227 44.227 44.820 -0.593 18112 14299 1 19 . 1 1 16 16 GLY H H 16 8.100 8.100 8.338 -0.238 18112 14300 1 19 . 1 1 17 17 LEU N N 17 120.315 120.315 124.531 -4.216 18112 14301 1 19 . 1 1 17 17 LEU C C 17 177.334 177.334 177.064 0.270 18112 14302 1 19 . 1 1 17 17 LEU CA C 17 53.544 53.544 54.640 -1.096 18112 14303 1 19 . 1 1 17 17 LEU CB C 17 42.140 42.140 41.739 0.401 18112 14304 1 19 . 1 1 17 17 LEU H H 17 8.222 8.222 8.104 0.118 18112 14305 1 19 . 1 1 18 18 SER N N 18 126.547 126.547 120.787 5.760 18112 14306 1 19 . 1 1 18 18 SER CA C 18 56.851 56.851 56.873 -0.022 18112 14307 1 19 . 1 1 18 18 SER CB C 18 64.636 64.636 62.916 1.720 18112 14308 1 19 . 1 1 18 18 SER H H 18 11.627 11.627 8.435 3.192 18112 14309 1 19 . 1 1 19 19 PRO C C 19 175.118 175.118 176.883 -1.765 18112 14310 1 19 . 1 1 20 20 ASN N N 20 121.372 121.372 117.674 3.698 18112 14311 1 19 . 1 1 20 20 ASN H H 20 8.172 8.172 8.759 -0.587 18112 14312 1 19 . 1 1 25 25 ALA CB C 25 18.020 18.020 18.516 -0.496 18112 14313 1 19 . 1 1 26 26 LYS N N 26 118.490 118.490 119.431 -0.941 18112 14314 1 19 . 1 1 26 26 LYS CA C 26 56.146 56.146 59.261 -3.115 18112 14315 1 19 . 1 1 26 26 LYS H H 26 6.794 6.794 7.773 -0.979 18112 14316 1 19 . 1 1 31 31 TYR HA H 31 4.398 4.398 4.357 0.041 18112 14317 1 19 . 1 1 31 31 TYR C C 31 173.714 173.714 175.613 -1.899 18112 14318 1 19 . 1 1 31 31 TYR CA C 31 59.757 59.757 56.667 3.090 18112 14319 1 19 . 1 1 32 32 THR N N 32 111.928 111.928 115.551 -3.623 18112 14320 1 19 . 1 1 32 32 THR HA H 32 4.209 4.209 4.178 0.031 18112 14321 1 19 . 1 1 32 32 THR C C 32 171.061 171.061 175.375 -4.314 18112 14322 1 19 . 1 1 32 32 THR CA C 32 56.905 56.905 64.286 -7.381 18112 14323 1 19 . 1 1 32 32 THR CB C 32 69.707 69.707 69.926 -0.219 18112 14324 1 19 . 1 1 32 32 THR H H 32 8.237 8.237 8.273 -0.036 18112 14325 1 19 . 1 1 33 33 ARG N N 33 124.856 124.856 118.033 6.823 18112 14326 1 19 . 1 1 33 33 ARG C C 33 176.451 176.451 176.029 0.422 18112 14327 1 19 . 1 1 33 33 ARG CA C 33 55.627 55.627 56.756 -1.129 18112 14328 1 19 . 1 1 33 33 ARG CB C 33 29.861 29.861 32.636 -2.775 18112 14329 1 19 . 1 1 33 33 ARG H H 33 9.159 9.159 8.467 0.692 18112 14330 1 19 . 1 1 34 34 TYR N N 34 117.908 117.908 115.200 2.708 18112 14331 1 19 . 1 1 34 34 TYR CA C 34 55.320 55.320 58.379 -3.059 18112 14332 1 19 . 1 1 34 34 TYR H H 34 8.995 8.995 8.295 0.700 18112 14333 1 19 . 1 1 35 35 PRO C C 35 177.280 177.280 177.113 0.167 18112 14334 1 19 . 1 1 36 36 SER N N 36 116.410 116.410 121.475 -5.065 18112 14335 1 19 . 1 1 36 36 SER C C 36 178.938 178.938 176.154 2.784 18112 14336 1 19 . 1 1 36 36 SER CA C 36 64.815 64.815 61.905 2.910 18112 14337 1 19 . 1 1 36 36 SER H H 36 8.106 8.106 8.127 -0.021 18112 14338 1 19 . 1 1 37 37 SER N N 37 117.488 117.488 118.149 -0.661 18112 14339 1 19 . 1 1 37 37 SER C C 37 177.698 177.698 176.574 1.124 18112 14340 1 19 . 1 1 37 37 SER CA C 37 61.357 61.357 61.210 0.147 18112 14341 1 19 . 1 1 37 37 SER CB C 37 68.118 68.118 62.653 5.465 18112 14342 1 19 . 1 1 37 37 SER H H 37 8.169 8.169 8.462 -0.293 18112 14343 1 19 . 1 1 38 38 ASN N N 38 115.638 115.638 121.328 -5.690 18112 14344 1 19 . 1 1 38 38 ASN HA H 38 4.259 4.259 4.442 -0.183 18112 14345 1 19 . 1 1 38 38 ASN C C 38 177.868 177.868 177.623 0.245 18112 14346 1 19 . 1 1 38 38 ASN CA C 38 55.907 55.907 55.784 0.123 18112 14347 1 19 . 1 1 38 38 ASN CB C 38 37.230 37.230 38.006 -0.776 18112 14348 1 19 . 1 1 38 38 ASN H H 38 8.284 8.284 7.480 0.804 18112 14349 1 19 . 1 1 39 39 MET N N 39 121.352 121.352 119.041 2.311 18112 14350 1 19 . 1 1 39 39 MET HA H 39 4.170 4.170 3.563 0.607 18112 14351 1 19 . 1 1 39 39 MET C C 39 179.068 179.068 178.210 0.858 18112 14352 1 19 . 1 1 39 39 MET CA C 39 58.751 58.751 58.637 0.114 18112 14353 1 19 . 1 1 39 39 MET CB C 39 31.850 31.850 32.171 -0.321 18112 14354 1 19 . 1 1 39 39 MET H H 39 7.857 7.857 7.616 0.241 18112 14355 1 19 . 1 1 40 40 LEU N N 40 118.936 118.936 121.644 -2.708 18112 14356 1 19 . 1 1 40 40 LEU HA H 40 4.139 4.139 4.085 0.054 18112 14357 1 19 . 1 1 40 40 LEU C C 40 178.700 178.700 178.451 0.249 18112 14358 1 19 . 1 1 40 40 LEU CA C 40 58.455 58.455 58.335 0.120 18112 14359 1 19 . 1 1 40 40 LEU CB C 40 40.304 40.304 42.000 -1.696 18112 14360 1 19 . 1 1 40 40 LEU H H 40 8.167 8.167 8.165 0.002 18112 14361 1 19 . 1 1 41 41 LYS N N 41 116.791 116.791 115.716 1.075 18112 14362 1 19 . 1 1 41 41 LYS HA H 41 3.475 3.475 3.857 -0.382 18112 14363 1 19 . 1 1 41 41 LYS C C 41 178.793 178.793 178.482 0.311 18112 14364 1 19 . 1 1 41 41 LYS CA C 41 59.161 59.161 58.941 0.220 18112 14365 1 19 . 1 1 41 41 LYS CB C 41 30.992 30.992 31.857 -0.865 18112 14366 1 19 . 1 1 41 41 LYS H H 41 7.632 7.632 7.925 -0.293 18112 14367 1 19 . 1 1 42 42 THR N N 42 112.819 112.819 115.711 -2.892 18112 14368 1 19 . 1 1 42 42 THR HA H 42 4.230 4.230 4.277 -0.047 18112 14369 1 19 . 1 1 42 42 THR C C 42 176.142 176.142 176.066 0.076 18112 14370 1 19 . 1 1 42 42 THR CA C 42 65.107 65.107 66.340 -1.233 18112 14371 1 19 . 1 1 42 42 THR CB C 42 68.306 68.306 69.085 -0.779 18112 14372 1 19 . 1 1 42 42 THR H H 42 7.469 7.469 7.857 -0.388 18112 14373 1 19 . 1 1 43 43 TYR N N 43 118.565 118.565 119.715 -1.150 18112 14374 1 19 . 1 1 43 43 TYR HA H 43 4.204 4.204 4.418 -0.214 18112 14375 1 19 . 1 1 43 43 TYR C C 43 174.240 174.240 177.816 -3.576 18112 14376 1 19 . 1 1 43 43 TYR CA C 43 60.886 60.886 57.854 3.032 18112 14377 1 19 . 1 1 43 43 TYR CB C 43 38.165 38.165 38.160 0.005 18112 14378 1 19 . 1 1 43 43 TYR H H 43 7.978 7.978 7.686 0.292 18112 14379 1 19 . 1 1 44 44 PHE N N 44 120.980 120.980 119.756 1.224 18112 14380 1 19 . 1 1 44 44 PHE HA H 44 4.920 4.920 5.234 -0.314 18112 14381 1 19 . 1 1 44 44 PHE C C 44 176.436 176.436 176.475 -0.039 18112 14382 1 19 . 1 1 44 44 PHE CA C 44 56.672 56.672 55.492 1.180 18112 14383 1 19 . 1 1 44 44 PHE CB C 44 36.570 36.570 36.566 0.004 18112 14384 1 19 . 1 1 44 44 PHE H H 44 7.955 7.955 8.207 -0.252 18112 14385 1 19 . 1 1 45 45 SER N N 45 113.407 113.407 117.107 -3.700 18112 14386 1 19 . 1 1 45 45 SER HA H 45 4.373 4.373 4.379 -0.006 18112 14387 1 19 . 1 1 45 45 SER C C 45 174.424 174.424 175.581 -1.157 18112 14388 1 19 . 1 1 45 45 SER CA C 45 61.037 61.037 61.201 -0.164 18112 14389 1 19 . 1 1 45 45 SER CB C 45 62.711 62.711 63.334 -0.623 18112 14390 1 19 . 1 1 45 45 SER H H 45 7.932 7.932 7.884 0.048 18112 14391 1 19 . 1 1 46 46 ASP N N 46 118.099 118.099 118.622 -0.523 18112 14392 1 19 . 1 1 46 46 ASP HA H 46 4.572 4.572 4.540 0.032 18112 14393 1 19 . 1 1 46 46 ASP C C 46 174.866 174.866 177.026 -2.160 18112 14394 1 19 . 1 1 46 46 ASP CA C 46 53.602 53.602 54.960 -1.358 18112 14395 1 19 . 1 1 46 46 ASP CB C 46 38.992 38.992 40.167 -1.175 18112 14396 1 19 . 1 1 46 46 ASP H H 46 9.889 9.889 8.741 1.148 18112 14397 1 19 . 1 1 47 47 VAL N N 47 121.496 121.496 119.988 1.508 18112 14398 1 19 . 1 1 47 47 VAL HA H 47 4.058 4.058 3.796 0.262 18112 14399 1 19 . 1 1 47 47 VAL C C 47 174.676 174.676 175.565 -0.889 18112 14400 1 19 . 1 1 47 47 VAL CA C 47 61.006 61.006 64.398 -3.392 18112 14401 1 19 . 1 1 47 47 VAL CB C 47 32.110 32.110 31.896 0.214 18112 14402 1 19 . 1 1 47 47 VAL H H 47 7.781 7.781 7.077 0.704 18112 14403 1 19 . 1 1 48 48 LYS N N 48 126.100 126.100 117.677 8.423 18112 14404 1 19 . 1 1 48 48 LYS HA H 48 4.402 4.402 3.798 0.604 18112 14405 1 19 . 1 1 48 48 LYS C C 48 175.564 175.564 175.511 0.053 18112 14406 1 19 . 1 1 48 48 LYS CA C 48 54.874 54.874 56.336 -1.462 18112 14407 1 19 . 1 1 48 48 LYS CB C 48 30.189 30.189 30.037 0.152 18112 14408 1 19 . 1 1 48 48 LYS H H 48 8.245 8.245 7.709 0.536 18112 14409 1 19 . 1 1 49 49 PHE N N 49 125.341 125.341 119.947 5.394 18112 14410 1 19 . 1 1 49 49 PHE HA H 49 3.813 3.813 4.387 -0.574 18112 14411 1 19 . 1 1 49 49 PHE C C 49 175.708 175.708 176.266 -0.558 18112 14412 1 19 . 1 1 49 49 PHE CA C 49 60.861 60.861 58.316 2.545 18112 14413 1 19 . 1 1 49 49 PHE CB C 49 38.616 38.616 39.569 -0.953 18112 14414 1 19 . 1 1 49 49 PHE H H 49 8.626 8.626 7.857 0.769 18112 14415 1 19 . 1 1 50 50 ASN N N 50 115.408 115.408 118.518 -3.110 18112 14416 1 19 . 1 1 50 50 ASN C C 50 176.072 176.072 174.622 1.450 18112 14417 1 19 . 1 1 50 50 ASN CA C 50 51.730 51.730 52.006 -0.276 18112 14418 1 19 . 1 1 50 50 ASN H H 50 7.030 7.030 8.140 -1.110 18112 14419 1 19 . 1 1 51 51 ARG N N 51 122.706 122.706 123.261 -0.555 18112 14420 1 19 . 1 1 51 51 ARG CA C 51 59.534 59.534 59.701 -0.167 18112 14421 1 19 . 1 1 51 51 ARG H H 51 7.790 7.790 8.852 -1.062 18112 14422 1 19 . 1 1 52 52 CYS N N 52 117.340 117.340 113.851 3.489 18112 14423 1 19 . 1 1 52 52 CYS HA H 52 4.108 4.108 4.190 -0.082 18112 14424 1 19 . 1 1 52 52 CYS C C 52 178.200 178.200 177.087 1.113 18112 14425 1 19 . 1 1 52 52 CYS CA C 52 61.143 61.143 60.736 0.407 18112 14426 1 19 . 1 1 52 52 CYS H H 52 7.681 7.681 8.296 -0.615 18112 14427 1 19 . 1 1 53 53 ILE N N 53 122.321 122.321 118.570 3.751 18112 14428 1 19 . 1 1 53 53 ILE HA H 53 3.588 3.588 3.667 -0.079 18112 14429 1 19 . 1 1 53 53 ILE C C 53 177.492 177.492 177.301 0.191 18112 14430 1 19 . 1 1 53 53 ILE CA C 53 64.109 64.109 63.617 0.492 18112 14431 1 19 . 1 1 53 53 ILE CB C 53 37.603 37.603 37.247 0.356 18112 14432 1 19 . 1 1 53 53 ILE H H 53 8.035 8.035 7.731 0.304 18112 14433 1 19 . 1 1 54 54 THR C C 54 175.903 175.903 176.724 -0.821 18112 14434 1 19 . 1 1 54 54 THR CA C 54 67.308 67.308 67.150 0.158 18112 14435 1 19 . 1 1 55 55 SER N N 55 113.819 113.819 117.865 -4.046 18112 14436 1 19 . 1 1 55 55 SER H H 55 7.844 7.844 8.012 -0.168 18112 14437 1 19 . 1 1 56 56 GLN C C 56 179.792 179.792 177.688 2.104 18112 14438 1 19 . 1 1 57 57 LEU N N 57 116.701 116.701 120.505 -3.804 18112 14439 1 19 . 1 1 57 57 LEU HA H 57 4.519 4.519 2.982 1.537 18112 14440 1 19 . 1 1 57 57 LEU C C 57 178.775 178.775 178.069 0.706 18112 14441 1 19 . 1 1 57 57 LEU CA C 57 55.232 55.232 57.260 -2.028 18112 14442 1 19 . 1 1 57 57 LEU CB C 57 37.131 37.131 41.525 -4.394 18112 14443 1 19 . 1 1 57 57 LEU H H 57 8.267 8.267 7.486 0.781 18112 14444 1 19 . 1 1 58 58 ILE N N 58 122.522 122.522 118.713 3.809 18112 14445 1 19 . 1 1 58 58 ILE HA H 58 4.640 4.640 3.361 1.279 18112 14446 1 19 . 1 1 58 58 ILE C C 58 177.380 177.380 178.030 -0.650 18112 14447 1 19 . 1 1 58 58 ILE CA C 58 62.163 62.163 65.280 -3.117 18112 14448 1 19 . 1 1 58 58 ILE CB C 58 30.657 30.657 37.471 -6.814 18112 14449 1 19 . 1 1 58 58 ILE H H 58 8.111 8.111 8.004 0.107 18112 14450 1 19 . 1 1 59 59 LYS N N 59 121.002 121.002 119.856 1.146 18112 14451 1 19 . 1 1 59 59 LYS C C 59 177.600 177.600 179.021 -1.421 18112 14452 1 19 . 1 1 59 59 LYS CA C 59 57.570 57.570 59.380 -1.810 18112 14453 1 19 . 1 1 59 59 LYS CB C 59 39.101 39.101 32.049 7.052 18112 14454 1 19 . 1 1 59 59 LYS H H 59 7.432 7.432 7.716 -0.284 18112 14455 1 19 . 1 1 60 60 TRP N N 60 118.679 118.679 120.891 -2.212 18112 14456 1 19 . 1 1 60 60 TRP HA H 60 3.739 3.739 3.998 -0.259 18112 14457 1 19 . 1 1 60 60 TRP C C 60 178.246 178.246 178.616 -0.370 18112 14458 1 19 . 1 1 60 60 TRP CA C 60 59.818 59.818 59.034 0.784 18112 14459 1 19 . 1 1 60 60 TRP CB C 60 31.851 31.851 28.322 3.529 18112 14460 1 19 . 1 1 60 60 TRP H H 60 7.565 7.565 7.873 -0.308 18112 14461 1 19 . 1 1 61 61 PHE N N 61 118.005 118.005 116.302 1.703 18112 14462 1 19 . 1 1 61 61 PHE HA H 61 3.882 3.882 3.883 -0.001 18112 14463 1 19 . 1 1 61 61 PHE CA C 61 60.054 60.054 59.313 0.741 18112 14464 1 19 . 1 1 61 61 PHE H H 61 7.819 7.819 8.472 -0.653 18112 14465 1 19 . 1 1 62 62 SER N N 62 121.144 121.144 115.509 5.635 18112 14466 1 19 . 1 1 62 62 SER C C 62 177.840 177.840 176.761 1.079 18112 14467 1 19 . 1 1 62 62 SER CA C 62 55.892 55.892 61.744 -5.852 18112 14468 1 19 . 1 1 62 62 SER H H 62 8.878 8.878 8.295 0.583 18112 14469 1 19 . 1 1 63 63 ASN N N 63 115.303 115.303 120.226 -4.923 18112 14470 1 19 . 1 1 63 63 ASN C C 63 177.222 177.222 178.055 -0.833 18112 14471 1 19 . 1 1 63 63 ASN CA C 63 60.467 60.467 56.550 3.917 18112 14472 1 19 . 1 1 63 63 ASN H H 63 8.001 8.001 7.928 0.073 18112 14473 1 19 . 1 1 64 64 PHE N N 64 112.571 112.571 119.360 -6.789 18112 14474 1 19 . 1 1 64 64 PHE CA C 64 56.453 56.453 60.075 -3.622 18112 14475 1 19 . 1 1 64 64 PHE H H 64 7.082 7.082 8.162 -1.080 18112 14476 1 19 . 1 1 65 65 ARG N N 65 116.695 116.695 119.084 -2.389 18112 14477 1 19 . 1 1 65 65 ARG CA C 65 59.590 59.590 59.467 0.124 18112 14478 1 19 . 1 1 65 65 ARG H H 65 8.091 8.091 8.480 -0.389 18112 14479 1 19 . 1 1 66 66 GLU N N 66 121.653 121.653 120.836 0.817 18112 14480 1 19 . 1 1 66 66 GLU HA H 66 4.739 4.739 4.250 0.489 18112 14481 1 19 . 1 1 66 66 GLU C C 66 174.621 174.621 178.784 -4.163 18112 14482 1 19 . 1 1 66 66 GLU CA C 66 59.583 59.583 59.601 -0.018 18112 14483 1 19 . 1 1 66 66 GLU H H 66 7.597 7.597 8.489 -0.892 18112 14484 1 19 . 1 1 67 67 PHE N N 67 111.578 111.578 118.749 -7.171 18112 14485 1 19 . 1 1 67 67 PHE C C 67 176.164 176.164 178.788 -2.624 18112 14486 1 19 . 1 1 67 67 PHE CA C 67 61.156 61.156 62.084 -0.928 18112 14487 1 19 . 1 1 67 67 PHE H H 67 7.067 7.067 8.351 -1.284 18112 14488 1 19 . 1 1 68 68 TYR N N 68 119.370 119.370 120.426 -1.056 18112 14489 1 19 . 1 1 68 68 TYR C C 68 176.844 176.844 178.707 -1.863 18112 14490 1 19 . 1 1 68 68 TYR CA C 68 61.758 61.758 59.266 2.492 18112 14491 1 19 . 1 1 68 68 TYR H H 68 7.442 7.442 8.960 -1.518 18112 14492 1 19 . 1 1 69 69 TYR N N 69 116.047 116.047 121.051 -5.004 18112 14493 1 19 . 1 1 69 69 TYR HA H 69 4.086 4.086 4.572 -0.486 18112 14494 1 19 . 1 1 69 69 TYR C C 69 180.328 180.328 178.042 2.286 18112 14495 1 19 . 1 1 69 69 TYR CA C 69 61.528 61.528 62.191 -0.663 18112 14496 1 19 . 1 1 69 69 TYR H H 69 9.127 9.127 8.460 0.667 18112 14497 1 19 . 1 1 70 70 ILE N N 70 124.738 124.738 119.040 5.698 18112 14498 1 19 . 1 1 70 70 ILE HA H 70 3.828 3.828 3.453 0.375 18112 14499 1 19 . 1 1 70 70 ILE C C 70 179.585 179.585 178.389 1.196 18112 14500 1 19 . 1 1 70 70 ILE CA C 70 65.787 65.787 64.852 0.935 18112 14501 1 19 . 1 1 70 70 ILE CB C 70 36.435 36.435 37.822 -1.387 18112 14502 1 19 . 1 1 70 70 ILE H H 70 8.631 8.631 8.639 -0.008 18112 14503 1 19 . 1 1 71 71 GLN N N 71 117.940 117.940 118.681 -0.741 18112 14504 1 19 . 1 1 71 71 GLN HA H 71 3.826 3.826 3.777 0.049 18112 14505 1 19 . 1 1 71 71 GLN C C 71 178.192 178.192 178.301 -0.109 18112 14506 1 19 . 1 1 71 71 GLN CA C 71 57.779 57.779 58.207 -0.428 18112 14507 1 19 . 1 1 71 71 GLN H H 71 7.738 7.738 8.234 -0.496 18112 14508 1 19 . 1 1 72 72 MET N N 72 117.353 117.353 118.913 -1.560 18112 14509 1 19 . 1 1 72 72 MET HA H 72 4.112 4.112 4.262 -0.150 18112 14510 1 19 . 1 1 72 72 MET C C 72 177.203 177.203 178.326 -1.123 18112 14511 1 19 . 1 1 72 72 MET CA C 72 57.272 57.272 57.875 -0.603 18112 14512 1 19 . 1 1 72 72 MET H H 72 7.844 7.844 8.262 -0.418 18112 14513 1 19 . 1 1 73 73 GLU N N 73 117.858 117.858 120.170 -2.312 18112 14514 1 19 . 1 1 73 73 GLU HA H 73 3.572 3.572 3.109 0.463 18112 14515 1 19 . 1 1 73 73 GLU C C 73 177.344 177.344 178.262 -0.918 18112 14516 1 19 . 1 1 73 73 GLU CA C 73 60.324 60.324 59.399 0.925 18112 14517 1 19 . 1 1 73 73 GLU H H 73 7.503 7.503 8.134 -0.631 18112 14518 1 19 . 1 1 74 74 LYS N N 74 118.716 118.716 118.892 -0.176 18112 14519 1 19 . 1 1 74 74 LYS HA H 74 3.867 3.867 3.924 -0.057 18112 14520 1 19 . 1 1 74 74 LYS C C 74 180.077 180.077 179.611 0.466 18112 14521 1 19 . 1 1 74 74 LYS CA C 74 59.754 59.754 58.718 1.036 18112 14522 1 19 . 1 1 74 74 LYS H H 74 7.912 7.912 7.623 0.289 18112 14523 1 19 . 1 1 75 75 TYR N N 75 117.309 117.309 118.586 -1.277 18112 14524 1 19 . 1 1 75 75 TYR HA H 75 4.085 4.085 4.222 -0.137 18112 14525 1 19 . 1 1 75 75 TYR C C 75 178.874 178.874 178.194 0.680 18112 14526 1 19 . 1 1 75 75 TYR CA C 75 63.306 63.306 59.706 3.600 18112 14527 1 19 . 1 1 75 75 TYR H H 75 8.421 8.421 7.926 0.495 18112 14528 1 19 . 1 1 76 76 ALA N N 76 125.392 125.392 122.646 2.746 18112 14529 1 19 . 1 1 76 76 ALA HA H 76 4.221 4.221 4.150 0.071 18112 14530 1 19 . 1 1 76 76 ALA C C 76 178.850 178.850 179.366 -0.516 18112 14531 1 19 . 1 1 76 76 ALA CA C 76 56.280 56.280 55.539 0.741 18112 14532 1 19 . 1 1 76 76 ALA CB C 76 18.687 18.687 18.607 0.080 18112 14533 1 19 . 1 1 76 76 ALA H H 76 8.553 8.553 8.307 0.246 18112 14534 1 19 . 1 1 77 77 ARG N N 77 115.067 115.067 117.013 -1.946 18112 14535 1 19 . 1 1 77 77 ARG HA H 77 3.935 3.935 3.984 -0.049 18112 14536 1 19 . 1 1 77 77 ARG C C 77 179.341 179.341 178.374 0.967 18112 14537 1 19 . 1 1 77 77 ARG CA C 77 60.499 60.499 58.763 1.736 18112 14538 1 19 . 1 1 77 77 ARG H H 77 8.471 8.471 8.138 0.333 18112 14539 1 19 . 1 1 78 78 GLN N N 78 120.107 120.107 120.823 -0.716 18112 14540 1 19 . 1 1 78 78 GLN HA H 78 3.921 3.921 4.099 -0.178 18112 14541 1 19 . 1 1 78 78 GLN C C 78 177.289 177.289 178.024 -0.735 18112 14542 1 19 . 1 1 78 78 GLN CA C 78 58.619 58.619 58.851 -0.232 18112 14543 1 19 . 1 1 78 78 GLN CB C 78 27.752 27.752 28.719 -0.967 18112 14544 1 19 . 1 1 78 78 GLN H H 78 8.142 8.142 8.375 -0.233 18112 14545 1 19 . 1 1 79 79 ALA N N 79 120.809 120.809 122.848 -2.039 18112 14546 1 19 . 1 1 79 79 ALA HA H 79 4.308 4.308 4.123 0.185 18112 14547 1 19 . 1 1 79 79 ALA C C 79 179.924 179.924 179.825 0.099 18112 14548 1 19 . 1 1 79 79 ALA CA C 79 54.970 54.970 55.245 -0.275 18112 14549 1 19 . 1 1 79 79 ALA CB C 79 17.064 17.064 18.601 -1.536 18112 14550 1 19 . 1 1 79 79 ALA H H 79 7.811 7.811 7.956 -0.145 18112 14551 1 19 . 1 1 80 80 ILE N N 80 118.524 118.524 118.587 -0.063 18112 14552 1 19 . 1 1 80 80 ILE HA H 80 3.894 3.894 3.650 0.244 18112 14553 1 19 . 1 1 80 80 ILE C C 80 181.268 181.268 178.223 3.045 18112 14554 1 19 . 1 1 80 80 ILE CA C 80 64.841 64.841 64.862 -0.021 18112 14555 1 19 . 1 1 80 80 ILE CB C 80 37.125 37.125 37.709 -0.584 18112 14556 1 19 . 1 1 80 80 ILE H H 80 7.837 7.837 8.142 -0.305 18112 14557 1 19 . 1 1 81 81 ASN N N 81 121.233 121.233 117.441 3.792 18112 14558 1 19 . 1 1 81 81 ASN HA H 81 4.398 4.398 4.471 -0.073 18112 14559 1 19 . 1 1 81 81 ASN C C 81 176.546 176.546 177.060 -0.514 18112 14560 1 19 . 1 1 81 81 ASN CA C 81 55.892 55.892 55.626 0.266 18112 14561 1 19 . 1 1 81 81 ASN CB C 81 37.603 37.603 38.627 -1.024 18112 14562 1 19 . 1 1 81 81 ASN H H 81 8.262 8.262 7.969 0.293 18112 14563 1 19 . 1 1 82 82 ASP N N 82 119.240 119.240 117.525 1.715 18112 14564 1 19 . 1 1 82 82 ASP HA H 82 4.666 4.666 4.632 0.034 18112 14565 1 19 . 1 1 82 82 ASP C C 82 176.767 176.767 177.265 -0.498 18112 14566 1 19 . 1 1 82 82 ASP CA C 82 54.771 54.771 54.579 0.192 18112 14567 1 19 . 1 1 82 82 ASP CB C 82 40.121 40.121 41.817 -1.696 18112 14568 1 19 . 1 1 82 82 ASP H H 82 8.316 8.316 8.151 0.165 18112 14569 1 19 . 1 1 83 83 GLY N N 83 106.913 106.913 106.235 0.678 18112 14570 1 19 . 1 1 83 83 GLY C C 83 174.601 174.601 174.637 -0.036 18112 14571 1 19 . 1 1 83 83 GLY CA C 83 45.214 45.214 44.914 0.299 18112 14572 1 19 . 1 1 83 83 GLY H H 83 7.810 7.810 8.075 -0.265 18112 14573 1 19 . 1 1 84 84 VAL N N 84 122.981 122.981 120.831 2.150 18112 14574 1 19 . 1 1 84 84 VAL HA H 84 3.850 3.850 4.082 -0.232 18112 14575 1 19 . 1 1 84 84 VAL C C 84 177.265 177.265 175.587 1.678 18112 14576 1 19 . 1 1 84 84 VAL CA C 84 64.270 64.270 63.334 0.936 18112 14577 1 19 . 1 1 84 84 VAL CB C 84 30.471 30.471 32.648 -2.177 18112 14578 1 19 . 1 1 84 84 VAL H H 84 8.157 8.157 7.596 0.561 18112 14579 1 19 . 1 1 85 85 THR N N 85 115.232 115.232 115.962 -0.730 18112 14580 1 19 . 1 1 85 85 THR HA H 85 4.716 4.716 4.900 -0.184 18112 14581 1 19 . 1 1 85 85 THR C C 85 174.489 174.489 174.054 0.435 18112 14582 1 19 . 1 1 85 85 THR CA C 85 61.618 61.618 60.960 0.658 18112 14583 1 19 . 1 1 85 85 THR CB C 85 70.081 70.081 69.682 0.399 18112 14584 1 19 . 1 1 85 85 THR H H 85 8.890 8.890 8.242 0.648 18112 14585 1 19 . 1 1 86 86 SER N N 86 117.009 117.009 117.802 -0.793 18112 14586 1 19 . 1 1 86 86 SER HA H 86 5.046 5.046 4.610 0.436 18112 14587 1 19 . 1 1 86 86 SER C C 86 174.473 174.473 175.171 -0.698 18112 14588 1 19 . 1 1 86 86 SER CA C 86 55.922 55.922 57.703 -1.781 18112 14589 1 19 . 1 1 86 86 SER CB C 86 64.385 64.385 65.064 -0.679 18112 14590 1 19 . 1 1 86 86 SER H H 86 7.704 7.704 7.870 -0.166 18112 14591 1 19 . 1 1 87 87 THR N N 87 118.634 118.634 117.457 1.177 18112 14592 1 19 . 1 1 87 87 THR HA H 87 4.065 4.065 3.925 0.140 18112 14593 1 19 . 1 1 87 87 THR C C 87 176.047 176.047 175.221 0.826 18112 14594 1 19 . 1 1 87 87 THR CA C 87 64.983 64.983 64.823 0.160 18112 14595 1 19 . 1 1 87 87 THR CB C 87 68.045 68.045 68.712 -0.667 18112 14596 1 19 . 1 1 87 87 THR H H 87 8.711 8.711 8.389 0.322 18112 14597 1 19 . 1 1 88 88 GLU N N 88 117.889 117.889 118.992 -1.103 18112 14598 1 19 . 1 1 88 88 GLU HA H 88 3.881 3.881 4.113 -0.232 18112 14599 1 19 . 1 1 88 88 GLU C C 88 177.146 177.146 176.879 0.267 18112 14600 1 19 . 1 1 88 88 GLU CA C 88 57.814 57.814 57.952 -0.138 18112 14601 1 19 . 1 1 88 88 GLU CB C 88 28.050 28.050 28.703 -0.653 18112 14602 1 19 . 1 1 88 88 GLU H H 88 8.152 8.152 8.536 -0.384 18112 14603 1 19 . 1 1 89 89 GLU N N 89 115.617 115.617 117.795 -2.178 18112 14604 1 19 . 1 1 89 89 GLU HA H 89 4.149 4.149 4.262 -0.113 18112 14605 1 19 . 1 1 89 89 GLU C C 89 176.192 176.192 177.496 -1.304 18112 14606 1 19 . 1 1 89 89 GLU CA C 89 56.133 56.133 56.891 -0.758 18112 14607 1 19 . 1 1 89 89 GLU CB C 89 29.415 29.415 30.582 -1.167 18112 14608 1 19 . 1 1 89 89 GLU H H 89 7.311 7.311 7.537 -0.226 18112 14609 1 19 . 1 1 90 90 LEU N N 90 120.870 120.870 119.914 0.956 18112 14610 1 19 . 1 1 90 90 LEU HA H 90 4.439 4.439 4.090 0.349 18112 14611 1 19 . 1 1 90 90 LEU C C 90 175.267 175.267 177.407 -2.140 18112 14612 1 19 . 1 1 90 90 LEU CA C 90 53.504 53.504 56.485 -2.981 18112 14613 1 19 . 1 1 90 90 LEU CB C 90 40.479 40.479 42.888 -2.409 18112 14614 1 19 . 1 1 90 90 LEU H H 90 7.311 7.311 7.419 -0.108 18112 14615 1 19 . 1 1 91 91 SER N N 91 118.376 118.376 110.733 7.643 18112 14616 1 19 . 1 1 91 91 SER HA H 91 4.747 4.747 4.561 0.186 18112 14617 1 19 . 1 1 91 91 SER C C 91 173.332 173.332 172.405 0.927 18112 14618 1 19 . 1 1 91 91 SER CA C 91 56.314 56.314 58.048 -1.734 18112 14619 1 19 . 1 1 91 91 SER CB C 91 64.615 64.615 64.032 0.583 18112 14620 1 19 . 1 1 91 91 SER H H 91 8.221 8.221 7.534 0.687 18112 14621 1 19 . 1 1 92 92 ILE N N 92 122.247 122.247 121.463 0.784 18112 14622 1 19 . 1 1 92 92 ILE HA H 92 4.537 4.537 4.395 0.142 18112 14623 1 19 . 1 1 92 92 ILE C C 92 174.059 174.059 176.170 -2.111 18112 14624 1 19 . 1 1 92 92 ILE CA C 92 59.881 59.881 58.710 1.171 18112 14625 1 19 . 1 1 92 92 ILE CB C 92 37.820 37.820 41.534 -3.714 18112 14626 1 19 . 1 1 92 92 ILE H H 92 8.570 8.570 8.109 0.461 18112 14627 1 19 . 1 1 93 93 THR N N 93 116.069 116.069 118.555 -2.486 18112 14628 1 19 . 1 1 93 93 THR HA H 93 4.580 4.580 4.122 0.458 18112 14629 1 19 . 1 1 93 93 THR C C 93 175.049 175.049 175.895 -0.846 18112 14630 1 19 . 1 1 93 93 THR CA C 93 58.988 58.988 65.507 -6.519 18112 14631 1 19 . 1 1 93 93 THR CB C 93 71.362 71.362 69.078 2.284 18112 14632 1 19 . 1 1 93 93 THR H H 93 7.224 7.224 8.795 -1.571 18112 14633 1 19 . 1 1 94 94 ARG N N 94 116.595 116.595 121.069 -4.474 18112 14634 1 19 . 1 1 94 94 ARG HA H 94 3.077 3.077 4.047 -0.970 18112 14635 1 19 . 1 1 94 94 ARG C C 94 175.076 175.076 174.891 0.185 18112 14636 1 19 . 1 1 94 94 ARG CA C 94 57.119 57.119 57.988 -0.869 18112 14637 1 19 . 1 1 94 94 ARG CB C 94 27.838 27.838 29.405 -1.567 18112 14638 1 19 . 1 1 94 94 ARG H H 94 8.596 8.596 9.089 -0.493 18112 14639 1 19 . 1 1 95 95 ASP N N 95 113.735 113.735 122.147 -8.412 18112 14640 1 19 . 1 1 95 95 ASP HA H 95 4.765 4.765 4.618 0.147 18112 14641 1 19 . 1 1 95 95 ASP C C 95 175.876 175.876 177.540 -1.664 18112 14642 1 19 . 1 1 95 95 ASP CA C 95 53.156 53.156 53.535 -0.379 18112 14643 1 19 . 1 1 95 95 ASP CB C 95 41.166 41.166 40.446 0.720 18112 14644 1 19 . 1 1 95 95 ASP H H 95 7.607 7.607 7.830 -0.223 18112 14645 1 19 . 1 1 96 96 CYS N N 96 116.012 116.012 123.842 -7.830 18112 14646 1 19 . 1 1 96 96 CYS C C 96 174.361 174.361 176.684 -2.323 18112 14647 1 19 . 1 1 96 96 CYS CA C 96 56.562 56.562 61.366 -4.804 18112 14648 1 19 . 1 1 96 96 CYS CB C 96 29.416 29.416 27.889 1.527 18112 14649 1 19 . 1 1 96 96 CYS H H 96 7.094 7.094 8.407 -1.313 18112 14650 1 19 . 1 1 97 97 GLU N N 97 123.087 123.087 120.735 2.352 18112 14651 1 19 . 1 1 97 97 GLU C C 97 178.748 178.748 178.666 0.082 18112 14652 1 19 . 1 1 97 97 GLU CA C 97 59.912 59.912 59.083 0.829 18112 14653 1 19 . 1 1 97 97 GLU CB C 97 29.195 29.195 29.252 -0.056 18112 14654 1 19 . 1 1 97 97 GLU H H 97 9.003 9.003 8.039 0.964 18112 14655 1 19 . 1 1 98 98 LEU N N 98 120.942 120.942 121.292 -0.350 18112 14656 1 19 . 1 1 98 98 LEU HA H 98 3.614 3.614 4.085 -0.471 18112 14657 1 19 . 1 1 98 98 LEU C C 98 177.796 177.796 178.464 -0.668 18112 14658 1 19 . 1 1 98 98 LEU CA C 98 58.090 58.090 57.705 0.385 18112 14659 1 19 . 1 1 98 98 LEU CB C 98 39.778 39.778 41.721 -1.943 18112 14660 1 19 . 1 1 98 98 LEU H H 98 8.656 8.656 7.604 1.052 18112 14661 1 19 . 1 1 99 99 TYR N N 99 118.313 118.313 118.916 -0.603 18112 14662 1 19 . 1 1 99 99 TYR C C 99 177.077 177.077 178.520 -1.443 18112 14663 1 19 . 1 1 99 99 TYR CA C 99 62.622 62.622 62.148 0.474 18112 14664 1 19 . 1 1 99 99 TYR CB C 99 38.742 38.742 37.678 1.064 18112 14665 1 19 . 1 1 99 99 TYR H H 99 7.522 7.522 8.290 -0.768 18112 14666 1 19 . 1 1 100 100 ARG N N 100 118.101 118.101 117.091 1.010 18112 14667 1 19 . 1 1 100 100 ARG C C 100 178.616 178.616 178.964 -0.348 18112 14668 1 19 . 1 1 100 100 ARG CA C 100 59.915 59.915 57.771 2.144 18112 14669 1 19 . 1 1 100 100 ARG CB C 100 29.100 29.100 29.139 -0.039 18112 14670 1 19 . 1 1 100 100 ARG H H 100 8.243 8.243 8.375 -0.132 18112 14671 1 19 . 1 1 101 101 ALA N N 101 120.972 120.972 123.046 -2.074 18112 14672 1 19 . 1 1 101 101 ALA HA H 101 4.145 4.145 4.248 -0.103 18112 14673 1 19 . 1 1 101 101 ALA C C 101 181.359 181.359 180.134 1.225 18112 14674 1 19 . 1 1 101 101 ALA CA C 101 55.057 55.057 55.079 -0.022 18112 14675 1 19 . 1 1 101 101 ALA CB C 101 17.543 17.543 18.211 -0.668 18112 14676 1 19 . 1 1 101 101 ALA H H 101 8.352 8.352 7.997 0.355 18112 14677 1 19 . 1 1 102 102 LEU N N 102 115.683 115.683 119.602 -3.919 18112 14678 1 19 . 1 1 102 102 LEU HA H 102 4.333 4.333 4.167 0.166 18112 14679 1 19 . 1 1 102 102 LEU C C 102 178.583 178.583 179.493 -0.910 18112 14680 1 19 . 1 1 102 102 LEU CA C 102 57.634 57.634 58.319 -0.685 18112 14681 1 19 . 1 1 102 102 LEU CB C 102 41.716 41.716 41.621 0.095 18112 14682 1 19 . 1 1 102 102 LEU H H 102 7.960 7.960 8.441 -0.481 18112 14683 1 19 . 1 1 103 103 ASN N N 103 118.957 118.957 117.882 1.075 18112 14684 1 19 . 1 1 103 103 ASN C C 103 177.470 177.470 178.014 -0.544 18112 14685 1 19 . 1 1 103 103 ASN CA C 103 56.974 56.974 56.188 0.786 18112 14686 1 19 . 1 1 103 103 ASN CB C 103 38.140 38.140 38.195 -0.055 18112 14687 1 19 . 1 1 103 103 ASN H H 103 9.301 9.301 8.282 1.019 18112 14688 1 19 . 1 1 104 104 MET N N 104 113.763 113.763 119.557 -5.794 18112 14689 1 19 . 1 1 104 104 MET CA C 104 57.362 57.362 58.164 -0.802 18112 14690 1 19 . 1 1 104 104 MET CB C 104 31.895 31.895 32.185 -0.290 18112 14691 1 19 . 1 1 104 104 MET H H 104 8.332 8.332 8.053 0.279 18112 14692 1 19 . 1 1 105 105 HIS N N 105 116.024 116.024 117.280 -1.256 18112 14693 1 19 . 1 1 105 105 HIS HA H 105 3.764 3.764 4.251 -0.487 18112 14694 1 19 . 1 1 105 105 HIS C C 105 176.939 176.939 177.625 -0.686 18112 14695 1 19 . 1 1 105 105 HIS CA C 105 59.069 59.069 59.289 -0.220 18112 14696 1 19 . 1 1 105 105 HIS H H 105 7.156 7.156 8.175 -1.019 18112 14697 1 19 . 1 1 106 106 TYR N N 106 113.161 113.161 117.917 -4.756 18112 14698 1 19 . 1 1 106 106 TYR C C 106 173.767 173.767 176.351 -2.584 18112 14699 1 19 . 1 1 106 106 TYR CA C 106 58.488 58.488 61.358 -2.870 18112 14700 1 19 . 1 1 106 106 TYR CB C 106 38.225 38.225 39.603 -1.378 18112 14701 1 19 . 1 1 106 106 TYR H H 106 7.204 7.204 8.130 -0.926 18112 14702 1 19 . 1 1 107 107 ASN N N 107 118.875 118.875 115.079 3.796 18112 14703 1 19 . 1 1 107 107 ASN HA H 107 3.922 3.922 4.912 -0.990 18112 14704 1 19 . 1 1 107 107 ASN C C 107 175.815 175.815 174.968 0.847 18112 14705 1 19 . 1 1 107 107 ASN CA C 107 51.233 51.233 52.803 -1.571 18112 14706 1 19 . 1 1 107 107 ASN CB C 107 38.142 38.142 40.786 -2.644 18112 14707 1 19 . 1 1 107 107 ASN H H 107 8.127 8.127 8.213 -0.086 18112 14708 1 19 . 1 1 108 108 LYS N N 108 122.850 122.850 124.217 -1.367 18112 14709 1 19 . 1 1 108 108 LYS HA H 108 3.954 3.954 4.197 -0.243 18112 14710 1 19 . 1 1 108 108 LYS C C 108 177.586 177.586 176.925 0.661 18112 14711 1 19 . 1 1 108 108 LYS CA C 108 59.749 59.749 58.336 1.413 18112 14712 1 19 . 1 1 108 108 LYS CB C 108 31.498 31.498 32.388 -0.890 18112 14713 1 19 . 1 1 108 108 LYS H H 108 7.772 7.772 8.792 -1.020 18112 14714 1 19 . 1 1 109 109 ALA N N 109 118.054 118.054 119.915 -1.861 18112 14715 1 19 . 1 1 109 109 ALA HA H 109 4.137 4.137 4.264 -0.127 18112 14716 1 19 . 1 1 109 109 ALA C C 109 177.889 177.889 176.813 1.076 18112 14717 1 19 . 1 1 109 109 ALA CA C 109 52.299 52.299 51.903 0.396 18112 14718 1 19 . 1 1 109 109 ALA CB C 109 17.787 17.787 18.908 -1.121 18112 14719 1 19 . 1 1 109 109 ALA H H 109 8.307 8.307 7.897 0.410 18112 14720 1 19 . 1 1 110 110 ASN N N 110 115.542 115.542 117.733 -2.191 18112 14721 1 19 . 1 1 110 110 ASN HA H 110 4.480 4.480 4.624 -0.144 18112 14722 1 19 . 1 1 110 110 ASN C C 110 174.277 174.277 175.025 -0.748 18112 14723 1 19 . 1 1 110 110 ASN CA C 110 53.504 53.504 53.742 -0.238 18112 14724 1 19 . 1 1 110 110 ASN CB C 110 37.283 37.283 38.340 -1.057 18112 14725 1 19 . 1 1 110 110 ASN H H 110 8.353 8.353 7.659 0.694 18112 14726 1 19 . 1 1 111 111 ASP N N 111 114.692 114.692 125.205 -10.513 18112 14727 1 19 . 1 1 111 111 ASP HA H 111 4.485 4.485 4.592 -0.107 18112 14728 1 19 . 1 1 111 111 ASP C C 111 174.868 174.868 175.878 -1.010 18112 14729 1 19 . 1 1 111 111 ASP CA C 111 53.227 53.227 53.924 -0.697 18112 14730 1 19 . 1 1 111 111 ASP CB C 111 39.228 39.228 41.010 -1.782 18112 14731 1 19 . 1 1 111 111 ASP H H 111 8.297 8.297 7.827 0.470 18112 14732 1 19 . 1 1 112 112 PHE N N 112 120.927 120.927 117.818 3.109 18112 14733 1 19 . 1 1 112 112 PHE HA H 112 4.752 4.752 4.572 0.180 18112 14734 1 19 . 1 1 112 112 PHE C C 112 174.633 174.633 175.842 -1.209 18112 14735 1 19 . 1 1 112 112 PHE CA C 112 56.346 56.346 57.310 -0.964 18112 14736 1 19 . 1 1 112 112 PHE H H 112 7.784 7.784 7.538 0.246 18112 14737 1 19 . 1 1 113 113 GLU N N 113 128.111 128.111 119.322 8.789 18112 14738 1 19 . 1 1 113 113 GLU HA H 113 4.011 4.011 4.509 -0.498 18112 14739 1 19 . 1 1 113 113 GLU C C 113 173.502 173.502 175.497 -1.995 18112 14740 1 19 . 1 1 113 113 GLU CA C 113 55.100 55.100 57.463 -2.363 18112 14741 1 19 . 1 1 113 113 GLU H H 113 7.752 7.752 8.850 -1.098 18112 14742 1 19 . 1 1 114 114 VAL N N 114 129.326 129.326 111.626 17.700 18112 14743 1 19 . 1 1 114 114 VAL HA H 114 3.241 3.241 3.846 -0.605 18112 14744 1 19 . 1 1 114 114 VAL CA C 114 60.838 60.838 61.411 -0.573 18112 14745 1 19 . 1 1 114 114 VAL CB C 114 32.609 32.609 30.501 2.108 18112 14746 1 19 . 1 1 114 114 VAL H H 114 8.008 8.008 7.718 0.290 18112 14747 1 19 . 1 1 115 115 PRO HA H 115 4.429 4.429 4.562 -0.133 18112 14748 1 19 . 1 1 115 115 PRO C C 115 177.421 177.421 178.059 -0.638 18112 14749 1 19 . 1 1 115 115 PRO CA C 115 61.882 61.882 62.783 -0.901 18112 14750 1 19 . 1 1 115 115 PRO CB C 115 30.974 30.974 32.758 -1.784 18112 14751 1 19 . 1 1 116 116 GLU N N 116 123.936 123.936 122.261 1.675 18112 14752 1 19 . 1 1 116 116 GLU C C 116 179.034 179.034 178.916 0.118 18112 14753 1 19 . 1 1 116 116 GLU CA C 116 58.913 58.913 59.974 -1.060 18112 14754 1 19 . 1 1 116 116 GLU CB C 116 28.378 28.378 29.417 -1.039 18112 14755 1 19 . 1 1 116 116 GLU H H 116 8.757 8.757 8.827 -0.070 18112 14756 1 19 . 1 1 117 117 ARG N N 117 116.943 116.943 120.123 -3.180 18112 14757 1 19 . 1 1 117 117 ARG C C 117 177.570 177.570 178.053 -0.483 18112 14758 1 19 . 1 1 117 117 ARG CA C 117 57.033 57.033 59.150 -2.117 18112 14759 1 19 . 1 1 117 117 ARG CB C 117 28.172 28.172 29.606 -1.434 18112 14760 1 19 . 1 1 117 117 ARG H H 117 8.733 8.733 8.469 0.264 18112 14761 1 19 . 1 1 118 118 PHE N N 118 117.528 117.528 119.536 -2.008 18112 14762 1 19 . 1 1 118 118 PHE HA H 118 4.137 4.137 3.743 0.394 18112 14763 1 19 . 1 1 118 118 PHE C C 118 176.992 176.992 177.192 -0.200 18112 14764 1 19 . 1 1 118 118 PHE CA C 118 61.627 61.627 60.697 0.930 18112 14765 1 19 . 1 1 118 118 PHE CB C 118 37.386 37.386 38.126 -0.740 18112 14766 1 19 . 1 1 118 118 PHE H H 118 7.606 7.606 7.503 0.103 18112 14767 1 19 . 1 1 119 119 LEU N N 119 118.483 118.483 118.852 -0.369 18112 14768 1 19 . 1 1 119 119 LEU HA H 119 3.684 3.684 3.664 0.020 18112 14769 1 19 . 1 1 119 119 LEU C C 119 178.802 178.802 178.860 -0.058 18112 14770 1 19 . 1 1 119 119 LEU CA C 119 59.875 59.875 57.130 2.745 18112 14771 1 19 . 1 1 119 119 LEU CB C 119 39.453 39.453 40.187 -0.734 18112 14772 1 19 . 1 1 119 119 LEU H H 119 7.248 7.248 7.536 -0.288 18112 14773 1 19 . 1 1 120 120 GLU N N 120 117.870 117.870 120.921 -3.051 18112 14774 1 19 . 1 1 120 120 GLU C C 120 179.932 179.932 179.261 0.671 18112 14775 1 19 . 1 1 120 120 GLU CA C 120 59.150 59.150 59.676 -0.526 18112 14776 1 19 . 1 1 120 120 GLU CB C 120 28.878 28.878 29.709 -0.831 18112 14777 1 19 . 1 1 120 120 GLU H H 120 7.423 7.423 8.026 -0.603 18112 14778 1 19 . 1 1 121 121 VAL N N 121 120.777 120.777 119.641 1.136 18112 14779 1 19 . 1 1 121 121 VAL HA H 121 3.545 3.545 3.461 0.084 18112 14780 1 19 . 1 1 121 121 VAL C C 121 179.302 179.302 177.805 1.497 18112 14781 1 19 . 1 1 121 121 VAL CA C 121 66.875 66.875 66.126 0.749 18112 14782 1 19 . 1 1 121 121 VAL CB C 121 30.823 30.823 31.518 -0.695 18112 14783 1 19 . 1 1 121 121 VAL H H 121 8.313 8.313 7.928 0.385 18112 14784 1 19 . 1 1 122 122 ALA N N 122 127.029 127.029 121.271 5.758 18112 14785 1 19 . 1 1 122 122 ALA HA H 122 4.251 4.251 3.744 0.507 18112 14786 1 19 . 1 1 122 122 ALA C C 122 178.366 178.366 179.275 -0.909 18112 14787 1 19 . 1 1 122 122 ALA CA C 122 54.748 54.748 55.284 -0.536 18112 14788 1 19 . 1 1 122 122 ALA CB C 122 16.565 16.565 17.797 -1.232 18112 14789 1 19 . 1 1 122 122 ALA H H 122 8.896 8.896 7.731 1.165 18112 14790 1 19 . 1 1 123 123 GLN N N 123 119.887 119.887 118.215 1.672 18112 14791 1 19 . 1 1 123 123 GLN C C 123 177.908 177.908 178.490 -0.582 18112 14792 1 19 . 1 1 123 123 GLN CA C 123 60.671 60.671 58.361 2.309 18112 14793 1 19 . 1 1 123 123 GLN H H 123 8.349 8.349 7.898 0.451 18112 14794 1 19 . 1 1 124 124 ILE N N 124 120.632 120.632 121.219 -0.587 18112 14795 1 19 . 1 1 124 124 ILE HA H 124 3.651 3.651 3.693 -0.042 18112 14796 1 19 . 1 1 124 124 ILE C C 124 178.703 178.703 178.096 0.607 18112 14797 1 19 . 1 1 124 124 ILE CA C 124 65.945 65.945 65.061 0.884 18112 14798 1 19 . 1 1 124 124 ILE H H 124 8.204 8.204 8.146 0.058 18112 14799 1 19 . 1 1 125 125 THR N N 125 115.084 115.084 116.022 -0.938 18112 14800 1 19 . 1 1 125 125 THR C C 125 175.568 175.568 176.303 -0.735 18112 14801 1 19 . 1 1 125 125 THR CA C 125 67.872 67.872 66.459 1.413 18112 14802 1 19 . 1 1 125 125 THR H H 125 8.399 8.399 8.064 0.335 18112 14803 1 19 . 1 1 126 126 LEU N N 126 125.011 125.011 122.662 2.349 18112 14804 1 19 . 1 1 126 126 LEU HA H 126 4.085 4.085 4.435 -0.350 18112 14805 1 19 . 1 1 126 126 LEU C C 126 178.559 178.559 178.194 0.365 18112 14806 1 19 . 1 1 126 126 LEU CA C 126 58.843 58.843 58.349 0.494 18112 14807 1 19 . 1 1 126 126 LEU CB C 126 41.421 41.421 41.948 -0.527 18112 14808 1 19 . 1 1 126 126 LEU H H 126 8.728 8.728 8.143 0.585 18112 14809 1 19 . 1 1 127 127 ARG N N 127 117.076 117.076 118.707 -1.631 18112 14810 1 19 . 1 1 127 127 ARG HA H 127 3.929 3.929 4.046 -0.117 18112 14811 1 19 . 1 1 127 127 ARG C C 127 177.984 177.984 178.530 -0.546 18112 14812 1 19 . 1 1 127 127 ARG CA C 127 60.685 60.685 59.634 1.051 18112 14813 1 19 . 1 1 127 127 ARG CB C 127 28.079 28.079 30.069 -1.990 18112 14814 1 19 . 1 1 127 127 ARG H H 127 8.213 8.213 8.061 0.152 18112 14815 1 19 . 1 1 128 128 GLU N N 128 118.617 118.617 120.631 -2.014 18112 14816 1 19 . 1 1 128 128 GLU HA H 128 4.147 4.147 4.099 0.048 18112 14817 1 19 . 1 1 128 128 GLU C C 128 181.150 181.150 178.689 2.461 18112 14818 1 19 . 1 1 128 128 GLU CA C 128 59.508 59.508 59.065 0.443 18112 14819 1 19 . 1 1 128 128 GLU H H 128 8.478 8.478 8.084 0.394 18112 14820 1 19 . 1 1 129 129 PHE N N 129 119.267 119.267 119.271 -0.004 18112 14821 1 19 . 1 1 129 129 PHE HA H 129 4.104 4.104 4.358 -0.254 18112 14822 1 19 . 1 1 129 129 PHE C C 129 177.170 177.170 178.033 -0.863 18112 14823 1 19 . 1 1 129 129 PHE CA C 129 63.694 63.694 61.238 2.456 18112 14824 1 19 . 1 1 129 129 PHE H H 129 8.570 8.570 8.083 0.487 18112 14825 1 19 . 1 1 130 130 PHE N N 130 118.739 118.739 119.270 -0.531 18112 14826 1 19 . 1 1 130 130 PHE HA H 130 3.884 3.884 3.995 -0.111 18112 14827 1 19 . 1 1 130 130 PHE C C 130 175.860 175.860 177.201 -1.341 18112 14828 1 19 . 1 1 130 130 PHE CA C 130 62.819 62.819 62.346 0.473 18112 14829 1 19 . 1 1 130 130 PHE H H 130 8.740 8.740 8.859 -0.119 18112 14830 1 19 . 1 1 131 131 ASN N N 131 116.028 116.028 117.852 -1.824 18112 14831 1 19 . 1 1 131 131 ASN HA H 131 4.373 4.373 4.287 0.086 18112 14832 1 19 . 1 1 131 131 ASN C C 131 178.228 178.228 177.704 0.524 18112 14833 1 19 . 1 1 131 131 ASN CA C 131 55.150 55.150 56.293 -1.143 18112 14834 1 19 . 1 1 131 131 ASN H H 131 8.864 8.864 8.395 0.469 18112 14835 1 19 . 1 1 132 132 ALA N N 132 120.922 120.922 122.688 -1.766 18112 14836 1 19 . 1 1 132 132 ALA HA H 132 4.020 4.020 4.226 -0.206 18112 14837 1 19 . 1 1 132 132 ALA C C 132 178.515 178.515 179.798 -1.283 18112 14838 1 19 . 1 1 132 132 ALA CA C 132 54.924 54.924 54.877 0.047 18112 14839 1 19 . 1 1 132 132 ALA CB C 132 18.441 18.441 18.548 -0.107 18112 14840 1 19 . 1 1 132 132 ALA H H 132 7.745 7.745 8.068 -0.323 18112 14841 1 19 . 1 1 133 133 ILE N N 133 118.200 118.200 119.995 -1.795 18112 14842 1 19 . 1 1 133 133 ILE HA H 133 3.235 3.235 3.957 -0.722 18112 14843 1 19 . 1 1 133 133 ILE C C 133 180.606 180.606 177.477 3.129 18112 14844 1 19 . 1 1 133 133 ILE CA C 133 65.215 65.215 65.209 0.006 18112 14845 1 19 . 1 1 133 133 ILE CB C 133 38.291 38.291 38.171 0.120 18112 14846 1 19 . 1 1 133 133 ILE H H 133 7.999 7.999 8.120 -0.121 18112 14847 1 19 . 1 1 134 134 ILE N N 134 122.564 122.564 118.882 3.682 18112 14848 1 19 . 1 1 134 134 ILE HA H 134 3.788 3.788 3.799 -0.011 18112 14849 1 19 . 1 1 134 134 ILE C C 134 177.215 177.215 177.376 -0.161 18112 14850 1 19 . 1 1 134 134 ILE CA C 134 63.584 63.584 63.181 0.403 18112 14851 1 19 . 1 1 134 134 ILE CB C 134 35.636 35.636 37.945 -2.309 18112 14852 1 19 . 1 1 134 134 ILE H H 134 8.670 8.670 7.952 0.718 18112 14853 1 19 . 1 1 135 135 ALA N N 135 119.989 119.989 120.341 -0.352 18112 14854 1 19 . 1 1 135 135 ALA HA H 135 4.357 4.357 4.136 0.221 18112 14855 1 19 . 1 1 135 135 ALA C C 135 177.786 177.786 178.136 -0.350 18112 14856 1 19 . 1 1 135 135 ALA CA C 135 51.521 51.521 54.118 -2.597 18112 14857 1 19 . 1 1 135 135 ALA CB C 135 18.839 18.839 19.492 -0.653 18112 14858 1 19 . 1 1 135 135 ALA H H 135 6.898 6.898 8.037 -1.139 18112 14859 1 19 . 1 1 136 136 GLY N N 136 107.682 107.682 104.254 3.428 18112 14860 1 19 . 1 1 136 136 GLY C C 136 176.324 176.324 174.779 1.545 18112 14861 1 19 . 1 1 136 136 GLY CA C 136 45.469 45.469 45.044 0.426 18112 14862 1 19 . 1 1 136 136 GLY H H 136 7.913 7.913 7.772 0.141 18112 14863 1 19 . 1 1 137 137 LYS N N 137 117.213 117.213 118.809 -1.596 18112 14864 1 19 . 1 1 137 137 LYS HA H 137 4.004 4.004 4.120 -0.116 18112 14865 1 19 . 1 1 137 137 LYS C C 137 176.616 176.616 174.387 2.229 18112 14866 1 19 . 1 1 137 137 LYS CA C 137 57.499 57.499 58.660 -1.161 18112 14867 1 19 . 1 1 137 137 LYS CB C 137 30.927 30.927 31.672 -0.744 18112 14868 1 19 . 1 1 137 137 LYS H H 137 8.312 8.312 8.625 -0.313 18112 14869 1 19 . 1 1 138 138 ASP N N 138 113.545 113.545 119.277 -5.732 18112 14870 1 19 . 1 1 138 138 ASP HA H 138 3.061 3.061 4.869 -1.808 18112 14871 1 19 . 1 1 138 138 ASP C C 138 174.698 174.698 175.887 -1.189 18112 14872 1 19 . 1 1 138 138 ASP CA C 138 53.694 53.694 54.285 -0.591 18112 14873 1 19 . 1 1 138 138 ASP CB C 138 36.008 36.008 40.639 -4.631 18112 14874 1 19 . 1 1 138 138 ASP H H 138 8.465 8.465 8.253 0.212 18112 14875 1 19 . 1 1 139 139 VAL N N 139 115.191 115.191 121.677 -6.486 18112 14876 1 19 . 1 1 139 139 VAL HA H 139 3.886 3.886 4.248 -0.362 18112 14877 1 19 . 1 1 139 139 VAL C C 139 175.889 175.889 175.344 0.545 18112 14878 1 19 . 1 1 139 139 VAL CA C 139 62.793 62.793 62.458 0.335 18112 14879 1 19 . 1 1 139 139 VAL CB C 139 30.662 30.662 33.643 -2.981 18112 14880 1 19 . 1 1 139 139 VAL H H 139 6.610 6.610 8.731 -2.121 18112 14881 1 19 . 1 1 140 140 ASP N N 140 123.363 123.363 118.040 5.323 18112 14882 1 19 . 1 1 140 140 ASP C C 140 175.234 175.234 174.464 0.770 18112 14883 1 19 . 1 1 140 140 ASP CA C 140 50.221 50.221 54.028 -3.807 18112 14884 1 19 . 1 1 140 140 ASP CB C 140 42.254 42.254 41.516 0.738 18112 14885 1 19 . 1 1 140 140 ASP H H 140 7.553 7.553 7.812 -0.259 18112 14886 1 19 . 1 1 141 141 PRO HA H 141 4.682 4.682 4.550 0.132 18112 14887 1 19 . 1 1 141 141 PRO C C 141 178.678 178.678 177.348 1.330 18112 14888 1 19 . 1 1 141 141 PRO CA C 141 64.532 64.532 63.883 0.649 18112 14889 1 19 . 1 1 141 141 PRO CB C 141 31.331 31.331 32.029 -0.698 18112 14890 1 19 . 1 1 142 142 SER N N 142 114.421 114.421 114.036 0.385 18112 14891 1 19 . 1 1 142 142 SER HA H 142 4.565 4.565 4.420 0.145 18112 14892 1 19 . 1 1 142 142 SER C C 142 176.524 176.524 175.556 0.968 18112 14893 1 19 . 1 1 142 142 SER CA C 142 58.711 58.711 59.275 -0.564 18112 14894 1 19 . 1 1 142 142 SER CB C 142 62.783 62.783 62.145 0.638 18112 14895 1 19 . 1 1 142 142 SER H H 142 8.703 8.703 8.489 0.214 18112 14896 1 19 . 1 1 143 143 TRP N N 143 123.598 123.598 123.136 0.462 18112 14897 1 19 . 1 1 143 143 TRP HA H 143 4.136 4.136 4.154 -0.018 18112 14898 1 19 . 1 1 143 143 TRP C C 143 177.113 177.113 177.500 -0.387 18112 14899 1 19 . 1 1 143 143 TRP CA C 143 59.803 59.803 62.370 -2.567 18112 14900 1 19 . 1 1 143 143 TRP CB C 143 26.364 26.364 29.478 -3.114 18112 14901 1 19 . 1 1 143 143 TRP H H 143 8.374 8.374 7.596 0.778 18112 14902 1 19 . 1 1 144 144 LYS N N 144 119.293 119.293 116.376 2.917 18112 14903 1 19 . 1 1 144 144 LYS HA H 144 2.719 2.719 3.970 -1.251 18112 14904 1 19 . 1 1 144 144 LYS C C 144 177.243 177.243 178.523 -1.280 18112 14905 1 19 . 1 1 144 144 LYS CA C 144 58.851 58.851 60.057 -1.206 18112 14906 1 19 . 1 1 144 144 LYS CB C 144 29.373 29.373 31.746 -2.373 18112 14907 1 19 . 1 1 144 144 LYS H H 144 7.196 7.196 8.826 -1.630 18112 14908 1 19 . 1 1 145 145 LYS N N 145 116.440 116.440 118.485 -2.045 18112 14909 1 19 . 1 1 145 145 LYS HA H 145 3.490 3.490 4.165 -0.675 18112 14910 1 19 . 1 1 145 145 LYS C C 145 179.149 179.149 178.492 0.657 18112 14911 1 19 . 1 1 145 145 LYS CA C 145 59.271 59.271 59.059 0.212 18112 14912 1 19 . 1 1 145 145 LYS CB C 145 30.521 30.521 31.248 -0.727 18112 14913 1 19 . 1 1 145 145 LYS H H 145 7.389 7.389 8.182 -0.793 18112 14914 1 19 . 1 1 146 146 ALA N N 146 118.582 118.582 123.258 -4.676 18112 14915 1 19 . 1 1 146 146 ALA HA H 146 3.932 3.932 4.084 -0.152 18112 14916 1 19 . 1 1 146 146 ALA C C 146 179.968 179.968 179.505 0.463 18112 14917 1 19 . 1 1 146 146 ALA CA C 146 54.241 54.241 54.717 -0.475 18112 14918 1 19 . 1 1 146 146 ALA CB C 146 17.689 17.689 18.229 -0.540 18112 14919 1 19 . 1 1 146 146 ALA H H 146 7.112 7.112 8.008 -0.896 18112 14920 1 19 . 1 1 147 147 ILE N N 147 118.537 118.537 119.297 -0.760 18112 14921 1 19 . 1 1 147 147 ILE HA H 147 3.642 3.642 3.480 0.162 18112 14922 1 19 . 1 1 147 147 ILE C C 147 178.919 178.919 177.950 0.969 18112 14923 1 19 . 1 1 147 147 ILE CA C 147 64.418 64.418 63.576 0.842 18112 14924 1 19 . 1 1 147 147 ILE CB C 147 36.519 36.519 36.218 0.301 18112 14925 1 19 . 1 1 147 147 ILE H H 147 6.734 6.734 7.748 -1.014 18112 14926 1 19 . 1 1 148 148 TYR N N 148 121.033 121.033 117.993 3.040 18112 14927 1 19 . 1 1 148 148 TYR HA H 148 4.489 4.489 3.990 0.499 18112 14928 1 19 . 1 1 148 148 TYR C C 148 178.348 178.348 178.382 -0.034 18112 14929 1 19 . 1 1 148 148 TYR CA C 148 57.389 57.389 59.407 -2.018 18112 14930 1 19 . 1 1 148 148 TYR CB C 148 35.280 35.280 36.928 -1.648 18112 14931 1 19 . 1 1 148 148 TYR H H 148 8.126 8.126 7.952 0.174 18112 14932 1 19 . 1 1 149 149 LYS N N 149 114.484 114.484 120.429 -5.945 18112 14933 1 19 . 1 1 149 149 LYS C C 149 178.051 178.051 178.500 -0.449 18112 14934 1 19 . 1 1 149 149 LYS CA C 149 59.036 59.036 59.257 -0.221 18112 14935 1 19 . 1 1 149 149 LYS CB C 149 31.575 31.575 32.270 -0.695 18112 14936 1 19 . 1 1 149 149 LYS H H 149 7.364 7.364 7.792 -0.428 18112 14937 1 19 . 1 1 150 150 VAL N N 150 117.812 117.812 115.659 2.153 18112 14938 1 19 . 1 1 150 150 VAL HA H 150 3.770 3.770 3.778 -0.008 18112 14939 1 19 . 1 1 150 150 VAL C C 150 178.786 178.786 177.013 1.773 18112 14940 1 19 . 1 1 150 150 VAL CA C 150 65.070 65.070 65.189 -0.119 18112 14941 1 19 . 1 1 150 150 VAL CB C 150 29.515 29.515 31.491 -1.976 18112 14942 1 19 . 1 1 150 150 VAL H H 150 7.254 7.254 7.693 -0.439 18112 14943 1 19 . 1 1 151 151 ILE N N 151 117.884 117.884 112.330 5.554 18112 14944 1 19 . 1 1 151 151 ILE C C 151 180.539 180.539 177.033 3.506 18112 14945 1 19 . 1 1 151 151 ILE CA C 151 61.490 61.490 61.834 -0.344 18112 14946 1 19 . 1 1 151 151 ILE CB C 151 33.994 33.994 38.275 -4.281 18112 14947 1 19 . 1 1 151 151 ILE H H 151 8.154 8.154 7.685 0.469 18112 14948 1 19 . 1 1 152 152 CYS N N 152 118.649 118.649 121.780 -3.131 18112 14949 1 19 . 1 1 152 152 CYS HA H 152 4.153 4.153 4.750 -0.597 18112 14950 1 19 . 1 1 152 152 CYS C C 152 174.888 174.888 176.893 -2.005 18112 14951 1 19 . 1 1 152 152 CYS CA C 152 61.052 61.052 60.179 0.873 18112 14952 1 19 . 1 1 152 152 CYS CB C 152 36.364 36.364 28.258 8.106 18112 14953 1 19 . 1 1 152 152 CYS H H 152 8.711 8.711 8.033 0.678 18112 14954 1 19 . 1 1 153 153 LYS N N 153 118.498 118.498 120.287 -1.789 18112 14955 1 19 . 1 1 153 153 LYS C C 153 177.389 177.389 177.256 0.133 18112 14956 1 19 . 1 1 153 153 LYS CA C 153 56.243 56.243 58.693 -2.450 18112 14957 1 19 . 1 1 153 153 LYS CB C 153 31.343 31.343 31.703 -0.360 18112 14958 1 19 . 1 1 153 153 LYS H H 153 6.782 6.782 7.920 -1.138 18112 14959 1 19 . 1 1 154 154 LEU N N 154 117.318 117.318 117.505 -0.187 18112 14960 1 19 . 1 1 154 154 LEU HA H 154 4.576 4.576 4.235 0.341 18112 14961 1 19 . 1 1 154 154 LEU C C 154 177.161 177.161 176.858 0.303 18112 14962 1 19 . 1 1 154 154 LEU CA C 154 53.782 53.782 55.297 -1.516 18112 14963 1 19 . 1 1 154 154 LEU CB C 154 40.881 40.881 41.967 -1.086 18112 14964 1 19 . 1 1 154 154 LEU H H 154 7.616 7.616 7.319 0.297 18112 14965 1 19 . 1 1 155 155 ASP N N 155 121.564 121.564 119.038 2.526 18112 14966 1 19 . 1 1 155 155 ASP C C 155 177.094 177.094 176.610 0.484 18112 14967 1 19 . 1 1 155 155 ASP CA C 155 55.732 55.732 54.378 1.354 18112 14968 1 19 . 1 1 155 155 ASP CB C 155 40.139 40.139 41.322 -1.183 18112 14969 1 19 . 1 1 155 155 ASP H H 155 7.582 7.582 7.572 0.010 18112 14970 1 19 . 1 1 156 156 SER N N 156 117.352 117.352 116.321 1.031 18112 14971 1 19 . 1 1 156 156 SER HA H 156 4.818 4.818 4.566 0.252 18112 14972 1 19 . 1 1 156 156 SER C C 156 173.409 173.409 174.143 -0.734 18112 14973 1 19 . 1 1 156 156 SER CA C 156 57.073 57.073 57.997 -0.924 18112 14974 1 19 . 1 1 156 156 SER CB C 156 65.150 65.150 62.404 2.745 18112 14975 1 19 . 1 1 156 156 SER H H 156 8.846 8.846 8.566 0.280 18112 14976 1 19 . 1 1 157 157 GLU N N 157 120.688 120.688 118.423 2.265 18112 14977 1 19 . 1 1 157 157 GLU HA H 157 4.038 4.038 3.953 0.085 18112 14978 1 19 . 1 1 157 157 GLU C C 157 176.332 176.332 174.767 1.565 18112 14979 1 19 . 1 1 157 157 GLU CA C 157 56.464 56.464 58.994 -2.530 18112 14980 1 19 . 1 1 157 157 GLU CB C 157 29.206 29.206 28.757 0.449 18112 14981 1 19 . 1 1 157 157 GLU H H 157 8.356 8.356 8.535 -0.179 18112 14982 1 19 . 1 1 158 158 VAL N N 158 126.906 126.906 113.790 13.116 18112 14983 1 19 . 1 1 158 158 VAL HA H 158 3.449 3.449 4.438 -0.989 18112 14984 1 19 . 1 1 158 158 VAL C C 158 176.382 176.382 173.577 2.805 18112 14985 1 19 . 1 1 158 158 VAL CA C 158 59.584 59.584 58.664 0.920 18112 14986 1 19 . 1 1 158 158 VAL CB C 158 31.160 31.160 33.419 -2.259 18112 14987 1 19 . 1 1 158 158 VAL H H 158 8.561 8.561 7.399 1.162 18112 14988 1 19 . 1 1 159 159 PRO HA H 159 4.403 4.403 4.515 -0.112 18112 14989 1 19 . 1 1 159 159 PRO C C 159 176.757 176.757 176.779 -0.022 18112 14990 1 19 . 1 1 159 159 PRO CA C 159 63.845 63.845 62.628 1.217 18112 14991 1 19 . 1 1 159 159 PRO CB C 159 32.106 32.106 32.508 -0.402 18112 14992 1 19 . 1 1 160 160 GLU N N 160 122.904 122.904 120.102 2.802 18112 14993 1 19 . 1 1 160 160 GLU HA H 160 4.008 4.008 4.084 -0.076 18112 14994 1 19 . 1 1 160 160 GLU C C 160 179.132 179.132 176.814 2.318 18112 14995 1 19 . 1 1 160 160 GLU CA C 160 59.407 59.407 58.516 0.891 18112 14996 1 19 . 1 1 160 160 GLU CB C 160 28.991 28.991 30.162 -1.171 18112 14997 1 19 . 1 1 160 160 GLU H H 160 8.650 8.650 8.366 0.284 18112 14998 1 19 . 1 1 161 161 ILE N N 161 119.782 119.782 114.692 5.090 18112 14999 1 19 . 1 1 161 161 ILE HA H 161 4.146 4.146 4.450 -0.304 18112 15000 1 19 . 1 1 161 161 ILE C C 161 176.176 176.176 174.328 1.848 18112 15001 1 19 . 1 1 161 161 ILE CA C 161 62.034 62.034 60.760 1.274 18112 15002 1 19 . 1 1 161 161 ILE CB C 161 37.113 37.113 39.622 -2.509 18112 15003 1 19 . 1 1 161 161 ILE H H 161 8.448 8.448 7.542 0.906 18112 15004 1 19 . 1 1 162 162 PHE N N 162 117.594 117.594 125.242 -7.648 18112 15005 1 19 . 1 1 162 162 PHE C C 162 176.115 176.115 176.796 -0.681 18112 15006 1 19 . 1 1 162 162 PHE CA C 162 61.009 61.009 59.572 1.437 18112 15007 1 19 . 1 1 162 162 PHE CB C 162 38.394 38.394 39.160 -0.766 18112 15008 1 19 . 1 1 162 162 PHE H H 162 8.145 8.145 8.779 -0.634 18112 15009 1 19 . 1 1 163 163 LYS N N 163 116.083 116.083 119.959 -3.876 18112 15010 1 19 . 1 1 163 163 LYS C C 163 178.196 178.196 176.619 1.577 18112 15011 1 19 . 1 1 163 163 LYS CA C 163 58.136 58.136 58.260 -0.124 18112 15012 1 19 . 1 1 163 163 LYS CB C 163 31.694 31.694 32.991 -1.297 18112 15013 1 19 . 1 1 163 163 LYS H H 163 8.232 8.232 7.965 0.267 18112 15014 1 19 . 1 1 164 164 SER N N 164 113.680 113.680 112.863 0.817 18112 15015 1 19 . 1 1 164 164 SER CA C 164 55.205 55.205 56.421 -1.216 18112 15016 1 19 . 1 1 164 164 SER CB C 164 63.265 63.265 64.010 -0.745 18112 15017 1 19 . 1 1 164 164 SER H H 164 7.708 7.708 7.795 -0.087 18112 15018 1 19 . 1 1 165 165 PRO HA H 165 4.580 4.580 4.142 0.438 18112 15019 1 19 . 1 1 165 165 PRO C C 165 177.541 177.541 176.816 0.725 18112 15020 1 19 . 1 1 165 165 PRO CA C 165 63.950 63.950 64.332 -0.382 18112 15021 1 19 . 1 1 165 165 PRO CB C 165 30.686 30.686 31.854 -1.168 18112 15022 1 19 . 1 1 166 166 ASN N N 166 116.304 116.304 116.398 -0.094 18112 15023 1 19 . 1 1 166 166 ASN HA H 166 5.029 5.029 4.221 0.808 18112 15024 1 19 . 1 1 166 166 ASN C C 166 175.811 175.811 176.533 -0.722 18112 15025 1 19 . 1 1 166 166 ASN CA C 166 51.962 51.962 56.262 -4.300 18112 15026 1 19 . 1 1 166 166 ASN CB C 166 37.915 37.915 36.975 0.940 18112 15027 1 19 . 1 1 166 166 ASN H H 166 8.216 8.216 8.963 -0.747 18112 15028 1 19 . 1 1 167 167 CYS N N 167 116.078 116.078 120.473 -4.395 18112 15029 1 19 . 1 1 167 167 CYS HA H 167 4.011 4.011 4.470 -0.459 18112 15030 1 19 . 1 1 167 167 CYS C C 167 175.057 175.057 176.123 -1.066 18112 15031 1 19 . 1 1 167 167 CYS CA C 167 59.816 59.816 59.824 -0.008 18112 15032 1 19 . 1 1 167 167 CYS CB C 167 27.446 27.446 26.754 0.692 18112 15033 1 19 . 1 1 167 167 CYS H H 167 7.246 7.246 7.816 -0.570 18112 15034 1 19 . 1 1 168 168 LEU N N 168 120.082 120.082 121.811 -1.729 18112 15035 1 19 . 1 1 168 168 LEU HA H 168 3.880 3.880 4.099 -0.219 18112 15036 1 19 . 1 1 168 168 LEU C C 168 178.541 178.541 177.952 0.589 18112 15037 1 19 . 1 1 168 168 LEU CA C 168 57.734 57.734 56.858 0.876 18112 15038 1 19 . 1 1 168 168 LEU CB C 168 38.825 38.825 40.003 -1.178 18112 15039 1 19 . 1 1 168 168 LEU H H 168 8.451 8.451 8.013 0.438 18112 15040 1 19 . 1 1 169 169 GLN N N 169 116.700 116.700 119.125 -2.425 18112 15041 1 19 . 1 1 169 169 GLN HA H 169 4.064 4.064 3.927 0.137 18112 15042 1 19 . 1 1 169 169 GLN C C 169 177.378 177.378 177.301 0.077 18112 15043 1 19 . 1 1 169 169 GLN CA C 169 57.675 57.675 58.869 -1.194 18112 15044 1 19 . 1 1 169 169 GLN CB C 169 27.710 27.710 28.486 -0.776 18112 15045 1 19 . 1 1 169 169 GLN H H 169 7.665 7.665 7.627 0.038 18112 15046 1 19 . 1 1 170 170 GLU N N 170 116.701 116.701 116.346 0.355 18112 15047 1 19 . 1 1 170 170 GLU HA H 170 4.214 4.214 4.246 -0.032 18112 15048 1 19 . 1 1 170 170 GLU C C 170 177.730 177.730 178.195 -0.465 18112 15049 1 19 . 1 1 170 170 GLU CA C 170 56.899 56.899 57.550 -0.651 18112 15050 1 19 . 1 1 170 170 GLU H H 170 7.405 7.405 7.855 -0.450 18112 15051 1 19 . 1 1 171 171 LEU N N 171 118.021 118.021 113.839 4.182 18112 15052 1 19 . 1 1 171 171 LEU HA H 171 4.209 4.209 4.644 -0.435 18112 15053 1 19 . 1 1 171 171 LEU C C 171 177.005 177.005 177.477 -0.472 18112 15054 1 19 . 1 1 171 171 LEU CA C 171 55.870 55.870 54.176 1.694 18112 15055 1 19 . 1 1 171 171 LEU CB C 171 43.680 43.680 42.468 1.212 18112 15056 1 19 . 1 1 171 171 LEU H H 171 7.823 7.823 7.436 0.387 18112 15057 1 19 . 1 1 172 172 LEU N N 172 117.580 117.580 122.891 -5.311 18112 15058 1 19 . 1 1 172 172 LEU HA H 172 4.571 4.571 4.422 0.149 18112 15059 1 19 . 1 1 172 172 LEU C C 172 176.411 176.411 175.798 0.613 18112 15060 1 19 . 1 1 172 172 LEU CA C 172 53.972 53.972 54.129 -0.157 18112 15061 1 19 . 1 1 172 172 LEU CB C 172 40.483 40.483 41.498 -1.015 18112 15062 1 19 . 1 1 172 172 LEU H H 172 7.306 7.306 7.476 -0.170 18112 15063 1 19 . 1 1 173 173 HIS N N 173 123.310 123.310 126.820 -3.510 18112 15064 1 19 . 1 1 173 173 HIS C C 173 179.022 179.022 174.973 4.049 18112 15065 1 19 . 1 1 173 173 HIS CA C 173 56.693 56.693 56.007 0.686 18112 15066 1 19 . 1 1 173 173 HIS CB C 173 29.371 29.371 29.583 -0.212 18112 15067 1 19 . 1 1 173 173 HIS H H 173 8.028 8.028 8.770 -0.742 18112 15068 1 20 . 1 1 12 12 ALA N N 12 125.167 125.167 126.677 -1.510 18112 15069 1 20 . 1 1 12 12 ALA C C 12 177.566 177.566 176.208 1.358 18112 15070 1 20 . 1 1 12 12 ALA CA C 12 52.067 52.067 50.917 1.149 18112 15071 1 20 . 1 1 12 12 ALA CB C 12 18.456 18.456 20.631 -2.175 18112 15072 1 20 . 1 1 12 12 ALA H H 12 8.311 8.311 8.598 -0.286 18112 15073 1 20 . 1 1 13 13 MET N N 13 119.278 119.278 120.634 -1.356 18112 15074 1 20 . 1 1 13 13 MET C C 13 176.325 176.325 176.678 -0.353 18112 15075 1 20 . 1 1 13 13 MET CA C 13 54.992 54.992 53.952 1.040 18112 15076 1 20 . 1 1 13 13 MET CB C 13 32.308 32.308 32.625 -0.317 18112 15077 1 20 . 1 1 13 13 MET H H 13 8.269 8.269 8.273 -0.004 18112 15078 1 20 . 1 1 14 14 GLN N N 14 120.869 120.869 122.154 -1.285 18112 15079 1 20 . 1 1 14 14 GLN HA H 14 4.399 4.399 4.270 0.129 18112 15080 1 20 . 1 1 14 14 GLN C C 14 175.644 175.644 175.036 0.608 18112 15081 1 20 . 1 1 14 14 GLN CA C 14 55.139 55.139 56.691 -1.552 18112 15082 1 20 . 1 1 14 14 GLN CB C 14 29.051 29.051 28.927 0.124 18112 15083 1 20 . 1 1 14 14 GLN H H 14 8.501 8.501 8.363 0.138 18112 15084 1 20 . 1 1 15 15 GLU N N 15 122.042 122.042 122.720 -0.678 18112 15085 1 20 . 1 1 15 15 GLU C C 15 176.242 176.242 175.721 0.521 18112 15086 1 20 . 1 1 15 15 GLU CA C 15 56.064 56.064 56.836 -0.772 18112 15087 1 20 . 1 1 15 15 GLU CB C 15 29.302 29.302 30.727 -1.425 18112 15088 1 20 . 1 1 15 15 GLU H H 15 8.547 8.547 9.164 -0.617 18112 15089 1 20 . 1 1 16 16 GLY N N 16 108.821 108.821 108.746 0.075 18112 15090 1 20 . 1 1 16 16 GLY C C 16 172.949 172.949 172.857 0.092 18112 15091 1 20 . 1 1 16 16 GLY CA C 16 44.227 44.227 44.698 -0.471 18112 15092 1 20 . 1 1 16 16 GLY H H 16 8.100 8.100 7.757 0.343 18112 15093 1 20 . 1 1 17 17 LEU N N 17 120.315 120.315 122.546 -2.231 18112 15094 1 20 . 1 1 17 17 LEU C C 17 177.334 177.334 176.290 1.044 18112 15095 1 20 . 1 1 17 17 LEU CA C 17 53.544 53.544 55.048 -1.504 18112 15096 1 20 . 1 1 17 17 LEU CB C 17 42.140 42.140 42.861 -0.721 18112 15097 1 20 . 1 1 17 17 LEU H H 17 8.222 8.222 8.163 0.059 18112 15098 1 20 . 1 1 18 18 SER N N 18 126.547 126.547 110.559 15.988 18112 15099 1 20 . 1 1 18 18 SER CA C 18 56.851 56.851 57.014 -0.163 18112 15100 1 20 . 1 1 18 18 SER CB C 18 64.636 64.636 63.960 0.676 18112 15101 1 20 . 1 1 18 18 SER H H 18 11.627 11.627 7.634 3.993 18112 15102 1 20 . 1 1 19 19 PRO C C 19 175.118 175.118 176.973 -1.855 18112 15103 1 20 . 1 1 20 20 ASN N N 20 121.372 121.372 117.639 3.733 18112 15104 1 20 . 1 1 20 20 ASN H H 20 8.172 8.172 8.721 -0.549 18112 15105 1 20 . 1 1 25 25 ALA CB C 25 18.020 18.020 18.489 -0.469 18112 15106 1 20 . 1 1 26 26 LYS N N 26 118.490 118.490 119.439 -0.949 18112 15107 1 20 . 1 1 26 26 LYS CA C 26 56.146 56.146 58.595 -2.449 18112 15108 1 20 . 1 1 26 26 LYS H H 26 6.794 6.794 7.684 -0.890 18112 15109 1 20 . 1 1 31 31 TYR HA H 31 4.398 4.398 2.738 1.660 18112 15110 1 20 . 1 1 31 31 TYR C C 31 173.714 173.714 175.727 -2.013 18112 15111 1 20 . 1 1 31 31 TYR CA C 31 59.757 59.757 59.977 -0.220 18112 15112 1 20 . 1 1 32 32 THR N N 32 111.928 111.928 109.997 1.931 18112 15113 1 20 . 1 1 32 32 THR HA H 32 4.209 4.209 3.816 0.393 18112 15114 1 20 . 1 1 32 32 THR C C 32 171.061 171.061 175.035 -3.974 18112 15115 1 20 . 1 1 32 32 THR CA C 32 56.905 56.905 64.377 -7.472 18112 15116 1 20 . 1 1 32 32 THR CB C 32 69.707 69.707 68.132 1.575 18112 15117 1 20 . 1 1 32 32 THR H H 32 8.237 8.237 7.429 0.808 18112 15118 1 20 . 1 1 33 33 ARG N N 33 124.856 124.856 122.318 2.538 18112 15119 1 20 . 1 1 33 33 ARG C C 33 176.451 176.451 175.855 0.596 18112 15120 1 20 . 1 1 33 33 ARG CA C 33 55.627 55.627 54.866 0.761 18112 15121 1 20 . 1 1 33 33 ARG CB C 33 29.861 29.861 30.549 -0.688 18112 15122 1 20 . 1 1 33 33 ARG H H 33 9.159 9.159 7.698 1.461 18112 15123 1 20 . 1 1 34 34 TYR N N 34 117.908 117.908 120.947 -3.039 18112 15124 1 20 . 1 1 34 34 TYR CA C 34 55.320 55.320 59.782 -4.462 18112 15125 1 20 . 1 1 34 34 TYR H H 34 8.995 8.995 8.463 0.532 18112 15126 1 20 . 1 1 35 35 PRO C C 35 177.280 177.280 177.182 0.098 18112 15127 1 20 . 1 1 36 36 SER N N 36 116.410 116.410 121.035 -4.625 18112 15128 1 20 . 1 1 36 36 SER C C 36 178.938 178.938 176.337 2.601 18112 15129 1 20 . 1 1 36 36 SER CA C 36 64.815 64.815 61.665 3.150 18112 15130 1 20 . 1 1 36 36 SER H H 36 8.106 8.106 8.604 -0.498 18112 15131 1 20 . 1 1 37 37 SER N N 37 117.488 117.488 115.602 1.886 18112 15132 1 20 . 1 1 37 37 SER C C 37 177.698 177.698 176.797 0.901 18112 15133 1 20 . 1 1 37 37 SER CA C 37 61.357 61.357 61.798 -0.441 18112 15134 1 20 . 1 1 37 37 SER CB C 37 68.118 68.118 62.507 5.611 18112 15135 1 20 . 1 1 37 37 SER H H 37 8.169 8.169 8.549 -0.380 18112 15136 1 20 . 1 1 38 38 ASN N N 38 115.638 115.638 121.221 -5.583 18112 15137 1 20 . 1 1 38 38 ASN HA H 38 4.259 4.259 4.435 -0.176 18112 15138 1 20 . 1 1 38 38 ASN C C 38 177.868 177.868 177.403 0.465 18112 15139 1 20 . 1 1 38 38 ASN CA C 38 55.907 55.907 56.007 -0.100 18112 15140 1 20 . 1 1 38 38 ASN CB C 38 37.230 37.230 38.173 -0.943 18112 15141 1 20 . 1 1 38 38 ASN H H 38 8.284 8.284 7.579 0.705 18112 15142 1 20 . 1 1 39 39 MET N N 39 121.352 121.352 118.651 2.701 18112 15143 1 20 . 1 1 39 39 MET HA H 39 4.170 4.170 3.745 0.425 18112 15144 1 20 . 1 1 39 39 MET C C 39 179.068 179.068 178.593 0.475 18112 15145 1 20 . 1 1 39 39 MET CA C 39 58.751 58.751 57.714 1.037 18112 15146 1 20 . 1 1 39 39 MET CB C 39 31.850 31.850 31.596 0.254 18112 15147 1 20 . 1 1 39 39 MET H H 39 7.857 7.857 7.706 0.151 18112 15148 1 20 . 1 1 40 40 LEU N N 40 118.936 118.936 121.768 -2.832 18112 15149 1 20 . 1 1 40 40 LEU HA H 40 4.139 4.139 4.375 -0.236 18112 15150 1 20 . 1 1 40 40 LEU C C 40 178.700 178.700 179.204 -0.504 18112 15151 1 20 . 1 1 40 40 LEU CA C 40 58.455 58.455 58.185 0.270 18112 15152 1 20 . 1 1 40 40 LEU CB C 40 40.304 40.304 41.442 -1.138 18112 15153 1 20 . 1 1 40 40 LEU H H 40 8.167 8.167 8.392 -0.225 18112 15154 1 20 . 1 1 41 41 LYS N N 41 116.791 116.791 117.072 -0.281 18112 15155 1 20 . 1 1 41 41 LYS HA H 41 3.475 3.475 4.272 -0.797 18112 15156 1 20 . 1 1 41 41 LYS C C 41 178.793 178.793 179.031 -0.238 18112 15157 1 20 . 1 1 41 41 LYS CA C 41 59.161 59.161 59.089 0.072 18112 15158 1 20 . 1 1 41 41 LYS CB C 41 30.992 30.992 32.062 -1.070 18112 15159 1 20 . 1 1 41 41 LYS H H 41 7.632 7.632 7.894 -0.262 18112 15160 1 20 . 1 1 42 42 THR N N 42 112.819 112.819 115.860 -3.041 18112 15161 1 20 . 1 1 42 42 THR HA H 42 4.230 4.230 4.214 0.016 18112 15162 1 20 . 1 1 42 42 THR C C 42 176.142 176.142 177.192 -1.050 18112 15163 1 20 . 1 1 42 42 THR CA C 42 65.107 65.107 66.144 -1.037 18112 15164 1 20 . 1 1 42 42 THR CB C 42 68.306 68.306 68.987 -0.682 18112 15165 1 20 . 1 1 42 42 THR H H 42 7.469 7.469 8.133 -0.664 18112 15166 1 20 . 1 1 43 43 TYR N N 43 118.565 118.565 120.260 -1.695 18112 15167 1 20 . 1 1 43 43 TYR HA H 43 4.204 4.204 4.366 -0.162 18112 15168 1 20 . 1 1 43 43 TYR C C 43 174.240 174.240 177.822 -3.582 18112 15169 1 20 . 1 1 43 43 TYR CA C 43 60.886 60.886 57.492 3.394 18112 15170 1 20 . 1 1 43 43 TYR CB C 43 38.165 38.165 38.323 -0.158 18112 15171 1 20 . 1 1 43 43 TYR H H 43 7.978 7.978 7.712 0.266 18112 15172 1 20 . 1 1 44 44 PHE N N 44 120.980 120.980 118.310 2.670 18112 15173 1 20 . 1 1 44 44 PHE HA H 44 4.920 4.920 4.805 0.115 18112 15174 1 20 . 1 1 44 44 PHE C C 44 176.436 176.436 176.442 -0.006 18112 15175 1 20 . 1 1 44 44 PHE CA C 44 56.672 56.672 57.242 -0.570 18112 15176 1 20 . 1 1 44 44 PHE CB C 44 36.570 36.570 36.796 -0.226 18112 15177 1 20 . 1 1 44 44 PHE H H 44 7.955 7.955 8.515 -0.560 18112 15178 1 20 . 1 1 45 45 SER N N 45 113.407 113.407 117.348 -3.941 18112 15179 1 20 . 1 1 45 45 SER HA H 45 4.373 4.373 4.449 -0.076 18112 15180 1 20 . 1 1 45 45 SER C C 45 174.424 174.424 175.703 -1.279 18112 15181 1 20 . 1 1 45 45 SER CA C 45 61.037 61.037 60.215 0.822 18112 15182 1 20 . 1 1 45 45 SER CB C 45 62.711 62.711 63.507 -0.796 18112 15183 1 20 . 1 1 45 45 SER H H 45 7.932 7.932 7.872 0.060 18112 15184 1 20 . 1 1 46 46 ASP N N 46 118.099 118.099 120.046 -1.947 18112 15185 1 20 . 1 1 46 46 ASP HA H 46 4.572 4.572 4.604 -0.032 18112 15186 1 20 . 1 1 46 46 ASP C C 46 174.866 174.866 176.637 -1.771 18112 15187 1 20 . 1 1 46 46 ASP CA C 46 53.602 53.602 55.620 -2.018 18112 15188 1 20 . 1 1 46 46 ASP CB C 46 38.992 38.992 41.496 -2.504 18112 15189 1 20 . 1 1 46 46 ASP H H 46 9.889 9.889 8.634 1.255 18112 15190 1 20 . 1 1 47 47 VAL N N 47 121.496 121.496 119.983 1.513 18112 15191 1 20 . 1 1 47 47 VAL HA H 47 4.058 4.058 3.850 0.208 18112 15192 1 20 . 1 1 47 47 VAL C C 47 174.676 174.676 176.023 -1.347 18112 15193 1 20 . 1 1 47 47 VAL CA C 47 61.006 61.006 62.161 -1.155 18112 15194 1 20 . 1 1 47 47 VAL CB C 47 32.110 32.110 32.092 0.019 18112 15195 1 20 . 1 1 47 47 VAL H H 47 7.781 7.781 7.451 0.330 18112 15196 1 20 . 1 1 48 48 LYS N N 48 126.100 126.100 125.935 0.165 18112 15197 1 20 . 1 1 48 48 LYS HA H 48 4.402 4.402 4.252 0.150 18112 15198 1 20 . 1 1 48 48 LYS C C 48 175.564 175.564 176.498 -0.934 18112 15199 1 20 . 1 1 48 48 LYS CA C 48 54.874 54.874 56.908 -2.034 18112 15200 1 20 . 1 1 48 48 LYS CB C 48 30.189 30.189 32.901 -2.712 18112 15201 1 20 . 1 1 48 48 LYS H H 48 8.245 8.245 8.235 0.010 18112 15202 1 20 . 1 1 49 49 PHE N N 49 125.341 125.341 114.987 10.354 18112 15203 1 20 . 1 1 49 49 PHE HA H 49 3.813 3.813 4.245 -0.432 18112 15204 1 20 . 1 1 49 49 PHE C C 49 175.708 175.708 174.719 0.989 18112 15205 1 20 . 1 1 49 49 PHE CA C 49 60.861 60.861 58.395 2.466 18112 15206 1 20 . 1 1 49 49 PHE CB C 49 38.616 38.616 36.927 1.689 18112 15207 1 20 . 1 1 49 49 PHE H H 49 8.626 8.626 7.684 0.942 18112 15208 1 20 . 1 1 50 50 ASN N N 50 115.408 115.408 118.959 -3.551 18112 15209 1 20 . 1 1 50 50 ASN C C 50 176.072 176.072 174.959 1.113 18112 15210 1 20 . 1 1 50 50 ASN CA C 50 51.730 51.730 51.217 0.513 18112 15211 1 20 . 1 1 50 50 ASN H H 50 7.030 7.030 7.800 -0.770 18112 15212 1 20 . 1 1 51 51 ARG N N 51 122.706 122.706 121.233 1.473 18112 15213 1 20 . 1 1 51 51 ARG CA C 51 59.534 59.534 60.052 -0.518 18112 15214 1 20 . 1 1 51 51 ARG H H 51 7.790 7.790 8.793 -1.003 18112 15215 1 20 . 1 1 52 52 CYS N N 52 117.340 117.340 115.018 2.322 18112 15216 1 20 . 1 1 52 52 CYS HA H 52 4.108 4.108 4.205 -0.097 18112 15217 1 20 . 1 1 52 52 CYS C C 52 178.200 178.200 176.896 1.304 18112 15218 1 20 . 1 1 52 52 CYS CA C 52 61.143 61.143 63.013 -1.870 18112 15219 1 20 . 1 1 52 52 CYS H H 52 7.681 7.681 7.979 -0.298 18112 15220 1 20 . 1 1 53 53 ILE N N 53 122.321 122.321 119.126 3.195 18112 15221 1 20 . 1 1 53 53 ILE HA H 53 3.588 3.588 3.636 -0.048 18112 15222 1 20 . 1 1 53 53 ILE C C 53 177.492 177.492 177.284 0.208 18112 15223 1 20 . 1 1 53 53 ILE CA C 53 64.109 64.109 64.698 -0.589 18112 15224 1 20 . 1 1 53 53 ILE CB C 53 37.603 37.603 36.950 0.652 18112 15225 1 20 . 1 1 53 53 ILE H H 53 8.035 8.035 7.933 0.102 18112 15226 1 20 . 1 1 54 54 THR C C 54 175.903 175.903 176.560 -0.657 18112 15227 1 20 . 1 1 54 54 THR CA C 54 67.308 67.308 66.615 0.693 18112 15228 1 20 . 1 1 55 55 SER N N 55 113.819 113.819 117.085 -3.266 18112 15229 1 20 . 1 1 55 55 SER H H 55 7.844 7.844 7.983 -0.139 18112 15230 1 20 . 1 1 56 56 GLN C C 56 179.792 179.792 177.300 2.492 18112 15231 1 20 . 1 1 57 57 LEU N N 57 116.701 116.701 120.856 -4.155 18112 15232 1 20 . 1 1 57 57 LEU HA H 57 4.519 4.519 2.818 1.701 18112 15233 1 20 . 1 1 57 57 LEU C C 57 178.775 178.775 178.377 0.398 18112 15234 1 20 . 1 1 57 57 LEU CA C 57 55.232 55.232 57.404 -2.171 18112 15235 1 20 . 1 1 57 57 LEU CB C 57 37.131 37.131 41.527 -4.396 18112 15236 1 20 . 1 1 57 57 LEU H H 57 8.267 8.267 7.411 0.856 18112 15237 1 20 . 1 1 58 58 ILE N N 58 122.522 122.522 117.154 5.368 18112 15238 1 20 . 1 1 58 58 ILE HA H 58 4.640 4.640 3.543 1.097 18112 15239 1 20 . 1 1 58 58 ILE C C 58 177.380 177.380 177.980 -0.600 18112 15240 1 20 . 1 1 58 58 ILE CA C 58 62.163 62.163 62.702 -0.539 18112 15241 1 20 . 1 1 58 58 ILE CB C 58 30.657 30.657 36.183 -5.526 18112 15242 1 20 . 1 1 58 58 ILE H H 58 8.111 8.111 7.959 0.152 18112 15243 1 20 . 1 1 59 59 LYS N N 59 121.002 121.002 122.086 -1.084 18112 15244 1 20 . 1 1 59 59 LYS C C 59 177.600 177.600 178.674 -1.074 18112 15245 1 20 . 1 1 59 59 LYS CA C 59 57.570 57.570 59.370 -1.800 18112 15246 1 20 . 1 1 59 59 LYS CB C 59 39.101 39.101 31.912 7.189 18112 15247 1 20 . 1 1 59 59 LYS H H 59 7.432 7.432 7.809 -0.377 18112 15248 1 20 . 1 1 60 60 TRP N N 60 118.679 118.679 118.581 0.098 18112 15249 1 20 . 1 1 60 60 TRP HA H 60 3.739 3.739 4.468 -0.730 18112 15250 1 20 . 1 1 60 60 TRP C C 60 178.246 178.246 179.027 -0.781 18112 15251 1 20 . 1 1 60 60 TRP CA C 60 59.818 59.818 59.039 0.779 18112 15252 1 20 . 1 1 60 60 TRP CB C 60 31.851 31.851 28.230 3.620 18112 15253 1 20 . 1 1 60 60 TRP H H 60 7.565 7.565 7.766 -0.201 18112 15254 1 20 . 1 1 61 61 PHE N N 61 118.005 118.005 118.490 -0.485 18112 15255 1 20 . 1 1 61 61 PHE HA H 61 3.882 3.882 3.856 0.026 18112 15256 1 20 . 1 1 61 61 PHE CA C 61 60.054 60.054 60.354 -0.300 18112 15257 1 20 . 1 1 61 61 PHE H H 61 7.819 7.819 8.581 -0.762 18112 15258 1 20 . 1 1 62 62 SER N N 62 121.144 121.144 114.749 6.395 18112 15259 1 20 . 1 1 62 62 SER C C 62 177.840 177.840 176.625 1.215 18112 15260 1 20 . 1 1 62 62 SER CA C 62 55.892 55.892 62.279 -6.387 18112 15261 1 20 . 1 1 62 62 SER H H 62 8.878 8.878 8.524 0.354 18112 15262 1 20 . 1 1 63 63 ASN N N 63 115.303 115.303 120.819 -5.516 18112 15263 1 20 . 1 1 63 63 ASN C C 63 177.222 177.222 177.417 -0.195 18112 15264 1 20 . 1 1 63 63 ASN CA C 63 60.467 60.467 56.321 4.146 18112 15265 1 20 . 1 1 63 63 ASN H H 63 8.001 8.001 8.153 -0.152 18112 15266 1 20 . 1 1 64 64 PHE N N 64 112.571 112.571 122.316 -9.745 18112 15267 1 20 . 1 1 64 64 PHE CA C 64 56.453 56.453 61.360 -4.907 18112 15268 1 20 . 1 1 64 64 PHE H H 64 7.082 7.082 8.806 -1.724 18112 15269 1 20 . 1 1 65 65 ARG N N 65 116.695 116.695 120.246 -3.551 18112 15270 1 20 . 1 1 65 65 ARG CA C 65 59.590 59.590 59.405 0.185 18112 15271 1 20 . 1 1 65 65 ARG H H 65 8.091 8.091 8.521 -0.430 18112 15272 1 20 . 1 1 66 66 GLU N N 66 121.653 121.653 119.571 2.082 18112 15273 1 20 . 1 1 66 66 GLU HA H 66 4.739 4.739 4.072 0.667 18112 15274 1 20 . 1 1 66 66 GLU C C 66 174.621 174.621 178.781 -4.160 18112 15275 1 20 . 1 1 66 66 GLU CA C 66 59.583 59.583 59.783 -0.200 18112 15276 1 20 . 1 1 66 66 GLU H H 66 7.597 7.597 8.234 -0.637 18112 15277 1 20 . 1 1 67 67 PHE N N 67 111.578 111.578 120.174 -8.596 18112 15278 1 20 . 1 1 67 67 PHE C C 67 176.164 176.164 177.558 -1.394 18112 15279 1 20 . 1 1 67 67 PHE CA C 67 61.156 61.156 61.513 -0.357 18112 15280 1 20 . 1 1 67 67 PHE H H 67 7.067 7.067 8.296 -1.229 18112 15281 1 20 . 1 1 68 68 TYR N N 68 119.370 119.370 120.675 -1.305 18112 15282 1 20 . 1 1 68 68 TYR C C 68 176.844 176.844 177.165 -0.321 18112 15283 1 20 . 1 1 68 68 TYR CA C 68 61.758 61.758 61.198 0.560 18112 15284 1 20 . 1 1 68 68 TYR H H 68 7.442 7.442 8.472 -1.030 18112 15285 1 20 . 1 1 69 69 TYR N N 69 116.047 116.047 119.829 -3.782 18112 15286 1 20 . 1 1 69 69 TYR HA H 69 4.086 4.086 3.911 0.175 18112 15287 1 20 . 1 1 69 69 TYR C C 69 180.328 180.328 177.570 2.758 18112 15288 1 20 . 1 1 69 69 TYR CA C 69 61.528 61.528 61.814 -0.286 18112 15289 1 20 . 1 1 69 69 TYR H H 69 9.127 9.127 8.220 0.907 18112 15290 1 20 . 1 1 70 70 ILE N N 70 124.738 124.738 118.782 5.956 18112 15291 1 20 . 1 1 70 70 ILE HA H 70 3.828 3.828 3.514 0.314 18112 15292 1 20 . 1 1 70 70 ILE C C 70 179.585 179.585 177.856 1.729 18112 15293 1 20 . 1 1 70 70 ILE CA C 70 65.787 65.787 63.763 2.024 18112 15294 1 20 . 1 1 70 70 ILE CB C 70 36.435 36.435 37.409 -0.974 18112 15295 1 20 . 1 1 70 70 ILE H H 70 8.631 8.631 8.284 0.347 18112 15296 1 20 . 1 1 71 71 GLN N N 71 117.940 117.940 119.215 -1.275 18112 15297 1 20 . 1 1 71 71 GLN HA H 71 3.826 3.826 3.416 0.410 18112 15298 1 20 . 1 1 71 71 GLN C C 71 178.192 178.192 178.197 -0.005 18112 15299 1 20 . 1 1 71 71 GLN CA C 71 57.779 57.779 58.154 -0.375 18112 15300 1 20 . 1 1 71 71 GLN H H 71 7.738 7.738 7.831 -0.093 18112 15301 1 20 . 1 1 72 72 MET N N 72 117.353 117.353 118.009 -0.656 18112 15302 1 20 . 1 1 72 72 MET HA H 72 4.112 4.112 4.113 -0.001 18112 15303 1 20 . 1 1 72 72 MET C C 72 177.203 177.203 178.284 -1.081 18112 15304 1 20 . 1 1 72 72 MET CA C 72 57.272 57.272 57.444 -0.172 18112 15305 1 20 . 1 1 72 72 MET H H 72 7.844 7.844 7.904 -0.060 18112 15306 1 20 . 1 1 73 73 GLU N N 73 117.858 117.858 119.951 -2.093 18112 15307 1 20 . 1 1 73 73 GLU HA H 73 3.572 3.572 3.267 0.305 18112 15308 1 20 . 1 1 73 73 GLU C C 73 177.344 177.344 178.608 -1.264 18112 15309 1 20 . 1 1 73 73 GLU CA C 73 60.324 60.324 59.200 1.124 18112 15310 1 20 . 1 1 73 73 GLU H H 73 7.503 7.503 7.592 -0.089 18112 15311 1 20 . 1 1 74 74 LYS N N 74 118.716 118.716 119.085 -0.369 18112 15312 1 20 . 1 1 74 74 LYS HA H 74 3.867 3.867 3.893 -0.026 18112 15313 1 20 . 1 1 74 74 LYS C C 74 180.077 180.077 179.533 0.544 18112 15314 1 20 . 1 1 74 74 LYS CA C 74 59.754 59.754 58.797 0.957 18112 15315 1 20 . 1 1 74 74 LYS H H 74 7.912 7.912 7.683 0.229 18112 15316 1 20 . 1 1 75 75 TYR N N 75 117.309 117.309 118.373 -1.064 18112 15317 1 20 . 1 1 75 75 TYR HA H 75 4.085 4.085 4.283 -0.198 18112 15318 1 20 . 1 1 75 75 TYR C C 75 178.874 178.874 178.208 0.666 18112 15319 1 20 . 1 1 75 75 TYR CA C 75 63.306 63.306 59.287 4.019 18112 15320 1 20 . 1 1 75 75 TYR H H 75 8.421 8.421 7.861 0.560 18112 15321 1 20 . 1 1 76 76 ALA N N 76 125.392 125.392 121.637 3.755 18112 15322 1 20 . 1 1 76 76 ALA HA H 76 4.221 4.221 4.065 0.156 18112 15323 1 20 . 1 1 76 76 ALA C C 76 178.850 178.850 179.149 -0.299 18112 15324 1 20 . 1 1 76 76 ALA CA C 76 56.280 56.280 55.481 0.799 18112 15325 1 20 . 1 1 76 76 ALA CB C 76 18.687 18.687 18.286 0.401 18112 15326 1 20 . 1 1 76 76 ALA H H 76 8.553 8.553 8.285 0.268 18112 15327 1 20 . 1 1 77 77 ARG N N 77 115.067 115.067 118.761 -3.694 18112 15328 1 20 . 1 1 77 77 ARG HA H 77 3.935 3.935 3.901 0.034 18112 15329 1 20 . 1 1 77 77 ARG C C 77 179.341 179.341 178.333 1.008 18112 15330 1 20 . 1 1 77 77 ARG CA C 77 60.499 60.499 59.551 0.948 18112 15331 1 20 . 1 1 77 77 ARG H H 77 8.471 8.471 8.195 0.276 18112 15332 1 20 . 1 1 78 78 GLN N N 78 120.107 120.107 119.256 0.851 18112 15333 1 20 . 1 1 78 78 GLN HA H 78 3.921 3.921 4.053 -0.132 18112 15334 1 20 . 1 1 78 78 GLN C C 78 177.289 177.289 178.176 -0.887 18112 15335 1 20 . 1 1 78 78 GLN CA C 78 58.619 58.619 58.971 -0.352 18112 15336 1 20 . 1 1 78 78 GLN CB C 78 27.752 27.752 28.619 -0.867 18112 15337 1 20 . 1 1 78 78 GLN H H 78 8.142 8.142 8.205 -0.063 18112 15338 1 20 . 1 1 79 79 ALA N N 79 120.809 120.809 122.607 -1.798 18112 15339 1 20 . 1 1 79 79 ALA HA H 79 4.308 4.308 4.147 0.161 18112 15340 1 20 . 1 1 79 79 ALA C C 79 179.924 179.924 179.891 0.033 18112 15341 1 20 . 1 1 79 79 ALA CA C 79 54.970 54.970 55.365 -0.395 18112 15342 1 20 . 1 1 79 79 ALA CB C 79 17.064 17.064 18.730 -1.665 18112 15343 1 20 . 1 1 79 79 ALA H H 79 7.811 7.811 8.013 -0.202 18112 15344 1 20 . 1 1 80 80 ILE N N 80 118.524 118.524 117.378 1.146 18112 15345 1 20 . 1 1 80 80 ILE HA H 80 3.894 3.894 3.770 0.124 18112 15346 1 20 . 1 1 80 80 ILE C C 80 181.268 181.268 177.654 3.614 18112 15347 1 20 . 1 1 80 80 ILE CA C 80 64.841 64.841 63.702 1.139 18112 15348 1 20 . 1 1 80 80 ILE CB C 80 37.125 37.125 36.477 0.648 18112 15349 1 20 . 1 1 80 80 ILE H H 80 7.837 7.837 8.080 -0.243 18112 15350 1 20 . 1 1 81 81 ASN N N 81 121.233 121.233 118.230 3.003 18112 15351 1 20 . 1 1 81 81 ASN HA H 81 4.398 4.398 4.549 -0.151 18112 15352 1 20 . 1 1 81 81 ASN C C 81 176.546 176.546 176.649 -0.103 18112 15353 1 20 . 1 1 81 81 ASN CA C 81 55.892 55.892 55.667 0.225 18112 15354 1 20 . 1 1 81 81 ASN CB C 81 37.603 37.603 39.510 -1.907 18112 15355 1 20 . 1 1 81 81 ASN H H 81 8.262 8.262 8.156 0.106 18112 15356 1 20 . 1 1 82 82 ASP N N 82 119.240 119.240 118.505 0.735 18112 15357 1 20 . 1 1 82 82 ASP HA H 82 4.666 4.666 4.625 0.041 18112 15358 1 20 . 1 1 82 82 ASP C C 82 176.767 176.767 176.587 0.180 18112 15359 1 20 . 1 1 82 82 ASP CA C 82 54.771 54.771 54.508 0.263 18112 15360 1 20 . 1 1 82 82 ASP CB C 82 40.121 40.121 42.013 -1.892 18112 15361 1 20 . 1 1 82 82 ASP H H 82 8.316 8.316 8.136 0.180 18112 15362 1 20 . 1 1 83 83 GLY N N 83 106.913 106.913 108.356 -1.443 18112 15363 1 20 . 1 1 83 83 GLY C C 83 174.601 174.601 173.798 0.803 18112 15364 1 20 . 1 1 83 83 GLY CA C 83 45.214 45.214 44.905 0.309 18112 15365 1 20 . 1 1 83 83 GLY H H 83 7.810 7.810 7.969 -0.159 18112 15366 1 20 . 1 1 84 84 VAL N N 84 122.981 122.981 121.600 1.381 18112 15367 1 20 . 1 1 84 84 VAL HA H 84 3.850 3.850 4.478 -0.628 18112 15368 1 20 . 1 1 84 84 VAL C C 84 177.265 177.265 175.742 1.523 18112 15369 1 20 . 1 1 84 84 VAL CA C 84 64.270 64.270 61.276 2.994 18112 15370 1 20 . 1 1 84 84 VAL CB C 84 30.471 30.471 33.894 -3.423 18112 15371 1 20 . 1 1 84 84 VAL H H 84 8.157 8.157 8.079 0.078 18112 15372 1 20 . 1 1 85 85 THR N N 85 115.232 115.232 116.886 -1.654 18112 15373 1 20 . 1 1 85 85 THR HA H 85 4.716 4.716 4.637 0.079 18112 15374 1 20 . 1 1 85 85 THR C C 85 174.489 174.489 174.694 -0.205 18112 15375 1 20 . 1 1 85 85 THR CA C 85 61.618 61.618 62.315 -0.697 18112 15376 1 20 . 1 1 85 85 THR CB C 85 70.081 70.081 69.475 0.606 18112 15377 1 20 . 1 1 85 85 THR H H 85 8.890 8.890 8.315 0.575 18112 15378 1 20 . 1 1 86 86 SER N N 86 117.009 117.009 118.337 -1.328 18112 15379 1 20 . 1 1 86 86 SER HA H 86 5.046 5.046 4.642 0.404 18112 15380 1 20 . 1 1 86 86 SER C C 86 174.473 174.473 175.080 -0.607 18112 15381 1 20 . 1 1 86 86 SER CA C 86 55.922 55.922 57.035 -1.113 18112 15382 1 20 . 1 1 86 86 SER CB C 86 64.385 64.385 64.214 0.171 18112 15383 1 20 . 1 1 86 86 SER H H 86 7.704 7.704 7.723 -0.019 18112 15384 1 20 . 1 1 87 87 THR N N 87 118.634 118.634 117.193 1.441 18112 15385 1 20 . 1 1 87 87 THR HA H 87 4.065 4.065 3.860 0.205 18112 15386 1 20 . 1 1 87 87 THR C C 87 176.047 176.047 175.425 0.622 18112 15387 1 20 . 1 1 87 87 THR CA C 87 64.983 64.983 64.594 0.389 18112 15388 1 20 . 1 1 87 87 THR CB C 87 68.045 68.045 68.421 -0.376 18112 15389 1 20 . 1 1 87 87 THR H H 87 8.711 8.711 8.472 0.239 18112 15390 1 20 . 1 1 88 88 GLU N N 88 117.889 117.889 117.906 -0.017 18112 15391 1 20 . 1 1 88 88 GLU HA H 88 3.881 3.881 4.098 -0.217 18112 15392 1 20 . 1 1 88 88 GLU C C 88 177.146 177.146 177.359 -0.213 18112 15393 1 20 . 1 1 88 88 GLU CA C 88 57.814 57.814 58.289 -0.475 18112 15394 1 20 . 1 1 88 88 GLU CB C 88 28.050 28.050 28.608 -0.558 18112 15395 1 20 . 1 1 88 88 GLU H H 88 8.152 8.152 8.676 -0.524 18112 15396 1 20 . 1 1 89 89 GLU N N 89 115.617 115.617 117.494 -1.877 18112 15397 1 20 . 1 1 89 89 GLU HA H 89 4.149 4.149 4.337 -0.188 18112 15398 1 20 . 1 1 89 89 GLU C C 89 176.192 176.192 177.414 -1.222 18112 15399 1 20 . 1 1 89 89 GLU CA C 89 56.133 56.133 56.297 -0.164 18112 15400 1 20 . 1 1 89 89 GLU CB C 89 29.415 29.415 29.951 -0.536 18112 15401 1 20 . 1 1 89 89 GLU H H 89 7.311 7.311 7.529 -0.218 18112 15402 1 20 . 1 1 90 90 LEU N N 90 120.870 120.870 116.947 3.923 18112 15403 1 20 . 1 1 90 90 LEU HA H 90 4.439 4.439 4.167 0.272 18112 15404 1 20 . 1 1 90 90 LEU C C 90 175.267 175.267 177.254 -1.987 18112 15405 1 20 . 1 1 90 90 LEU CA C 90 53.504 53.504 55.465 -1.961 18112 15406 1 20 . 1 1 90 90 LEU CB C 90 40.479 40.479 42.783 -2.304 18112 15407 1 20 . 1 1 90 90 LEU H H 90 7.311 7.311 7.572 -0.261 18112 15408 1 20 . 1 1 91 91 SER N N 91 118.376 118.376 112.003 6.373 18112 15409 1 20 . 1 1 91 91 SER HA H 91 4.747 4.747 4.530 0.217 18112 15410 1 20 . 1 1 91 91 SER C C 91 173.332 173.332 172.535 0.797 18112 15411 1 20 . 1 1 91 91 SER CA C 91 56.314 56.314 57.626 -1.312 18112 15412 1 20 . 1 1 91 91 SER CB C 91 64.615 64.615 65.305 -0.690 18112 15413 1 20 . 1 1 91 91 SER H H 91 8.221 8.221 7.766 0.455 18112 15414 1 20 . 1 1 92 92 ILE N N 92 122.247 122.247 116.619 5.628 18112 15415 1 20 . 1 1 92 92 ILE HA H 92 4.537 4.537 3.963 0.574 18112 15416 1 20 . 1 1 92 92 ILE C C 92 174.059 174.059 175.418 -1.359 18112 15417 1 20 . 1 1 92 92 ILE CA C 92 59.881 59.881 62.343 -2.462 18112 15418 1 20 . 1 1 92 92 ILE CB C 92 37.820 37.820 38.292 -0.472 18112 15419 1 20 . 1 1 92 92 ILE H H 92 8.570 8.570 8.475 0.095 18112 15420 1 20 . 1 1 93 93 THR N N 93 116.069 116.069 121.152 -5.083 18112 15421 1 20 . 1 1 93 93 THR HA H 93 4.580 4.580 4.277 0.303 18112 15422 1 20 . 1 1 93 93 THR C C 93 175.049 175.049 174.512 0.537 18112 15423 1 20 . 1 1 93 93 THR CA C 93 58.988 58.988 64.398 -5.410 18112 15424 1 20 . 1 1 93 93 THR CB C 93 71.362 71.362 68.558 2.804 18112 15425 1 20 . 1 1 93 93 THR H H 93 7.224 7.224 8.578 -1.354 18112 15426 1 20 . 1 1 94 94 ARG N N 94 116.595 116.595 128.383 -11.788 18112 15427 1 20 . 1 1 94 94 ARG HA H 94 3.077 3.077 4.575 -1.498 18112 15428 1 20 . 1 1 94 94 ARG C C 94 175.076 175.076 175.855 -0.779 18112 15429 1 20 . 1 1 94 94 ARG CA C 94 57.119 57.119 54.845 2.274 18112 15430 1 20 . 1 1 94 94 ARG CB C 94 27.838 27.838 30.672 -2.834 18112 15431 1 20 . 1 1 94 94 ARG H H 94 8.596 8.596 8.163 0.433 18112 15432 1 20 . 1 1 95 95 ASP N N 95 113.735 113.735 122.297 -8.562 18112 15433 1 20 . 1 1 95 95 ASP HA H 95 4.765 4.765 3.643 1.122 18112 15434 1 20 . 1 1 95 95 ASP C C 95 175.876 175.876 176.252 -0.376 18112 15435 1 20 . 1 1 95 95 ASP CA C 95 53.156 53.156 57.389 -4.234 18112 15436 1 20 . 1 1 95 95 ASP CB C 95 41.166 41.166 40.484 0.682 18112 15437 1 20 . 1 1 95 95 ASP H H 95 7.607 7.607 8.753 -1.146 18112 15438 1 20 . 1 1 96 96 CYS N N 96 116.012 116.012 115.502 0.510 18112 15439 1 20 . 1 1 96 96 CYS C C 96 174.361 174.361 176.053 -1.692 18112 15440 1 20 . 1 1 96 96 CYS CA C 96 56.562 56.562 60.468 -3.906 18112 15441 1 20 . 1 1 96 96 CYS CB C 96 29.416 29.416 28.393 1.023 18112 15442 1 20 . 1 1 96 96 CYS H H 96 7.094 7.094 7.684 -0.590 18112 15443 1 20 . 1 1 97 97 GLU N N 97 123.087 123.087 120.779 2.308 18112 15444 1 20 . 1 1 97 97 GLU C C 97 178.748 178.748 178.951 -0.203 18112 15445 1 20 . 1 1 97 97 GLU CA C 97 59.912 59.912 59.840 0.072 18112 15446 1 20 . 1 1 97 97 GLU CB C 97 29.195 29.195 29.157 0.038 18112 15447 1 20 . 1 1 97 97 GLU H H 97 9.003 9.003 8.470 0.533 18112 15448 1 20 . 1 1 98 98 LEU N N 98 120.942 120.942 120.284 0.658 18112 15449 1 20 . 1 1 98 98 LEU HA H 98 3.614 3.614 4.133 -0.519 18112 15450 1 20 . 1 1 98 98 LEU C C 98 177.796 177.796 178.938 -1.142 18112 15451 1 20 . 1 1 98 98 LEU CA C 98 58.090 58.090 57.265 0.825 18112 15452 1 20 . 1 1 98 98 LEU CB C 98 39.778 39.778 41.773 -1.995 18112 15453 1 20 . 1 1 98 98 LEU H H 98 8.656 8.656 7.723 0.933 18112 15454 1 20 . 1 1 99 99 TYR N N 99 118.313 118.313 118.775 -0.462 18112 15455 1 20 . 1 1 99 99 TYR C C 99 177.077 177.077 178.177 -1.100 18112 15456 1 20 . 1 1 99 99 TYR CA C 99 62.622 62.622 60.950 1.672 18112 15457 1 20 . 1 1 99 99 TYR CB C 99 38.742 38.742 37.441 1.301 18112 15458 1 20 . 1 1 99 99 TYR H H 99 7.522 7.522 7.814 -0.292 18112 15459 1 20 . 1 1 100 100 ARG N N 100 118.101 118.101 118.373 -0.272 18112 15460 1 20 . 1 1 100 100 ARG C C 100 178.616 178.616 178.709 -0.093 18112 15461 1 20 . 1 1 100 100 ARG CA C 100 59.915 59.915 59.776 0.139 18112 15462 1 20 . 1 1 100 100 ARG CB C 100 29.100 29.100 29.939 -0.838 18112 15463 1 20 . 1 1 100 100 ARG H H 100 8.243 8.243 8.416 -0.173 18112 15464 1 20 . 1 1 101 101 ALA N N 101 120.972 120.972 123.172 -2.200 18112 15465 1 20 . 1 1 101 101 ALA HA H 101 4.145 4.145 3.898 0.247 18112 15466 1 20 . 1 1 101 101 ALA C C 101 181.359 181.359 179.171 2.188 18112 15467 1 20 . 1 1 101 101 ALA CA C 101 55.057 55.057 54.934 0.123 18112 15468 1 20 . 1 1 101 101 ALA CB C 101 17.543 17.543 18.434 -0.891 18112 15469 1 20 . 1 1 101 101 ALA H H 101 8.352 8.352 7.837 0.515 18112 15470 1 20 . 1 1 102 102 LEU N N 102 115.683 115.683 119.108 -3.425 18112 15471 1 20 . 1 1 102 102 LEU HA H 102 4.333 4.333 3.778 0.555 18112 15472 1 20 . 1 1 102 102 LEU C C 102 178.583 178.583 179.335 -0.752 18112 15473 1 20 . 1 1 102 102 LEU CA C 102 57.634 57.634 58.259 -0.625 18112 15474 1 20 . 1 1 102 102 LEU CB C 102 41.716 41.716 41.634 0.082 18112 15475 1 20 . 1 1 102 102 LEU H H 102 7.960 7.960 8.407 -0.447 18112 15476 1 20 . 1 1 103 103 ASN N N 103 118.957 118.957 116.854 2.103 18112 15477 1 20 . 1 1 103 103 ASN C C 103 177.470 177.470 177.798 -0.328 18112 15478 1 20 . 1 1 103 103 ASN CA C 103 56.974 56.974 56.180 0.794 18112 15479 1 20 . 1 1 103 103 ASN CB C 103 38.140 38.140 38.248 -0.108 18112 15480 1 20 . 1 1 103 103 ASN H H 103 9.301 9.301 8.285 1.016 18112 15481 1 20 . 1 1 104 104 MET N N 104 113.763 113.763 120.642 -6.879 18112 15482 1 20 . 1 1 104 104 MET CA C 104 57.362 57.362 58.769 -1.407 18112 15483 1 20 . 1 1 104 104 MET CB C 104 31.895 31.895 32.712 -0.817 18112 15484 1 20 . 1 1 104 104 MET H H 104 8.332 8.332 8.015 0.317 18112 15485 1 20 . 1 1 105 105 HIS N N 105 116.024 116.024 117.973 -1.949 18112 15486 1 20 . 1 1 105 105 HIS HA H 105 3.764 3.764 4.464 -0.700 18112 15487 1 20 . 1 1 105 105 HIS C C 105 176.939 176.939 177.343 -0.404 18112 15488 1 20 . 1 1 105 105 HIS CA C 105 59.069 59.069 59.103 -0.034 18112 15489 1 20 . 1 1 105 105 HIS H H 105 7.156 7.156 7.796 -0.640 18112 15490 1 20 . 1 1 106 106 TYR N N 106 113.161 113.161 117.587 -4.426 18112 15491 1 20 . 1 1 106 106 TYR C C 106 173.767 173.767 177.305 -3.538 18112 15492 1 20 . 1 1 106 106 TYR CA C 106 58.488 58.488 61.398 -2.910 18112 15493 1 20 . 1 1 106 106 TYR CB C 106 38.225 38.225 39.038 -0.812 18112 15494 1 20 . 1 1 106 106 TYR H H 106 7.204 7.204 8.576 -1.372 18112 15495 1 20 . 1 1 107 107 ASN N N 107 118.875 118.875 114.456 4.419 18112 15496 1 20 . 1 1 107 107 ASN HA H 107 3.922 3.922 4.911 -0.989 18112 15497 1 20 . 1 1 107 107 ASN C C 107 175.815 175.815 175.049 0.766 18112 15498 1 20 . 1 1 107 107 ASN CA C 107 51.233 51.233 53.149 -1.916 18112 15499 1 20 . 1 1 107 107 ASN CB C 107 38.142 38.142 40.788 -2.646 18112 15500 1 20 . 1 1 107 107 ASN H H 107 8.127 8.127 8.192 -0.065 18112 15501 1 20 . 1 1 108 108 LYS N N 108 122.850 122.850 118.215 4.635 18112 15502 1 20 . 1 1 108 108 LYS HA H 108 3.954 3.954 4.474 -0.520 18112 15503 1 20 . 1 1 108 108 LYS C C 108 177.586 177.586 174.637 2.949 18112 15504 1 20 . 1 1 108 108 LYS CA C 108 59.749 59.749 57.122 2.627 18112 15505 1 20 . 1 1 108 108 LYS CB C 108 31.498 31.498 33.089 -1.591 18112 15506 1 20 . 1 1 108 108 LYS H H 108 7.772 7.772 7.971 -0.199 18112 15507 1 20 . 1 1 109 109 ALA N N 109 118.054 118.054 124.768 -6.714 18112 15508 1 20 . 1 1 109 109 ALA HA H 109 4.137 4.137 4.539 -0.402 18112 15509 1 20 . 1 1 109 109 ALA C C 109 177.889 177.889 176.135 1.754 18112 15510 1 20 . 1 1 109 109 ALA CA C 109 52.299 52.299 51.099 1.200 18112 15511 1 20 . 1 1 109 109 ALA CB C 109 17.787 17.787 18.246 -0.459 18112 15512 1 20 . 1 1 109 109 ALA H H 109 8.307 8.307 8.058 0.249 18112 15513 1 20 . 1 1 110 110 ASN N N 110 115.542 115.542 120.131 -4.589 18112 15514 1 20 . 1 1 110 110 ASN HA H 110 4.480 4.480 4.465 0.015 18112 15515 1 20 . 1 1 110 110 ASN C C 110 174.277 174.277 175.723 -1.446 18112 15516 1 20 . 1 1 110 110 ASN CA C 110 53.504 53.504 53.194 0.310 18112 15517 1 20 . 1 1 110 110 ASN CB C 110 37.283 37.283 38.995 -1.712 18112 15518 1 20 . 1 1 110 110 ASN H H 110 8.353 8.353 8.088 0.265 18112 15519 1 20 . 1 1 111 111 ASP N N 111 114.692 114.692 125.291 -10.599 18112 15520 1 20 . 1 1 111 111 ASP HA H 111 4.485 4.485 4.372 0.113 18112 15521 1 20 . 1 1 111 111 ASP C C 111 174.868 174.868 176.815 -1.947 18112 15522 1 20 . 1 1 111 111 ASP CA C 111 53.227 53.227 55.959 -2.732 18112 15523 1 20 . 1 1 111 111 ASP CB C 111 39.228 39.228 41.128 -1.900 18112 15524 1 20 . 1 1 111 111 ASP H H 111 8.297 8.297 8.528 -0.231 18112 15525 1 20 . 1 1 112 112 PHE N N 112 120.927 120.927 118.022 2.905 18112 15526 1 20 . 1 1 112 112 PHE HA H 112 4.752 4.752 4.507 0.245 18112 15527 1 20 . 1 1 112 112 PHE C C 112 174.633 174.633 176.062 -1.429 18112 15528 1 20 . 1 1 112 112 PHE CA C 112 56.346 56.346 56.914 -0.568 18112 15529 1 20 . 1 1 112 112 PHE H H 112 7.784 7.784 7.326 0.458 18112 15530 1 20 . 1 1 113 113 GLU N N 113 128.111 128.111 121.211 6.900 18112 15531 1 20 . 1 1 113 113 GLU HA H 113 4.011 4.011 4.408 -0.397 18112 15532 1 20 . 1 1 113 113 GLU C C 113 173.502 173.502 175.347 -1.845 18112 15533 1 20 . 1 1 113 113 GLU CA C 113 55.100 55.100 57.407 -2.307 18112 15534 1 20 . 1 1 113 113 GLU H H 113 7.752 7.752 8.694 -0.942 18112 15535 1 20 . 1 1 114 114 VAL N N 114 129.326 129.326 112.484 16.842 18112 15536 1 20 . 1 1 114 114 VAL HA H 114 3.241 3.241 4.276 -1.035 18112 15537 1 20 . 1 1 114 114 VAL CA C 114 60.838 60.838 60.068 0.770 18112 15538 1 20 . 1 1 114 114 VAL CB C 114 32.609 32.609 31.607 1.002 18112 15539 1 20 . 1 1 114 114 VAL H H 114 8.008 8.008 7.670 0.338 18112 15540 1 20 . 1 1 115 115 PRO HA H 115 4.429 4.429 4.379 0.050 18112 15541 1 20 . 1 1 115 115 PRO C C 115 177.421 177.421 177.721 -0.300 18112 15542 1 20 . 1 1 115 115 PRO CA C 115 61.882 61.882 63.137 -1.255 18112 15543 1 20 . 1 1 115 115 PRO CB C 115 30.974 30.974 32.575 -1.601 18112 15544 1 20 . 1 1 116 116 GLU N N 116 123.936 123.936 125.065 -1.129 18112 15545 1 20 . 1 1 116 116 GLU C C 116 179.034 179.034 178.561 0.473 18112 15546 1 20 . 1 1 116 116 GLU CA C 116 58.913 58.913 59.985 -1.072 18112 15547 1 20 . 1 1 116 116 GLU CB C 116 28.378 28.378 29.761 -1.383 18112 15548 1 20 . 1 1 116 116 GLU H H 116 8.757 8.757 8.709 0.048 18112 15549 1 20 . 1 1 117 117 ARG N N 117 116.943 116.943 118.009 -1.066 18112 15550 1 20 . 1 1 117 117 ARG C C 117 177.570 177.570 178.269 -0.699 18112 15551 1 20 . 1 1 117 117 ARG CA C 117 57.033 57.033 59.007 -1.974 18112 15552 1 20 . 1 1 117 117 ARG CB C 117 28.172 28.172 29.340 -1.168 18112 15553 1 20 . 1 1 117 117 ARG H H 117 8.733 8.733 8.191 0.542 18112 15554 1 20 . 1 1 118 118 PHE N N 118 117.528 117.528 115.964 1.564 18112 15555 1 20 . 1 1 118 118 PHE HA H 118 4.137 4.137 4.187 -0.050 18112 15556 1 20 . 1 1 118 118 PHE C C 118 176.992 176.992 177.500 -0.508 18112 15557 1 20 . 1 1 118 118 PHE CA C 118 61.627 61.627 58.767 2.860 18112 15558 1 20 . 1 1 118 118 PHE CB C 118 37.386 37.386 37.410 -0.024 18112 15559 1 20 . 1 1 118 118 PHE H H 118 7.606 7.606 7.454 0.152 18112 15560 1 20 . 1 1 119 119 LEU N N 119 118.483 118.483 120.060 -1.577 18112 15561 1 20 . 1 1 119 119 LEU HA H 119 3.684 3.684 4.221 -0.537 18112 15562 1 20 . 1 1 119 119 LEU C C 119 178.802 178.802 179.076 -0.274 18112 15563 1 20 . 1 1 119 119 LEU CA C 119 59.875 59.875 56.970 2.905 18112 15564 1 20 . 1 1 119 119 LEU CB C 119 39.453 39.453 40.731 -1.278 18112 15565 1 20 . 1 1 119 119 LEU H H 119 7.248 7.248 7.297 -0.049 18112 15566 1 20 . 1 1 120 120 GLU N N 120 117.870 117.870 121.038 -3.168 18112 15567 1 20 . 1 1 120 120 GLU C C 120 179.932 179.932 179.184 0.748 18112 15568 1 20 . 1 1 120 120 GLU CA C 120 59.150 59.150 59.062 0.088 18112 15569 1 20 . 1 1 120 120 GLU CB C 120 28.878 28.878 29.278 -0.400 18112 15570 1 20 . 1 1 120 120 GLU H H 120 7.423 7.423 8.127 -0.704 18112 15571 1 20 . 1 1 121 121 VAL N N 121 120.777 120.777 119.479 1.298 18112 15572 1 20 . 1 1 121 121 VAL HA H 121 3.545 3.545 3.825 -0.280 18112 15573 1 20 . 1 1 121 121 VAL C C 121 179.302 179.302 178.314 0.988 18112 15574 1 20 . 1 1 121 121 VAL CA C 121 66.875 66.875 66.415 0.460 18112 15575 1 20 . 1 1 121 121 VAL CB C 121 30.823 30.823 31.296 -0.473 18112 15576 1 20 . 1 1 121 121 VAL H H 121 8.313 8.313 8.091 0.222 18112 15577 1 20 . 1 1 122 122 ALA N N 122 127.029 127.029 122.398 4.631 18112 15578 1 20 . 1 1 122 122 ALA HA H 122 4.251 4.251 4.334 -0.083 18112 15579 1 20 . 1 1 122 122 ALA C C 122 178.366 178.366 179.791 -1.425 18112 15580 1 20 . 1 1 122 122 ALA CA C 122 54.748 54.748 55.307 -0.559 18112 15581 1 20 . 1 1 122 122 ALA CB C 122 16.565 16.565 18.605 -2.040 18112 15582 1 20 . 1 1 122 122 ALA H H 122 8.896 8.896 8.250 0.646 18112 15583 1 20 . 1 1 123 123 GLN N N 123 119.887 119.887 119.390 0.497 18112 15584 1 20 . 1 1 123 123 GLN C C 123 177.908 177.908 178.376 -0.468 18112 15585 1 20 . 1 1 123 123 GLN CA C 123 60.671 60.671 59.143 1.528 18112 15586 1 20 . 1 1 123 123 GLN H H 123 8.349 8.349 8.024 0.325 18112 15587 1 20 . 1 1 124 124 ILE N N 124 120.632 120.632 118.934 1.698 18112 15588 1 20 . 1 1 124 124 ILE HA H 124 3.651 3.651 3.721 -0.070 18112 15589 1 20 . 1 1 124 124 ILE C C 124 178.703 178.703 178.110 0.593 18112 15590 1 20 . 1 1 124 124 ILE CA C 124 65.945 65.945 65.261 0.684 18112 15591 1 20 . 1 1 124 124 ILE H H 124 8.204 8.204 8.209 -0.005 18112 15592 1 20 . 1 1 125 125 THR N N 125 115.084 115.084 116.056 -0.972 18112 15593 1 20 . 1 1 125 125 THR C C 125 175.568 175.568 176.373 -0.805 18112 15594 1 20 . 1 1 125 125 THR CA C 125 67.872 67.872 66.239 1.633 18112 15595 1 20 . 1 1 125 125 THR H H 125 8.399 8.399 8.188 0.211 18112 15596 1 20 . 1 1 126 126 LEU N N 126 125.011 125.011 123.436 1.575 18112 15597 1 20 . 1 1 126 126 LEU HA H 126 4.085 4.085 4.297 -0.212 18112 15598 1 20 . 1 1 126 126 LEU C C 126 178.559 178.559 178.181 0.378 18112 15599 1 20 . 1 1 126 126 LEU CA C 126 58.843 58.843 58.207 0.636 18112 15600 1 20 . 1 1 126 126 LEU CB C 126 41.421 41.421 41.762 -0.341 18112 15601 1 20 . 1 1 126 126 LEU H H 126 8.728 8.728 8.121 0.607 18112 15602 1 20 . 1 1 127 127 ARG N N 127 117.076 117.076 118.828 -1.752 18112 15603 1 20 . 1 1 127 127 ARG HA H 127 3.929 3.929 3.883 0.046 18112 15604 1 20 . 1 1 127 127 ARG C C 127 177.984 177.984 178.440 -0.456 18112 15605 1 20 . 1 1 127 127 ARG CA C 127 60.685 60.685 59.968 0.717 18112 15606 1 20 . 1 1 127 127 ARG CB C 127 28.079 28.079 30.006 -1.927 18112 15607 1 20 . 1 1 127 127 ARG H H 127 8.213 8.213 8.327 -0.114 18112 15608 1 20 . 1 1 128 128 GLU N N 128 118.617 118.617 119.600 -0.983 18112 15609 1 20 . 1 1 128 128 GLU HA H 128 4.147 4.147 4.023 0.124 18112 15610 1 20 . 1 1 128 128 GLU C C 128 181.150 181.150 178.829 2.321 18112 15611 1 20 . 1 1 128 128 GLU CA C 128 59.508 59.508 59.227 0.281 18112 15612 1 20 . 1 1 128 128 GLU H H 128 8.478 8.478 7.824 0.654 18112 15613 1 20 . 1 1 129 129 PHE N N 129 119.267 119.267 119.252 0.015 18112 15614 1 20 . 1 1 129 129 PHE HA H 129 4.104 4.104 4.147 -0.043 18112 15615 1 20 . 1 1 129 129 PHE C C 129 177.170 177.170 177.910 -0.740 18112 15616 1 20 . 1 1 129 129 PHE CA C 129 63.694 63.694 61.614 2.080 18112 15617 1 20 . 1 1 129 129 PHE H H 129 8.570 8.570 7.903 0.667 18112 15618 1 20 . 1 1 130 130 PHE N N 130 118.739 118.739 118.939 -0.200 18112 15619 1 20 . 1 1 130 130 PHE HA H 130 3.884 3.884 3.969 -0.085 18112 15620 1 20 . 1 1 130 130 PHE C C 130 175.860 175.860 177.286 -1.426 18112 15621 1 20 . 1 1 130 130 PHE CA C 130 62.819 62.819 62.035 0.784 18112 15622 1 20 . 1 1 130 130 PHE H H 130 8.740 8.740 8.830 -0.090 18112 15623 1 20 . 1 1 131 131 ASN N N 131 116.028 116.028 117.795 -1.767 18112 15624 1 20 . 1 1 131 131 ASN HA H 131 4.373 4.373 4.338 0.035 18112 15625 1 20 . 1 1 131 131 ASN C C 131 178.228 178.228 177.714 0.514 18112 15626 1 20 . 1 1 131 131 ASN CA C 131 55.150 55.150 56.471 -1.321 18112 15627 1 20 . 1 1 131 131 ASN H H 131 8.864 8.864 8.454 0.410 18112 15628 1 20 . 1 1 132 132 ALA N N 132 120.922 120.922 122.801 -1.879 18112 15629 1 20 . 1 1 132 132 ALA HA H 132 4.020 4.020 4.141 -0.121 18112 15630 1 20 . 1 1 132 132 ALA C C 132 178.515 178.515 179.943 -1.428 18112 15631 1 20 . 1 1 132 132 ALA CA C 132 54.924 54.924 54.836 0.088 18112 15632 1 20 . 1 1 132 132 ALA CB C 132 18.441 18.441 18.241 0.200 18112 15633 1 20 . 1 1 132 132 ALA H H 132 7.745 7.745 7.908 -0.163 18112 15634 1 20 . 1 1 133 133 ILE N N 133 118.200 118.200 120.365 -2.165 18112 15635 1 20 . 1 1 133 133 ILE HA H 133 3.235 3.235 3.995 -0.760 18112 15636 1 20 . 1 1 133 133 ILE C C 133 180.606 180.606 177.620 2.986 18112 15637 1 20 . 1 1 133 133 ILE CA C 133 65.215 65.215 65.260 -0.045 18112 15638 1 20 . 1 1 133 133 ILE CB C 133 38.291 38.291 38.139 0.152 18112 15639 1 20 . 1 1 133 133 ILE H H 133 7.999 7.999 8.094 -0.095 18112 15640 1 20 . 1 1 134 134 ILE N N 134 122.564 122.564 118.887 3.677 18112 15641 1 20 . 1 1 134 134 ILE HA H 134 3.788 3.788 3.760 0.028 18112 15642 1 20 . 1 1 134 134 ILE C C 134 177.215 177.215 177.351 -0.136 18112 15643 1 20 . 1 1 134 134 ILE CA C 134 63.584 63.584 63.376 0.208 18112 15644 1 20 . 1 1 134 134 ILE CB C 134 35.636 35.636 37.900 -2.264 18112 15645 1 20 . 1 1 134 134 ILE H H 134 8.670 8.670 7.888 0.782 18112 15646 1 20 . 1 1 135 135 ALA N N 135 119.989 119.989 120.534 -0.545 18112 15647 1 20 . 1 1 135 135 ALA HA H 135 4.357 4.357 4.119 0.238 18112 15648 1 20 . 1 1 135 135 ALA C C 135 177.786 177.786 178.326 -0.540 18112 15649 1 20 . 1 1 135 135 ALA CA C 135 51.521 51.521 54.264 -2.743 18112 15650 1 20 . 1 1 135 135 ALA CB C 135 18.839 18.839 19.439 -0.600 18112 15651 1 20 . 1 1 135 135 ALA H H 135 6.898 6.898 8.020 -1.122 18112 15652 1 20 . 1 1 136 136 GLY N N 136 107.682 107.682 102.988 4.694 18112 15653 1 20 . 1 1 136 136 GLY C C 136 176.324 176.324 174.805 1.519 18112 15654 1 20 . 1 1 136 136 GLY CA C 136 45.469 45.469 45.099 0.370 18112 15655 1 20 . 1 1 136 136 GLY H H 136 7.913 7.913 7.766 0.147 18112 15656 1 20 . 1 1 137 137 LYS N N 137 117.213 117.213 117.155 0.058 18112 15657 1 20 . 1 1 137 137 LYS HA H 137 4.004 4.004 4.175 -0.171 18112 15658 1 20 . 1 1 137 137 LYS C C 137 176.616 176.616 174.563 2.053 18112 15659 1 20 . 1 1 137 137 LYS CA C 137 57.499 57.499 58.074 -0.575 18112 15660 1 20 . 1 1 137 137 LYS CB C 137 30.927 30.927 30.432 0.495 18112 15661 1 20 . 1 1 137 137 LYS H H 137 8.312 8.312 8.571 -0.259 18112 15662 1 20 . 1 1 138 138 ASP N N 138 113.545 113.545 120.757 -7.212 18112 15663 1 20 . 1 1 138 138 ASP HA H 138 3.061 3.061 4.850 -1.789 18112 15664 1 20 . 1 1 138 138 ASP C C 138 174.698 174.698 174.720 -0.022 18112 15665 1 20 . 1 1 138 138 ASP CA C 138 53.694 53.694 53.631 0.063 18112 15666 1 20 . 1 1 138 138 ASP CB C 138 36.008 36.008 41.557 -5.549 18112 15667 1 20 . 1 1 138 138 ASP H H 138 8.465 8.465 7.557 0.908 18112 15668 1 20 . 1 1 139 139 VAL N N 139 115.191 115.191 125.092 -9.901 18112 15669 1 20 . 1 1 139 139 VAL HA H 139 3.886 3.886 4.388 -0.502 18112 15670 1 20 . 1 1 139 139 VAL C C 139 175.889 175.889 174.481 1.408 18112 15671 1 20 . 1 1 139 139 VAL CA C 139 62.793 62.793 61.007 1.786 18112 15672 1 20 . 1 1 139 139 VAL CB C 139 30.662 30.662 32.277 -1.615 18112 15673 1 20 . 1 1 139 139 VAL H H 139 6.610 6.610 8.935 -2.325 18112 15674 1 20 . 1 1 140 140 ASP N N 140 123.363 123.363 120.773 2.590 18112 15675 1 20 . 1 1 140 140 ASP C C 140 175.234 175.234 175.023 0.211 18112 15676 1 20 . 1 1 140 140 ASP CA C 140 50.221 50.221 55.297 -5.076 18112 15677 1 20 . 1 1 140 140 ASP CB C 140 42.254 42.254 40.686 1.568 18112 15678 1 20 . 1 1 140 140 ASP H H 140 7.553 7.553 8.296 -0.743 18112 15679 1 20 . 1 1 141 141 PRO HA H 141 4.682 4.682 4.477 0.205 18112 15680 1 20 . 1 1 141 141 PRO C C 141 178.678 178.678 177.601 1.077 18112 15681 1 20 . 1 1 141 141 PRO CA C 141 64.532 64.532 64.198 0.334 18112 15682 1 20 . 1 1 141 141 PRO CB C 141 31.331 31.331 31.897 -0.566 18112 15683 1 20 . 1 1 142 142 SER N N 142 114.421 114.421 114.278 0.143 18112 15684 1 20 . 1 1 142 142 SER HA H 142 4.565 4.565 4.380 0.185 18112 15685 1 20 . 1 1 142 142 SER C C 142 176.524 176.524 175.881 0.643 18112 15686 1 20 . 1 1 142 142 SER CA C 142 58.711 58.711 59.520 -0.809 18112 15687 1 20 . 1 1 142 142 SER CB C 142 62.783 62.783 62.539 0.244 18112 15688 1 20 . 1 1 142 142 SER H H 142 8.703 8.703 8.316 0.387 18112 15689 1 20 . 1 1 143 143 TRP N N 143 123.598 123.598 122.999 0.599 18112 15690 1 20 . 1 1 143 143 TRP HA H 143 4.136 4.136 4.160 -0.024 18112 15691 1 20 . 1 1 143 143 TRP C C 143 177.113 177.113 178.044 -0.931 18112 15692 1 20 . 1 1 143 143 TRP CA C 143 59.803 59.803 62.306 -2.502 18112 15693 1 20 . 1 1 143 143 TRP CB C 143 26.364 26.364 29.303 -2.939 18112 15694 1 20 . 1 1 143 143 TRP H H 143 8.374 8.374 7.705 0.669 18112 15695 1 20 . 1 1 144 144 LYS N N 144 119.293 119.293 116.955 2.338 18112 15696 1 20 . 1 1 144 144 LYS HA H 144 2.719 2.719 3.828 -1.109 18112 15697 1 20 . 1 1 144 144 LYS C C 144 177.243 177.243 178.318 -1.075 18112 15698 1 20 . 1 1 144 144 LYS CA C 144 58.851 58.851 59.605 -0.754 18112 15699 1 20 . 1 1 144 144 LYS CB C 144 29.373 29.373 31.845 -2.472 18112 15700 1 20 . 1 1 144 144 LYS H H 144 7.196 7.196 8.562 -1.366 18112 15701 1 20 . 1 1 145 145 LYS N N 145 116.440 116.440 120.303 -3.863 18112 15702 1 20 . 1 1 145 145 LYS HA H 145 3.490 3.490 4.158 -0.668 18112 15703 1 20 . 1 1 145 145 LYS C C 145 179.149 179.149 178.683 0.466 18112 15704 1 20 . 1 1 145 145 LYS CA C 145 59.271 59.271 59.720 -0.449 18112 15705 1 20 . 1 1 145 145 LYS CB C 145 30.521 30.521 32.260 -1.739 18112 15706 1 20 . 1 1 145 145 LYS H H 145 7.389 7.389 8.184 -0.795 18112 15707 1 20 . 1 1 146 146 ALA N N 146 118.582 118.582 122.077 -3.495 18112 15708 1 20 . 1 1 146 146 ALA HA H 146 3.932 3.932 4.018 -0.086 18112 15709 1 20 . 1 1 146 146 ALA C C 146 179.968 179.968 179.516 0.452 18112 15710 1 20 . 1 1 146 146 ALA CA C 146 54.241 54.241 55.118 -0.877 18112 15711 1 20 . 1 1 146 146 ALA CB C 146 17.689 17.689 18.234 -0.545 18112 15712 1 20 . 1 1 146 146 ALA H H 146 7.112 7.112 8.045 -0.933 18112 15713 1 20 . 1 1 147 147 ILE N N 147 118.537 118.537 119.110 -0.573 18112 15714 1 20 . 1 1 147 147 ILE HA H 147 3.642 3.642 3.399 0.243 18112 15715 1 20 . 1 1 147 147 ILE C C 147 178.919 178.919 178.082 0.837 18112 15716 1 20 . 1 1 147 147 ILE CA C 147 64.418 64.418 63.660 0.758 18112 15717 1 20 . 1 1 147 147 ILE CB C 147 36.519 36.519 36.092 0.427 18112 15718 1 20 . 1 1 147 147 ILE H H 147 6.734 6.734 7.693 -0.959 18112 15719 1 20 . 1 1 148 148 TYR N N 148 121.033 121.033 118.051 2.982 18112 15720 1 20 . 1 1 148 148 TYR HA H 148 4.489 4.489 3.775 0.714 18112 15721 1 20 . 1 1 148 148 TYR C C 148 178.348 178.348 178.175 0.173 18112 15722 1 20 . 1 1 148 148 TYR CA C 148 57.389 57.389 59.564 -2.175 18112 15723 1 20 . 1 1 148 148 TYR CB C 148 35.280 35.280 36.585 -1.305 18112 15724 1 20 . 1 1 148 148 TYR H H 148 8.126 8.126 7.781 0.345 18112 15725 1 20 . 1 1 149 149 LYS N N 149 114.484 114.484 119.949 -5.465 18112 15726 1 20 . 1 1 149 149 LYS C C 149 178.051 178.051 178.817 -0.766 18112 15727 1 20 . 1 1 149 149 LYS CA C 149 59.036 59.036 60.006 -0.970 18112 15728 1 20 . 1 1 149 149 LYS CB C 149 31.575 31.575 32.631 -1.056 18112 15729 1 20 . 1 1 149 149 LYS H H 149 7.364 7.364 8.011 -0.648 18112 15730 1 20 . 1 1 150 150 VAL N N 150 117.812 117.812 115.241 2.571 18112 15731 1 20 . 1 1 150 150 VAL HA H 150 3.770 3.770 3.822 -0.052 18112 15732 1 20 . 1 1 150 150 VAL C C 150 178.786 178.786 177.060 1.726 18112 15733 1 20 . 1 1 150 150 VAL CA C 150 65.070 65.070 65.727 -0.657 18112 15734 1 20 . 1 1 150 150 VAL CB C 150 29.515 29.515 31.701 -2.186 18112 15735 1 20 . 1 1 150 150 VAL H H 150 7.254 7.254 7.839 -0.585 18112 15736 1 20 . 1 1 151 151 ILE N N 151 117.884 117.884 114.457 3.427 18112 15737 1 20 . 1 1 151 151 ILE C C 151 180.539 180.539 177.491 3.048 18112 15738 1 20 . 1 1 151 151 ILE CA C 151 61.490 61.490 63.435 -1.945 18112 15739 1 20 . 1 1 151 151 ILE CB C 151 33.994 33.994 38.106 -4.112 18112 15740 1 20 . 1 1 151 151 ILE H H 151 8.154 8.154 7.830 0.324 18112 15741 1 20 . 1 1 152 152 CYS N N 152 118.649 118.649 120.631 -1.982 18112 15742 1 20 . 1 1 152 152 CYS HA H 152 4.153 4.153 4.623 -0.470 18112 15743 1 20 . 1 1 152 152 CYS C C 152 174.888 174.888 176.066 -1.178 18112 15744 1 20 . 1 1 152 152 CYS CA C 152 61.052 61.052 59.865 1.187 18112 15745 1 20 . 1 1 152 152 CYS CB C 152 36.364 36.364 28.992 7.372 18112 15746 1 20 . 1 1 152 152 CYS H H 152 8.711 8.711 7.947 0.764 18112 15747 1 20 . 1 1 153 153 LYS N N 153 118.498 118.498 120.802 -2.304 18112 15748 1 20 . 1 1 153 153 LYS C C 153 177.389 177.389 175.655 1.734 18112 15749 1 20 . 1 1 153 153 LYS CA C 153 56.243 56.243 55.650 0.593 18112 15750 1 20 . 1 1 153 153 LYS CB C 153 31.343 31.343 29.934 1.409 18112 15751 1 20 . 1 1 153 153 LYS H H 153 6.782 6.782 8.074 -1.292 18112 15752 1 20 . 1 1 154 154 LEU N N 154 117.318 117.318 119.629 -2.311 18112 15753 1 20 . 1 1 154 154 LEU HA H 154 4.576 4.576 4.485 0.091 18112 15754 1 20 . 1 1 154 154 LEU C C 154 177.161 177.161 177.529 -0.368 18112 15755 1 20 . 1 1 154 154 LEU CA C 154 53.782 53.782 55.619 -1.837 18112 15756 1 20 . 1 1 154 154 LEU CB C 154 40.881 40.881 43.296 -2.415 18112 15757 1 20 . 1 1 154 154 LEU H H 154 7.616 7.616 7.837 -0.221 18112 15758 1 20 . 1 1 155 155 ASP N N 155 121.564 121.564 117.647 3.917 18112 15759 1 20 . 1 1 155 155 ASP C C 155 177.094 177.094 175.445 1.649 18112 15760 1 20 . 1 1 155 155 ASP CA C 155 55.732 55.732 53.228 2.503 18112 15761 1 20 . 1 1 155 155 ASP CB C 155 40.139 40.139 43.135 -2.996 18112 15762 1 20 . 1 1 155 155 ASP H H 155 7.582 7.582 8.336 -0.754 18112 15763 1 20 . 1 1 156 156 SER N N 156 117.352 117.352 114.190 3.162 18112 15764 1 20 . 1 1 156 156 SER HA H 156 4.818 4.818 4.622 0.196 18112 15765 1 20 . 1 1 156 156 SER C C 156 173.409 173.409 174.549 -1.140 18112 15766 1 20 . 1 1 156 156 SER CA C 156 57.073 57.073 57.708 -0.635 18112 15767 1 20 . 1 1 156 156 SER CB C 156 65.150 65.150 64.228 0.922 18112 15768 1 20 . 1 1 156 156 SER H H 156 8.846 8.846 8.215 0.631 18112 15769 1 20 . 1 1 157 157 GLU N N 157 120.688 120.688 121.588 -0.900 18112 15770 1 20 . 1 1 157 157 GLU HA H 157 4.038 4.038 4.278 -0.240 18112 15771 1 20 . 1 1 157 157 GLU C C 157 176.332 176.332 176.612 -0.280 18112 15772 1 20 . 1 1 157 157 GLU CA C 157 56.464 56.464 56.356 0.108 18112 15773 1 20 . 1 1 157 157 GLU CB C 157 29.206 29.206 29.860 -0.654 18112 15774 1 20 . 1 1 157 157 GLU H H 157 8.356 8.356 8.373 -0.017 18112 15775 1 20 . 1 1 158 158 VAL N N 158 126.906 126.906 112.411 14.495 18112 15776 1 20 . 1 1 158 158 VAL HA H 158 3.449 3.449 4.448 -0.999 18112 15777 1 20 . 1 1 158 158 VAL C C 158 176.382 176.382 173.404 2.978 18112 15778 1 20 . 1 1 158 158 VAL CA C 158 59.584 59.584 57.904 1.680 18112 15779 1 20 . 1 1 158 158 VAL CB C 158 31.160 31.160 34.040 -2.880 18112 15780 1 20 . 1 1 158 158 VAL H H 158 8.561 8.561 7.544 1.017 18112 15781 1 20 . 1 1 159 159 PRO HA H 159 4.403 4.403 4.224 0.179 18112 15782 1 20 . 1 1 159 159 PRO C C 159 176.757 176.757 175.502 1.255 18112 15783 1 20 . 1 1 159 159 PRO CA C 159 63.845 63.845 62.687 1.158 18112 15784 1 20 . 1 1 159 159 PRO CB C 159 32.106 32.106 31.040 1.066 18112 15785 1 20 . 1 1 160 160 GLU N N 160 122.904 122.904 122.402 0.502 18112 15786 1 20 . 1 1 160 160 GLU HA H 160 4.008 4.008 3.892 0.116 18112 15787 1 20 . 1 1 160 160 GLU C C 160 179.132 179.132 175.710 3.422 18112 15788 1 20 . 1 1 160 160 GLU CA C 160 59.407 59.407 58.795 0.612 18112 15789 1 20 . 1 1 160 160 GLU CB C 160 28.991 28.991 30.362 -1.371 18112 15790 1 20 . 1 1 160 160 GLU H H 160 8.650 8.650 8.435 0.215 18112 15791 1 20 . 1 1 161 161 ILE N N 161 119.782 119.782 117.513 2.269 18112 15792 1 20 . 1 1 161 161 ILE HA H 161 4.146 4.146 4.294 -0.148 18112 15793 1 20 . 1 1 161 161 ILE C C 161 176.176 176.176 174.927 1.249 18112 15794 1 20 . 1 1 161 161 ILE CA C 161 62.034 62.034 60.267 1.768 18112 15795 1 20 . 1 1 161 161 ILE CB C 161 37.113 37.113 38.981 -1.868 18112 15796 1 20 . 1 1 161 161 ILE H H 161 8.448 8.448 7.537 0.911 18112 15797 1 20 . 1 1 162 162 PHE N N 162 117.594 117.594 124.585 -6.991 18112 15798 1 20 . 1 1 162 162 PHE C C 162 176.115 176.115 177.382 -1.267 18112 15799 1 20 . 1 1 162 162 PHE CA C 162 61.009 61.009 60.104 0.905 18112 15800 1 20 . 1 1 162 162 PHE CB C 162 38.394 38.394 38.801 -0.407 18112 15801 1 20 . 1 1 162 162 PHE H H 162 8.145 8.145 8.833 -0.688 18112 15802 1 20 . 1 1 163 163 LYS N N 163 116.083 116.083 120.202 -4.119 18112 15803 1 20 . 1 1 163 163 LYS C C 163 178.196 178.196 176.590 1.606 18112 15804 1 20 . 1 1 163 163 LYS CA C 163 58.136 58.136 58.216 -0.080 18112 15805 1 20 . 1 1 163 163 LYS CB C 163 31.694 31.694 32.759 -1.065 18112 15806 1 20 . 1 1 163 163 LYS H H 163 8.232 8.232 8.074 0.158 18112 15807 1 20 . 1 1 164 164 SER N N 164 113.680 113.680 108.949 4.731 18112 15808 1 20 . 1 1 164 164 SER CA C 164 55.205 55.205 56.700 -1.495 18112 15809 1 20 . 1 1 164 164 SER CB C 164 63.265 63.265 64.829 -1.565 18112 15810 1 20 . 1 1 164 164 SER H H 164 7.708 7.708 7.436 0.272 18112 15811 1 20 . 1 1 165 165 PRO HA H 165 4.580 4.580 4.566 0.014 18112 15812 1 20 . 1 1 165 165 PRO C C 165 177.541 177.541 176.497 1.044 18112 15813 1 20 . 1 1 165 165 PRO CA C 165 63.950 63.950 63.456 0.494 18112 15814 1 20 . 1 1 165 165 PRO CB C 165 30.686 30.686 31.710 -1.024 18112 15815 1 20 . 1 1 166 166 ASN N N 166 116.304 116.304 115.383 0.921 18112 15816 1 20 . 1 1 166 166 ASN HA H 166 5.029 5.029 4.710 0.319 18112 15817 1 20 . 1 1 166 166 ASN C C 166 175.811 175.811 175.774 0.037 18112 15818 1 20 . 1 1 166 166 ASN CA C 166 51.962 51.962 53.496 -1.534 18112 15819 1 20 . 1 1 166 166 ASN CB C 166 37.915 37.915 38.986 -1.071 18112 15820 1 20 . 1 1 166 166 ASN H H 166 8.216 8.216 8.071 0.145 18112 15821 1 20 . 1 1 167 167 CYS N N 167 116.078 116.078 120.005 -3.927 18112 15822 1 20 . 1 1 167 167 CYS HA H 167 4.011 4.011 4.298 -0.287 18112 15823 1 20 . 1 1 167 167 CYS C C 167 175.057 175.057 176.056 -0.999 18112 15824 1 20 . 1 1 167 167 CYS CA C 167 59.816 59.816 62.027 -2.211 18112 15825 1 20 . 1 1 167 167 CYS CB C 167 27.446 27.446 28.230 -0.784 18112 15826 1 20 . 1 1 167 167 CYS H H 167 7.246 7.246 7.598 -0.352 18112 15827 1 20 . 1 1 168 168 LEU N N 168 120.082 120.082 119.792 0.290 18112 15828 1 20 . 1 1 168 168 LEU HA H 168 3.880 3.880 4.320 -0.440 18112 15829 1 20 . 1 1 168 168 LEU C C 168 178.541 178.541 178.357 0.184 18112 15830 1 20 . 1 1 168 168 LEU CA C 168 57.734 57.734 57.418 0.316 18112 15831 1 20 . 1 1 168 168 LEU CB C 168 38.825 38.825 40.848 -2.023 18112 15832 1 20 . 1 1 168 168 LEU H H 168 8.451 8.451 7.348 1.103 18112 15833 1 20 . 1 1 169 169 GLN N N 169 116.700 116.700 119.500 -2.800 18112 15834 1 20 . 1 1 169 169 GLN HA H 169 4.064 4.064 3.964 0.100 18112 15835 1 20 . 1 1 169 169 GLN C C 169 177.378 177.378 177.418 -0.040 18112 15836 1 20 . 1 1 169 169 GLN CA C 169 57.675 57.675 58.912 -1.237 18112 15837 1 20 . 1 1 169 169 GLN CB C 169 27.710 27.710 28.076 -0.366 18112 15838 1 20 . 1 1 169 169 GLN H H 169 7.665 7.665 8.252 -0.587 18112 15839 1 20 . 1 1 170 170 GLU N N 170 116.701 116.701 116.413 0.288 18112 15840 1 20 . 1 1 170 170 GLU HA H 170 4.214 4.214 4.201 0.013 18112 15841 1 20 . 1 1 170 170 GLU C C 170 177.730 177.730 178.257 -0.527 18112 15842 1 20 . 1 1 170 170 GLU CA C 170 56.899 56.899 57.577 -0.678 18112 15843 1 20 . 1 1 170 170 GLU H H 170 7.405 7.405 7.768 -0.363 18112 15844 1 20 . 1 1 171 171 LEU N N 171 118.021 118.021 116.585 1.436 18112 15845 1 20 . 1 1 171 171 LEU HA H 171 4.209 4.209 4.245 -0.036 18112 15846 1 20 . 1 1 171 171 LEU C C 171 177.005 177.005 178.082 -1.077 18112 15847 1 20 . 1 1 171 171 LEU CA C 171 55.870 55.870 56.050 -0.180 18112 15848 1 20 . 1 1 171 171 LEU CB C 171 43.680 43.680 42.505 1.175 18112 15849 1 20 . 1 1 171 171 LEU H H 171 7.823 7.823 7.383 0.440 18112 15850 1 20 . 1 1 172 172 LEU N N 172 117.580 117.580 117.954 -0.374 18112 15851 1 20 . 1 1 172 172 LEU HA H 172 4.571 4.571 4.392 0.179 18112 15852 1 20 . 1 1 172 172 LEU C C 172 176.411 176.411 176.038 0.373 18112 15853 1 20 . 1 1 172 172 LEU CA C 172 53.972 53.972 54.037 -0.065 18112 15854 1 20 . 1 1 172 172 LEU CB C 172 40.483 40.483 40.575 -0.092 18112 15855 1 20 . 1 1 172 172 LEU H H 172 7.306 7.306 7.530 -0.224 18112 15856 1 20 . 1 1 173 173 HIS N N 173 123.310 123.310 126.033 -2.723 18112 15857 1 20 . 1 1 173 173 HIS C C 173 179.022 179.022 174.221 4.801 18112 15858 1 20 . 1 1 173 173 HIS CA C 173 56.693 56.693 55.503 1.190 18112 15859 1 20 . 1 1 173 173 HIS CB C 173 29.371 29.371 29.057 0.314 18112 15860 1 20 . 1 1 173 173 HIS H H 173 8.028 8.028 8.701 -0.673 18112 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 144 4.062 0.449 4.052 18112 2 1 1 "Average Difference" HA 104 0.417 0.021 0.419 18112 3 1 1 "Average Difference" C 141 1.398 -0.001 1.403 18112 4 1 1 "Average Difference" CA 148 1.962 0.242 1.954 18112 5 1 1 "Average Difference" CB 112 2.122 0.583 2.049 18112 6 1 1 "Average Difference" HN 144 0.637 -0.001 0.640 18112 7 1 2 "Average Difference" N 144 3.926 0.468 3.912 18112 8 1 2 "Average Difference" HA 104 0.411 0.073 0.407 18112 9 1 2 "Average Difference" C 141 1.330 -0.039 1.334 18112 10 1 2 "Average Difference" CA 148 1.771 0.210 1.764 18112 11 1 2 "Average Difference" CB 112 2.007 0.642 1.910 18112 12 1 2 "Average Difference" HN 144 0.701 0.042 0.702 18112 13 1 3 "Average Difference" N 144 4.000 0.277 4.005 18112 14 1 3 "Average Difference" HA 104 0.460 0.034 0.461 18112 15 1 3 "Average Difference" C 141 1.409 -0.014 1.414 18112 16 1 3 "Average Difference" CA 148 1.845 0.315 1.824 18112 17 1 3 "Average Difference" CB 112 2.060 0.580 1.985 18112 18 1 3 "Average Difference" HN 144 0.668 0.026 0.670 18112 19 1 4 "Average Difference" N 144 3.881 0.355 3.879 18112 20 1 4 "Average Difference" HA 104 0.421 0.000 0.423 18112 21 1 4 "Average Difference" C 141 1.279 0.060 1.282 18112 22 1 4 "Average Difference" CA 148 1.776 0.372 1.742 18112 23 1 4 "Average Difference" CB 112 2.028 0.500 1.974 18112 24 1 4 "Average Difference" HN 144 0.635 0.005 0.638 18112 25 1 5 "Average Difference" N 144 4.120 0.238 4.127 18112 26 1 5 "Average Difference" HA 104 0.409 0.016 0.411 18112 27 1 5 "Average Difference" C 141 1.371 -0.007 1.375 18112 28 1 5 "Average Difference" CA 148 1.810 0.295 1.792 18112 29 1 5 "Average Difference" CB 112 2.128 0.678 2.026 18112 30 1 5 "Average Difference" HN 144 0.663 0.021 0.665 18112 31 1 6 "Average Difference" N 144 3.624 0.144 3.633 18112 32 1 6 "Average Difference" HA 104 0.405 -0.009 0.407 18112 33 1 6 "Average Difference" C 141 1.291 0.000 1.296 18112 34 1 6 "Average Difference" CA 148 1.836 0.282 1.820 18112 35 1 6 "Average Difference" CB 112 2.060 0.552 1.994 18112 36 1 6 "Average Difference" HN 144 0.658 -0.019 0.660 18112 37 1 7 "Average Difference" N 144 3.948 0.228 3.955 18112 38 1 7 "Average Difference" HA 104 0.450 0.002 0.452 18112 39 1 7 "Average Difference" C 141 1.392 -0.017 1.397 18112 40 1 7 "Average Difference" CA 148 1.746 0.276 1.730 18112 41 1 7 "Average Difference" CB 112 2.030 0.491 1.979 18112 42 1 7 "Average Difference" HN 144 0.651 -0.006 0.653 18112 43 1 8 "Average Difference" N 144 4.187 0.292 4.192 18112 44 1 8 "Average Difference" HA 104 0.418 0.041 0.418 18112 45 1 8 "Average Difference" C 141 1.334 0.032 1.339 18112 46 1 8 "Average Difference" CA 148 1.920 0.351 1.894 18112 47 1 8 "Average Difference" CB 112 2.015 0.584 1.938 18112 48 1 8 "Average Difference" HN 144 0.648 0.028 0.650 18112 49 1 9 "Average Difference" N 144 3.788 0.712 3.734 18112 50 1 9 "Average Difference" HA 104 0.508 0.009 0.510 18112 51 1 9 "Average Difference" C 141 1.349 0.003 1.354 18112 52 1 9 "Average Difference" CA 148 1.796 0.149 1.796 18112 53 1 9 "Average Difference" CB 112 2.035 0.513 1.978 18112 54 1 9 "Average Difference" HN 144 0.673 0.005 0.675 18112 55 1 10 "Average Difference" N 144 3.743 0.319 3.742 18112 56 1 10 "Average Difference" HA 104 0.411 0.046 0.411 18112 57 1 10 "Average Difference" C 141 1.451 -0.092 1.453 18112 58 1 10 "Average Difference" CA 148 1.737 0.171 1.734 18112 59 1 10 "Average Difference" CB 112 2.122 0.604 2.044 18112 60 1 10 "Average Difference" HN 144 0.634 0.032 0.635 18112 61 1 11 "Average Difference" N 144 3.940 0.207 3.948 18112 62 1 11 "Average Difference" HA 104 0.432 0.014 0.434 18112 63 1 11 "Average Difference" C 141 1.420 -0.015 1.425 18112 64 1 11 "Average Difference" CA 148 1.741 0.254 1.729 18112 65 1 11 "Average Difference" CB 112 2.048 0.476 2.001 18112 66 1 11 "Average Difference" HN 144 0.649 0.000 0.652 18112 67 1 12 "Average Difference" N 144 3.907 0.297 3.910 18112 68 1 12 "Average Difference" HA 104 0.497 0.009 0.500 18112 69 1 12 "Average Difference" C 141 1.382 0.029 1.387 18112 70 1 12 "Average Difference" CA 148 1.782 0.314 1.760 18112 71 1 12 "Average Difference" CB 112 2.063 0.503 2.010 18112 72 1 12 "Average Difference" HN 144 0.629 0.027 0.631 18112 73 1 13 "Average Difference" N 144 3.623 0.119 3.633 18112 74 1 13 "Average Difference" HA 104 0.407 0.013 0.409 18112 75 1 13 "Average Difference" C 141 1.370 0.074 1.373 18112 76 1 13 "Average Difference" CA 148 1.725 0.264 1.710 18112 77 1 13 "Average Difference" CB 112 2.071 0.596 1.992 18112 78 1 13 "Average Difference" HN 144 0.642 -0.002 0.644 18112 79 1 14 "Average Difference" N 144 3.529 0.383 3.520 18112 80 1 14 "Average Difference" HA 104 0.434 0.030 0.435 18112 81 1 14 "Average Difference" C 141 1.360 0.036 1.364 18112 82 1 14 "Average Difference" CA 148 1.806 0.155 1.805 18112 83 1 14 "Average Difference" CB 112 2.149 0.579 2.079 18112 84 1 14 "Average Difference" HN 144 0.616 0.034 0.617 18112 85 1 15 "Average Difference" N 144 3.791 0.267 3.795 18112 86 1 15 "Average Difference" HA 104 0.456 0.043 0.456 18112 87 1 15 "Average Difference" C 141 1.371 -0.008 1.376 18112 88 1 15 "Average Difference" CA 148 1.746 0.347 1.717 18112 89 1 15 "Average Difference" CB 112 2.117 0.585 2.044 18112 90 1 15 "Average Difference" HN 144 0.693 0.019 0.695 18112 91 1 16 "Average Difference" N 144 4.073 0.335 4.073 18112 92 1 16 "Average Difference" HA 104 0.436 0.013 0.438 18112 93 1 16 "Average Difference" C 141 1.343 -0.023 1.348 18112 94 1 16 "Average Difference" CA 148 1.806 0.302 1.786 18112 95 1 16 "Average Difference" CB 112 2.017 0.360 1.993 18112 96 1 16 "Average Difference" HN 144 0.677 0.012 0.680 18112 97 1 17 "Average Difference" N 144 3.927 0.318 3.928 18112 98 1 17 "Average Difference" HA 104 0.415 0.019 0.417 18112 99 1 17 "Average Difference" C 141 1.380 0.104 1.381 18112 100 1 17 "Average Difference" CA 148 1.772 0.253 1.760 18112 101 1 17 "Average Difference" CB 112 2.120 0.557 2.055 18112 102 1 17 "Average Difference" HN 144 0.608 -0.000 0.610 18112 103 1 18 "Average Difference" N 144 3.383 0.374 3.374 18112 104 1 18 "Average Difference" HA 104 0.456 0.018 0.458 18112 105 1 18 "Average Difference" C 141 1.286 -0.075 1.288 18112 106 1 18 "Average Difference" CA 148 1.693 0.146 1.692 18112 107 1 18 "Average Difference" CB 112 1.977 0.614 1.888 18112 108 1 18 "Average Difference" HN 144 0.653 0.005 0.655 18112 109 1 19 "Average Difference" N 144 3.993 0.246 4.000 18112 110 1 19 "Average Difference" HA 104 0.445 0.053 0.444 18112 111 1 19 "Average Difference" C 141 1.387 0.016 1.392 18112 112 1 19 "Average Difference" CA 148 1.789 0.276 1.774 18112 113 1 19 "Average Difference" CB 112 2.015 0.605 1.930 18112 114 1 19 "Average Difference" HN 144 0.686 0.041 0.687 18112 115 1 20 "Average Difference" N 144 4.321 0.237 4.330 18112 116 1 20 "Average Difference" HA 104 0.510 0.038 0.511 18112 117 1 20 "Average Difference" C 141 1.447 -0.061 1.451 18112 118 1 20 "Average Difference" CA 148 1.858 0.269 1.845 18112 119 1 20 "Average Difference" CB 112 2.011 0.633 1.918 18112 120 1 20 "Average Difference" HN 144 0.714 0.025 0.716 18112 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 18112 _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 12 12 ALA N N 12 125.167 125.167 125.759 -0.592 18112 2 1 . 1 1 12 12 ALA C C 12 177.566 177.566 176.895 0.671 18112 3 1 . 1 1 12 12 ALA CA C 12 52.067 52.067 51.613 0.454 18112 4 1 . 1 1 12 12 ALA CB C 12 18.456 18.456 19.948 -1.492 18112 5 1 . 1 1 12 12 ALA H H 12 8.311 8.311 8.160 0.151 18112 6 1 . 1 1 13 13 MET N N 13 119.278 119.278 120.346 -1.068 18112 7 1 . 1 1 13 13 MET C C 13 176.325 176.325 175.972 0.353 18112 8 1 . 1 1 13 13 MET CA C 13 54.992 54.992 55.421 -0.429 18112 9 1 . 1 1 13 13 MET CB C 13 32.308 32.308 31.827 0.481 18112 10 1 . 1 1 13 13 MET H H 13 8.269 8.269 8.383 -0.114 18112 11 1 . 1 1 14 14 GLN N N 14 120.869 120.869 121.339 -0.470 18112 12 1 . 1 1 14 14 GLN HA H 14 4.399 4.399 4.413 -0.014 18112 13 1 . 1 1 14 14 GLN C C 14 175.644 175.644 174.985 0.659 18112 14 1 . 1 1 14 14 GLN CA C 14 55.139 55.139 55.573 -0.434 18112 15 1 . 1 1 14 14 GLN CB C 14 29.051 29.051 29.284 -0.233 18112 16 1 . 1 1 14 14 GLN H H 14 8.501 8.501 8.285 0.216 18112 17 1 . 1 1 15 15 GLU N N 15 122.042 122.042 122.439 -0.397 18112 18 1 . 1 1 15 15 GLU C C 15 176.242 176.242 176.378 -0.136 18112 19 1 . 1 1 15 15 GLU CA C 15 56.064 56.064 56.202 -0.138 18112 20 1 . 1 1 15 15 GLU CB C 15 29.302 29.302 30.175 -0.873 18112 21 1 . 1 1 15 15 GLU H H 15 8.547 8.547 8.357 0.190 18112 22 1 . 1 1 16 16 GLY N N 16 108.821 108.821 109.483 -0.662 18112 23 1 . 1 1 16 16 GLY C C 16 172.949 172.949 174.067 -1.118 18112 24 1 . 1 1 16 16 GLY CA C 16 44.227 44.227 45.144 -0.917 18112 25 1 . 1 1 16 16 GLY H H 16 8.100 8.100 8.345 -0.245 18112 26 1 . 1 1 17 17 LEU N N 17 120.315 120.315 121.062 -0.747 18112 27 1 . 1 1 17 17 LEU C C 17 177.334 177.334 176.527 0.807 18112 28 1 . 1 1 17 17 LEU CA C 17 53.544 53.544 54.846 -1.302 18112 29 1 . 1 1 17 17 LEU CB C 17 42.140 42.140 42.069 0.071 18112 30 1 . 1 1 17 17 LEU H H 17 8.222 8.222 7.917 0.305 18112 31 1 . 1 1 18 18 SER N N 18 126.547 126.547 116.233 10.314 18112 32 1 . 1 1 18 18 SER CA C 18 56.851 56.851 58.013 -1.162 18112 33 1 . 1 1 18 18 SER CB C 18 64.636 64.636 63.188 1.448 18112 34 1 . 1 1 18 18 SER H H 18 11.627 11.627 8.310 3.317 18112 35 1 . 1 1 19 19 PRO C C 19 175.118 175.118 177.566 -2.449 18112 36 1 . 1 1 20 20 ASN N N 20 121.372 121.372 116.627 4.745 18112 37 1 . 1 1 20 20 ASN H H 20 8.172 8.172 8.748 -0.576 18112 38 1 . 1 1 25 25 ALA CB C 25 18.020 18.020 18.458 -0.438 18112 39 1 . 1 1 26 26 LYS N N 26 118.490 118.490 119.070 -0.580 18112 40 1 . 1 1 26 26 LYS CA C 26 56.146 56.146 58.996 -2.850 18112 41 1 . 1 1 26 26 LYS H H 26 6.794 6.794 7.759 -0.965 18112 42 1 . 1 1 31 31 TYR HA H 31 4.398 4.398 4.185 0.213 18112 43 1 . 1 1 31 31 TYR C C 31 173.714 173.714 175.061 -1.347 18112 44 1 . 1 1 31 31 TYR CA C 31 59.757 59.757 57.752 2.005 18112 45 1 . 1 1 32 32 THR N N 32 111.928 111.928 113.857 -1.929 18112 46 1 . 1 1 32 32 THR HA H 32 4.209 4.209 4.270 -0.061 18112 47 1 . 1 1 32 32 THR C C 32 171.061 171.061 174.395 -3.334 18112 48 1 . 1 1 32 32 THR CA C 32 56.905 56.905 62.624 -5.719 18112 49 1 . 1 1 32 32 THR CB C 32 69.707 69.707 69.822 -0.115 18112 50 1 . 1 1 32 32 THR H H 32 8.237 8.237 7.758 0.479 18112 51 1 . 1 1 33 33 ARG N N 33 124.856 124.856 121.775 3.081 18112 52 1 . 1 1 33 33 ARG C C 33 176.451 176.451 175.564 0.887 18112 53 1 . 1 1 33 33 ARG CA C 33 55.627 55.627 55.860 -0.233 18112 54 1 . 1 1 33 33 ARG CB C 33 29.861 29.861 30.840 -0.979 18112 55 1 . 1 1 33 33 ARG H H 33 9.159 9.159 8.087 1.072 18112 56 1 . 1 1 34 34 TYR N N 34 117.908 117.908 119.943 -2.035 18112 57 1 . 1 1 34 34 TYR CA C 34 55.320 55.320 58.323 -3.003 18112 58 1 . 1 1 34 34 TYR H H 34 8.995 8.995 8.157 0.838 18112 59 1 . 1 1 35 35 PRO C C 35 177.280 177.280 177.320 -0.040 18112 60 1 . 1 1 36 36 SER N N 36 116.410 116.410 119.337 -2.927 18112 61 1 . 1 1 36 36 SER C C 36 178.938 178.938 176.344 2.594 18112 62 1 . 1 1 36 36 SER CA C 36 64.815 64.815 61.975 2.840 18112 63 1 . 1 1 36 36 SER H H 36 8.106 8.106 8.508 -0.402 18112 64 1 . 1 1 37 37 SER N N 37 117.488 117.488 117.021 0.467 18112 65 1 . 1 1 37 37 SER C C 37 177.698 177.698 176.609 1.089 18112 66 1 . 1 1 37 37 SER CA C 37 61.357 61.357 61.424 -0.067 18112 67 1 . 1 1 37 37 SER CB C 37 68.118 68.118 62.563 5.555 18112 68 1 . 1 1 37 37 SER H H 37 8.169 8.169 8.420 -0.251 18112 69 1 . 1 1 38 38 ASN N N 38 115.638 115.638 120.811 -5.173 18112 70 1 . 1 1 38 38 ASN HA H 38 4.259 4.259 4.384 -0.125 18112 71 1 . 1 1 38 38 ASN C C 38 177.868 177.868 177.473 0.395 18112 72 1 . 1 1 38 38 ASN CA C 38 55.907 55.907 55.995 -0.088 18112 73 1 . 1 1 38 38 ASN CB C 38 37.230 37.230 38.189 -0.959 18112 74 1 . 1 1 38 38 ASN H H 38 8.284 8.284 7.731 0.553 18112 75 1 . 1 1 39 39 MET N N 39 121.352 121.352 119.184 2.168 18112 76 1 . 1 1 39 39 MET HA H 39 4.170 4.170 3.618 0.552 18112 77 1 . 1 1 39 39 MET C C 39 179.068 179.068 178.186 0.882 18112 78 1 . 1 1 39 39 MET CA C 39 58.751 58.751 58.093 0.658 18112 79 1 . 1 1 39 39 MET CB C 39 31.850 31.850 31.946 -0.096 18112 80 1 . 1 1 39 39 MET H H 39 7.857 7.857 7.650 0.207 18112 81 1 . 1 1 40 40 LEU N N 40 118.936 118.936 121.538 -2.602 18112 82 1 . 1 1 40 40 LEU HA H 40 4.139 4.139 4.279 -0.140 18112 83 1 . 1 1 40 40 LEU C C 40 178.700 178.700 178.700 -0.000 18112 84 1 . 1 1 40 40 LEU CA C 40 58.455 58.455 58.612 -0.157 18112 85 1 . 1 1 40 40 LEU CB C 40 40.304 40.304 41.661 -1.357 18112 86 1 . 1 1 40 40 LEU H H 40 8.167 8.167 8.217 -0.050 18112 87 1 . 1 1 41 41 LYS N N 41 116.791 116.791 117.359 -0.568 18112 88 1 . 1 1 41 41 LYS HA H 41 3.475 3.475 4.137 -0.662 18112 89 1 . 1 1 41 41 LYS C C 41 178.793 178.793 178.809 -0.016 18112 90 1 . 1 1 41 41 LYS CA C 41 59.161 59.161 59.135 0.025 18112 91 1 . 1 1 41 41 LYS CB C 41 30.992 30.992 32.207 -1.215 18112 92 1 . 1 1 41 41 LYS H H 41 7.632 7.632 7.926 -0.295 18112 93 1 . 1 1 42 42 THR N N 42 112.819 112.819 115.052 -2.233 18112 94 1 . 1 1 42 42 THR HA H 42 4.230 4.230 4.190 0.040 18112 95 1 . 1 1 42 42 THR C C 42 176.142 176.142 176.803 -0.661 18112 96 1 . 1 1 42 42 THR CA C 42 65.107 65.107 66.131 -1.024 18112 97 1 . 1 1 42 42 THR CB C 42 68.306 68.306 69.024 -0.718 18112 98 1 . 1 1 42 42 THR H H 42 7.469 7.469 7.981 -0.512 18112 99 1 . 1 1 43 43 TYR N N 43 118.565 118.565 119.211 -0.646 18112 100 1 . 1 1 43 43 TYR HA H 43 4.204 4.204 4.398 -0.194 18112 101 1 . 1 1 43 43 TYR C C 43 174.240 174.240 176.973 -2.733 18112 102 1 . 1 1 43 43 TYR CA C 43 60.886 60.886 57.839 3.047 18112 103 1 . 1 1 43 43 TYR CB C 43 38.165 38.165 38.434 -0.269 18112 104 1 . 1 1 43 43 TYR H H 43 7.978 7.978 7.696 0.282 18112 105 1 . 1 1 44 44 PHE N N 44 120.980 120.980 117.835 3.145 18112 106 1 . 1 1 44 44 PHE HA H 44 4.920 4.920 4.926 -0.006 18112 107 1 . 1 1 44 44 PHE C C 44 176.436 176.436 176.304 0.132 18112 108 1 . 1 1 44 44 PHE CA C 44 56.672 56.672 56.340 0.331 18112 109 1 . 1 1 44 44 PHE CB C 44 36.570 36.570 37.297 -0.727 18112 110 1 . 1 1 44 44 PHE H H 44 7.955 7.955 8.080 -0.125 18112 111 1 . 1 1 45 45 SER N N 45 113.407 113.407 117.026 -3.619 18112 112 1 . 1 1 45 45 SER HA H 45 4.373 4.373 4.438 -0.065 18112 113 1 . 1 1 45 45 SER C C 45 174.424 174.424 175.412 -0.988 18112 114 1 . 1 1 45 45 SER CA C 45 61.037 61.037 60.350 0.687 18112 115 1 . 1 1 45 45 SER CB C 45 62.711 62.711 63.586 -0.875 18112 116 1 . 1 1 45 45 SER H H 45 7.932 7.932 8.034 -0.102 18112 117 1 . 1 1 46 46 ASP N N 46 118.099 118.099 119.975 -1.876 18112 118 1 . 1 1 46 46 ASP HA H 46 4.572 4.572 4.563 0.009 18112 119 1 . 1 1 46 46 ASP C C 46 174.866 174.866 176.049 -1.183 18112 120 1 . 1 1 46 46 ASP CA C 46 53.602 53.602 55.266 -1.664 18112 121 1 . 1 1 46 46 ASP CB C 46 38.992 38.992 40.996 -2.004 18112 122 1 . 1 1 46 46 ASP H H 46 9.889 9.889 8.559 1.330 18112 123 1 . 1 1 47 47 VAL N N 47 121.496 121.496 120.706 0.790 18112 124 1 . 1 1 47 47 VAL HA H 47 4.058 4.058 3.789 0.269 18112 125 1 . 1 1 47 47 VAL C C 47 174.676 174.676 175.368 -0.692 18112 126 1 . 1 1 47 47 VAL CA C 47 61.006 61.006 62.183 -1.177 18112 127 1 . 1 1 47 47 VAL CB C 47 32.110 32.110 31.467 0.643 18112 128 1 . 1 1 47 47 VAL H H 47 7.781 7.781 7.372 0.409 18112 129 1 . 1 1 48 48 LYS N N 48 126.100 126.100 126.756 -0.656 18112 130 1 . 1 1 48 48 LYS HA H 48 4.402 4.402 4.070 0.332 18112 131 1 . 1 1 48 48 LYS C C 48 175.564 175.564 176.077 -0.513 18112 132 1 . 1 1 48 48 LYS CA C 48 54.874 54.874 56.571 -1.697 18112 133 1 . 1 1 48 48 LYS CB C 48 30.189 30.189 31.843 -1.654 18112 134 1 . 1 1 48 48 LYS H H 48 8.245 8.245 8.268 -0.023 18112 135 1 . 1 1 49 49 PHE N N 49 125.341 125.341 117.856 7.485 18112 136 1 . 1 1 49 49 PHE HA H 49 3.813 3.813 4.229 -0.416 18112 137 1 . 1 1 49 49 PHE C C 49 175.708 175.708 175.282 0.426 18112 138 1 . 1 1 49 49 PHE CA C 49 60.861 60.861 58.176 2.685 18112 139 1 . 1 1 49 49 PHE CB C 49 38.616 38.616 37.206 1.410 18112 140 1 . 1 1 49 49 PHE H H 49 8.626 8.626 7.727 0.899 18112 141 1 . 1 1 50 50 ASN N N 50 115.408 115.408 120.462 -5.054 18112 142 1 . 1 1 50 50 ASN C C 50 176.072 176.072 175.728 0.344 18112 143 1 . 1 1 50 50 ASN CA C 50 51.730 51.730 51.926 -0.196 18112 144 1 . 1 1 50 50 ASN H H 50 7.030 7.030 8.080 -1.050 18112 145 1 . 1 1 51 51 ARG N N 51 122.706 122.706 122.965 -0.259 18112 146 1 . 1 1 51 51 ARG CA C 51 59.534 59.534 59.691 -0.157 18112 147 1 . 1 1 51 51 ARG H H 51 7.790 7.790 8.896 -1.106 18112 148 1 . 1 1 52 52 CYS N N 52 117.340 117.340 116.006 1.334 18112 149 1 . 1 1 52 52 CYS HA H 52 4.108 4.108 4.195 -0.087 18112 150 1 . 1 1 52 52 CYS C C 52 178.200 178.200 177.060 1.140 18112 151 1 . 1 1 52 52 CYS CA C 52 61.143 61.143 62.132 -0.989 18112 152 1 . 1 1 52 52 CYS H H 52 7.681 7.681 8.150 -0.469 18112 153 1 . 1 1 53 53 ILE N N 53 122.321 122.321 118.356 3.965 18112 154 1 . 1 1 53 53 ILE HA H 53 3.588 3.588 3.779 -0.191 18112 155 1 . 1 1 53 53 ILE C C 53 177.492 177.492 177.291 0.201 18112 156 1 . 1 1 53 53 ILE CA C 53 64.109 64.109 64.004 0.106 18112 157 1 . 1 1 53 53 ILE CB C 53 37.603 37.603 37.353 0.250 18112 158 1 . 1 1 53 53 ILE H H 53 8.035 8.035 7.676 0.359 18112 159 1 . 1 1 54 54 THR C C 54 175.903 175.903 176.634 -0.731 18112 160 1 . 1 1 54 54 THR CA C 54 67.308 67.308 67.007 0.301 18112 161 1 . 1 1 55 55 SER N N 55 113.819 113.819 117.457 -3.638 18112 162 1 . 1 1 55 55 SER H H 55 7.844 7.844 8.029 -0.185 18112 163 1 . 1 1 56 56 GLN C C 56 179.792 179.792 177.631 2.161 18112 164 1 . 1 1 57 57 LEU N N 57 116.701 116.701 120.661 -3.960 18112 165 1 . 1 1 57 57 LEU HA H 57 4.519 4.519 2.961 1.558 18112 166 1 . 1 1 57 57 LEU C C 57 178.775 178.775 178.449 0.326 18112 167 1 . 1 1 57 57 LEU CA C 57 55.232 55.232 57.324 -2.092 18112 168 1 . 1 1 57 57 LEU CB C 57 37.131 37.131 41.671 -4.540 18112 169 1 . 1 1 57 57 LEU H H 57 8.267 8.267 7.523 0.744 18112 170 1 . 1 1 58 58 ILE N N 58 122.522 122.522 118.129 4.393 18112 171 1 . 1 1 58 58 ILE HA H 58 4.640 4.640 3.521 1.119 18112 172 1 . 1 1 58 58 ILE C C 58 177.380 177.380 177.925 -0.545 18112 173 1 . 1 1 58 58 ILE CA C 58 62.163 62.163 64.507 -2.344 18112 174 1 . 1 1 58 58 ILE CB C 58 30.657 30.657 37.206 -6.549 18112 175 1 . 1 1 58 58 ILE H H 58 8.111 8.111 8.027 0.084 18112 176 1 . 1 1 59 59 LYS N N 59 121.002 121.002 121.061 -0.059 18112 177 1 . 1 1 59 59 LYS C C 59 177.600 177.600 178.956 -1.356 18112 178 1 . 1 1 59 59 LYS CA C 59 57.570 57.570 59.309 -1.739 18112 179 1 . 1 1 59 59 LYS CB C 59 39.101 39.101 31.933 7.168 18112 180 1 . 1 1 59 59 LYS H H 59 7.432 7.432 7.758 -0.326 18112 181 1 . 1 1 60 60 TRP N N 60 118.679 118.679 119.856 -1.177 18112 182 1 . 1 1 60 60 TRP HA H 60 3.739 3.739 4.369 -0.630 18112 183 1 . 1 1 60 60 TRP C C 60 178.246 178.246 179.070 -0.824 18112 184 1 . 1 1 60 60 TRP CA C 60 59.818 59.818 58.906 0.912 18112 185 1 . 1 1 60 60 TRP CB C 60 31.851 31.851 28.434 3.417 18112 186 1 . 1 1 60 60 TRP H H 60 7.565 7.565 7.930 -0.365 18112 187 1 . 1 1 61 61 PHE N N 61 118.005 118.005 117.306 0.699 18112 188 1 . 1 1 61 61 PHE HA H 61 3.882 3.882 3.841 0.041 18112 189 1 . 1 1 61 61 PHE CA C 61 60.054 60.054 60.186 -0.131 18112 190 1 . 1 1 61 61 PHE H H 61 7.819 7.819 8.538 -0.719 18112 191 1 . 1 1 62 62 SER N N 62 121.144 121.144 115.085 6.059 18112 192 1 . 1 1 62 62 SER C C 62 177.840 177.840 176.704 1.136 18112 193 1 . 1 1 62 62 SER CA C 62 55.892 55.892 61.587 -5.695 18112 194 1 . 1 1 62 62 SER H H 62 8.878 8.878 8.361 0.517 18112 195 1 . 1 1 63 63 ASN N N 63 115.303 115.303 121.242 -5.939 18112 196 1 . 1 1 63 63 ASN C C 63 177.222 177.222 177.523 -0.301 18112 197 1 . 1 1 63 63 ASN CA C 63 60.467 60.467 56.406 4.061 18112 198 1 . 1 1 63 63 ASN H H 63 8.001 8.001 8.136 -0.135 18112 199 1 . 1 1 64 64 PHE N N 64 112.571 112.571 120.675 -8.104 18112 200 1 . 1 1 64 64 PHE CA C 64 56.453 56.453 61.293 -4.840 18112 201 1 . 1 1 64 64 PHE H H 64 7.082 7.082 8.394 -1.312 18112 202 1 . 1 1 65 65 ARG N N 65 116.695 116.695 119.449 -2.754 18112 203 1 . 1 1 65 65 ARG CA C 65 59.590 59.590 59.695 -0.105 18112 204 1 . 1 1 65 65 ARG H H 65 8.091 8.091 8.458 -0.367 18112 205 1 . 1 1 66 66 GLU N N 66 121.653 121.653 119.726 1.927 18112 206 1 . 1 1 66 66 GLU HA H 66 4.739 4.739 4.239 0.500 18112 207 1 . 1 1 66 66 GLU C C 66 174.621 174.621 178.915 -4.294 18112 208 1 . 1 1 66 66 GLU CA C 66 59.583 59.583 59.288 0.295 18112 209 1 . 1 1 66 66 GLU H H 66 7.597 7.597 8.260 -0.663 18112 210 1 . 1 1 67 67 PHE N N 67 111.578 111.578 120.408 -8.830 18112 211 1 . 1 1 67 67 PHE C C 67 176.164 176.164 177.741 -1.577 18112 212 1 . 1 1 67 67 PHE CA C 67 61.156 61.156 61.055 0.101 18112 213 1 . 1 1 67 67 PHE H H 67 7.067 7.067 8.279 -1.212 18112 214 1 . 1 1 68 68 TYR N N 68 119.370 119.370 120.688 -1.318 18112 215 1 . 1 1 68 68 TYR C C 68 176.844 176.844 177.827 -0.983 18112 216 1 . 1 1 68 68 TYR CA C 68 61.758 61.758 61.489 0.269 18112 217 1 . 1 1 68 68 TYR H H 68 7.442 7.442 8.653 -1.211 18112 218 1 . 1 1 69 69 TYR N N 69 116.047 116.047 120.033 -3.986 18112 219 1 . 1 1 69 69 TYR HA H 69 4.086 4.086 4.110 -0.024 18112 220 1 . 1 1 69 69 TYR C C 69 180.328 180.328 177.529 2.799 18112 221 1 . 1 1 69 69 TYR CA C 69 61.528 61.528 61.902 -0.374 18112 222 1 . 1 1 69 69 TYR H H 69 9.127 9.127 8.359 0.768 18112 223 1 . 1 1 70 70 ILE N N 70 124.738 124.738 118.508 6.230 18112 224 1 . 1 1 70 70 ILE HA H 70 3.828 3.828 3.500 0.328 18112 225 1 . 1 1 70 70 ILE C C 70 179.585 179.585 178.141 1.444 18112 226 1 . 1 1 70 70 ILE CA C 70 65.787 65.787 63.961 1.826 18112 227 1 . 1 1 70 70 ILE CB C 70 36.435 36.435 37.154 -0.719 18112 228 1 . 1 1 70 70 ILE H H 70 8.631 8.631 8.305 0.326 18112 229 1 . 1 1 71 71 GLN N N 71 117.940 117.940 119.034 -1.094 18112 230 1 . 1 1 71 71 GLN HA H 71 3.826 3.826 3.549 0.277 18112 231 1 . 1 1 71 71 GLN C C 71 178.192 178.192 178.106 0.086 18112 232 1 . 1 1 71 71 GLN CA C 71 57.779 57.779 58.306 -0.527 18112 233 1 . 1 1 71 71 GLN H H 71 7.738 7.738 7.882 -0.144 18112 234 1 . 1 1 72 72 MET N N 72 117.353 117.353 118.125 -0.772 18112 235 1 . 1 1 72 72 MET HA H 72 4.112 4.112 4.041 0.071 18112 236 1 . 1 1 72 72 MET C C 72 177.203 177.203 178.208 -1.005 18112 237 1 . 1 1 72 72 MET CA C 72 57.272 57.272 57.306 -0.035 18112 238 1 . 1 1 72 72 MET H H 72 7.844 7.844 7.851 -0.007 18112 239 1 . 1 1 73 73 GLU N N 73 117.858 117.858 119.533 -1.675 18112 240 1 . 1 1 73 73 GLU HA H 73 3.572 3.572 3.535 0.037 18112 241 1 . 1 1 73 73 GLU C C 73 177.344 177.344 178.488 -1.144 18112 242 1 . 1 1 73 73 GLU CA C 73 60.324 60.324 59.382 0.942 18112 243 1 . 1 1 73 73 GLU H H 73 7.503 7.503 7.849 -0.346 18112 244 1 . 1 1 74 74 LYS N N 74 118.716 118.716 119.628 -0.912 18112 245 1 . 1 1 74 74 LYS HA H 74 3.867 3.867 3.968 -0.101 18112 246 1 . 1 1 74 74 LYS C C 74 180.077 180.077 179.360 0.717 18112 247 1 . 1 1 74 74 LYS CA C 74 59.754 59.754 58.648 1.106 18112 248 1 . 1 1 74 74 LYS H H 74 7.912 7.912 7.557 0.355 18112 249 1 . 1 1 75 75 TYR N N 75 117.309 117.309 118.891 -1.582 18112 250 1 . 1 1 75 75 TYR HA H 75 4.085 4.085 4.289 -0.204 18112 251 1 . 1 1 75 75 TYR C C 75 178.874 178.874 178.347 0.527 18112 252 1 . 1 1 75 75 TYR CA C 75 63.306 63.306 59.211 4.095 18112 253 1 . 1 1 75 75 TYR H H 75 8.421 8.421 7.903 0.518 18112 254 1 . 1 1 76 76 ALA N N 76 125.392 125.392 121.633 3.760 18112 255 1 . 1 1 76 76 ALA HA H 76 4.221 4.221 4.096 0.125 18112 256 1 . 1 1 76 76 ALA C C 76 178.850 178.850 179.394 -0.544 18112 257 1 . 1 1 76 76 ALA CA C 76 56.280 56.280 55.343 0.937 18112 258 1 . 1 1 76 76 ALA CB C 76 18.687 18.687 18.397 0.290 18112 259 1 . 1 1 76 76 ALA H H 76 8.553 8.553 8.352 0.201 18112 260 1 . 1 1 77 77 ARG N N 77 115.067 115.067 118.434 -3.367 18112 261 1 . 1 1 77 77 ARG HA H 77 3.935 3.935 3.925 0.010 18112 262 1 . 1 1 77 77 ARG C C 77 179.341 179.341 178.367 0.974 18112 263 1 . 1 1 77 77 ARG CA C 77 60.499 60.499 59.430 1.069 18112 264 1 . 1 1 77 77 ARG H H 77 8.471 8.471 8.203 0.268 18112 265 1 . 1 1 78 78 GLN N N 78 120.107 120.107 119.270 0.837 18112 266 1 . 1 1 78 78 GLN HA H 78 3.921 3.921 4.115 -0.194 18112 267 1 . 1 1 78 78 GLN C C 78 177.289 177.289 178.134 -0.845 18112 268 1 . 1 1 78 78 GLN CA C 78 58.619 58.619 58.671 -0.052 18112 269 1 . 1 1 78 78 GLN CB C 78 27.752 27.752 28.554 -0.802 18112 270 1 . 1 1 78 78 GLN H H 78 8.142 8.142 8.153 -0.011 18112 271 1 . 1 1 79 79 ALA N N 79 120.809 120.809 123.114 -2.305 18112 272 1 . 1 1 79 79 ALA HA H 79 4.308 4.308 4.071 0.237 18112 273 1 . 1 1 79 79 ALA C C 79 179.924 179.924 179.764 0.160 18112 274 1 . 1 1 79 79 ALA CA C 79 54.970 54.970 55.316 -0.346 18112 275 1 . 1 1 79 79 ALA CB C 79 17.064 17.064 18.556 -1.492 18112 276 1 . 1 1 79 79 ALA H H 79 7.811 7.811 7.995 -0.184 18112 277 1 . 1 1 80 80 ILE N N 80 118.524 118.524 118.504 0.020 18112 278 1 . 1 1 80 80 ILE HA H 80 3.894 3.894 3.650 0.244 18112 279 1 . 1 1 80 80 ILE C C 80 181.268 181.268 178.171 3.097 18112 280 1 . 1 1 80 80 ILE CA C 80 64.841 64.841 64.168 0.673 18112 281 1 . 1 1 80 80 ILE CB C 80 37.125 37.125 37.214 -0.089 18112 282 1 . 1 1 80 80 ILE H H 80 7.837 7.837 8.066 -0.229 18112 283 1 . 1 1 81 81 ASN N N 81 121.233 121.233 117.676 3.557 18112 284 1 . 1 1 81 81 ASN HA H 81 4.398 4.398 4.435 -0.037 18112 285 1 . 1 1 81 81 ASN C C 81 176.546 176.546 177.006 -0.460 18112 286 1 . 1 1 81 81 ASN CA C 81 55.892 55.892 55.772 0.120 18112 287 1 . 1 1 81 81 ASN CB C 81 37.603 37.603 38.748 -1.145 18112 288 1 . 1 1 81 81 ASN H H 81 8.262 8.262 8.074 0.188 18112 289 1 . 1 1 82 82 ASP N N 82 119.240 119.240 117.540 1.700 18112 290 1 . 1 1 82 82 ASP HA H 82 4.666 4.666 4.629 0.037 18112 291 1 . 1 1 82 82 ASP C C 82 176.767 176.767 177.138 -0.371 18112 292 1 . 1 1 82 82 ASP CA C 82 54.771 54.771 54.555 0.216 18112 293 1 . 1 1 82 82 ASP CB C 82 40.121 40.121 41.809 -1.688 18112 294 1 . 1 1 82 82 ASP H H 82 8.316 8.316 8.060 0.256 18112 295 1 . 1 1 83 83 GLY N N 83 106.913 106.913 107.024 -0.111 18112 296 1 . 1 1 83 83 GLY C C 83 174.601 174.601 175.001 -0.400 18112 297 1 . 1 1 83 83 GLY CA C 83 45.214 45.214 45.142 0.072 18112 298 1 . 1 1 83 83 GLY H H 83 7.810 7.810 7.960 -0.150 18112 299 1 . 1 1 84 84 VAL N N 84 122.981 122.981 120.803 2.178 18112 300 1 . 1 1 84 84 VAL HA H 84 3.850 3.850 3.930 -0.080 18112 301 1 . 1 1 84 84 VAL C C 84 177.265 177.265 176.612 0.653 18112 302 1 . 1 1 84 84 VAL CA C 84 64.270 64.270 64.012 0.257 18112 303 1 . 1 1 84 84 VAL CB C 84 30.471 30.471 32.029 -1.558 18112 304 1 . 1 1 84 84 VAL H H 84 8.157 8.157 7.816 0.341 18112 305 1 . 1 1 85 85 THR N N 85 115.232 115.232 113.356 1.876 18112 306 1 . 1 1 85 85 THR HA H 85 4.716 4.716 4.447 0.269 18112 307 1 . 1 1 85 85 THR C C 85 174.489 174.489 174.007 0.482 18112 308 1 . 1 1 85 85 THR CA C 85 61.618 61.618 62.860 -1.242 18112 309 1 . 1 1 85 85 THR CB C 85 70.081 70.081 69.148 0.933 18112 310 1 . 1 1 85 85 THR H H 85 8.890 8.890 8.153 0.737 18112 311 1 . 1 1 86 86 SER N N 86 117.009 117.009 116.974 0.035 18112 312 1 . 1 1 86 86 SER HA H 86 5.046 5.046 4.568 0.478 18112 313 1 . 1 1 86 86 SER C C 86 174.473 174.473 175.040 -0.567 18112 314 1 . 1 1 86 86 SER CA C 86 55.922 55.922 57.060 -1.138 18112 315 1 . 1 1 86 86 SER CB C 86 64.385 64.385 64.947 -0.562 18112 316 1 . 1 1 86 86 SER H H 86 7.704 7.704 7.743 -0.039 18112 317 1 . 1 1 87 87 THR N N 87 118.634 118.634 117.875 0.759 18112 318 1 . 1 1 87 87 THR HA H 87 4.065 4.065 3.939 0.126 18112 319 1 . 1 1 87 87 THR C C 87 176.047 176.047 175.566 0.481 18112 320 1 . 1 1 87 87 THR CA C 87 64.983 64.983 64.659 0.324 18112 321 1 . 1 1 87 87 THR CB C 87 68.045 68.045 68.608 -0.563 18112 322 1 . 1 1 87 87 THR H H 87 8.711 8.711 8.523 0.188 18112 323 1 . 1 1 88 88 GLU N N 88 117.889 117.889 119.469 -1.580 18112 324 1 . 1 1 88 88 GLU HA H 88 3.881 3.881 4.116 -0.235 18112 325 1 . 1 1 88 88 GLU C C 88 177.146 177.146 177.295 -0.149 18112 326 1 . 1 1 88 88 GLU CA C 88 57.814 57.814 58.148 -0.334 18112 327 1 . 1 1 88 88 GLU CB C 88 28.050 28.050 28.668 -0.618 18112 328 1 . 1 1 88 88 GLU H H 88 8.152 8.152 8.547 -0.395 18112 329 1 . 1 1 89 89 GLU N N 89 115.617 115.617 118.061 -2.444 18112 330 1 . 1 1 89 89 GLU HA H 89 4.149 4.149 4.267 -0.118 18112 331 1 . 1 1 89 89 GLU C C 89 176.192 176.192 177.246 -1.054 18112 332 1 . 1 1 89 89 GLU CA C 89 56.133 56.133 57.201 -1.068 18112 333 1 . 1 1 89 89 GLU CB C 89 29.415 29.415 30.332 -0.917 18112 334 1 . 1 1 89 89 GLU H H 89 7.311 7.311 7.650 -0.339 18112 335 1 . 1 1 90 90 LEU N N 90 120.870 120.870 116.833 4.037 18112 336 1 . 1 1 90 90 LEU HA H 90 4.439 4.439 4.447 -0.008 18112 337 1 . 1 1 90 90 LEU C C 90 175.267 175.267 176.906 -1.639 18112 338 1 . 1 1 90 90 LEU CA C 90 53.504 53.504 55.244 -1.740 18112 339 1 . 1 1 90 90 LEU CB C 90 40.479 40.479 42.935 -2.456 18112 340 1 . 1 1 90 90 LEU H H 90 7.311 7.311 7.404 -0.093 18112 341 1 . 1 1 91 91 SER N N 91 118.376 118.376 114.052 4.324 18112 342 1 . 1 1 91 91 SER HA H 91 4.747 4.747 4.528 0.219 18112 343 1 . 1 1 91 91 SER C C 91 173.332 173.332 172.896 0.436 18112 344 1 . 1 1 91 91 SER CA C 91 56.314 56.314 58.428 -2.114 18112 345 1 . 1 1 91 91 SER CB C 91 64.615 64.615 63.497 1.118 18112 346 1 . 1 1 91 91 SER H H 91 8.221 8.221 7.880 0.341 18112 347 1 . 1 1 92 92 ILE N N 92 122.247 122.247 121.944 0.303 18112 348 1 . 1 1 92 92 ILE HA H 92 4.537 4.537 4.357 0.180 18112 349 1 . 1 1 92 92 ILE C C 92 174.059 174.059 175.507 -1.448 18112 350 1 . 1 1 92 92 ILE CA C 92 59.881 59.881 59.226 0.655 18112 351 1 . 1 1 92 92 ILE CB C 92 37.820 37.820 41.552 -3.732 18112 352 1 . 1 1 92 92 ILE H H 92 8.570 8.570 7.869 0.701 18112 353 1 . 1 1 93 93 THR N N 93 116.069 116.069 119.349 -3.280 18112 354 1 . 1 1 93 93 THR HA H 93 4.580 4.580 4.297 0.283 18112 355 1 . 1 1 93 93 THR C C 93 175.049 175.049 174.684 0.365 18112 356 1 . 1 1 93 93 THR CA C 93 58.988 58.988 64.394 -5.406 18112 357 1 . 1 1 93 93 THR CB C 93 71.362 71.362 68.568 2.794 18112 358 1 . 1 1 93 93 THR H H 93 7.224 7.224 8.617 -1.393 18112 359 1 . 1 1 94 94 ARG N N 94 116.595 116.595 124.506 -7.911 18112 360 1 . 1 1 94 94 ARG HA H 94 3.077 3.077 4.309 -1.232 18112 361 1 . 1 1 94 94 ARG C C 94 175.076 175.076 175.192 -0.116 18112 362 1 . 1 1 94 94 ARG CA C 94 57.119 57.119 55.603 1.516 18112 363 1 . 1 1 94 94 ARG CB C 94 27.838 27.838 30.292 -2.454 18112 364 1 . 1 1 94 94 ARG H H 94 8.596 8.596 8.482 0.114 18112 365 1 . 1 1 95 95 ASP N N 95 113.735 113.735 120.293 -6.558 18112 366 1 . 1 1 95 95 ASP HA H 95 4.765 4.765 3.634 1.131 18112 367 1 . 1 1 95 95 ASP C C 95 175.876 175.876 176.130 -0.254 18112 368 1 . 1 1 95 95 ASP CA C 95 53.156 53.156 55.636 -2.480 18112 369 1 . 1 1 95 95 ASP CB C 95 41.166 41.166 39.958 1.208 18112 370 1 . 1 1 95 95 ASP H H 95 7.607 7.607 8.213 -0.606 18112 371 1 . 1 1 96 96 CYS N N 96 116.012 116.012 119.976 -3.964 18112 372 1 . 1 1 96 96 CYS C C 96 174.361 174.361 176.232 -1.871 18112 373 1 . 1 1 96 96 CYS CA C 96 56.562 56.562 60.844 -4.282 18112 374 1 . 1 1 96 96 CYS CB C 96 29.416 29.416 28.365 1.051 18112 375 1 . 1 1 96 96 CYS H H 96 7.094 7.094 8.044 -0.950 18112 376 1 . 1 1 97 97 GLU N N 97 123.087 123.087 120.749 2.338 18112 377 1 . 1 1 97 97 GLU C C 97 178.748 178.748 178.660 0.088 18112 378 1 . 1 1 97 97 GLU CA C 97 59.912 59.912 59.386 0.526 18112 379 1 . 1 1 97 97 GLU CB C 97 29.195 29.195 29.249 -0.054 18112 380 1 . 1 1 97 97 GLU H H 97 9.003 9.003 8.216 0.787 18112 381 1 . 1 1 98 98 LEU N N 98 120.942 120.942 120.550 0.392 18112 382 1 . 1 1 98 98 LEU HA H 98 3.614 3.614 4.130 -0.517 18112 383 1 . 1 1 98 98 LEU C C 98 177.796 177.796 178.697 -0.901 18112 384 1 . 1 1 98 98 LEU CA C 98 58.090 58.090 57.684 0.406 18112 385 1 . 1 1 98 98 LEU CB C 98 39.778 39.778 41.768 -1.990 18112 386 1 . 1 1 98 98 LEU H H 98 8.656 8.656 7.861 0.795 18112 387 1 . 1 1 99 99 TYR N N 99 118.313 118.313 118.252 0.061 18112 388 1 . 1 1 99 99 TYR C C 99 177.077 177.077 178.350 -1.273 18112 389 1 . 1 1 99 99 TYR CA C 99 62.622 62.622 61.099 1.523 18112 390 1 . 1 1 99 99 TYR CB C 99 38.742 38.742 37.513 1.229 18112 391 1 . 1 1 99 99 TYR H H 99 7.522 7.522 8.145 -0.623 18112 392 1 . 1 1 100 100 ARG N N 100 118.101 118.101 118.815 -0.714 18112 393 1 . 1 1 100 100 ARG C C 100 178.616 178.616 178.589 0.027 18112 394 1 . 1 1 100 100 ARG CA C 100 59.915 59.915 58.698 1.217 18112 395 1 . 1 1 100 100 ARG CB C 100 29.100 29.100 29.770 -0.670 18112 396 1 . 1 1 100 100 ARG H H 100 8.243 8.243 8.381 -0.138 18112 397 1 . 1 1 101 101 ALA N N 101 120.972 120.972 123.182 -2.210 18112 398 1 . 1 1 101 101 ALA HA H 101 4.145 4.145 4.118 0.027 18112 399 1 . 1 1 101 101 ALA C C 101 181.359 181.359 179.530 1.829 18112 400 1 . 1 1 101 101 ALA CA C 101 55.057 55.057 55.082 -0.025 18112 401 1 . 1 1 101 101 ALA CB C 101 17.543 17.543 18.464 -0.921 18112 402 1 . 1 1 101 101 ALA H H 101 8.352 8.352 7.983 0.369 18112 403 1 . 1 1 102 102 LEU N N 102 115.683 115.683 118.554 -2.871 18112 404 1 . 1 1 102 102 LEU HA H 102 4.333 4.333 4.074 0.259 18112 405 1 . 1 1 102 102 LEU C C 102 178.583 178.583 179.521 -0.938 18112 406 1 . 1 1 102 102 LEU CA C 102 57.634 57.634 57.994 -0.360 18112 407 1 . 1 1 102 102 LEU CB C 102 41.716 41.716 41.476 0.240 18112 408 1 . 1 1 102 102 LEU H H 102 7.960 7.960 8.319 -0.359 18112 409 1 . 1 1 103 103 ASN N N 103 118.957 118.957 118.318 0.639 18112 410 1 . 1 1 103 103 ASN C C 103 177.470 177.470 177.806 -0.336 18112 411 1 . 1 1 103 103 ASN CA C 103 56.974 56.974 56.199 0.775 18112 412 1 . 1 1 103 103 ASN CB C 103 38.140 38.140 38.488 -0.348 18112 413 1 . 1 1 103 103 ASN H H 103 9.301 9.301 8.308 0.993 18112 414 1 . 1 1 104 104 MET N N 104 113.763 113.763 118.672 -4.909 18112 415 1 . 1 1 104 104 MET CA C 104 57.362 57.362 58.137 -0.775 18112 416 1 . 1 1 104 104 MET CB C 104 31.895 31.895 32.533 -0.638 18112 417 1 . 1 1 104 104 MET H H 104 8.332 8.332 8.051 0.281 18112 418 1 . 1 1 105 105 HIS N N 105 116.024 116.024 116.673 -0.649 18112 419 1 . 1 1 105 105 HIS HA H 105 3.764 3.764 4.375 -0.611 18112 420 1 . 1 1 105 105 HIS C C 105 176.939 176.939 176.978 -0.039 18112 421 1 . 1 1 105 105 HIS CA C 105 59.069 59.069 58.717 0.352 18112 422 1 . 1 1 105 105 HIS H H 105 7.156 7.156 8.166 -1.010 18112 423 1 . 1 1 106 106 TYR N N 106 113.161 113.161 116.838 -3.677 18112 424 1 . 1 1 106 106 TYR C C 106 173.767 173.767 175.772 -2.005 18112 425 1 . 1 1 106 106 TYR CA C 106 58.488 58.488 60.098 -1.610 18112 426 1 . 1 1 106 106 TYR CB C 106 38.225 38.225 39.577 -1.352 18112 427 1 . 1 1 106 106 TYR H H 106 7.204 7.204 8.242 -1.038 18112 428 1 . 1 1 107 107 ASN N N 107 118.875 118.875 114.815 4.060 18112 429 1 . 1 1 107 107 ASN HA H 107 3.922 3.922 4.800 -0.878 18112 430 1 . 1 1 107 107 ASN C C 107 175.815 175.815 174.563 1.252 18112 431 1 . 1 1 107 107 ASN CA C 107 51.233 51.233 52.943 -1.710 18112 432 1 . 1 1 107 107 ASN CB C 107 38.142 38.142 39.684 -1.542 18112 433 1 . 1 1 107 107 ASN H H 107 8.127 8.127 8.169 -0.042 18112 434 1 . 1 1 108 108 LYS N N 108 122.850 122.850 122.161 0.689 18112 435 1 . 1 1 108 108 LYS HA H 108 3.954 3.954 4.302 -0.348 18112 436 1 . 1 1 108 108 LYS C C 108 177.586 177.586 176.552 1.034 18112 437 1 . 1 1 108 108 LYS CA C 108 59.749 59.749 57.562 2.187 18112 438 1 . 1 1 108 108 LYS CB C 108 31.498 31.498 32.268 -0.770 18112 439 1 . 1 1 108 108 LYS H H 108 7.772 7.772 8.620 -0.848 18112 440 1 . 1 1 109 109 ALA N N 109 118.054 118.054 121.983 -3.929 18112 441 1 . 1 1 109 109 ALA HA H 109 4.137 4.137 4.264 -0.128 18112 442 1 . 1 1 109 109 ALA C C 109 177.889 177.889 177.093 0.796 18112 443 1 . 1 1 109 109 ALA CA C 109 52.299 52.299 52.175 0.124 18112 444 1 . 1 1 109 109 ALA CB C 109 17.787 17.787 18.268 -0.481 18112 445 1 . 1 1 109 109 ALA H H 109 8.307 8.307 8.046 0.261 18112 446 1 . 1 1 110 110 ASN N N 110 115.542 115.542 117.686 -2.144 18112 447 1 . 1 1 110 110 ASN HA H 110 4.480 4.480 4.486 -0.006 18112 448 1 . 1 1 110 110 ASN C C 110 174.277 174.277 175.171 -0.894 18112 449 1 . 1 1 110 110 ASN CA C 110 53.504 53.504 54.011 -0.507 18112 450 1 . 1 1 110 110 ASN CB C 110 37.283 37.283 37.744 -0.461 18112 451 1 . 1 1 110 110 ASN H H 110 8.353 8.353 8.136 0.217 18112 452 1 . 1 1 111 111 ASP N N 111 114.692 114.692 122.021 -7.329 18112 453 1 . 1 1 111 111 ASP HA H 111 4.485 4.485 4.430 0.055 18112 454 1 . 1 1 111 111 ASP C C 111 174.868 174.868 176.058 -1.190 18112 455 1 . 1 1 111 111 ASP CA C 111 53.227 53.227 55.636 -2.409 18112 456 1 . 1 1 111 111 ASP CB C 111 39.228 39.228 40.947 -1.719 18112 457 1 . 1 1 111 111 ASP H H 111 8.297 8.297 8.196 0.101 18112 458 1 . 1 1 112 112 PHE N N 112 120.927 120.927 118.892 2.035 18112 459 1 . 1 1 112 112 PHE HA H 112 4.752 4.752 4.477 0.275 18112 460 1 . 1 1 112 112 PHE C C 112 174.633 174.633 175.943 -1.309 18112 461 1 . 1 1 112 112 PHE CA C 112 56.346 56.346 57.951 -1.605 18112 462 1 . 1 1 112 112 PHE H H 112 7.784 7.784 7.892 -0.108 18112 463 1 . 1 1 113 113 GLU N N 113 128.111 128.111 122.324 5.787 18112 464 1 . 1 1 113 113 GLU HA H 113 4.011 4.011 4.240 -0.229 18112 465 1 . 1 1 113 113 GLU C C 113 173.502 173.502 175.767 -2.264 18112 466 1 . 1 1 113 113 GLU CA C 113 55.100 55.100 56.631 -1.531 18112 467 1 . 1 1 113 113 GLU H H 113 7.752 7.752 8.572 -0.820 18112 468 1 . 1 1 114 114 VAL N N 114 129.326 129.326 114.492 14.834 18112 469 1 . 1 1 114 114 VAL HA H 114 3.241 3.241 3.754 -0.513 18112 470 1 . 1 1 114 114 VAL CA C 114 60.838 60.838 61.073 -0.235 18112 471 1 . 1 1 114 114 VAL CB C 114 32.609 32.609 30.673 1.936 18112 472 1 . 1 1 114 114 VAL H H 114 8.008 8.008 7.630 0.378 18112 473 1 . 1 1 115 115 PRO HA H 115 4.429 4.429 4.512 -0.083 18112 474 1 . 1 1 115 115 PRO C C 115 177.421 177.421 177.890 -0.469 18112 475 1 . 1 1 115 115 PRO CA C 115 61.882 61.882 62.488 -0.606 18112 476 1 . 1 1 115 115 PRO CB C 115 30.974 30.974 32.707 -1.733 18112 477 1 . 1 1 116 116 GLU N N 116 123.936 123.936 121.295 2.641 18112 478 1 . 1 1 116 116 GLU C C 116 179.034 179.034 178.775 0.259 18112 479 1 . 1 1 116 116 GLU CA C 116 58.913 58.913 60.188 -1.275 18112 480 1 . 1 1 116 116 GLU CB C 116 28.378 28.378 29.315 -0.937 18112 481 1 . 1 1 116 116 GLU H H 116 8.757 8.757 8.830 -0.073 18112 482 1 . 1 1 117 117 ARG N N 117 116.943 116.943 118.564 -1.621 18112 483 1 . 1 1 117 117 ARG C C 117 177.570 177.570 178.516 -0.946 18112 484 1 . 1 1 117 117 ARG CA C 117 57.033 57.033 58.864 -1.831 18112 485 1 . 1 1 117 117 ARG CB C 117 28.172 28.172 29.421 -1.249 18112 486 1 . 1 1 117 117 ARG H H 117 8.733 8.733 8.416 0.317 18112 487 1 . 1 1 118 118 PHE N N 118 117.528 117.528 119.389 -1.861 18112 488 1 . 1 1 118 118 PHE HA H 118 4.137 4.137 4.275 -0.138 18112 489 1 . 1 1 118 118 PHE C C 118 176.992 176.992 177.523 -0.531 18112 490 1 . 1 1 118 118 PHE CA C 118 61.627 61.627 60.988 0.639 18112 491 1 . 1 1 118 118 PHE CB C 118 37.386 37.386 38.725 -1.339 18112 492 1 . 1 1 118 118 PHE H H 118 7.606 7.606 7.845 -0.239 18112 493 1 . 1 1 119 119 LEU N N 119 118.483 118.483 118.934 -0.451 18112 494 1 . 1 1 119 119 LEU HA H 119 3.684 3.684 4.046 -0.362 18112 495 1 . 1 1 119 119 LEU C C 119 178.802 178.802 179.096 -0.294 18112 496 1 . 1 1 119 119 LEU CA C 119 59.875 59.875 56.900 2.975 18112 497 1 . 1 1 119 119 LEU CB C 119 39.453 39.453 40.375 -0.922 18112 498 1 . 1 1 119 119 LEU H H 119 7.248 7.248 7.717 -0.469 18112 499 1 . 1 1 120 120 GLU N N 120 117.870 117.870 120.968 -3.098 18112 500 1 . 1 1 120 120 GLU C C 120 179.932 179.932 179.274 0.658 18112 501 1 . 1 1 120 120 GLU CA C 120 59.150 59.150 59.366 -0.216 18112 502 1 . 1 1 120 120 GLU CB C 120 28.878 28.878 29.483 -0.605 18112 503 1 . 1 1 120 120 GLU H H 120 7.423 7.423 8.260 -0.837 18112 504 1 . 1 1 121 121 VAL N N 121 120.777 120.777 120.130 0.647 18112 505 1 . 1 1 121 121 VAL HA H 121 3.545 3.545 3.605 -0.060 18112 506 1 . 1 1 121 121 VAL C C 121 179.302 179.302 177.876 1.426 18112 507 1 . 1 1 121 121 VAL CA C 121 66.875 66.875 66.565 0.310 18112 508 1 . 1 1 121 121 VAL CB C 121 30.823 30.823 31.382 -0.559 18112 509 1 . 1 1 121 121 VAL H H 121 8.313 8.313 8.080 0.233 18112 510 1 . 1 1 122 122 ALA N N 122 127.029 127.029 121.668 5.361 18112 511 1 . 1 1 122 122 ALA HA H 122 4.251 4.251 4.018 0.233 18112 512 1 . 1 1 122 122 ALA C C 122 178.366 178.366 179.566 -1.200 18112 513 1 . 1 1 122 122 ALA CA C 122 54.748 54.748 55.235 -0.487 18112 514 1 . 1 1 122 122 ALA CB C 122 16.565 16.565 18.224 -1.659 18112 515 1 . 1 1 122 122 ALA H H 122 8.896 8.896 7.979 0.916 18112 516 1 . 1 1 123 123 GLN N N 123 119.887 119.887 119.022 0.865 18112 517 1 . 1 1 123 123 GLN C C 123 177.908 177.908 178.516 -0.608 18112 518 1 . 1 1 123 123 GLN CA C 123 60.671 60.671 58.827 1.844 18112 519 1 . 1 1 123 123 GLN H H 123 8.349 8.349 7.903 0.446 18112 520 1 . 1 1 124 124 ILE N N 124 120.632 120.632 119.530 1.102 18112 521 1 . 1 1 124 124 ILE HA H 124 3.651 3.651 3.774 -0.123 18112 522 1 . 1 1 124 124 ILE C C 124 178.703 178.703 178.276 0.427 18112 523 1 . 1 1 124 124 ILE CA C 124 65.945 65.945 65.001 0.944 18112 524 1 . 1 1 124 124 ILE H H 124 8.204 8.204 8.168 0.036 18112 525 1 . 1 1 125 125 THR N N 125 115.084 115.084 116.236 -1.152 18112 526 1 . 1 1 125 125 THR C C 125 175.568 175.568 176.479 -0.911 18112 527 1 . 1 1 125 125 THR CA C 125 67.872 67.872 66.764 1.108 18112 528 1 . 1 1 125 125 THR H H 125 8.399 8.399 8.246 0.153 18112 529 1 . 1 1 126 126 LEU N N 126 125.011 125.011 122.413 2.598 18112 530 1 . 1 1 126 126 LEU HA H 126 4.085 4.085 4.400 -0.315 18112 531 1 . 1 1 126 126 LEU C C 126 178.559 178.559 178.167 0.392 18112 532 1 . 1 1 126 126 LEU CA C 126 58.843 58.843 57.933 0.910 18112 533 1 . 1 1 126 126 LEU CB C 126 41.421 41.421 41.836 -0.415 18112 534 1 . 1 1 126 126 LEU H H 126 8.728 8.728 8.123 0.605 18112 535 1 . 1 1 127 127 ARG N N 127 117.076 117.076 119.446 -2.370 18112 536 1 . 1 1 127 127 ARG HA H 127 3.929 3.929 4.032 -0.103 18112 537 1 . 1 1 127 127 ARG C C 127 177.984 177.984 178.521 -0.537 18112 538 1 . 1 1 127 127 ARG CA C 127 60.685 60.685 59.746 0.939 18112 539 1 . 1 1 127 127 ARG CB C 127 28.079 28.079 29.940 -1.861 18112 540 1 . 1 1 127 127 ARG H H 127 8.213 8.213 8.277 -0.064 18112 541 1 . 1 1 128 128 GLU N N 128 118.617 118.617 119.547 -0.930 18112 542 1 . 1 1 128 128 GLU HA H 128 4.147 4.147 4.137 0.010 18112 543 1 . 1 1 128 128 GLU C C 128 181.150 181.150 179.147 2.003 18112 544 1 . 1 1 128 128 GLU CA C 128 59.508 59.508 58.927 0.581 18112 545 1 . 1 1 128 128 GLU H H 128 8.478 8.478 8.037 0.441 18112 546 1 . 1 1 129 129 PHE N N 129 119.267 119.267 120.108 -0.841 18112 547 1 . 1 1 129 129 PHE HA H 129 4.104 4.104 4.298 -0.194 18112 548 1 . 1 1 129 129 PHE C C 129 177.170 177.170 177.760 -0.590 18112 549 1 . 1 1 129 129 PHE CA C 129 63.694 63.694 61.683 2.011 18112 550 1 . 1 1 129 129 PHE H H 129 8.570 8.570 8.333 0.237 18112 551 1 . 1 1 130 130 PHE N N 130 118.739 118.739 119.526 -0.787 18112 552 1 . 1 1 130 130 PHE HA H 130 3.884 3.884 4.035 -0.151 18112 553 1 . 1 1 130 130 PHE C C 130 175.860 175.860 177.230 -1.370 18112 554 1 . 1 1 130 130 PHE CA C 130 62.819 62.819 61.950 0.869 18112 555 1 . 1 1 130 130 PHE H H 130 8.740 8.740 8.792 -0.052 18112 556 1 . 1 1 131 131 ASN N N 131 116.028 116.028 118.002 -1.974 18112 557 1 . 1 1 131 131 ASN HA H 131 4.373 4.373 4.283 0.090 18112 558 1 . 1 1 131 131 ASN C C 131 178.228 178.228 177.592 0.636 18112 559 1 . 1 1 131 131 ASN CA C 131 55.150 55.150 56.354 -1.204 18112 560 1 . 1 1 131 131 ASN H H 131 8.864 8.864 8.351 0.513 18112 561 1 . 1 1 132 132 ALA N N 132 120.922 120.922 122.985 -2.063 18112 562 1 . 1 1 132 132 ALA HA H 132 4.020 4.020 4.085 -0.065 18112 563 1 . 1 1 132 132 ALA C C 132 178.515 178.515 179.765 -1.250 18112 564 1 . 1 1 132 132 ALA CA C 132 54.924 54.924 55.067 -0.143 18112 565 1 . 1 1 132 132 ALA CB C 132 18.441 18.441 18.580 -0.139 18112 566 1 . 1 1 132 132 ALA H H 132 7.745 7.745 7.869 -0.124 18112 567 1 . 1 1 133 133 ILE N N 133 118.200 118.200 119.715 -1.515 18112 568 1 . 1 1 133 133 ILE HA H 133 3.235 3.235 3.831 -0.596 18112 569 1 . 1 1 133 133 ILE C C 133 180.606 180.606 178.063 2.543 18112 570 1 . 1 1 133 133 ILE CA C 133 65.215 65.215 64.689 0.526 18112 571 1 . 1 1 133 133 ILE CB C 133 38.291 38.291 37.856 0.435 18112 572 1 . 1 1 133 133 ILE H H 133 7.999 7.999 7.988 0.011 18112 573 1 . 1 1 134 134 ILE N N 134 122.564 122.564 119.690 2.874 18112 574 1 . 1 1 134 134 ILE HA H 134 3.788 3.788 3.666 0.123 18112 575 1 . 1 1 134 134 ILE C C 134 177.215 177.215 177.071 0.144 18112 576 1 . 1 1 134 134 ILE CA C 134 63.584 63.584 63.597 -0.013 18112 577 1 . 1 1 134 134 ILE CB C 134 35.636 35.636 37.602 -1.966 18112 578 1 . 1 1 134 134 ILE H H 134 8.670 8.670 7.956 0.714 18112 579 1 . 1 1 135 135 ALA N N 135 119.989 119.989 120.757 -0.767 18112 580 1 . 1 1 135 135 ALA HA H 135 4.357 4.357 4.183 0.174 18112 581 1 . 1 1 135 135 ALA C C 135 177.786 177.786 178.119 -0.333 18112 582 1 . 1 1 135 135 ALA CA C 135 51.521 51.521 53.318 -1.797 18112 583 1 . 1 1 135 135 ALA CB C 135 18.839 18.839 19.726 -0.887 18112 584 1 . 1 1 135 135 ALA H H 135 6.898 6.898 7.896 -0.998 18112 585 1 . 1 1 136 136 GLY N N 136 107.682 107.682 104.810 2.872 18112 586 1 . 1 1 136 136 GLY C C 136 176.324 176.324 174.851 1.473 18112 587 1 . 1 1 136 136 GLY CA C 136 45.469 45.469 44.864 0.605 18112 588 1 . 1 1 136 136 GLY H H 136 7.913 7.913 7.780 0.133 18112 589 1 . 1 1 137 137 LYS N N 137 117.213 117.213 119.368 -2.155 18112 590 1 . 1 1 137 137 LYS HA H 137 4.004 4.004 4.091 -0.087 18112 591 1 . 1 1 137 137 LYS C C 137 176.616 176.616 176.210 0.406 18112 592 1 . 1 1 137 137 LYS CA C 137 57.499 57.499 57.287 0.211 18112 593 1 . 1 1 137 137 LYS CB C 137 30.927 30.927 31.777 -0.850 18112 594 1 . 1 1 137 137 LYS H H 137 8.312 8.312 8.232 0.080 18112 595 1 . 1 1 138 138 ASP N N 138 113.545 113.545 118.904 -5.359 18112 596 1 . 1 1 138 138 ASP HA H 138 3.061 3.061 3.776 -0.715 18112 597 1 . 1 1 138 138 ASP C C 138 174.698 174.698 176.472 -1.775 18112 598 1 . 1 1 138 138 ASP CA C 138 53.694 53.694 55.124 -1.430 18112 599 1 . 1 1 138 138 ASP CB C 138 36.008 36.008 39.862 -3.854 18112 600 1 . 1 1 138 138 ASP H H 138 8.465 8.465 8.050 0.415 18112 601 1 . 1 1 139 139 VAL N N 139 115.191 115.191 116.436 -1.245 18112 602 1 . 1 1 139 139 VAL HA H 139 3.886 3.886 3.968 -0.082 18112 603 1 . 1 1 139 139 VAL C C 139 175.889 175.889 175.793 0.096 18112 604 1 . 1 1 139 139 VAL CA C 139 62.793 62.793 62.529 0.264 18112 605 1 . 1 1 139 139 VAL CB C 139 30.662 30.662 31.874 -1.212 18112 606 1 . 1 1 139 139 VAL H H 139 6.610 6.610 7.606 -0.996 18112 607 1 . 1 1 140 140 ASP N N 140 123.363 123.363 119.512 3.851 18112 608 1 . 1 1 140 140 ASP C C 140 175.234 175.234 175.191 0.043 18112 609 1 . 1 1 140 140 ASP CA C 140 50.221 50.221 53.822 -3.601 18112 610 1 . 1 1 140 140 ASP CB C 140 42.254 42.254 41.155 1.099 18112 611 1 . 1 1 140 140 ASP H H 140 7.553 7.553 7.740 -0.187 18112 612 1 . 1 1 141 141 PRO HA H 141 4.682 4.682 4.494 0.188 18112 613 1 . 1 1 141 141 PRO C C 141 178.678 178.678 177.976 0.702 18112 614 1 . 1 1 141 141 PRO CA C 141 64.532 64.532 64.454 0.078 18112 615 1 . 1 1 141 141 PRO CB C 141 31.331 31.331 32.065 -0.734 18112 616 1 . 1 1 142 142 SER N N 142 114.421 114.421 114.210 0.211 18112 617 1 . 1 1 142 142 SER HA H 142 4.565 4.565 4.432 0.133 18112 618 1 . 1 1 142 142 SER C C 142 176.524 176.524 176.334 0.190 18112 619 1 . 1 1 142 142 SER CA C 142 58.711 58.711 60.205 -1.494 18112 620 1 . 1 1 142 142 SER CB C 142 62.783 62.783 62.661 0.122 18112 621 1 . 1 1 142 142 SER H H 142 8.703 8.703 8.351 0.352 18112 622 1 . 1 1 143 143 TRP N N 143 123.598 123.598 122.454 1.144 18112 623 1 . 1 1 143 143 TRP HA H 143 4.136 4.136 4.229 -0.093 18112 624 1 . 1 1 143 143 TRP C C 143 177.113 177.113 177.167 -0.054 18112 625 1 . 1 1 143 143 TRP CA C 143 59.803 59.803 60.234 -0.430 18112 626 1 . 1 1 143 143 TRP CB C 143 26.364 26.364 28.333 -1.969 18112 627 1 . 1 1 143 143 TRP H H 143 8.374 8.374 8.115 0.259 18112 628 1 . 1 1 144 144 LYS N N 144 119.293 119.293 118.781 0.512 18112 629 1 . 1 1 144 144 LYS HA H 144 2.719 2.719 3.316 -0.597 18112 630 1 . 1 1 144 144 LYS C C 144 177.243 177.243 178.167 -0.924 18112 631 1 . 1 1 144 144 LYS CA C 144 58.851 58.851 59.096 -0.245 18112 632 1 . 1 1 144 144 LYS CB C 144 29.373 29.373 31.223 -1.850 18112 633 1 . 1 1 144 144 LYS H H 144 7.196 7.196 7.570 -0.374 18112 634 1 . 1 1 145 145 LYS N N 145 116.440 116.440 119.572 -3.132 18112 635 1 . 1 1 145 145 LYS HA H 145 3.490 3.490 4.056 -0.566 18112 636 1 . 1 1 145 145 LYS C C 145 179.149 179.149 178.746 0.403 18112 637 1 . 1 1 145 145 LYS CA C 145 59.271 59.271 58.877 0.394 18112 638 1 . 1 1 145 145 LYS CB C 145 30.521 30.521 31.904 -1.383 18112 639 1 . 1 1 145 145 LYS H H 145 7.389 7.389 7.792 -0.402 18112 640 1 . 1 1 146 146 ALA N N 146 118.582 118.582 122.799 -4.217 18112 641 1 . 1 1 146 146 ALA HA H 146 3.932 3.932 4.036 -0.104 18112 642 1 . 1 1 146 146 ALA C C 146 179.968 179.968 179.592 0.376 18112 643 1 . 1 1 146 146 ALA CA C 146 54.241 54.241 55.009 -0.768 18112 644 1 . 1 1 146 146 ALA CB C 146 17.689 17.689 18.200 -0.512 18112 645 1 . 1 1 146 146 ALA H H 146 7.112 7.112 7.900 -0.788 18112 646 1 . 1 1 147 147 ILE N N 147 118.537 118.537 119.294 -0.757 18112 647 1 . 1 1 147 147 ILE HA H 147 3.642 3.642 3.498 0.144 18112 648 1 . 1 1 147 147 ILE C C 147 178.919 178.919 178.001 0.918 18112 649 1 . 1 1 147 147 ILE CA C 147 64.418 64.418 64.283 0.135 18112 650 1 . 1 1 147 147 ILE CB C 147 36.519 36.519 36.661 -0.142 18112 651 1 . 1 1 147 147 ILE H H 147 6.734 6.734 7.838 -1.104 18112 652 1 . 1 1 148 148 TYR N N 148 121.033 121.033 118.108 2.925 18112 653 1 . 1 1 148 148 TYR HA H 148 4.489 4.489 4.051 0.438 18112 654 1 . 1 1 148 148 TYR C C 148 178.348 178.348 178.409 -0.061 18112 655 1 . 1 1 148 148 TYR CA C 148 57.389 57.389 59.494 -2.105 18112 656 1 . 1 1 148 148 TYR CB C 148 35.280 35.280 36.914 -1.634 18112 657 1 . 1 1 148 148 TYR H H 148 8.126 8.126 7.949 0.177 18112 658 1 . 1 1 149 149 LYS N N 149 114.484 114.484 119.914 -5.430 18112 659 1 . 1 1 149 149 LYS C C 149 178.051 178.051 178.896 -0.845 18112 660 1 . 1 1 149 149 LYS CA C 149 59.036 59.036 59.423 -0.387 18112 661 1 . 1 1 149 149 LYS CB C 149 31.575 31.575 32.456 -0.881 18112 662 1 . 1 1 149 149 LYS H H 149 7.364 7.364 7.924 -0.560 18112 663 1 . 1 1 150 150 VAL N N 150 117.812 117.812 116.856 0.956 18112 664 1 . 1 1 150 150 VAL HA H 150 3.770 3.770 3.779 -0.009 18112 665 1 . 1 1 150 150 VAL C C 150 178.786 178.786 177.686 1.100 18112 666 1 . 1 1 150 150 VAL CA C 150 65.070 65.070 65.722 -0.653 18112 667 1 . 1 1 150 150 VAL CB C 150 29.515 29.515 31.488 -1.973 18112 668 1 . 1 1 150 150 VAL H H 150 7.254 7.254 7.848 -0.594 18112 669 1 . 1 1 151 151 ILE N N 151 117.884 117.884 114.847 3.037 18112 670 1 . 1 1 151 151 ILE C C 151 180.539 180.539 177.265 3.274 18112 671 1 . 1 1 151 151 ILE CA C 151 61.490 61.490 63.270 -1.780 18112 672 1 . 1 1 151 151 ILE CB C 151 33.994 33.994 38.076 -4.082 18112 673 1 . 1 1 151 151 ILE H H 151 8.154 8.154 7.924 0.230 18112 674 1 . 1 1 152 152 CYS N N 152 118.649 118.649 120.359 -1.710 18112 675 1 . 1 1 152 152 CYS HA H 152 4.153 4.153 4.460 -0.307 18112 676 1 . 1 1 152 152 CYS C C 152 174.888 174.888 176.320 -1.432 18112 677 1 . 1 1 152 152 CYS CA C 152 61.052 61.052 60.244 0.808 18112 678 1 . 1 1 152 152 CYS CB C 152 36.364 36.364 27.650 8.714 18112 679 1 . 1 1 152 152 CYS H H 152 8.711 8.711 8.144 0.567 18112 680 1 . 1 1 153 153 LYS N N 153 118.498 118.498 120.239 -1.741 18112 681 1 . 1 1 153 153 LYS C C 153 177.389 177.389 177.522 -0.133 18112 682 1 . 1 1 153 153 LYS CA C 153 56.243 56.243 58.088 -1.845 18112 683 1 . 1 1 153 153 LYS CB C 153 31.343 31.343 31.988 -0.644 18112 684 1 . 1 1 153 153 LYS H H 153 6.782 6.782 7.864 -1.082 18112 685 1 . 1 1 154 154 LEU N N 154 117.318 117.318 117.764 -0.446 18112 686 1 . 1 1 154 154 LEU HA H 154 4.576 4.576 4.262 0.314 18112 687 1 . 1 1 154 154 LEU C C 154 177.161 177.161 177.204 -0.043 18112 688 1 . 1 1 154 154 LEU CA C 154 53.782 53.782 55.571 -1.789 18112 689 1 . 1 1 154 154 LEU CB C 154 40.881 40.881 42.320 -1.439 18112 690 1 . 1 1 154 154 LEU H H 154 7.616 7.616 7.407 0.209 18112 691 1 . 1 1 155 155 ASP N N 155 121.564 121.564 118.546 3.018 18112 692 1 . 1 1 155 155 ASP C C 155 177.094 177.094 175.594 1.500 18112 693 1 . 1 1 155 155 ASP CA C 155 55.732 55.732 54.541 1.191 18112 694 1 . 1 1 155 155 ASP CB C 155 40.139 40.139 41.882 -1.742 18112 695 1 . 1 1 155 155 ASP H H 155 7.582 7.582 7.670 -0.088 18112 696 1 . 1 1 156 156 SER N N 156 117.352 117.352 117.369 -0.017 18112 697 1 . 1 1 156 156 SER HA H 156 4.818 4.818 4.549 0.269 18112 698 1 . 1 1 156 156 SER C C 156 173.409 173.409 173.836 -0.427 18112 699 1 . 1 1 156 156 SER CA C 156 57.073 57.073 58.105 -1.032 18112 700 1 . 1 1 156 156 SER CB C 156 65.150 65.150 64.516 0.634 18112 701 1 . 1 1 156 156 SER H H 156 8.846 8.846 8.378 0.468 18112 702 1 . 1 1 157 157 GLU N N 157 120.688 120.688 120.170 0.518 18112 703 1 . 1 1 157 157 GLU HA H 157 4.038 4.038 4.503 -0.465 18112 704 1 . 1 1 157 157 GLU C C 157 176.332 176.332 175.663 0.668 18112 705 1 . 1 1 157 157 GLU CA C 157 56.464 56.464 55.739 0.725 18112 706 1 . 1 1 157 157 GLU CB C 157 29.206 29.206 30.829 -1.623 18112 707 1 . 1 1 157 157 GLU H H 157 8.356 8.356 8.085 0.271 18112 708 1 . 1 1 158 158 VAL N N 158 126.906 126.906 116.918 9.988 18112 709 1 . 1 1 158 158 VAL HA H 158 3.449 3.449 4.343 -0.894 18112 710 1 . 1 1 158 158 VAL C C 158 176.382 176.382 174.271 2.111 18112 711 1 . 1 1 158 158 VAL CA C 158 59.584 59.584 59.139 0.445 18112 712 1 . 1 1 158 158 VAL CB C 158 31.160 31.160 31.754 -0.595 18112 713 1 . 1 1 158 158 VAL H H 158 8.561 8.561 7.975 0.586 18112 714 1 . 1 1 159 159 PRO HA H 159 4.403 4.403 4.346 0.057 18112 715 1 . 1 1 159 159 PRO C C 159 176.757 176.757 176.148 0.609 18112 716 1 . 1 1 159 159 PRO CA C 159 63.845 63.845 63.057 0.788 18112 717 1 . 1 1 159 159 PRO CB C 159 32.106 32.106 31.630 0.476 18112 718 1 . 1 1 160 160 GLU N N 160 122.904 122.904 121.368 1.536 18112 719 1 . 1 1 160 160 GLU HA H 160 4.008 4.008 4.035 -0.027 18112 720 1 . 1 1 160 160 GLU C C 160 179.132 179.132 175.803 3.329 18112 721 1 . 1 1 160 160 GLU CA C 160 59.407 59.407 57.272 2.135 18112 722 1 . 1 1 160 160 GLU CB C 160 28.991 28.991 30.257 -1.266 18112 723 1 . 1 1 160 160 GLU H H 160 8.650 8.650 8.342 0.308 18112 724 1 . 1 1 161 161 ILE N N 161 119.782 119.782 118.370 1.412 18112 725 1 . 1 1 161 161 ILE HA H 161 4.146 4.146 4.210 -0.064 18112 726 1 . 1 1 161 161 ILE C C 161 176.176 176.176 174.668 1.508 18112 727 1 . 1 1 161 161 ILE CA C 161 62.034 62.034 60.201 1.833 18112 728 1 . 1 1 161 161 ILE CB C 161 37.113 37.113 39.317 -2.204 18112 729 1 . 1 1 161 161 ILE H H 161 8.448 8.448 7.569 0.879 18112 730 1 . 1 1 162 162 PHE N N 162 117.594 117.594 125.849 -8.255 18112 731 1 . 1 1 162 162 PHE C C 162 176.115 176.115 177.031 -0.916 18112 732 1 . 1 1 162 162 PHE CA C 162 61.009 61.009 59.814 1.195 18112 733 1 . 1 1 162 162 PHE CB C 162 38.394 38.394 39.001 -0.607 18112 734 1 . 1 1 162 162 PHE H H 162 8.145 8.145 8.728 -0.583 18112 735 1 . 1 1 163 163 LYS N N 163 116.083 116.083 119.601 -3.518 18112 736 1 . 1 1 163 163 LYS C C 163 178.196 178.196 176.489 1.707 18112 737 1 . 1 1 163 163 LYS CA C 163 58.136 58.136 58.179 -0.043 18112 738 1 . 1 1 163 163 LYS CB C 163 31.694 31.694 32.783 -1.090 18112 739 1 . 1 1 163 163 LYS H H 163 8.232 8.232 8.085 0.148 18112 740 1 . 1 1 164 164 SER N N 164 113.680 113.680 111.577 2.103 18112 741 1 . 1 1 164 164 SER CA C 164 55.205 55.205 56.441 -1.236 18112 742 1 . 1 1 164 164 SER CB C 164 63.265 63.265 64.337 -1.072 18112 743 1 . 1 1 164 164 SER H H 164 7.708 7.708 7.648 0.060 18112 744 1 . 1 1 165 165 PRO HA H 165 4.580 4.580 4.373 0.207 18112 745 1 . 1 1 165 165 PRO C C 165 177.541 177.541 176.759 0.782 18112 746 1 . 1 1 165 165 PRO CA C 165 63.950 63.950 64.243 -0.293 18112 747 1 . 1 1 165 165 PRO CB C 165 30.686 30.686 31.617 -0.931 18112 748 1 . 1 1 166 166 ASN N N 166 116.304 116.304 116.859 -0.555 18112 749 1 . 1 1 166 166 ASN HA H 166 5.029 5.029 4.458 0.571 18112 750 1 . 1 1 166 166 ASN C C 166 175.811 175.811 176.340 -0.529 18112 751 1 . 1 1 166 166 ASN CA C 166 51.962 51.962 54.496 -2.534 18112 752 1 . 1 1 166 166 ASN CB C 166 37.915 37.915 37.886 0.029 18112 753 1 . 1 1 166 166 ASN H H 166 8.216 8.216 8.584 -0.368 18112 754 1 . 1 1 167 167 CYS N N 167 116.078 116.078 119.729 -3.651 18112 755 1 . 1 1 167 167 CYS HA H 167 4.011 4.011 4.378 -0.367 18112 756 1 . 1 1 167 167 CYS C C 167 175.057 175.057 176.049 -0.992 18112 757 1 . 1 1 167 167 CYS CA C 167 59.816 59.816 60.581 -0.765 18112 758 1 . 1 1 167 167 CYS CB C 167 27.446 27.446 27.432 0.014 18112 759 1 . 1 1 167 167 CYS H H 167 7.246 7.246 7.892 -0.646 18112 760 1 . 1 1 168 168 LEU N N 168 120.082 120.082 120.595 -0.513 18112 761 1 . 1 1 168 168 LEU HA H 168 3.880 3.880 4.200 -0.320 18112 762 1 . 1 1 168 168 LEU C C 168 178.541 178.541 178.117 0.424 18112 763 1 . 1 1 168 168 LEU CA C 168 57.734 57.734 56.775 0.958 18112 764 1 . 1 1 168 168 LEU CB C 168 38.825 38.825 40.269 -1.444 18112 765 1 . 1 1 168 168 LEU H H 168 8.451 8.451 7.909 0.542 18112 766 1 . 1 1 169 169 GLN N N 169 116.700 116.700 119.966 -3.266 18112 767 1 . 1 1 169 169 GLN HA H 169 4.064 4.064 3.997 0.067 18112 768 1 . 1 1 169 169 GLN C C 169 177.378 177.378 177.654 -0.276 18112 769 1 . 1 1 169 169 GLN CA C 169 57.675 57.675 58.568 -0.893 18112 770 1 . 1 1 169 169 GLN CB C 169 27.710 27.710 28.354 -0.644 18112 771 1 . 1 1 169 169 GLN H H 169 7.665 7.665 7.903 -0.237 18112 772 1 . 1 1 170 170 GLU N N 170 116.701 116.701 118.004 -1.303 18112 773 1 . 1 1 170 170 GLU HA H 170 4.214 4.214 4.170 0.044 18112 774 1 . 1 1 170 170 GLU C C 170 177.730 177.730 177.982 -0.252 18112 775 1 . 1 1 170 170 GLU CA C 170 56.899 56.899 58.090 -1.191 18112 776 1 . 1 1 170 170 GLU H H 170 7.405 7.405 7.774 -0.369 18112 777 1 . 1 1 171 171 LEU N N 171 118.021 118.021 116.603 1.418 18112 778 1 . 1 1 171 171 LEU HA H 171 4.209 4.209 4.343 -0.134 18112 779 1 . 1 1 171 171 LEU C C 171 177.005 177.005 177.532 -0.527 18112 780 1 . 1 1 171 171 LEU CA C 171 55.870 55.870 55.856 0.014 18112 781 1 . 1 1 171 171 LEU CB C 171 43.680 43.680 42.300 1.380 18112 782 1 . 1 1 171 171 LEU H H 171 7.823 7.823 7.489 0.334 18112 783 1 . 1 1 172 172 LEU N N 172 117.580 117.580 118.988 -1.408 18112 784 1 . 1 1 172 172 LEU HA H 172 4.571 4.571 4.370 0.201 18112 785 1 . 1 1 172 172 LEU C C 172 176.411 176.411 175.846 0.565 18112 786 1 . 1 1 172 172 LEU CA C 172 53.972 53.972 54.643 -0.671 18112 787 1 . 1 1 172 172 LEU CB C 172 40.483 40.483 40.081 0.402 18112 788 1 . 1 1 172 172 LEU H H 172 7.306 7.306 7.459 -0.153 18112 789 1 . 1 1 173 173 HIS N N 173 123.310 123.310 123.069 0.240 18112 790 1 . 1 1 173 173 HIS C C 173 179.022 179.022 174.088 4.934 18112 791 1 . 1 1 173 173 HIS CA C 173 56.693 56.693 55.618 1.075 18112 792 1 . 1 1 173 173 HIS CB C 173 29.371 29.371 31.345 -1.974 18112 793 1 . 1 1 173 173 HIS H H 173 8.028 8.028 8.174 -0.146 18112 stop_ save_