data_18496 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 18496 _Entry.PDB_ID 2LTT 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 18496 _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 2 2 ALA HA H 2 4.074 4.074 4.518 -0.444 18496 2 1 1 . 1 1 2 2 ALA CA C 2 51.966 51.966 51.596 0.370 18496 3 1 1 . 1 1 2 2 ALA CB C 2 19.732 19.732 20.028 -0.296 18496 4 1 1 . 1 1 3 3 ASP HA H 3 4.632 4.632 4.463 0.169 18496 5 1 1 . 1 1 3 3 ASP C C 3 175.822 175.822 176.020 -0.198 18496 6 1 1 . 1 1 3 3 ASP CA C 3 54.440 54.440 55.444 -1.004 18496 7 1 1 . 1 1 3 3 ASP CB C 3 41.577 41.577 41.188 0.389 18496 8 1 1 . 1 1 4 4 LYS N N 4 121.655 121.655 119.172 2.483 18496 9 1 1 . 1 1 4 4 LYS HA H 4 4.379 4.379 4.582 -0.203 18496 10 1 1 . 1 1 4 4 LYS C C 4 176.011 176.011 175.550 0.461 18496 11 1 1 . 1 1 4 4 LYS CA C 4 56.213 56.213 54.791 1.422 18496 12 1 1 . 1 1 4 4 LYS CB C 4 33.407 33.407 32.481 0.926 18496 13 1 1 . 1 1 4 4 LYS H H 4 8.394 8.394 7.950 0.444 18496 14 1 1 . 1 1 5 5 LEU N N 5 125.369 125.369 125.118 0.251 18496 15 1 1 . 1 1 5 5 LEU HA H 5 4.351 4.351 4.365 -0.014 18496 16 1 1 . 1 1 5 5 LEU C C 5 175.682 175.682 176.619 -0.937 18496 17 1 1 . 1 1 5 5 LEU CA C 5 55.117 55.117 54.593 0.524 18496 18 1 1 . 1 1 5 5 LEU CB C 5 43.197 43.197 42.874 0.322 18496 19 1 1 . 1 1 5 5 LEU H H 5 8.136 8.136 8.279 -0.143 18496 20 1 1 . 1 1 6 6 LYS N N 6 126.844 126.844 126.873 -0.029 18496 21 1 1 . 1 1 6 6 LYS HA H 6 4.451 4.451 4.414 0.037 18496 22 1 1 . 1 1 6 6 LYS C C 6 174.665 174.665 175.400 -0.735 18496 23 1 1 . 1 1 6 6 LYS CA C 6 55.974 55.974 56.513 -0.539 18496 24 1 1 . 1 1 6 6 LYS CB C 6 34.386 34.386 33.291 1.095 18496 25 1 1 . 1 1 6 6 LYS H H 6 8.615 8.615 8.592 0.023 18496 26 1 1 . 1 1 7 7 PHE N N 7 119.818 119.818 117.990 1.828 18496 27 1 1 . 1 1 7 7 PHE HA H 7 5.343 5.343 5.468 -0.125 18496 28 1 1 . 1 1 7 7 PHE C C 7 173.569 173.569 173.555 0.014 18496 29 1 1 . 1 1 7 7 PHE CA C 7 55.813 55.813 56.021 -0.208 18496 30 1 1 . 1 1 7 7 PHE CB C 7 42.975 42.975 42.287 0.688 18496 31 1 1 . 1 1 7 7 PHE H H 7 7.734 7.734 8.028 -0.294 18496 32 1 1 . 1 1 8 8 GLU N N 8 119.165 119.165 119.068 0.097 18496 33 1 1 . 1 1 8 8 GLU HA H 8 4.158 4.158 4.203 -0.045 18496 34 1 1 . 1 1 8 8 GLU C C 8 175.026 175.026 174.263 0.763 18496 35 1 1 . 1 1 8 8 GLU CA C 8 55.221 55.221 54.639 0.582 18496 36 1 1 . 1 1 8 8 GLU CB C 8 33.699 33.699 32.842 0.857 18496 37 1 1 . 1 1 8 8 GLU H H 8 8.295 8.295 8.758 -0.463 18496 38 1 1 . 1 1 9 9 ILE N N 9 127.619 127.619 127.599 0.020 18496 39 1 1 . 1 1 9 9 ILE HA H 9 3.768 3.768 4.167 -0.399 18496 40 1 1 . 1 1 9 9 ILE C C 9 174.902 174.902 175.787 -0.885 18496 41 1 1 . 1 1 9 9 ILE CA C 9 62.505 62.505 62.480 0.025 18496 42 1 1 . 1 1 9 9 ILE CB C 9 36.094 36.094 37.686 -1.592 18496 43 1 1 . 1 1 9 9 ILE H H 9 9.157 9.157 8.654 0.503 18496 44 1 1 . 1 1 10 10 ILE N N 10 131.245 131.245 128.778 2.467 18496 45 1 1 . 1 1 10 10 ILE HA H 10 3.861 3.861 4.115 -0.254 18496 46 1 1 . 1 1 10 10 ILE C C 10 176.247 176.247 176.367 -0.120 18496 47 1 1 . 1 1 10 10 ILE CA C 10 60.554 60.554 62.125 -1.571 18496 48 1 1 . 1 1 10 10 ILE CB C 10 37.406 37.406 38.422 -1.016 18496 49 1 1 . 1 1 10 10 ILE H H 10 8.428 8.428 8.897 -0.469 18496 50 1 1 . 1 1 11 11 GLU N N 11 117.669 117.669 118.945 -1.276 18496 51 1 1 . 1 1 11 11 GLU HA H 11 4.315 4.315 4.550 -0.235 18496 52 1 1 . 1 1 11 11 GLU C C 11 174.155 174.155 174.587 -0.432 18496 53 1 1 . 1 1 11 11 GLU CA C 11 55.755 55.755 55.391 0.364 18496 54 1 1 . 1 1 11 11 GLU CB C 11 34.386 34.386 32.974 1.412 18496 55 1 1 . 1 1 11 11 GLU H H 11 7.551 7.551 8.004 -0.453 18496 56 1 1 . 1 1 12 12 GLU N N 12 128.587 128.587 126.028 2.559 18496 57 1 1 . 1 1 12 12 GLU HA H 12 5.214 5.214 4.592 0.622 18496 58 1 1 . 1 1 12 12 GLU C C 12 176.877 176.877 175.740 1.137 18496 59 1 1 . 1 1 12 12 GLU CA C 12 54.801 54.801 56.902 -2.101 18496 60 1 1 . 1 1 12 12 GLU CB C 12 30.137 30.137 30.129 0.008 18496 61 1 1 . 1 1 12 12 GLU H H 12 8.762 8.762 8.919 -0.157 18496 62 1 1 . 1 1 13 13 LEU N N 13 122.508 122.508 124.892 -2.384 18496 63 1 1 . 1 1 13 13 LEU HA H 13 4.872 4.872 4.708 0.164 18496 64 1 1 . 1 1 13 13 LEU C C 13 176.060 176.060 177.147 -1.087 18496 65 1 1 . 1 1 13 13 LEU CA C 13 57.372 57.372 55.955 1.417 18496 66 1 1 . 1 1 13 13 LEU CB C 13 42.284 42.284 43.295 -1.011 18496 67 1 1 . 1 1 13 13 LEU H H 13 8.058 8.058 8.657 -0.599 18496 68 1 1 . 1 1 14 14 ILE N N 14 115.422 115.422 117.653 -2.231 18496 69 1 1 . 1 1 14 14 ILE HA H 14 4.553 4.553 4.481 0.072 18496 70 1 1 . 1 1 14 14 ILE C C 14 174.893 174.893 174.115 0.778 18496 71 1 1 . 1 1 14 14 ILE CA C 14 60.586 60.586 59.392 1.194 18496 72 1 1 . 1 1 14 14 ILE CB C 14 44.329 44.329 41.234 3.095 18496 73 1 1 . 1 1 14 14 ILE H H 14 8.450 8.450 8.336 0.114 18496 74 1 1 . 1 1 15 15 VAL N N 15 129.108 129.108 124.781 4.327 18496 75 1 1 . 1 1 15 15 VAL HA H 15 4.196 4.196 4.359 -0.163 18496 76 1 1 . 1 1 15 15 VAL C C 15 175.180 175.180 174.862 0.318 18496 77 1 1 . 1 1 15 15 VAL CA C 15 63.288 63.288 61.342 1.946 18496 78 1 1 . 1 1 15 15 VAL CB C 15 32.117 32.117 33.261 -1.144 18496 79 1 1 . 1 1 15 15 VAL H H 15 8.867 8.867 8.466 0.401 18496 80 1 1 . 1 1 16 16 LEU N N 16 127.846 127.846 129.426 -1.580 18496 81 1 1 . 1 1 16 16 LEU HA H 16 4.317 4.317 4.634 -0.317 18496 82 1 1 . 1 1 16 16 LEU C C 16 176.070 176.070 177.234 -1.164 18496 83 1 1 . 1 1 16 16 LEU CA C 16 57.252 57.252 56.417 0.835 18496 84 1 1 . 1 1 16 16 LEU CB C 16 42.035 42.035 42.659 -0.624 18496 85 1 1 . 1 1 16 16 LEU H H 16 9.555 9.555 9.017 0.538 18496 86 1 1 . 1 1 17 17 SER N N 17 107.073 107.073 109.918 -2.845 18496 87 1 1 . 1 1 17 17 SER HA H 17 4.540 4.540 4.567 -0.027 18496 88 1 1 . 1 1 17 17 SER C C 17 172.277 172.277 172.313 -0.036 18496 89 1 1 . 1 1 17 17 SER CA C 17 57.882 57.882 58.038 -0.155 18496 90 1 1 . 1 1 17 17 SER CB C 17 64.046 64.046 64.984 -0.938 18496 91 1 1 . 1 1 17 17 SER H H 17 7.699 7.699 7.631 0.068 18496 92 1 1 . 1 1 18 18 GLU N N 18 119.235 119.235 119.822 -0.587 18496 93 1 1 . 1 1 18 18 GLU HA H 18 5.143 5.143 4.894 0.249 18496 94 1 1 . 1 1 18 18 GLU C C 18 175.469 175.469 176.393 -0.924 18496 95 1 1 . 1 1 18 18 GLU CA C 18 55.248 55.248 55.374 -0.126 18496 96 1 1 . 1 1 18 18 GLU CB C 18 33.454 33.454 30.887 2.567 18496 97 1 1 . 1 1 18 18 GLU H H 18 8.437 8.437 8.502 -0.065 18496 98 1 1 . 1 1 19 19 ASN N N 19 123.988 123.988 118.632 5.356 18496 99 1 1 . 1 1 19 19 ASN HA H 19 5.097 5.097 4.899 0.198 18496 100 1 1 . 1 1 19 19 ASN CA C 19 50.916 50.916 52.460 -1.544 18496 101 1 1 . 1 1 19 19 ASN CB C 19 39.482 39.482 39.913 -0.431 18496 102 1 1 . 1 1 19 19 ASN H H 19 8.779 8.779 8.068 0.711 18496 103 1 1 . 1 1 20 20 ALA N N 20 120.854 120.854 123.530 -2.676 18496 104 1 1 . 1 1 20 20 ALA HA H 20 4.239 4.239 4.177 0.062 18496 105 1 1 . 1 1 20 20 ALA C C 20 179.032 179.032 177.724 1.308 18496 106 1 1 . 1 1 20 20 ALA CA C 20 54.924 54.924 54.491 0.433 18496 107 1 1 . 1 1 20 20 ALA CB C 20 18.621 18.621 18.501 0.120 18496 108 1 1 . 1 1 20 20 ALA H H 20 8.616 8.616 8.468 0.148 18496 109 1 1 . 1 1 21 21 LYS N N 21 115.771 115.771 116.721 -0.950 18496 110 1 1 . 1 1 21 21 LYS HA H 21 4.497 4.497 4.250 0.247 18496 111 1 1 . 1 1 21 21 LYS C C 21 176.615 176.615 176.516 0.099 18496 112 1 1 . 1 1 21 21 LYS CA C 21 55.503 55.503 55.553 -0.050 18496 113 1 1 . 1 1 21 21 LYS CB C 21 32.742 32.742 32.070 0.672 18496 114 1 1 . 1 1 21 21 LYS H H 21 7.767 7.767 7.804 -0.037 18496 115 1 1 . 1 1 22 22 GLY N N 22 107.695 107.695 106.392 1.303 18496 116 1 1 . 1 1 22 22 GLY C C 22 174.843 174.843 173.965 0.878 18496 117 1 1 . 1 1 22 22 GLY CA C 22 45.297 45.297 45.200 0.097 18496 118 1 1 . 1 1 22 22 GLY H H 22 8.317 8.317 7.787 0.530 18496 119 1 1 . 1 1 23 23 TRP N N 23 121.316 121.316 121.254 0.062 18496 120 1 1 . 1 1 23 23 TRP HA H 23 4.815 4.815 4.805 0.010 18496 121 1 1 . 1 1 23 23 TRP C C 23 176.754 176.754 176.541 0.213 18496 122 1 1 . 1 1 23 23 TRP CA C 23 58.291 58.291 55.299 2.992 18496 123 1 1 . 1 1 23 23 TRP CB C 23 28.127 28.127 27.916 0.211 18496 124 1 1 . 1 1 23 23 TRP H H 23 7.983 7.983 8.001 -0.018 18496 125 1 1 . 1 1 24 24 ARG N N 24 120.789 120.789 127.150 -6.361 18496 126 1 1 . 1 1 24 24 ARG HA H 24 5.496 5.496 4.615 0.881 18496 127 1 1 . 1 1 24 24 ARG C C 24 175.831 175.831 175.685 0.146 18496 128 1 1 . 1 1 24 24 ARG CA C 24 54.755 54.755 54.615 0.140 18496 129 1 1 . 1 1 24 24 ARG CB C 24 33.735 33.735 29.633 4.102 18496 130 1 1 . 1 1 24 24 ARG H H 24 9.046 9.046 9.243 -0.197 18496 131 1 1 . 1 1 25 25 LYS N N 25 126.507 126.507 128.828 -2.321 18496 132 1 1 . 1 1 25 25 LYS HA H 25 5.081 5.081 4.388 0.693 18496 133 1 1 . 1 1 25 25 LYS C C 25 175.648 175.648 175.503 0.145 18496 134 1 1 . 1 1 25 25 LYS CA C 25 56.071 56.071 56.894 -0.823 18496 135 1 1 . 1 1 25 25 LYS CB C 25 32.214 32.214 32.256 -0.042 18496 136 1 1 . 1 1 25 25 LYS H H 25 8.526 8.526 8.796 -0.270 18496 137 1 1 . 1 1 26 26 GLU N N 26 126.009 126.009 123.284 2.725 18496 138 1 1 . 1 1 26 26 GLU HA H 26 5.275 5.275 4.929 0.346 18496 139 1 1 . 1 1 26 26 GLU C C 26 174.894 174.894 173.735 1.159 18496 140 1 1 . 1 1 26 26 GLU CA C 26 55.271 55.271 54.783 0.488 18496 141 1 1 . 1 1 26 26 GLU CB C 26 33.781 33.781 34.821 -1.040 18496 142 1 1 . 1 1 26 26 GLU H H 26 9.125 9.125 8.590 0.535 18496 143 1 1 . 1 1 27 27 LEU N N 27 121.930 121.930 122.756 -0.826 18496 144 1 1 . 1 1 27 27 LEU HA H 27 5.788 5.788 4.756 1.032 18496 145 1 1 . 1 1 27 27 LEU C C 27 173.941 173.941 174.207 -0.266 18496 146 1 1 . 1 1 27 27 LEU CA C 27 53.859 53.859 54.076 -0.217 18496 147 1 1 . 1 1 27 27 LEU CB C 27 44.020 44.020 44.603 -0.583 18496 148 1 1 . 1 1 27 27 LEU H H 27 8.938 8.938 8.980 -0.042 18496 149 1 1 . 1 1 28 28 ASN N N 28 124.630 124.630 124.805 -0.175 18496 150 1 1 . 1 1 28 28 ASN HA H 28 5.411 5.411 5.271 0.140 18496 151 1 1 . 1 1 28 28 ASN C C 28 174.366 174.366 173.245 1.121 18496 152 1 1 . 1 1 28 28 ASN CA C 28 52.063 52.063 52.348 -0.285 18496 153 1 1 . 1 1 28 28 ASN CB C 28 44.430 44.430 43.559 0.872 18496 154 1 1 . 1 1 28 28 ASN H H 28 9.345 9.345 8.307 1.038 18496 155 1 1 . 1 1 29 29 ARG N N 29 118.443 118.443 122.589 -4.146 18496 156 1 1 . 1 1 29 29 ARG HA H 29 5.058 5.058 4.868 0.190 18496 157 1 1 . 1 1 29 29 ARG C C 29 175.779 175.779 174.724 1.055 18496 158 1 1 . 1 1 29 29 ARG CA C 29 56.091 56.091 55.593 0.498 18496 159 1 1 . 1 1 29 29 ARG CB C 29 31.710 31.710 31.095 0.615 18496 160 1 1 . 1 1 29 29 ARG H H 29 9.109 9.109 9.145 -0.036 18496 161 1 1 . 1 1 30 30 VAL N N 30 124.605 124.605 121.815 2.790 18496 162 1 1 . 1 1 30 30 VAL HA H 30 4.535 4.535 5.398 -0.863 18496 163 1 1 . 1 1 30 30 VAL C C 30 174.775 174.775 174.473 0.302 18496 164 1 1 . 1 1 30 30 VAL CA C 30 60.921 60.921 59.181 1.740 18496 165 1 1 . 1 1 30 30 VAL CB C 30 37.790 37.790 36.336 1.454 18496 166 1 1 . 1 1 30 30 VAL H H 30 9.054 9.054 8.575 0.479 18496 167 1 1 . 1 1 31 31 SER N N 31 120.794 120.794 114.831 5.963 18496 168 1 1 . 1 1 31 31 SER HA H 31 4.652 4.652 5.120 -0.468 18496 169 1 1 . 1 1 31 31 SER C C 31 174.214 174.214 175.468 -1.254 18496 170 1 1 . 1 1 31 31 SER CA C 31 56.279 56.279 56.978 -0.699 18496 171 1 1 . 1 1 31 31 SER CB C 31 64.128 64.128 64.155 -0.027 18496 172 1 1 . 1 1 31 31 SER H H 31 8.667 8.667 8.898 -0.231 18496 173 1 1 . 1 1 32 32 TRP N N 32 132.303 132.303 128.155 4.148 18496 174 1 1 . 1 1 32 32 TRP HA H 32 5.105 5.105 4.518 0.587 18496 175 1 1 . 1 1 32 32 TRP C C 32 177.276 177.276 177.112 0.164 18496 176 1 1 . 1 1 32 32 TRP CA C 32 56.198 56.198 58.099 -1.901 18496 177 1 1 . 1 1 32 32 TRP CB C 32 29.968 29.968 28.018 1.950 18496 178 1 1 . 1 1 32 32 TRP H H 32 9.282 9.282 9.203 0.079 18496 179 1 1 . 1 1 33 33 ASN N N 33 124.979 124.979 123.258 1.721 18496 180 1 1 . 1 1 33 33 ASN HA H 33 4.257 4.257 4.365 -0.108 18496 181 1 1 . 1 1 33 33 ASN C C 33 174.030 174.030 174.726 -0.696 18496 182 1 1 . 1 1 33 33 ASN CA C 33 54.709 54.709 54.711 -0.002 18496 183 1 1 . 1 1 33 33 ASN CB C 33 37.921 37.921 37.025 0.896 18496 184 1 1 . 1 1 33 33 ASN H H 33 9.813 9.813 8.808 1.005 18496 185 1 1 . 1 1 34 34 ASP N N 34 111.880 111.880 113.850 -1.970 18496 186 1 1 . 1 1 34 34 ASP HA H 34 4.126 4.126 4.239 -0.113 18496 187 1 1 . 1 1 34 34 ASP CA C 34 56.130 56.130 55.316 0.814 18496 188 1 1 . 1 1 34 34 ASP CB C 34 39.760 39.760 40.196 -0.436 18496 189 1 1 . 1 1 34 34 ASP H H 34 9.251 9.251 8.213 1.038 18496 190 1 1 . 1 1 35 35 ALA N N 35 121.811 121.811 121.183 0.628 18496 191 1 1 . 1 1 35 35 ALA HA H 35 4.477 4.477 4.528 -0.051 18496 192 1 1 . 1 1 35 35 ALA C C 35 177.778 177.778 176.911 0.867 18496 193 1 1 . 1 1 35 35 ALA CA C 35 51.528 51.528 52.563 -1.035 18496 194 1 1 . 1 1 35 35 ALA CB C 35 20.445 20.445 20.540 -0.095 18496 195 1 1 . 1 1 35 35 ALA H H 35 7.625 7.625 7.657 -0.032 18496 196 1 1 . 1 1 36 36 GLU N N 36 121.068 121.068 122.460 -1.392 18496 197 1 1 . 1 1 36 36 GLU HA H 36 4.390 4.390 4.741 -0.351 18496 198 1 1 . 1 1 36 36 GLU CA C 36 55.276 55.276 52.373 2.903 18496 199 1 1 . 1 1 36 36 GLU CB C 36 28.575 28.575 31.004 -2.429 18496 200 1 1 . 1 1 36 36 GLU H H 36 8.658 8.658 8.164 0.494 18496 201 1 1 . 1 1 37 37 PRO HA H 37 4.289 4.289 4.755 -0.466 18496 202 1 1 . 1 1 37 37 PRO C C 37 175.799 175.799 176.051 -0.252 18496 203 1 1 . 1 1 37 37 PRO CA C 37 63.105 63.105 62.134 0.971 18496 204 1 1 . 1 1 37 37 PRO CB C 37 32.076 32.076 31.839 0.237 18496 205 1 1 . 1 1 38 38 LYS N N 38 120.881 120.881 123.498 -2.617 18496 206 1 1 . 1 1 38 38 LYS HA H 38 4.700 4.700 4.327 0.373 18496 207 1 1 . 1 1 38 38 LYS C C 38 176.906 176.906 174.788 2.118 18496 208 1 1 . 1 1 38 38 LYS CA C 38 54.399 54.399 54.922 -0.524 18496 209 1 1 . 1 1 38 38 LYS CB C 38 37.217 37.217 36.539 0.678 18496 210 1 1 . 1 1 38 38 LYS H H 38 8.316 8.316 8.869 -0.553 18496 211 1 1 . 1 1 39 39 TYR N N 39 119.792 119.792 119.335 0.457 18496 212 1 1 . 1 1 39 39 TYR HA H 39 4.636 4.636 4.593 0.043 18496 213 1 1 . 1 1 39 39 TYR C C 39 175.834 175.834 175.022 0.812 18496 214 1 1 . 1 1 39 39 TYR CA C 39 60.228 60.228 57.763 2.465 18496 215 1 1 . 1 1 39 39 TYR CB C 39 38.683 38.683 38.712 -0.029 18496 216 1 1 . 1 1 39 39 TYR H H 39 8.508 8.508 7.886 0.622 18496 217 1 1 . 1 1 40 40 ASP N N 40 126.502 126.502 122.712 3.790 18496 218 1 1 . 1 1 40 40 ASP HA H 40 5.597 5.597 5.229 0.368 18496 219 1 1 . 1 1 40 40 ASP C C 40 175.283 175.283 174.069 1.214 18496 220 1 1 . 1 1 40 40 ASP CA C 40 55.053 55.053 53.656 1.397 18496 221 1 1 . 1 1 40 40 ASP CB C 40 48.656 48.656 45.320 3.336 18496 222 1 1 . 1 1 40 40 ASP H H 40 9.219 9.219 8.663 0.556 18496 223 1 1 . 1 1 41 41 ILE N N 41 125.910 125.910 125.066 0.844 18496 224 1 1 . 1 1 41 41 ILE HA H 41 5.722 5.722 4.823 0.899 18496 225 1 1 . 1 1 41 41 ILE C C 41 174.167 174.167 173.460 0.707 18496 226 1 1 . 1 1 41 41 ILE CA C 41 60.734 60.734 59.773 0.961 18496 227 1 1 . 1 1 41 41 ILE CB C 41 40.198 40.198 39.744 0.454 18496 228 1 1 . 1 1 41 41 ILE H H 41 8.972 8.972 8.728 0.244 18496 229 1 1 . 1 1 42 42 ARG N N 42 120.300 120.300 126.399 -6.099 18496 230 1 1 . 1 1 42 42 ARG HA H 42 4.716 4.716 4.599 0.117 18496 231 1 1 . 1 1 42 42 ARG CA C 42 54.826 54.826 54.745 0.081 18496 232 1 1 . 1 1 42 42 ARG CB C 42 32.665 32.665 35.283 -2.618 18496 233 1 1 . 1 1 42 42 ARG H H 42 8.320 8.320 8.408 -0.088 18496 234 1 1 . 1 1 43 43 THR HA H 43 5.585 5.585 4.939 0.646 18496 235 1 1 . 1 1 43 43 THR C C 43 173.294 173.294 172.945 0.349 18496 236 1 1 . 1 1 43 43 THR CA C 43 60.847 60.847 59.331 1.516 18496 237 1 1 . 1 1 43 43 THR CB C 43 69.961 69.961 70.883 -0.922 18496 238 1 1 . 1 1 44 44 TRP N N 44 122.747 122.747 123.079 -0.332 18496 239 1 1 . 1 1 44 44 TRP HA H 44 4.945 4.945 4.923 0.022 18496 240 1 1 . 1 1 44 44 TRP C C 44 175.056 175.056 176.332 -1.276 18496 241 1 1 . 1 1 44 44 TRP CA C 44 56.107 56.107 54.885 1.222 18496 242 1 1 . 1 1 44 44 TRP CB C 44 34.506 34.506 31.634 2.872 18496 243 1 1 . 1 1 44 44 TRP H H 44 9.180 9.180 8.032 1.148 18496 244 1 1 . 1 1 45 45 SER N N 45 117.385 117.385 116.252 1.133 18496 245 1 1 . 1 1 45 45 SER HA H 45 2.300 2.300 4.769 -2.469 18496 246 1 1 . 1 1 45 45 SER CA C 45 56.481 56.481 57.418 -0.937 18496 247 1 1 . 1 1 45 45 SER CB C 45 60.743 60.743 61.993 -1.250 18496 248 1 1 . 1 1 45 45 SER H H 45 7.879 7.879 8.323 -0.444 18496 249 1 1 . 1 1 46 46 PRO HA H 46 4.104 4.104 4.534 -0.430 18496 250 1 1 . 1 1 46 46 PRO CA C 46 64.990 64.990 65.669 -0.679 18496 251 1 1 . 1 1 46 46 PRO CB C 46 31.272 31.272 31.977 -0.705 18496 252 1 1 . 1 1 47 47 ASP HA H 47 4.520 4.520 4.650 -0.130 18496 253 1 1 . 1 1 47 47 ASP C C 47 175.629 175.629 175.653 -0.024 18496 254 1 1 . 1 1 47 47 ASP CA C 47 53.453 53.453 53.256 0.197 18496 255 1 1 . 1 1 47 47 ASP CB C 47 40.239 40.239 40.791 -0.552 18496 256 1 1 . 1 1 48 48 HIS N N 48 111.320 111.320 115.401 -4.081 18496 257 1 1 . 1 1 48 48 HIS HA H 48 3.916 3.916 4.409 -0.493 18496 258 1 1 . 1 1 48 48 HIS CA C 48 60.347 60.347 57.082 3.265 18496 259 1 1 . 1 1 48 48 HIS CB C 48 25.499 25.499 27.976 -2.477 18496 260 1 1 . 1 1 48 48 HIS H H 48 8.269 8.269 8.183 0.086 18496 261 1 1 . 1 1 49 49 GLU N N 49 114.659 114.659 117.852 -3.193 18496 262 1 1 . 1 1 49 49 GLU HA H 49 4.447 4.447 4.262 0.185 18496 263 1 1 . 1 1 49 49 GLU C C 49 176.394 176.394 176.181 0.213 18496 264 1 1 . 1 1 49 49 GLU CA C 49 57.940 57.940 57.379 0.561 18496 265 1 1 . 1 1 49 49 GLU CB C 49 30.641 30.641 30.618 0.023 18496 266 1 1 . 1 1 49 49 GLU H H 49 7.381 7.381 8.501 -1.120 18496 267 1 1 . 1 1 50 50 LYS N N 50 118.126 118.126 118.124 0.002 18496 268 1 1 . 1 1 50 50 LYS HA H 50 4.665 4.665 4.502 0.164 18496 269 1 1 . 1 1 50 50 LYS CA C 50 54.431 54.431 55.002 -0.571 18496 270 1 1 . 1 1 50 50 LYS CB C 50 36.543 36.543 35.495 1.048 18496 271 1 1 . 1 1 50 50 LYS H H 50 8.067 8.067 7.614 0.453 18496 272 1 1 . 1 1 51 51 MET HA H 51 4.936 4.936 5.025 -0.089 18496 273 1 1 . 1 1 51 51 MET CA C 51 54.048 54.048 53.472 0.576 18496 274 1 1 . 1 1 51 51 MET CB C 51 33.768 33.768 35.245 -1.477 18496 275 1 1 . 1 1 52 52 GLY C C 52 173.534 173.534 172.631 0.903 18496 276 1 1 . 1 1 52 52 GLY CA C 52 43.060 43.060 44.326 -1.266 18496 277 1 1 . 1 1 53 53 LYS N N 53 118.012 118.012 121.026 -3.014 18496 278 1 1 . 1 1 53 53 LYS HA H 53 4.155 4.155 4.666 -0.511 18496 279 1 1 . 1 1 53 53 LYS C C 53 176.818 176.818 176.343 0.475 18496 280 1 1 . 1 1 53 53 LYS CA C 53 56.478 56.478 55.700 0.778 18496 281 1 1 . 1 1 53 53 LYS CB C 53 33.117 33.117 33.818 -0.701 18496 282 1 1 . 1 1 53 53 LYS H H 53 8.132 8.132 8.343 -0.211 18496 283 1 1 . 1 1 54 54 GLY N N 54 109.836 109.836 109.478 0.358 18496 284 1 1 . 1 1 54 54 GLY C C 54 170.848 170.848 172.872 -2.024 18496 285 1 1 . 1 1 54 54 GLY CA C 54 46.701 46.701 44.810 1.891 18496 286 1 1 . 1 1 54 54 GLY H H 54 8.079 8.079 8.308 -0.229 18496 287 1 1 . 1 1 55 55 ILE N N 55 119.382 119.382 119.971 -0.589 18496 288 1 1 . 1 1 55 55 ILE HA H 55 4.956 4.956 4.564 0.392 18496 289 1 1 . 1 1 55 55 ILE C C 55 171.737 171.737 173.183 -1.446 18496 290 1 1 . 1 1 55 55 ILE CA C 55 57.059 57.059 60.695 -3.636 18496 291 1 1 . 1 1 55 55 ILE CB C 55 44.241 44.241 41.944 2.297 18496 292 1 1 . 1 1 55 55 ILE H H 55 8.661 8.661 8.450 0.211 18496 293 1 1 . 1 1 56 56 THR N N 56 113.795 113.795 123.111 -9.316 18496 294 1 1 . 1 1 56 56 THR HA H 56 5.607 5.607 4.809 0.798 18496 295 1 1 . 1 1 56 56 THR C C 56 174.417 174.417 173.754 0.663 18496 296 1 1 . 1 1 56 56 THR CA C 56 59.098 59.098 62.233 -3.135 18496 297 1 1 . 1 1 56 56 THR CB C 56 72.153 72.153 69.542 2.611 18496 298 1 1 . 1 1 56 56 THR H H 56 7.916 7.916 8.387 -0.471 18496 299 1 1 . 1 1 57 57 LEU N N 57 121.044 121.044 129.262 -8.218 18496 300 1 1 . 1 1 57 57 LEU HA H 57 5.311 5.311 4.610 0.701 18496 301 1 1 . 1 1 57 57 LEU C C 57 176.150 176.150 175.657 0.493 18496 302 1 1 . 1 1 57 57 LEU CA C 57 53.264 53.264 53.874 -0.610 18496 303 1 1 . 1 1 57 57 LEU CB C 57 45.901 45.901 43.210 2.691 18496 304 1 1 . 1 1 57 57 LEU H H 57 9.421 9.421 8.991 0.430 18496 305 1 1 . 1 1 58 58 SER N N 58 119.548 119.548 119.809 -0.261 18496 306 1 1 . 1 1 58 58 SER HA H 58 4.734 4.734 4.452 0.282 18496 307 1 1 . 1 1 58 58 SER C C 58 174.786 174.786 175.365 -0.579 18496 308 1 1 . 1 1 58 58 SER CA C 58 56.948 56.948 57.676 -0.728 18496 309 1 1 . 1 1 58 58 SER CB C 58 65.726 65.726 64.013 1.713 18496 310 1 1 . 1 1 58 58 SER H H 58 9.771 9.771 9.024 0.747 18496 311 1 1 . 1 1 59 59 GLU N N 59 120.827 120.827 122.897 -2.070 18496 312 1 1 . 1 1 59 59 GLU HA H 59 4.319 4.319 4.205 0.114 18496 313 1 1 . 1 1 59 59 GLU C C 59 179.806 179.806 178.914 0.892 18496 314 1 1 . 1 1 59 59 GLU CA C 59 60.913 60.913 60.819 0.094 18496 315 1 1 . 1 1 59 59 GLU CB C 59 29.538 29.538 29.375 0.163 18496 316 1 1 . 1 1 59 59 GLU H H 59 9.394 9.394 9.042 0.352 18496 317 1 1 . 1 1 60 60 GLU N N 60 119.587 119.587 119.442 0.145 18496 318 1 1 . 1 1 60 60 GLU HA H 60 4.188 4.188 4.077 0.111 18496 319 1 1 . 1 1 60 60 GLU C C 60 179.686 179.686 178.854 0.832 18496 320 1 1 . 1 1 60 60 GLU CA C 60 60.279 60.279 59.550 0.730 18496 321 1 1 . 1 1 60 60 GLU CB C 60 29.559 29.559 28.769 0.790 18496 322 1 1 . 1 1 60 60 GLU H H 60 8.905 8.905 8.902 0.003 18496 323 1 1 . 1 1 61 61 GLU N N 61 120.145 120.145 120.052 0.093 18496 324 1 1 . 1 1 61 61 GLU HA H 61 4.037 4.037 4.130 -0.093 18496 325 1 1 . 1 1 61 61 GLU C C 61 178.530 178.530 178.813 -0.283 18496 326 1 1 . 1 1 61 61 GLU CA C 61 59.118 59.118 58.815 0.303 18496 327 1 1 . 1 1 61 61 GLU CB C 61 30.976 30.976 29.446 1.530 18496 328 1 1 . 1 1 61 61 GLU H H 61 8.013 8.013 8.120 -0.107 18496 329 1 1 . 1 1 62 62 PHE N N 62 119.925 119.925 120.585 -0.660 18496 330 1 1 . 1 1 62 62 PHE HA H 62 3.927 3.927 4.037 -0.110 18496 331 1 1 . 1 1 62 62 PHE C C 62 176.783 176.783 177.848 -1.065 18496 332 1 1 . 1 1 62 62 PHE CA C 62 61.827 61.827 61.004 0.823 18496 333 1 1 . 1 1 62 62 PHE CB C 62 40.216 40.216 38.551 1.665 18496 334 1 1 . 1 1 62 62 PHE H H 62 9.192 9.192 8.982 0.210 18496 335 1 1 . 1 1 63 63 GLY N N 63 104.854 104.854 107.171 -2.317 18496 336 1 1 . 1 1 63 63 GLY C C 63 176.854 176.854 176.011 0.843 18496 337 1 1 . 1 1 63 63 GLY CA C 63 47.178 47.178 47.414 -0.236 18496 338 1 1 . 1 1 63 63 GLY H H 63 8.316 8.316 8.743 -0.427 18496 339 1 1 . 1 1 64 64 VAL N N 64 123.719 123.719 122.892 0.827 18496 340 1 1 . 1 1 64 64 VAL HA H 64 3.663 3.663 3.735 -0.072 18496 341 1 1 . 1 1 64 64 VAL C C 64 177.644 177.644 177.997 -0.353 18496 342 1 1 . 1 1 64 64 VAL CA C 64 67.090 67.090 65.360 1.730 18496 343 1 1 . 1 1 64 64 VAL CB C 64 31.367 31.367 31.069 0.298 18496 344 1 1 . 1 1 64 64 VAL H H 64 7.759 7.759 7.507 0.252 18496 345 1 1 . 1 1 65 65 LEU N N 65 120.099 120.099 121.470 -1.371 18496 346 1 1 . 1 1 65 65 LEU HA H 65 3.672 3.672 3.935 -0.263 18496 347 1 1 . 1 1 65 65 LEU C C 65 177.636 177.636 178.634 -0.998 18496 348 1 1 . 1 1 65 65 LEU CA C 65 58.552 58.552 58.597 -0.045 18496 349 1 1 . 1 1 65 65 LEU CB C 65 41.358 41.358 41.757 -0.399 18496 350 1 1 . 1 1 65 65 LEU H H 65 7.660 7.660 8.377 -0.717 18496 351 1 1 . 1 1 66 66 LEU N N 66 115.733 115.733 118.163 -2.430 18496 352 1 1 . 1 1 66 66 LEU HA H 66 3.556 3.556 3.600 -0.044 18496 353 1 1 . 1 1 66 66 LEU C C 66 179.729 179.729 178.826 0.903 18496 354 1 1 . 1 1 66 66 LEU CA C 66 58.069 58.069 58.035 0.034 18496 355 1 1 . 1 1 66 66 LEU CB C 66 41.625 41.625 40.920 0.705 18496 356 1 1 . 1 1 66 66 LEU H H 66 8.083 8.083 8.204 -0.121 18496 357 1 1 . 1 1 67 67 LYS N N 67 119.120 119.120 119.950 -0.830 18496 358 1 1 . 1 1 67 67 LYS HA H 67 3.965 3.965 3.795 0.170 18496 359 1 1 . 1 1 67 67 LYS C C 67 179.379 179.379 179.029 0.350 18496 360 1 1 . 1 1 67 67 LYS CA C 67 59.227 59.227 59.805 -0.578 18496 361 1 1 . 1 1 67 67 LYS CB C 67 32.737 32.737 32.212 0.525 18496 362 1 1 . 1 1 67 67 LYS H H 67 7.861 7.861 7.977 -0.116 18496 363 1 1 . 1 1 68 68 GLU N N 68 116.924 116.924 118.984 -2.060 18496 364 1 1 . 1 1 68 68 GLU HA H 68 4.409 4.409 4.075 0.334 18496 365 1 1 . 1 1 68 68 GLU CA C 68 57.712 57.712 58.676 -0.964 18496 366 1 1 . 1 1 68 68 GLU CB C 68 29.586 29.586 29.444 0.142 18496 367 1 1 . 1 1 68 68 GLU H H 68 8.319 8.319 7.901 0.418 18496 368 1 1 . 1 1 69 69 LEU N N 69 120.032 120.032 119.981 0.051 18496 369 1 1 . 1 1 69 69 LEU HA H 69 4.107 4.107 3.934 0.173 18496 370 1 1 . 1 1 69 69 LEU CA C 69 57.563 57.563 57.541 0.022 18496 371 1 1 . 1 1 69 69 LEU CB C 69 41.373 41.373 41.473 -0.100 18496 372 1 1 . 1 1 69 69 LEU H H 69 8.233 8.233 8.586 -0.353 18496 373 1 1 . 1 1 70 70 GLY N N 70 105.472 105.472 105.402 0.070 18496 374 1 1 . 1 1 70 70 GLY C C 70 174.986 174.986 175.812 -0.826 18496 375 1 1 . 1 1 70 70 GLY CA C 70 46.704 46.704 46.827 -0.123 18496 376 1 1 . 1 1 70 70 GLY H H 70 7.960 7.960 8.572 -0.612 18496 377 1 1 . 1 1 71 71 ASN N N 71 118.596 118.596 119.382 -0.786 18496 378 1 1 . 1 1 71 71 ASN HA H 71 4.681 4.681 4.830 -0.149 18496 379 1 1 . 1 1 71 71 ASN C C 71 176.412 176.412 177.713 -1.301 18496 380 1 1 . 1 1 71 71 ASN CA C 71 54.407 54.407 55.169 -0.762 18496 381 1 1 . 1 1 71 71 ASN CB C 71 38.729 38.729 38.681 0.048 18496 382 1 1 . 1 1 71 71 ASN H H 71 7.857 7.857 7.691 0.166 18496 383 1 1 . 1 1 72 72 LYS N N 72 119.973 119.973 120.945 -0.972 18496 384 1 1 . 1 1 72 72 LYS HA H 72 4.282 4.282 4.115 0.167 18496 385 1 1 . 1 1 72 72 LYS CA C 72 57.338 57.338 58.200 -0.862 18496 386 1 1 . 1 1 72 72 LYS CB C 72 32.755 32.755 31.993 0.762 18496 387 1 1 . 1 1 72 72 LYS H H 72 8.100 8.100 8.002 0.098 18496 388 1 1 . 1 1 73 73 LEU HA H 73 4.281 4.281 4.336 -0.055 18496 389 1 1 . 1 1 73 73 LEU CA C 73 55.774 55.774 54.741 1.033 18496 390 1 1 . 1 1 73 73 LEU CB C 73 41.983 41.983 42.052 -0.069 18496 391 1 2 . 1 1 2 2 ALA HA H 2 4.074 4.074 4.544 -0.470 18496 392 1 2 . 1 1 2 2 ALA CA C 2 51.966 51.966 51.472 0.494 18496 393 1 2 . 1 1 2 2 ALA CB C 2 19.732 19.732 20.043 -0.311 18496 394 1 2 . 1 1 3 3 ASP HA H 3 4.632 4.632 4.512 0.120 18496 395 1 2 . 1 1 3 3 ASP C C 3 175.822 175.822 176.307 -0.485 18496 396 1 2 . 1 1 3 3 ASP CA C 3 54.440 54.440 55.517 -1.077 18496 397 1 2 . 1 1 3 3 ASP CB C 3 41.577 41.577 41.287 0.290 18496 398 1 2 . 1 1 4 4 LYS N N 4 121.655 121.655 119.723 1.932 18496 399 1 2 . 1 1 4 4 LYS HA H 4 4.379 4.379 4.524 -0.145 18496 400 1 2 . 1 1 4 4 LYS C C 4 176.011 176.011 175.456 0.555 18496 401 1 2 . 1 1 4 4 LYS CA C 4 56.213 56.213 55.190 1.023 18496 402 1 2 . 1 1 4 4 LYS CB C 4 33.407 33.407 31.974 1.433 18496 403 1 2 . 1 1 4 4 LYS H H 4 8.394 8.394 7.983 0.411 18496 404 1 2 . 1 1 5 5 LEU N N 5 125.369 125.369 124.769 0.600 18496 405 1 2 . 1 1 5 5 LEU HA H 5 4.351 4.351 4.346 0.005 18496 406 1 2 . 1 1 5 5 LEU C C 5 175.682 175.682 176.689 -1.007 18496 407 1 2 . 1 1 5 5 LEU CA C 5 55.117 55.117 54.789 0.328 18496 408 1 2 . 1 1 5 5 LEU CB C 5 43.197 43.197 42.956 0.241 18496 409 1 2 . 1 1 5 5 LEU H H 5 8.136 8.136 8.202 -0.066 18496 410 1 2 . 1 1 6 6 LYS N N 6 126.844 126.844 125.246 1.598 18496 411 1 2 . 1 1 6 6 LYS HA H 6 4.451 4.451 4.514 -0.063 18496 412 1 2 . 1 1 6 6 LYS C C 6 174.665 174.665 175.343 -0.678 18496 413 1 2 . 1 1 6 6 LYS CA C 6 55.974 55.974 56.194 -0.221 18496 414 1 2 . 1 1 6 6 LYS CB C 6 34.386 34.386 33.096 1.290 18496 415 1 2 . 1 1 6 6 LYS H H 6 8.615 8.615 8.577 0.038 18496 416 1 2 . 1 1 7 7 PHE N N 7 119.818 119.818 119.344 0.474 18496 417 1 2 . 1 1 7 7 PHE HA H 7 5.343 5.343 5.530 -0.187 18496 418 1 2 . 1 1 7 7 PHE C C 7 173.569 173.569 173.838 -0.269 18496 419 1 2 . 1 1 7 7 PHE CA C 7 55.813 55.813 55.566 0.246 18496 420 1 2 . 1 1 7 7 PHE CB C 7 42.975 42.975 42.539 0.435 18496 421 1 2 . 1 1 7 7 PHE H H 7 7.734 7.734 8.236 -0.502 18496 422 1 2 . 1 1 8 8 GLU N N 8 119.165 119.165 119.988 -0.823 18496 423 1 2 . 1 1 8 8 GLU HA H 8 4.158 4.158 4.288 -0.130 18496 424 1 2 . 1 1 8 8 GLU C C 8 175.026 175.026 174.448 0.578 18496 425 1 2 . 1 1 8 8 GLU CA C 8 55.221 55.221 54.642 0.579 18496 426 1 2 . 1 1 8 8 GLU CB C 8 33.699 33.699 32.571 1.128 18496 427 1 2 . 1 1 8 8 GLU H H 8 8.295 8.295 8.839 -0.544 18496 428 1 2 . 1 1 9 9 ILE N N 9 127.619 127.619 128.314 -0.695 18496 429 1 2 . 1 1 9 9 ILE HA H 9 3.768 3.768 4.267 -0.499 18496 430 1 2 . 1 1 9 9 ILE C C 9 174.902 174.902 175.953 -1.051 18496 431 1 2 . 1 1 9 9 ILE CA C 9 62.505 62.505 62.690 -0.185 18496 432 1 2 . 1 1 9 9 ILE CB C 9 36.094 36.094 37.550 -1.456 18496 433 1 2 . 1 1 9 9 ILE H H 9 9.157 9.157 8.756 0.401 18496 434 1 2 . 1 1 10 10 ILE N N 10 131.245 131.245 128.942 2.303 18496 435 1 2 . 1 1 10 10 ILE HA H 10 3.861 3.861 4.089 -0.228 18496 436 1 2 . 1 1 10 10 ILE C C 10 176.247 176.247 176.303 -0.056 18496 437 1 2 . 1 1 10 10 ILE CA C 10 60.554 60.554 62.174 -1.620 18496 438 1 2 . 1 1 10 10 ILE CB C 10 37.406 37.406 38.391 -0.985 18496 439 1 2 . 1 1 10 10 ILE H H 10 8.428 8.428 8.964 -0.536 18496 440 1 2 . 1 1 11 11 GLU N N 11 117.669 117.669 118.721 -1.052 18496 441 1 2 . 1 1 11 11 GLU HA H 11 4.315 4.315 4.496 -0.181 18496 442 1 2 . 1 1 11 11 GLU C C 11 174.155 174.155 174.590 -0.435 18496 443 1 2 . 1 1 11 11 GLU CA C 11 55.755 55.755 55.485 0.270 18496 444 1 2 . 1 1 11 11 GLU CB C 11 34.386 34.386 32.790 1.596 18496 445 1 2 . 1 1 11 11 GLU H H 11 7.551 7.551 7.827 -0.276 18496 446 1 2 . 1 1 12 12 GLU N N 12 128.587 128.587 125.671 2.916 18496 447 1 2 . 1 1 12 12 GLU HA H 12 5.214 5.214 4.549 0.665 18496 448 1 2 . 1 1 12 12 GLU C C 12 176.877 176.877 175.711 1.166 18496 449 1 2 . 1 1 12 12 GLU CA C 12 54.801 54.801 57.541 -2.740 18496 450 1 2 . 1 1 12 12 GLU CB C 12 30.137 30.137 30.178 -0.041 18496 451 1 2 . 1 1 12 12 GLU H H 12 8.762 8.762 8.891 -0.129 18496 452 1 2 . 1 1 13 13 LEU N N 13 122.508 122.508 124.490 -1.982 18496 453 1 2 . 1 1 13 13 LEU HA H 13 4.872 4.872 4.715 0.157 18496 454 1 2 . 1 1 13 13 LEU C C 13 176.060 176.060 177.066 -1.006 18496 455 1 2 . 1 1 13 13 LEU CA C 13 57.372 57.372 55.859 1.513 18496 456 1 2 . 1 1 13 13 LEU CB C 13 42.284 42.284 43.452 -1.168 18496 457 1 2 . 1 1 13 13 LEU H H 13 8.058 8.058 8.610 -0.552 18496 458 1 2 . 1 1 14 14 ILE N N 14 115.422 115.422 117.796 -2.374 18496 459 1 2 . 1 1 14 14 ILE HA H 14 4.553 4.553 4.438 0.115 18496 460 1 2 . 1 1 14 14 ILE C C 14 174.893 174.893 174.049 0.844 18496 461 1 2 . 1 1 14 14 ILE CA C 14 60.586 60.586 59.764 0.822 18496 462 1 2 . 1 1 14 14 ILE CB C 14 44.329 44.329 41.411 2.918 18496 463 1 2 . 1 1 14 14 ILE H H 14 8.450 8.450 8.310 0.140 18496 464 1 2 . 1 1 15 15 VAL N N 15 129.108 129.108 126.067 3.041 18496 465 1 2 . 1 1 15 15 VAL HA H 15 4.196 4.196 4.431 -0.235 18496 466 1 2 . 1 1 15 15 VAL C C 15 175.180 175.180 175.110 0.070 18496 467 1 2 . 1 1 15 15 VAL CA C 15 63.288 63.288 61.045 2.243 18496 468 1 2 . 1 1 15 15 VAL CB C 15 32.117 32.117 32.610 -0.493 18496 469 1 2 . 1 1 15 15 VAL H H 15 8.867 8.867 8.552 0.315 18496 470 1 2 . 1 1 16 16 LEU N N 16 127.846 127.846 129.151 -1.305 18496 471 1 2 . 1 1 16 16 LEU HA H 16 4.317 4.317 4.621 -0.304 18496 472 1 2 . 1 1 16 16 LEU C C 16 176.070 176.070 177.342 -1.272 18496 473 1 2 . 1 1 16 16 LEU CA C 16 57.252 57.252 56.412 0.840 18496 474 1 2 . 1 1 16 16 LEU CB C 16 42.035 42.035 42.606 -0.571 18496 475 1 2 . 1 1 16 16 LEU H H 16 9.555 9.555 8.627 0.928 18496 476 1 2 . 1 1 17 17 SER N N 17 107.073 107.073 110.344 -3.271 18496 477 1 2 . 1 1 17 17 SER HA H 17 4.540 4.540 4.620 -0.080 18496 478 1 2 . 1 1 17 17 SER C C 17 172.277 172.277 172.249 0.028 18496 479 1 2 . 1 1 17 17 SER CA C 17 57.882 57.882 58.042 -0.160 18496 480 1 2 . 1 1 17 17 SER CB C 17 64.046 64.046 65.196 -1.150 18496 481 1 2 . 1 1 17 17 SER H H 17 7.699 7.699 7.910 -0.211 18496 482 1 2 . 1 1 18 18 GLU N N 18 119.235 119.235 120.057 -0.822 18496 483 1 2 . 1 1 18 18 GLU HA H 18 5.143 5.143 4.855 0.288 18496 484 1 2 . 1 1 18 18 GLU C C 18 175.469 175.469 176.184 -0.715 18496 485 1 2 . 1 1 18 18 GLU CA C 18 55.248 55.248 55.125 0.123 18496 486 1 2 . 1 1 18 18 GLU CB C 18 33.454 33.454 30.860 2.594 18496 487 1 2 . 1 1 18 18 GLU H H 18 8.437 8.437 8.515 -0.078 18496 488 1 2 . 1 1 19 19 ASN N N 19 123.988 123.988 121.646 2.342 18496 489 1 2 . 1 1 19 19 ASN HA H 19 5.097 5.097 4.721 0.376 18496 490 1 2 . 1 1 19 19 ASN CA C 19 50.916 50.916 53.298 -2.382 18496 491 1 2 . 1 1 19 19 ASN CB C 19 39.482 39.482 39.649 -0.167 18496 492 1 2 . 1 1 19 19 ASN H H 19 8.779 8.779 8.446 0.333 18496 493 1 2 . 1 1 20 20 ALA N N 20 120.854 120.854 122.487 -1.633 18496 494 1 2 . 1 1 20 20 ALA HA H 20 4.239 4.239 4.176 0.063 18496 495 1 2 . 1 1 20 20 ALA C C 20 179.032 179.032 178.032 1.000 18496 496 1 2 . 1 1 20 20 ALA CA C 20 54.924 54.924 54.245 0.679 18496 497 1 2 . 1 1 20 20 ALA CB C 20 18.621 18.621 18.692 -0.071 18496 498 1 2 . 1 1 20 20 ALA H H 20 8.616 8.616 8.626 -0.010 18496 499 1 2 . 1 1 21 21 LYS N N 21 115.771 115.771 116.574 -0.803 18496 500 1 2 . 1 1 21 21 LYS HA H 21 4.497 4.497 4.231 0.266 18496 501 1 2 . 1 1 21 21 LYS C C 21 176.615 176.615 176.602 0.013 18496 502 1 2 . 1 1 21 21 LYS CA C 21 55.503 55.503 55.281 0.222 18496 503 1 2 . 1 1 21 21 LYS CB C 21 32.742 32.742 31.880 0.862 18496 504 1 2 . 1 1 21 21 LYS H H 21 7.767 7.767 7.722 0.045 18496 505 1 2 . 1 1 22 22 GLY N N 22 107.695 107.695 106.944 0.751 18496 506 1 2 . 1 1 22 22 GLY C C 22 174.843 174.843 174.549 0.294 18496 507 1 2 . 1 1 22 22 GLY CA C 22 45.297 45.297 45.297 -0.000 18496 508 1 2 . 1 1 22 22 GLY H H 22 8.317 8.317 7.810 0.507 18496 509 1 2 . 1 1 23 23 TRP N N 23 121.316 121.316 121.231 0.085 18496 510 1 2 . 1 1 23 23 TRP HA H 23 4.815 4.815 4.774 0.041 18496 511 1 2 . 1 1 23 23 TRP C C 23 176.754 176.754 176.513 0.241 18496 512 1 2 . 1 1 23 23 TRP CA C 23 58.291 58.291 54.927 3.364 18496 513 1 2 . 1 1 23 23 TRP CB C 23 28.127 28.127 27.916 0.211 18496 514 1 2 . 1 1 23 23 TRP H H 23 7.983 7.983 8.005 -0.022 18496 515 1 2 . 1 1 24 24 ARG N N 24 120.789 120.789 126.936 -6.147 18496 516 1 2 . 1 1 24 24 ARG HA H 24 5.496 5.496 4.918 0.578 18496 517 1 2 . 1 1 24 24 ARG C C 24 175.831 175.831 176.082 -0.251 18496 518 1 2 . 1 1 24 24 ARG CA C 24 54.755 54.755 54.868 -0.113 18496 519 1 2 . 1 1 24 24 ARG CB C 24 33.735 33.735 30.296 3.439 18496 520 1 2 . 1 1 24 24 ARG H H 24 9.046 9.046 9.361 -0.315 18496 521 1 2 . 1 1 25 25 LYS N N 25 126.507 126.507 129.487 -2.980 18496 522 1 2 . 1 1 25 25 LYS HA H 25 5.081 5.081 4.942 0.139 18496 523 1 2 . 1 1 25 25 LYS C C 25 175.648 175.648 175.635 0.013 18496 524 1 2 . 1 1 25 25 LYS CA C 25 56.071 56.071 56.729 -0.658 18496 525 1 2 . 1 1 25 25 LYS CB C 25 32.214 32.214 32.937 -0.723 18496 526 1 2 . 1 1 25 25 LYS H H 25 8.526 8.526 8.393 0.133 18496 527 1 2 . 1 1 26 26 GLU N N 26 126.009 126.009 124.234 1.775 18496 528 1 2 . 1 1 26 26 GLU HA H 26 5.275 5.275 5.146 0.129 18496 529 1 2 . 1 1 26 26 GLU C C 26 174.894 174.894 174.252 0.642 18496 530 1 2 . 1 1 26 26 GLU CA C 26 55.271 55.271 55.021 0.250 18496 531 1 2 . 1 1 26 26 GLU CB C 26 33.781 33.781 34.604 -0.823 18496 532 1 2 . 1 1 26 26 GLU H H 26 9.125 9.125 8.969 0.156 18496 533 1 2 . 1 1 27 27 LEU N N 27 121.930 121.930 125.211 -3.281 18496 534 1 2 . 1 1 27 27 LEU HA H 27 5.788 5.788 4.829 0.959 18496 535 1 2 . 1 1 27 27 LEU C C 27 173.941 173.941 174.432 -0.491 18496 536 1 2 . 1 1 27 27 LEU CA C 27 53.859 53.859 53.739 0.121 18496 537 1 2 . 1 1 27 27 LEU CB C 27 44.020 44.020 43.843 0.177 18496 538 1 2 . 1 1 27 27 LEU H H 27 8.938 8.938 9.095 -0.157 18496 539 1 2 . 1 1 28 28 ASN N N 28 124.630 124.630 125.300 -0.670 18496 540 1 2 . 1 1 28 28 ASN HA H 28 5.411 5.411 5.218 0.193 18496 541 1 2 . 1 1 28 28 ASN C C 28 174.366 174.366 173.475 0.891 18496 542 1 2 . 1 1 28 28 ASN CA C 28 52.063 52.063 52.281 -0.218 18496 543 1 2 . 1 1 28 28 ASN CB C 28 44.430 44.430 43.289 1.141 18496 544 1 2 . 1 1 28 28 ASN H H 28 9.345 9.345 8.269 1.076 18496 545 1 2 . 1 1 29 29 ARG N N 29 118.443 118.443 123.221 -4.778 18496 546 1 2 . 1 1 29 29 ARG HA H 29 5.058 5.058 4.723 0.335 18496 547 1 2 . 1 1 29 29 ARG C C 29 175.779 175.779 174.834 0.945 18496 548 1 2 . 1 1 29 29 ARG CA C 29 56.091 56.091 56.087 0.004 18496 549 1 2 . 1 1 29 29 ARG CB C 29 31.710 31.710 30.923 0.787 18496 550 1 2 . 1 1 29 29 ARG H H 29 9.109 9.109 9.087 0.022 18496 551 1 2 . 1 1 30 30 VAL N N 30 124.605 124.605 121.267 3.338 18496 552 1 2 . 1 1 30 30 VAL HA H 30 4.535 4.535 5.403 -0.868 18496 553 1 2 . 1 1 30 30 VAL C C 30 174.775 174.775 174.476 0.299 18496 554 1 2 . 1 1 30 30 VAL CA C 30 60.921 60.921 58.869 2.052 18496 555 1 2 . 1 1 30 30 VAL CB C 30 37.790 37.790 36.216 1.574 18496 556 1 2 . 1 1 30 30 VAL H H 30 9.054 9.054 8.560 0.494 18496 557 1 2 . 1 1 31 31 SER N N 31 120.794 120.794 115.354 5.440 18496 558 1 2 . 1 1 31 31 SER HA H 31 4.652 4.652 5.108 -0.456 18496 559 1 2 . 1 1 31 31 SER C C 31 174.214 174.214 175.544 -1.330 18496 560 1 2 . 1 1 31 31 SER CA C 31 56.279 56.279 56.931 -0.652 18496 561 1 2 . 1 1 31 31 SER CB C 31 64.128 64.128 64.326 -0.199 18496 562 1 2 . 1 1 31 31 SER H H 31 8.667 8.667 8.748 -0.081 18496 563 1 2 . 1 1 32 32 TRP N N 32 132.303 132.303 128.000 4.303 18496 564 1 2 . 1 1 32 32 TRP HA H 32 5.105 5.105 4.541 0.564 18496 565 1 2 . 1 1 32 32 TRP C C 32 177.276 177.276 177.110 0.166 18496 566 1 2 . 1 1 32 32 TRP CA C 32 56.198 56.198 58.220 -2.022 18496 567 1 2 . 1 1 32 32 TRP CB C 32 29.968 29.968 28.023 1.945 18496 568 1 2 . 1 1 32 32 TRP H H 32 9.282 9.282 9.290 -0.008 18496 569 1 2 . 1 1 33 33 ASN N N 33 124.979 124.979 123.616 1.363 18496 570 1 2 . 1 1 33 33 ASN HA H 33 4.257 4.257 4.386 -0.129 18496 571 1 2 . 1 1 33 33 ASN C C 33 174.030 174.030 174.764 -0.734 18496 572 1 2 . 1 1 33 33 ASN CA C 33 54.709 54.709 54.786 -0.077 18496 573 1 2 . 1 1 33 33 ASN CB C 33 37.921 37.921 36.926 0.995 18496 574 1 2 . 1 1 33 33 ASN H H 33 9.813 9.813 8.820 0.993 18496 575 1 2 . 1 1 34 34 ASP N N 34 111.880 111.880 113.428 -1.548 18496 576 1 2 . 1 1 34 34 ASP HA H 34 4.126 4.126 4.235 -0.109 18496 577 1 2 . 1 1 34 34 ASP CA C 34 56.130 56.130 55.517 0.613 18496 578 1 2 . 1 1 34 34 ASP CB C 34 39.760 39.760 40.434 -0.674 18496 579 1 2 . 1 1 34 34 ASP H H 34 9.251 9.251 8.199 1.052 18496 580 1 2 . 1 1 35 35 ALA N N 35 121.811 121.811 121.576 0.235 18496 581 1 2 . 1 1 35 35 ALA HA H 35 4.477 4.477 4.452 0.025 18496 582 1 2 . 1 1 35 35 ALA C C 35 177.778 177.778 177.210 0.568 18496 583 1 2 . 1 1 35 35 ALA CA C 35 51.528 51.528 52.798 -1.270 18496 584 1 2 . 1 1 35 35 ALA CB C 35 20.445 20.445 20.280 0.165 18496 585 1 2 . 1 1 35 35 ALA H H 35 7.625 7.625 7.795 -0.170 18496 586 1 2 . 1 1 36 36 GLU N N 36 121.068 121.068 121.512 -0.444 18496 587 1 2 . 1 1 36 36 GLU HA H 36 4.390 4.390 4.759 -0.369 18496 588 1 2 . 1 1 36 36 GLU CA C 36 55.276 55.276 52.201 3.075 18496 589 1 2 . 1 1 36 36 GLU CB C 36 28.575 28.575 31.259 -2.684 18496 590 1 2 . 1 1 36 36 GLU H H 36 8.658 8.658 8.148 0.510 18496 591 1 2 . 1 1 37 37 PRO HA H 37 4.289 4.289 4.796 -0.507 18496 592 1 2 . 1 1 37 37 PRO C C 37 175.799 175.799 176.035 -0.236 18496 593 1 2 . 1 1 37 37 PRO CA C 37 63.105 63.105 62.080 1.025 18496 594 1 2 . 1 1 37 37 PRO CB C 37 32.076 32.076 31.973 0.103 18496 595 1 2 . 1 1 38 38 LYS N N 38 120.881 120.881 123.095 -2.214 18496 596 1 2 . 1 1 38 38 LYS HA H 38 4.700 4.700 4.388 0.312 18496 597 1 2 . 1 1 38 38 LYS C C 38 176.906 176.906 174.714 2.192 18496 598 1 2 . 1 1 38 38 LYS CA C 38 54.399 54.399 54.513 -0.114 18496 599 1 2 . 1 1 38 38 LYS CB C 38 37.217 37.217 36.487 0.730 18496 600 1 2 . 1 1 38 38 LYS H H 38 8.316 8.316 8.875 -0.559 18496 601 1 2 . 1 1 39 39 TYR N N 39 119.792 119.792 118.392 1.400 18496 602 1 2 . 1 1 39 39 TYR HA H 39 4.636 4.636 4.536 0.100 18496 603 1 2 . 1 1 39 39 TYR C C 39 175.834 175.834 174.780 1.054 18496 604 1 2 . 1 1 39 39 TYR CA C 39 60.228 60.228 57.448 2.780 18496 605 1 2 . 1 1 39 39 TYR CB C 39 38.683 38.683 38.961 -0.278 18496 606 1 2 . 1 1 39 39 TYR H H 39 8.508 8.508 7.754 0.754 18496 607 1 2 . 1 1 40 40 ASP N N 40 126.502 126.502 122.742 3.760 18496 608 1 2 . 1 1 40 40 ASP HA H 40 5.597 5.597 5.305 0.292 18496 609 1 2 . 1 1 40 40 ASP C C 40 175.283 175.283 174.103 1.180 18496 610 1 2 . 1 1 40 40 ASP CA C 40 55.053 55.053 53.695 1.358 18496 611 1 2 . 1 1 40 40 ASP CB C 40 48.656 48.656 45.286 3.370 18496 612 1 2 . 1 1 40 40 ASP H H 40 9.219 9.219 8.355 0.864 18496 613 1 2 . 1 1 41 41 ILE N N 41 125.910 125.910 125.234 0.676 18496 614 1 2 . 1 1 41 41 ILE HA H 41 5.722 5.722 4.999 0.723 18496 615 1 2 . 1 1 41 41 ILE C C 41 174.167 174.167 173.690 0.477 18496 616 1 2 . 1 1 41 41 ILE CA C 41 60.734 60.734 59.873 0.861 18496 617 1 2 . 1 1 41 41 ILE CB C 41 40.198 40.198 39.830 0.368 18496 618 1 2 . 1 1 41 41 ILE H H 41 8.972 8.972 8.645 0.327 18496 619 1 2 . 1 1 42 42 ARG N N 42 120.300 120.300 127.072 -6.772 18496 620 1 2 . 1 1 42 42 ARG HA H 42 4.716 4.716 4.721 -0.005 18496 621 1 2 . 1 1 42 42 ARG CA C 42 54.826 54.826 54.572 0.254 18496 622 1 2 . 1 1 42 42 ARG CB C 42 32.665 32.665 35.380 -2.715 18496 623 1 2 . 1 1 42 42 ARG H H 42 8.320 8.320 8.787 -0.467 18496 624 1 2 . 1 1 43 43 THR HA H 43 5.585 5.585 5.323 0.262 18496 625 1 2 . 1 1 43 43 THR C C 43 173.294 173.294 173.603 -0.309 18496 626 1 2 . 1 1 43 43 THR CA C 43 60.847 60.847 60.515 0.332 18496 627 1 2 . 1 1 43 43 THR CB C 43 69.961 69.961 70.348 -0.387 18496 628 1 2 . 1 1 44 44 TRP N N 44 122.747 122.747 123.774 -1.027 18496 629 1 2 . 1 1 44 44 TRP HA H 44 4.945 4.945 4.844 0.101 18496 630 1 2 . 1 1 44 44 TRP C C 44 175.056 175.056 175.737 -0.681 18496 631 1 2 . 1 1 44 44 TRP CA C 44 56.107 56.107 56.039 0.068 18496 632 1 2 . 1 1 44 44 TRP CB C 44 34.506 34.506 33.581 0.925 18496 633 1 2 . 1 1 44 44 TRP H H 44 9.180 9.180 8.900 0.280 18496 634 1 2 . 1 1 45 45 SER N N 45 117.385 117.385 116.662 0.723 18496 635 1 2 . 1 1 45 45 SER HA H 45 2.300 2.300 4.938 -2.638 18496 636 1 2 . 1 1 45 45 SER CA C 45 56.481 56.481 56.722 -0.241 18496 637 1 2 . 1 1 45 45 SER CB C 45 60.743 60.743 62.438 -1.695 18496 638 1 2 . 1 1 45 45 SER H H 45 7.879 7.879 8.497 -0.618 18496 639 1 2 . 1 1 46 46 PRO HA H 46 4.104 4.104 4.513 -0.409 18496 640 1 2 . 1 1 46 46 PRO CA C 46 64.990 64.990 65.323 -0.333 18496 641 1 2 . 1 1 46 46 PRO CB C 46 31.272 31.272 31.920 -0.648 18496 642 1 2 . 1 1 47 47 ASP HA H 47 4.520 4.520 4.737 -0.217 18496 643 1 2 . 1 1 47 47 ASP C C 47 175.629 175.629 175.198 0.431 18496 644 1 2 . 1 1 47 47 ASP CA C 47 53.453 53.453 53.119 0.334 18496 645 1 2 . 1 1 47 47 ASP CB C 47 40.239 40.239 40.895 -0.656 18496 646 1 2 . 1 1 48 48 HIS N N 48 111.320 111.320 116.083 -4.763 18496 647 1 2 . 1 1 48 48 HIS HA H 48 3.916 3.916 4.490 -0.574 18496 648 1 2 . 1 1 48 48 HIS CA C 48 60.347 60.347 57.843 2.505 18496 649 1 2 . 1 1 48 48 HIS CB C 48 25.499 25.499 27.836 -2.337 18496 650 1 2 . 1 1 48 48 HIS H H 48 8.269 8.269 8.279 -0.010 18496 651 1 2 . 1 1 49 49 GLU N N 49 114.659 114.659 115.648 -0.989 18496 652 1 2 . 1 1 49 49 GLU HA H 49 4.447 4.447 4.411 0.036 18496 653 1 2 . 1 1 49 49 GLU C C 49 176.394 176.394 176.010 0.384 18496 654 1 2 . 1 1 49 49 GLU CA C 49 57.940 57.940 58.157 -0.217 18496 655 1 2 . 1 1 49 49 GLU CB C 49 30.641 30.641 31.582 -0.942 18496 656 1 2 . 1 1 49 49 GLU H H 49 7.381 7.381 8.467 -1.086 18496 657 1 2 . 1 1 50 50 LYS N N 50 118.126 118.126 118.095 0.031 18496 658 1 2 . 1 1 50 50 LYS HA H 50 4.665 4.665 4.690 -0.025 18496 659 1 2 . 1 1 50 50 LYS CA C 50 54.431 54.431 54.305 0.126 18496 660 1 2 . 1 1 50 50 LYS CB C 50 36.543 36.543 36.454 0.089 18496 661 1 2 . 1 1 50 50 LYS H H 50 8.067 8.067 8.026 0.041 18496 662 1 2 . 1 1 51 51 MET HA H 51 4.936 4.936 4.563 0.373 18496 663 1 2 . 1 1 51 51 MET CA C 51 54.048 54.048 53.126 0.922 18496 664 1 2 . 1 1 51 51 MET CB C 51 33.768 33.768 35.261 -1.493 18496 665 1 2 . 1 1 52 52 GLY C C 52 173.534 173.534 172.159 1.375 18496 666 1 2 . 1 1 52 52 GLY CA C 52 43.060 43.060 44.046 -0.986 18496 667 1 2 . 1 1 53 53 LYS N N 53 118.012 118.012 119.490 -1.478 18496 668 1 2 . 1 1 53 53 LYS HA H 53 4.155 4.155 4.454 -0.299 18496 669 1 2 . 1 1 53 53 LYS C C 53 176.818 176.818 175.710 1.108 18496 670 1 2 . 1 1 53 53 LYS CA C 53 56.478 56.478 55.654 0.824 18496 671 1 2 . 1 1 53 53 LYS CB C 53 33.117 33.117 33.945 -0.828 18496 672 1 2 . 1 1 53 53 LYS H H 53 8.132 8.132 8.149 -0.017 18496 673 1 2 . 1 1 54 54 GLY N N 54 109.836 109.836 108.070 1.766 18496 674 1 2 . 1 1 54 54 GLY C C 54 170.848 170.848 172.984 -2.136 18496 675 1 2 . 1 1 54 54 GLY CA C 54 46.701 46.701 44.533 2.168 18496 676 1 2 . 1 1 54 54 GLY H H 54 8.079 8.079 8.108 -0.029 18496 677 1 2 . 1 1 55 55 ILE N N 55 119.382 119.382 121.660 -2.278 18496 678 1 2 . 1 1 55 55 ILE HA H 55 4.956 4.956 4.590 0.366 18496 679 1 2 . 1 1 55 55 ILE C C 55 171.737 171.737 173.726 -1.989 18496 680 1 2 . 1 1 55 55 ILE CA C 55 57.059 57.059 60.581 -3.522 18496 681 1 2 . 1 1 55 55 ILE CB C 55 44.241 44.241 41.331 2.909 18496 682 1 2 . 1 1 55 55 ILE H H 55 8.661 8.661 8.401 0.260 18496 683 1 2 . 1 1 56 56 THR N N 56 113.795 113.795 122.792 -8.997 18496 684 1 2 . 1 1 56 56 THR HA H 56 5.607 5.607 4.864 0.743 18496 685 1 2 . 1 1 56 56 THR C C 56 174.417 174.417 173.638 0.779 18496 686 1 2 . 1 1 56 56 THR CA C 56 59.098 59.098 61.680 -2.582 18496 687 1 2 . 1 1 56 56 THR CB C 56 72.153 72.153 70.214 1.939 18496 688 1 2 . 1 1 56 56 THR H H 56 7.916 7.916 8.395 -0.479 18496 689 1 2 . 1 1 57 57 LEU N N 57 121.044 121.044 127.264 -6.220 18496 690 1 2 . 1 1 57 57 LEU HA H 57 5.311 5.311 4.943 0.368 18496 691 1 2 . 1 1 57 57 LEU C C 57 176.150 176.150 175.584 0.566 18496 692 1 2 . 1 1 57 57 LEU CA C 57 53.264 53.264 53.743 -0.479 18496 693 1 2 . 1 1 57 57 LEU CB C 57 45.901 45.901 45.258 0.643 18496 694 1 2 . 1 1 57 57 LEU H H 57 9.421 9.421 9.154 0.267 18496 695 1 2 . 1 1 58 58 SER N N 58 119.548 119.548 119.383 0.165 18496 696 1 2 . 1 1 58 58 SER HA H 58 4.734 4.734 4.433 0.301 18496 697 1 2 . 1 1 58 58 SER C C 58 174.786 174.786 175.304 -0.518 18496 698 1 2 . 1 1 58 58 SER CA C 58 56.948 56.948 57.938 -0.990 18496 699 1 2 . 1 1 58 58 SER CB C 58 65.726 65.726 63.853 1.873 18496 700 1 2 . 1 1 58 58 SER H H 58 9.771 9.771 9.685 0.086 18496 701 1 2 . 1 1 59 59 GLU N N 59 120.827 120.827 123.382 -2.555 18496 702 1 2 . 1 1 59 59 GLU HA H 59 4.319 4.319 4.217 0.102 18496 703 1 2 . 1 1 59 59 GLU C C 59 179.806 179.806 178.952 0.854 18496 704 1 2 . 1 1 59 59 GLU CA C 59 60.913 60.913 60.728 0.185 18496 705 1 2 . 1 1 59 59 GLU CB C 59 29.538 29.538 29.313 0.225 18496 706 1 2 . 1 1 59 59 GLU H H 59 9.394 9.394 8.990 0.404 18496 707 1 2 . 1 1 60 60 GLU N N 60 119.587 119.587 119.460 0.127 18496 708 1 2 . 1 1 60 60 GLU HA H 60 4.188 4.188 4.124 0.064 18496 709 1 2 . 1 1 60 60 GLU C C 60 179.686 179.686 178.829 0.857 18496 710 1 2 . 1 1 60 60 GLU CA C 60 60.279 60.279 59.513 0.766 18496 711 1 2 . 1 1 60 60 GLU CB C 60 29.559 29.559 28.747 0.812 18496 712 1 2 . 1 1 60 60 GLU H H 60 8.905 8.905 8.854 0.051 18496 713 1 2 . 1 1 61 61 GLU N N 61 120.145 120.145 120.010 0.135 18496 714 1 2 . 1 1 61 61 GLU HA H 61 4.037 4.037 4.103 -0.066 18496 715 1 2 . 1 1 61 61 GLU C C 61 178.530 178.530 178.962 -0.432 18496 716 1 2 . 1 1 61 61 GLU CA C 61 59.118 59.118 58.911 0.207 18496 717 1 2 . 1 1 61 61 GLU CB C 61 30.976 30.976 29.314 1.662 18496 718 1 2 . 1 1 61 61 GLU H H 61 8.013 8.013 8.408 -0.395 18496 719 1 2 . 1 1 62 62 PHE N N 62 119.925 119.925 120.644 -0.719 18496 720 1 2 . 1 1 62 62 PHE HA H 62 3.927 3.927 4.132 -0.205 18496 721 1 2 . 1 1 62 62 PHE C C 62 176.783 176.783 177.529 -0.746 18496 722 1 2 . 1 1 62 62 PHE CA C 62 61.827 61.827 61.272 0.555 18496 723 1 2 . 1 1 62 62 PHE CB C 62 40.216 40.216 38.914 1.302 18496 724 1 2 . 1 1 62 62 PHE H H 62 9.192 9.192 8.930 0.262 18496 725 1 2 . 1 1 63 63 GLY N N 63 104.854 104.854 107.496 -2.642 18496 726 1 2 . 1 1 63 63 GLY C C 63 176.854 176.854 176.087 0.767 18496 727 1 2 . 1 1 63 63 GLY CA C 63 47.178 47.178 47.470 -0.292 18496 728 1 2 . 1 1 63 63 GLY H H 63 8.316 8.316 8.563 -0.247 18496 729 1 2 . 1 1 64 64 VAL N N 64 123.719 123.719 122.850 0.869 18496 730 1 2 . 1 1 64 64 VAL HA H 64 3.663 3.663 3.718 -0.055 18496 731 1 2 . 1 1 64 64 VAL C C 64 177.644 177.644 177.865 -0.221 18496 732 1 2 . 1 1 64 64 VAL CA C 64 67.090 67.090 65.831 1.259 18496 733 1 2 . 1 1 64 64 VAL CB C 64 31.367 31.367 31.050 0.317 18496 734 1 2 . 1 1 64 64 VAL H H 64 7.759 7.759 7.765 -0.006 18496 735 1 2 . 1 1 65 65 LEU N N 65 120.099 120.099 121.392 -1.293 18496 736 1 2 . 1 1 65 65 LEU HA H 65 3.672 3.672 3.930 -0.258 18496 737 1 2 . 1 1 65 65 LEU C C 65 177.636 177.636 178.660 -1.024 18496 738 1 2 . 1 1 65 65 LEU CA C 65 58.552 58.552 58.446 0.106 18496 739 1 2 . 1 1 65 65 LEU CB C 65 41.358 41.358 41.757 -0.399 18496 740 1 2 . 1 1 65 65 LEU H H 65 7.660 7.660 7.906 -0.246 18496 741 1 2 . 1 1 66 66 LEU N N 66 115.733 115.733 118.043 -2.310 18496 742 1 2 . 1 1 66 66 LEU HA H 66 3.556 3.556 3.636 -0.080 18496 743 1 2 . 1 1 66 66 LEU C C 66 179.729 179.729 178.846 0.883 18496 744 1 2 . 1 1 66 66 LEU CA C 66 58.069 58.069 58.027 0.042 18496 745 1 2 . 1 1 66 66 LEU CB C 66 41.625 41.625 40.864 0.761 18496 746 1 2 . 1 1 66 66 LEU H H 66 8.083 8.083 8.204 -0.121 18496 747 1 2 . 1 1 67 67 LYS N N 67 119.120 119.120 120.077 -0.957 18496 748 1 2 . 1 1 67 67 LYS HA H 67 3.965 3.965 3.802 0.163 18496 749 1 2 . 1 1 67 67 LYS C C 67 179.379 179.379 179.053 0.326 18496 750 1 2 . 1 1 67 67 LYS CA C 67 59.227 59.227 59.837 -0.610 18496 751 1 2 . 1 1 67 67 LYS CB C 67 32.737 32.737 32.229 0.508 18496 752 1 2 . 1 1 67 67 LYS H H 67 7.861 7.861 8.258 -0.397 18496 753 1 2 . 1 1 68 68 GLU N N 68 116.924 116.924 118.821 -1.897 18496 754 1 2 . 1 1 68 68 GLU HA H 68 4.409 4.409 4.099 0.310 18496 755 1 2 . 1 1 68 68 GLU CA C 68 57.712 57.712 58.443 -0.730 18496 756 1 2 . 1 1 68 68 GLU CB C 68 29.586 29.586 29.444 0.142 18496 757 1 2 . 1 1 68 68 GLU H H 68 8.319 8.319 7.899 0.420 18496 758 1 2 . 1 1 69 69 LEU N N 69 120.032 120.032 120.075 -0.043 18496 759 1 2 . 1 1 69 69 LEU HA H 69 4.107 4.107 3.949 0.158 18496 760 1 2 . 1 1 69 69 LEU CA C 69 57.563 57.563 57.547 0.016 18496 761 1 2 . 1 1 69 69 LEU CB C 69 41.373 41.373 41.504 -0.131 18496 762 1 2 . 1 1 69 69 LEU H H 69 8.233 8.233 8.517 -0.284 18496 763 1 2 . 1 1 70 70 GLY N N 70 105.472 105.472 105.677 -0.205 18496 764 1 2 . 1 1 70 70 GLY C C 70 174.986 174.986 175.537 -0.551 18496 765 1 2 . 1 1 70 70 GLY CA C 70 46.704 46.704 46.816 -0.112 18496 766 1 2 . 1 1 70 70 GLY H H 70 7.960 7.960 8.568 -0.608 18496 767 1 2 . 1 1 71 71 ASN N N 71 118.596 118.596 119.322 -0.726 18496 768 1 2 . 1 1 71 71 ASN HA H 71 4.681 4.681 4.761 -0.080 18496 769 1 2 . 1 1 71 71 ASN C C 71 176.412 176.412 177.810 -1.398 18496 770 1 2 . 1 1 71 71 ASN CA C 71 54.407 54.407 55.178 -0.771 18496 771 1 2 . 1 1 71 71 ASN CB C 71 38.729 38.729 38.565 0.164 18496 772 1 2 . 1 1 71 71 ASN H H 71 7.857 7.857 7.670 0.187 18496 773 1 2 . 1 1 72 72 LYS N N 72 119.973 119.973 119.988 -0.015 18496 774 1 2 . 1 1 72 72 LYS HA H 72 4.282 4.282 4.140 0.142 18496 775 1 2 . 1 1 72 72 LYS CA C 72 57.338 57.338 58.227 -0.889 18496 776 1 2 . 1 1 72 72 LYS CB C 72 32.755 32.755 32.195 0.560 18496 777 1 2 . 1 1 72 72 LYS H H 72 8.100 8.100 7.962 0.138 18496 778 1 2 . 1 1 73 73 LEU HA H 73 4.281 4.281 4.290 -0.009 18496 779 1 2 . 1 1 73 73 LEU CA C 73 55.774 55.774 54.967 0.807 18496 780 1 2 . 1 1 73 73 LEU CB C 73 41.983 41.983 42.183 -0.200 18496 781 1 3 . 1 1 2 2 ALA HA H 2 4.074 4.074 4.505 -0.431 18496 782 1 3 . 1 1 2 2 ALA CA C 2 51.966 51.966 51.587 0.378 18496 783 1 3 . 1 1 2 2 ALA CB C 2 19.732 19.732 20.038 -0.306 18496 784 1 3 . 1 1 3 3 ASP HA H 3 4.632 4.632 4.497 0.135 18496 785 1 3 . 1 1 3 3 ASP C C 3 175.822 175.822 176.139 -0.317 18496 786 1 3 . 1 1 3 3 ASP CA C 3 54.440 54.440 55.518 -1.078 18496 787 1 3 . 1 1 3 3 ASP CB C 3 41.577 41.577 41.282 0.295 18496 788 1 3 . 1 1 4 4 LYS N N 4 121.655 121.655 119.414 2.241 18496 789 1 3 . 1 1 4 4 LYS HA H 4 4.379 4.379 4.534 -0.155 18496 790 1 3 . 1 1 4 4 LYS C C 4 176.011 176.011 175.332 0.679 18496 791 1 3 . 1 1 4 4 LYS CA C 4 56.213 56.213 55.126 1.087 18496 792 1 3 . 1 1 4 4 LYS CB C 4 33.407 33.407 32.399 1.008 18496 793 1 3 . 1 1 4 4 LYS H H 4 8.394 8.394 7.888 0.506 18496 794 1 3 . 1 1 5 5 LEU N N 5 125.369 125.369 124.821 0.548 18496 795 1 3 . 1 1 5 5 LEU HA H 5 4.351 4.351 4.397 -0.046 18496 796 1 3 . 1 1 5 5 LEU C C 5 175.682 175.682 176.553 -0.871 18496 797 1 3 . 1 1 5 5 LEU CA C 5 55.117 55.117 54.593 0.524 18496 798 1 3 . 1 1 5 5 LEU CB C 5 43.197 43.197 43.095 0.102 18496 799 1 3 . 1 1 5 5 LEU H H 5 8.136 8.136 8.262 -0.126 18496 800 1 3 . 1 1 6 6 LYS N N 6 126.844 126.844 125.376 1.468 18496 801 1 3 . 1 1 6 6 LYS HA H 6 4.451 4.451 4.564 -0.113 18496 802 1 3 . 1 1 6 6 LYS C C 6 174.665 174.665 175.380 -0.715 18496 803 1 3 . 1 1 6 6 LYS CA C 6 55.974 55.974 56.045 -0.071 18496 804 1 3 . 1 1 6 6 LYS CB C 6 34.386 34.386 33.156 1.230 18496 805 1 3 . 1 1 6 6 LYS H H 6 8.615 8.615 8.529 0.086 18496 806 1 3 . 1 1 7 7 PHE N N 7 119.818 119.818 119.976 -0.158 18496 807 1 3 . 1 1 7 7 PHE HA H 7 5.343 5.343 5.489 -0.146 18496 808 1 3 . 1 1 7 7 PHE C C 7 173.569 173.569 173.957 -0.388 18496 809 1 3 . 1 1 7 7 PHE CA C 7 55.813 55.813 55.491 0.322 18496 810 1 3 . 1 1 7 7 PHE CB C 7 42.975 42.975 42.518 0.457 18496 811 1 3 . 1 1 7 7 PHE H H 7 7.734 7.734 8.290 -0.556 18496 812 1 3 . 1 1 8 8 GLU N N 8 119.165 119.165 119.643 -0.478 18496 813 1 3 . 1 1 8 8 GLU HA H 8 4.158 4.158 4.285 -0.127 18496 814 1 3 . 1 1 8 8 GLU C C 8 175.026 175.026 174.425 0.601 18496 815 1 3 . 1 1 8 8 GLU CA C 8 55.221 55.221 54.732 0.489 18496 816 1 3 . 1 1 8 8 GLU CB C 8 33.699 33.699 32.392 1.307 18496 817 1 3 . 1 1 8 8 GLU H H 8 8.295 8.295 8.862 -0.567 18496 818 1 3 . 1 1 9 9 ILE N N 9 127.619 127.619 127.894 -0.275 18496 819 1 3 . 1 1 9 9 ILE HA H 9 3.768 3.768 4.169 -0.401 18496 820 1 3 . 1 1 9 9 ILE C C 9 174.902 174.902 175.673 -0.771 18496 821 1 3 . 1 1 9 9 ILE CA C 9 62.505 62.505 61.963 0.542 18496 822 1 3 . 1 1 9 9 ILE CB C 9 36.094 36.094 37.440 -1.346 18496 823 1 3 . 1 1 9 9 ILE H H 9 9.157 9.157 8.664 0.493 18496 824 1 3 . 1 1 10 10 ILE N N 10 131.245 131.245 128.663 2.582 18496 825 1 3 . 1 1 10 10 ILE HA H 10 3.861 3.861 4.033 -0.172 18496 826 1 3 . 1 1 10 10 ILE C C 10 176.247 176.247 176.698 -0.451 18496 827 1 3 . 1 1 10 10 ILE CA C 10 60.554 60.554 62.157 -1.603 18496 828 1 3 . 1 1 10 10 ILE CB C 10 37.406 37.406 38.298 -0.892 18496 829 1 3 . 1 1 10 10 ILE H H 10 8.428 8.428 8.811 -0.383 18496 830 1 3 . 1 1 11 11 GLU N N 11 117.669 117.669 117.597 0.072 18496 831 1 3 . 1 1 11 11 GLU HA H 11 4.315 4.315 4.543 -0.228 18496 832 1 3 . 1 1 11 11 GLU C C 11 174.155 174.155 174.391 -0.236 18496 833 1 3 . 1 1 11 11 GLU CA C 11 55.755 55.755 55.431 0.324 18496 834 1 3 . 1 1 11 11 GLU CB C 11 34.386 34.386 32.499 1.887 18496 835 1 3 . 1 1 11 11 GLU H H 11 7.551 7.551 7.916 -0.365 18496 836 1 3 . 1 1 12 12 GLU N N 12 128.587 128.587 125.208 3.379 18496 837 1 3 . 1 1 12 12 GLU HA H 12 5.214 5.214 4.408 0.806 18496 838 1 3 . 1 1 12 12 GLU C C 12 176.877 176.877 175.925 0.952 18496 839 1 3 . 1 1 12 12 GLU CA C 12 54.801 54.801 57.132 -2.331 18496 840 1 3 . 1 1 12 12 GLU CB C 12 30.137 30.137 30.132 0.005 18496 841 1 3 . 1 1 12 12 GLU H H 12 8.762 8.762 8.812 -0.050 18496 842 1 3 . 1 1 13 13 LEU N N 13 122.508 122.508 122.295 0.213 18496 843 1 3 . 1 1 13 13 LEU HA H 13 4.872 4.872 4.485 0.387 18496 844 1 3 . 1 1 13 13 LEU C C 13 176.060 176.060 177.030 -0.970 18496 845 1 3 . 1 1 13 13 LEU CA C 13 57.372 57.372 55.514 1.858 18496 846 1 3 . 1 1 13 13 LEU CB C 13 42.284 42.284 43.324 -1.040 18496 847 1 3 . 1 1 13 13 LEU H H 13 8.058 8.058 8.356 -0.298 18496 848 1 3 . 1 1 14 14 ILE N N 14 115.422 115.422 117.878 -2.456 18496 849 1 3 . 1 1 14 14 ILE HA H 14 4.553 4.553 4.469 0.084 18496 850 1 3 . 1 1 14 14 ILE C C 14 174.893 174.893 174.200 0.693 18496 851 1 3 . 1 1 14 14 ILE CA C 14 60.586 60.586 59.458 1.128 18496 852 1 3 . 1 1 14 14 ILE CB C 14 44.329 44.329 41.282 3.047 18496 853 1 3 . 1 1 14 14 ILE H H 14 8.450 8.450 8.298 0.152 18496 854 1 3 . 1 1 15 15 VAL N N 15 129.108 129.108 126.145 2.963 18496 855 1 3 . 1 1 15 15 VAL HA H 15 4.196 4.196 4.418 -0.222 18496 856 1 3 . 1 1 15 15 VAL C C 15 175.180 175.180 175.066 0.114 18496 857 1 3 . 1 1 15 15 VAL CA C 15 63.288 63.288 60.583 2.705 18496 858 1 3 . 1 1 15 15 VAL CB C 15 32.117 32.117 33.385 -1.268 18496 859 1 3 . 1 1 15 15 VAL H H 15 8.867 8.867 8.414 0.453 18496 860 1 3 . 1 1 16 16 LEU N N 16 127.846 127.846 129.769 -1.923 18496 861 1 3 . 1 1 16 16 LEU HA H 16 4.317 4.317 4.632 -0.315 18496 862 1 3 . 1 1 16 16 LEU C C 16 176.070 176.070 176.856 -0.786 18496 863 1 3 . 1 1 16 16 LEU CA C 16 57.252 57.252 55.835 1.417 18496 864 1 3 . 1 1 16 16 LEU CB C 16 42.035 42.035 42.665 -0.630 18496 865 1 3 . 1 1 16 16 LEU H H 16 9.555 9.555 8.966 0.589 18496 866 1 3 . 1 1 17 17 SER N N 17 107.073 107.073 109.427 -2.354 18496 867 1 3 . 1 1 17 17 SER HA H 17 4.540 4.540 4.588 -0.048 18496 868 1 3 . 1 1 17 17 SER C C 17 172.277 172.277 172.325 -0.048 18496 869 1 3 . 1 1 17 17 SER CA C 17 57.882 57.882 57.946 -0.064 18496 870 1 3 . 1 1 17 17 SER CB C 17 64.046 64.046 64.727 -0.681 18496 871 1 3 . 1 1 17 17 SER H H 17 7.699 7.699 8.023 -0.324 18496 872 1 3 . 1 1 18 18 GLU N N 18 119.235 119.235 119.606 -0.371 18496 873 1 3 . 1 1 18 18 GLU HA H 18 5.143 5.143 5.065 0.078 18496 874 1 3 . 1 1 18 18 GLU C C 18 175.469 175.469 176.359 -0.890 18496 875 1 3 . 1 1 18 18 GLU CA C 18 55.248 55.248 55.189 0.059 18496 876 1 3 . 1 1 18 18 GLU CB C 18 33.454 33.454 31.187 2.267 18496 877 1 3 . 1 1 18 18 GLU H H 18 8.437 8.437 8.470 -0.033 18496 878 1 3 . 1 1 19 19 ASN N N 19 123.988 123.988 121.389 2.599 18496 879 1 3 . 1 1 19 19 ASN HA H 19 5.097 5.097 4.793 0.304 18496 880 1 3 . 1 1 19 19 ASN CA C 19 50.916 50.916 53.076 -2.160 18496 881 1 3 . 1 1 19 19 ASN CB C 19 39.482 39.482 39.080 0.402 18496 882 1 3 . 1 1 19 19 ASN H H 19 8.779 8.779 8.432 0.347 18496 883 1 3 . 1 1 20 20 ALA N N 20 120.854 120.854 122.362 -1.508 18496 884 1 3 . 1 1 20 20 ALA HA H 20 4.239 4.239 4.127 0.112 18496 885 1 3 . 1 1 20 20 ALA C C 20 179.032 179.032 177.958 1.074 18496 886 1 3 . 1 1 20 20 ALA CA C 20 54.924 54.924 54.372 0.552 18496 887 1 3 . 1 1 20 20 ALA CB C 20 18.621 18.621 18.507 0.114 18496 888 1 3 . 1 1 20 20 ALA H H 20 8.616 8.616 8.573 0.043 18496 889 1 3 . 1 1 21 21 LYS N N 21 115.771 115.771 116.608 -0.837 18496 890 1 3 . 1 1 21 21 LYS HA H 21 4.497 4.497 4.207 0.290 18496 891 1 3 . 1 1 21 21 LYS C C 21 176.615 176.615 176.811 -0.196 18496 892 1 3 . 1 1 21 21 LYS CA C 21 55.503 55.503 55.240 0.263 18496 893 1 3 . 1 1 21 21 LYS CB C 21 32.742 32.742 31.590 1.152 18496 894 1 3 . 1 1 21 21 LYS H H 21 7.767 7.767 7.715 0.052 18496 895 1 3 . 1 1 22 22 GLY N N 22 107.695 107.695 106.804 0.891 18496 896 1 3 . 1 1 22 22 GLY C C 22 174.843 174.843 173.967 0.876 18496 897 1 3 . 1 1 22 22 GLY CA C 22 45.297 45.297 45.245 0.052 18496 898 1 3 . 1 1 22 22 GLY H H 22 8.317 8.317 7.859 0.458 18496 899 1 3 . 1 1 23 23 TRP N N 23 121.316 121.316 121.004 0.312 18496 900 1 3 . 1 1 23 23 TRP HA H 23 4.815 4.815 4.875 -0.060 18496 901 1 3 . 1 1 23 23 TRP C C 23 176.754 176.754 176.392 0.362 18496 902 1 3 . 1 1 23 23 TRP CA C 23 58.291 58.291 54.892 3.399 18496 903 1 3 . 1 1 23 23 TRP CB C 23 28.127 28.127 28.044 0.083 18496 904 1 3 . 1 1 23 23 TRP H H 23 7.983 7.983 7.999 -0.016 18496 905 1 3 . 1 1 24 24 ARG N N 24 120.789 120.789 126.868 -6.079 18496 906 1 3 . 1 1 24 24 ARG HA H 24 5.496 5.496 4.976 0.519 18496 907 1 3 . 1 1 24 24 ARG C C 24 175.831 175.831 176.113 -0.282 18496 908 1 3 . 1 1 24 24 ARG CA C 24 54.755 54.755 54.379 0.376 18496 909 1 3 . 1 1 24 24 ARG CB C 24 33.735 33.735 30.138 3.597 18496 910 1 3 . 1 1 24 24 ARG H H 24 9.046 9.046 9.352 -0.306 18496 911 1 3 . 1 1 25 25 LYS N N 25 126.507 126.507 129.257 -2.750 18496 912 1 3 . 1 1 25 25 LYS HA H 25 5.081 5.081 4.824 0.257 18496 913 1 3 . 1 1 25 25 LYS C C 25 175.648 175.648 175.666 -0.018 18496 914 1 3 . 1 1 25 25 LYS CA C 25 56.071 56.071 57.003 -0.932 18496 915 1 3 . 1 1 25 25 LYS CB C 25 32.214 32.214 32.755 -0.541 18496 916 1 3 . 1 1 25 25 LYS H H 25 8.526 8.526 8.529 -0.003 18496 917 1 3 . 1 1 26 26 GLU N N 26 126.009 126.009 123.959 2.050 18496 918 1 3 . 1 1 26 26 GLU HA H 26 5.275 5.275 5.106 0.169 18496 919 1 3 . 1 1 26 26 GLU C C 26 174.894 174.894 174.227 0.667 18496 920 1 3 . 1 1 26 26 GLU CA C 26 55.271 55.271 55.105 0.166 18496 921 1 3 . 1 1 26 26 GLU CB C 26 33.781 33.781 34.623 -0.842 18496 922 1 3 . 1 1 26 26 GLU H H 26 9.125 9.125 9.229 -0.104 18496 923 1 3 . 1 1 27 27 LEU N N 27 121.930 121.930 124.895 -2.965 18496 924 1 3 . 1 1 27 27 LEU HA H 27 5.788 5.788 4.898 0.890 18496 925 1 3 . 1 1 27 27 LEU C C 27 173.941 173.941 174.434 -0.493 18496 926 1 3 . 1 1 27 27 LEU CA C 27 53.859 53.859 53.864 -0.005 18496 927 1 3 . 1 1 27 27 LEU CB C 27 44.020 44.020 44.302 -0.282 18496 928 1 3 . 1 1 27 27 LEU H H 27 8.938 8.938 9.081 -0.143 18496 929 1 3 . 1 1 28 28 ASN N N 28 124.630 124.630 125.082 -0.452 18496 930 1 3 . 1 1 28 28 ASN HA H 28 5.411 5.411 5.228 0.183 18496 931 1 3 . 1 1 28 28 ASN C C 28 174.366 174.366 173.302 1.064 18496 932 1 3 . 1 1 28 28 ASN CA C 28 52.063 52.063 52.137 -0.074 18496 933 1 3 . 1 1 28 28 ASN CB C 28 44.430 44.430 43.227 1.203 18496 934 1 3 . 1 1 28 28 ASN H H 28 9.345 9.345 8.222 1.123 18496 935 1 3 . 1 1 29 29 ARG N N 29 118.443 118.443 121.990 -3.547 18496 936 1 3 . 1 1 29 29 ARG HA H 29 5.058 5.058 4.909 0.149 18496 937 1 3 . 1 1 29 29 ARG C C 29 175.779 175.779 174.666 1.113 18496 938 1 3 . 1 1 29 29 ARG CA C 29 56.091 56.091 55.677 0.414 18496 939 1 3 . 1 1 29 29 ARG CB C 29 31.710 31.710 31.146 0.564 18496 940 1 3 . 1 1 29 29 ARG H H 29 9.109 9.109 8.931 0.178 18496 941 1 3 . 1 1 30 30 VAL N N 30 124.605 124.605 121.992 2.613 18496 942 1 3 . 1 1 30 30 VAL HA H 30 4.535 4.535 5.401 -0.866 18496 943 1 3 . 1 1 30 30 VAL C C 30 174.775 174.775 174.311 0.464 18496 944 1 3 . 1 1 30 30 VAL CA C 30 60.921 60.921 59.416 1.505 18496 945 1 3 . 1 1 30 30 VAL CB C 30 37.790 37.790 36.416 1.375 18496 946 1 3 . 1 1 30 30 VAL H H 30 9.054 9.054 8.693 0.361 18496 947 1 3 . 1 1 31 31 SER N N 31 120.794 120.794 115.582 5.212 18496 948 1 3 . 1 1 31 31 SER HA H 31 4.652 4.652 5.063 -0.411 18496 949 1 3 . 1 1 31 31 SER C C 31 174.214 174.214 175.253 -1.039 18496 950 1 3 . 1 1 31 31 SER CA C 31 56.279 56.279 57.165 -0.886 18496 951 1 3 . 1 1 31 31 SER CB C 31 64.128 64.128 64.087 0.041 18496 952 1 3 . 1 1 31 31 SER H H 31 8.667 8.667 8.707 -0.040 18496 953 1 3 . 1 1 32 32 TRP N N 32 132.303 132.303 127.866 4.437 18496 954 1 3 . 1 1 32 32 TRP HA H 32 5.105 5.105 4.519 0.586 18496 955 1 3 . 1 1 32 32 TRP C C 32 177.276 177.276 177.133 0.143 18496 956 1 3 . 1 1 32 32 TRP CA C 32 56.198 56.198 58.169 -1.971 18496 957 1 3 . 1 1 32 32 TRP CB C 32 29.968 29.968 28.108 1.860 18496 958 1 3 . 1 1 32 32 TRP H H 32 9.282 9.282 9.104 0.178 18496 959 1 3 . 1 1 33 33 ASN N N 33 124.979 124.979 123.662 1.317 18496 960 1 3 . 1 1 33 33 ASN HA H 33 4.257 4.257 4.381 -0.124 18496 961 1 3 . 1 1 33 33 ASN C C 33 174.030 174.030 174.769 -0.739 18496 962 1 3 . 1 1 33 33 ASN CA C 33 54.709 54.709 54.725 -0.016 18496 963 1 3 . 1 1 33 33 ASN CB C 33 37.921 37.921 36.904 1.017 18496 964 1 3 . 1 1 33 33 ASN H H 33 9.813 9.813 8.827 0.986 18496 965 1 3 . 1 1 34 34 ASP N N 34 111.880 111.880 113.125 -1.245 18496 966 1 3 . 1 1 34 34 ASP HA H 34 4.126 4.126 4.230 -0.104 18496 967 1 3 . 1 1 34 34 ASP CA C 34 56.130 56.130 55.466 0.664 18496 968 1 3 . 1 1 34 34 ASP CB C 34 39.760 39.760 40.421 -0.661 18496 969 1 3 . 1 1 34 34 ASP H H 34 9.251 9.251 8.200 1.051 18496 970 1 3 . 1 1 35 35 ALA N N 35 121.811 121.811 121.377 0.434 18496 971 1 3 . 1 1 35 35 ALA HA H 35 4.477 4.477 4.492 -0.015 18496 972 1 3 . 1 1 35 35 ALA C C 35 177.778 177.778 176.974 0.804 18496 973 1 3 . 1 1 35 35 ALA CA C 35 51.528 51.528 52.656 -1.128 18496 974 1 3 . 1 1 35 35 ALA CB C 35 20.445 20.445 20.406 0.039 18496 975 1 3 . 1 1 35 35 ALA H H 35 7.625 7.625 7.770 -0.145 18496 976 1 3 . 1 1 36 36 GLU N N 36 121.068 121.068 121.405 -0.337 18496 977 1 3 . 1 1 36 36 GLU HA H 36 4.390 4.390 4.767 -0.377 18496 978 1 3 . 1 1 36 36 GLU CA C 36 55.276 55.276 52.024 3.252 18496 979 1 3 . 1 1 36 36 GLU CB C 36 28.575 28.575 31.124 -2.549 18496 980 1 3 . 1 1 36 36 GLU H H 36 8.658 8.658 8.422 0.236 18496 981 1 3 . 1 1 37 37 PRO HA H 37 4.289 4.289 4.644 -0.355 18496 982 1 3 . 1 1 37 37 PRO C C 37 175.799 175.799 175.933 -0.134 18496 983 1 3 . 1 1 37 37 PRO CA C 37 63.105 63.105 62.477 0.628 18496 984 1 3 . 1 1 37 37 PRO CB C 37 32.076 32.076 32.280 -0.204 18496 985 1 3 . 1 1 38 38 LYS N N 38 120.881 120.881 122.994 -2.113 18496 986 1 3 . 1 1 38 38 LYS HA H 38 4.700 4.700 4.346 0.354 18496 987 1 3 . 1 1 38 38 LYS C C 38 176.906 176.906 174.526 2.380 18496 988 1 3 . 1 1 38 38 LYS CA C 38 54.399 54.399 54.943 -0.544 18496 989 1 3 . 1 1 38 38 LYS CB C 38 37.217 37.217 36.525 0.692 18496 990 1 3 . 1 1 38 38 LYS H H 38 8.316 8.316 8.815 -0.499 18496 991 1 3 . 1 1 39 39 TYR N N 39 119.792 119.792 118.445 1.347 18496 992 1 3 . 1 1 39 39 TYR HA H 39 4.636 4.636 4.911 -0.275 18496 993 1 3 . 1 1 39 39 TYR C C 39 175.834 175.834 174.850 0.984 18496 994 1 3 . 1 1 39 39 TYR CA C 39 60.228 60.228 56.941 3.287 18496 995 1 3 . 1 1 39 39 TYR CB C 39 38.683 38.683 39.181 -0.498 18496 996 1 3 . 1 1 39 39 TYR H H 39 8.508 8.508 7.755 0.753 18496 997 1 3 . 1 1 40 40 ASP N N 40 126.502 126.502 122.832 3.670 18496 998 1 3 . 1 1 40 40 ASP HA H 40 5.597 5.597 5.366 0.231 18496 999 1 3 . 1 1 40 40 ASP C C 40 175.283 175.283 174.068 1.215 18496 1000 1 3 . 1 1 40 40 ASP CA C 40 55.053 55.053 53.597 1.456 18496 1001 1 3 . 1 1 40 40 ASP CB C 40 48.656 48.656 45.451 3.205 18496 1002 1 3 . 1 1 40 40 ASP H H 40 9.219 9.219 8.420 0.799 18496 1003 1 3 . 1 1 41 41 ILE N N 41 125.910 125.910 124.813 1.097 18496 1004 1 3 . 1 1 41 41 ILE HA H 41 5.722 5.722 4.925 0.797 18496 1005 1 3 . 1 1 41 41 ILE C C 41 174.167 174.167 173.627 0.540 18496 1006 1 3 . 1 1 41 41 ILE CA C 41 60.734 60.734 59.837 0.897 18496 1007 1 3 . 1 1 41 41 ILE CB C 41 40.198 40.198 39.969 0.229 18496 1008 1 3 . 1 1 41 41 ILE H H 41 8.972 8.972 8.804 0.168 18496 1009 1 3 . 1 1 42 42 ARG N N 42 120.300 120.300 127.118 -6.818 18496 1010 1 3 . 1 1 42 42 ARG HA H 42 4.716 4.716 4.807 -0.091 18496 1011 1 3 . 1 1 42 42 ARG CA C 42 54.826 54.826 54.989 -0.163 18496 1012 1 3 . 1 1 42 42 ARG CB C 42 32.665 32.665 35.424 -2.759 18496 1013 1 3 . 1 1 42 42 ARG H H 42 8.320 8.320 8.751 -0.431 18496 1014 1 3 . 1 1 43 43 THR HA H 43 5.585 5.585 5.485 0.100 18496 1015 1 3 . 1 1 43 43 THR C C 43 173.294 173.294 173.140 0.154 18496 1016 1 3 . 1 1 43 43 THR CA C 43 60.847 60.847 59.387 1.460 18496 1017 1 3 . 1 1 43 43 THR CB C 43 69.961 69.961 70.887 -0.926 18496 1018 1 3 . 1 1 44 44 TRP N N 44 122.747 122.747 123.866 -1.119 18496 1019 1 3 . 1 1 44 44 TRP HA H 44 4.945 4.945 4.705 0.240 18496 1020 1 3 . 1 1 44 44 TRP C C 44 175.056 175.056 176.225 -1.169 18496 1021 1 3 . 1 1 44 44 TRP CA C 44 56.107 56.107 55.619 0.488 18496 1022 1 3 . 1 1 44 44 TRP CB C 44 34.506 34.506 31.839 2.667 18496 1023 1 3 . 1 1 44 44 TRP H H 44 9.180 9.180 8.896 0.284 18496 1024 1 3 . 1 1 45 45 SER N N 45 117.385 117.385 117.072 0.313 18496 1025 1 3 . 1 1 45 45 SER HA H 45 2.300 2.300 4.709 -2.409 18496 1026 1 3 . 1 1 45 45 SER CA C 45 56.481 56.481 58.557 -2.076 18496 1027 1 3 . 1 1 45 45 SER CB C 45 60.743 60.743 62.381 -1.638 18496 1028 1 3 . 1 1 45 45 SER H H 45 7.879 7.879 8.483 -0.604 18496 1029 1 3 . 1 1 46 46 PRO HA H 46 4.104 4.104 4.505 -0.401 18496 1030 1 3 . 1 1 46 46 PRO CA C 46 64.990 64.990 65.398 -0.408 18496 1031 1 3 . 1 1 46 46 PRO CB C 46 31.272 31.272 31.966 -0.694 18496 1032 1 3 . 1 1 47 47 ASP HA H 47 4.520 4.520 4.674 -0.154 18496 1033 1 3 . 1 1 47 47 ASP C C 47 175.629 175.629 175.407 0.222 18496 1034 1 3 . 1 1 47 47 ASP CA C 47 53.453 53.453 53.038 0.415 18496 1035 1 3 . 1 1 47 47 ASP CB C 47 40.239 40.239 40.568 -0.329 18496 1036 1 3 . 1 1 48 48 HIS N N 48 111.320 111.320 116.253 -4.933 18496 1037 1 3 . 1 1 48 48 HIS HA H 48 3.916 3.916 4.507 -0.591 18496 1038 1 3 . 1 1 48 48 HIS CA C 48 60.347 60.347 57.544 2.803 18496 1039 1 3 . 1 1 48 48 HIS CB C 48 25.499 25.499 28.389 -2.890 18496 1040 1 3 . 1 1 48 48 HIS H H 48 8.269 8.269 8.277 -0.008 18496 1041 1 3 . 1 1 49 49 GLU N N 49 114.659 114.659 116.680 -2.021 18496 1042 1 3 . 1 1 49 49 GLU HA H 49 4.447 4.447 4.290 0.157 18496 1043 1 3 . 1 1 49 49 GLU C C 49 176.394 176.394 176.298 0.096 18496 1044 1 3 . 1 1 49 49 GLU CA C 49 57.940 57.940 57.563 0.377 18496 1045 1 3 . 1 1 49 49 GLU CB C 49 30.641 30.641 30.251 0.390 18496 1046 1 3 . 1 1 49 49 GLU H H 49 7.381 7.381 8.627 -1.246 18496 1047 1 3 . 1 1 50 50 LYS N N 50 118.126 118.126 117.628 0.498 18496 1048 1 3 . 1 1 50 50 LYS HA H 50 4.665 4.665 4.579 0.086 18496 1049 1 3 . 1 1 50 50 LYS CA C 50 54.431 54.431 55.009 -0.578 18496 1050 1 3 . 1 1 50 50 LYS CB C 50 36.543 36.543 35.992 0.551 18496 1051 1 3 . 1 1 50 50 LYS H H 50 8.067 8.067 7.339 0.728 18496 1052 1 3 . 1 1 51 51 MET HA H 51 4.936 4.936 4.391 0.545 18496 1053 1 3 . 1 1 51 51 MET CA C 51 54.048 54.048 52.819 1.229 18496 1054 1 3 . 1 1 51 51 MET CB C 51 33.768 33.768 34.981 -1.213 18496 1055 1 3 . 1 1 52 52 GLY C C 52 173.534 173.534 172.271 1.263 18496 1056 1 3 . 1 1 52 52 GLY CA C 52 43.060 43.060 44.414 -1.354 18496 1057 1 3 . 1 1 53 53 LYS N N 53 118.012 118.012 119.556 -1.544 18496 1058 1 3 . 1 1 53 53 LYS HA H 53 4.155 4.155 4.467 -0.312 18496 1059 1 3 . 1 1 53 53 LYS C C 53 176.818 176.818 176.149 0.669 18496 1060 1 3 . 1 1 53 53 LYS CA C 53 56.478 56.478 56.111 0.367 18496 1061 1 3 . 1 1 53 53 LYS CB C 53 33.117 33.117 33.455 -0.338 18496 1062 1 3 . 1 1 53 53 LYS H H 53 8.132 8.132 8.166 -0.034 18496 1063 1 3 . 1 1 54 54 GLY N N 54 109.836 109.836 108.113 1.723 18496 1064 1 3 . 1 1 54 54 GLY C C 54 170.848 170.848 172.768 -1.920 18496 1065 1 3 . 1 1 54 54 GLY CA C 54 46.701 46.701 44.818 1.883 18496 1066 1 3 . 1 1 54 54 GLY H H 54 8.079 8.079 8.170 -0.091 18496 1067 1 3 . 1 1 55 55 ILE N N 55 119.382 119.382 121.746 -2.364 18496 1068 1 3 . 1 1 55 55 ILE HA H 55 4.956 4.956 4.615 0.341 18496 1069 1 3 . 1 1 55 55 ILE C C 55 171.737 171.737 173.752 -2.015 18496 1070 1 3 . 1 1 55 55 ILE CA C 55 57.059 57.059 60.493 -3.434 18496 1071 1 3 . 1 1 55 55 ILE CB C 55 44.241 44.241 41.495 2.746 18496 1072 1 3 . 1 1 55 55 ILE H H 55 8.661 8.661 8.509 0.152 18496 1073 1 3 . 1 1 56 56 THR N N 56 113.795 113.795 122.709 -8.914 18496 1074 1 3 . 1 1 56 56 THR HA H 56 5.607 5.607 4.923 0.684 18496 1075 1 3 . 1 1 56 56 THR C C 56 174.417 174.417 173.680 0.737 18496 1076 1 3 . 1 1 56 56 THR CA C 56 59.098 59.098 61.656 -2.558 18496 1077 1 3 . 1 1 56 56 THR CB C 56 72.153 72.153 70.194 1.959 18496 1078 1 3 . 1 1 56 56 THR H H 56 7.916 7.916 8.421 -0.505 18496 1079 1 3 . 1 1 57 57 LEU N N 57 121.044 121.044 127.910 -6.866 18496 1080 1 3 . 1 1 57 57 LEU HA H 57 5.311 5.311 5.019 0.292 18496 1081 1 3 . 1 1 57 57 LEU C C 57 176.150 176.150 175.865 0.285 18496 1082 1 3 . 1 1 57 57 LEU CA C 57 53.264 53.264 53.639 -0.375 18496 1083 1 3 . 1 1 57 57 LEU CB C 57 45.901 45.901 45.056 0.845 18496 1084 1 3 . 1 1 57 57 LEU H H 57 9.421 9.421 9.110 0.311 18496 1085 1 3 . 1 1 58 58 SER N N 58 119.548 119.548 118.199 1.349 18496 1086 1 3 . 1 1 58 58 SER HA H 58 4.734 4.734 4.490 0.244 18496 1087 1 3 . 1 1 58 58 SER C C 58 174.786 174.786 175.835 -1.049 18496 1088 1 3 . 1 1 58 58 SER CA C 58 56.948 56.948 58.280 -1.332 18496 1089 1 3 . 1 1 58 58 SER CB C 58 65.726 65.726 64.646 1.080 18496 1090 1 3 . 1 1 58 58 SER H H 58 9.771 9.771 9.204 0.567 18496 1091 1 3 . 1 1 59 59 GLU N N 59 120.827 120.827 122.838 -2.011 18496 1092 1 3 . 1 1 59 59 GLU HA H 59 4.319 4.319 4.217 0.102 18496 1093 1 3 . 1 1 59 59 GLU C C 59 179.806 179.806 178.637 1.169 18496 1094 1 3 . 1 1 59 59 GLU CA C 59 60.913 60.913 61.274 -0.361 18496 1095 1 3 . 1 1 59 59 GLU CB C 59 29.538 29.538 29.430 0.108 18496 1096 1 3 . 1 1 59 59 GLU H H 59 9.394 9.394 9.153 0.241 18496 1097 1 3 . 1 1 60 60 GLU N N 60 119.587 119.587 119.411 0.176 18496 1098 1 3 . 1 1 60 60 GLU HA H 60 4.188 4.188 4.127 0.061 18496 1099 1 3 . 1 1 60 60 GLU C C 60 179.686 179.686 178.849 0.837 18496 1100 1 3 . 1 1 60 60 GLU CA C 60 60.279 60.279 59.502 0.777 18496 1101 1 3 . 1 1 60 60 GLU CB C 60 29.559 29.559 28.815 0.744 18496 1102 1 3 . 1 1 60 60 GLU H H 60 8.905 8.905 8.875 0.030 18496 1103 1 3 . 1 1 61 61 GLU N N 61 120.145 120.145 120.122 0.023 18496 1104 1 3 . 1 1 61 61 GLU HA H 61 4.037 4.037 4.116 -0.079 18496 1105 1 3 . 1 1 61 61 GLU C C 61 178.530 178.530 178.837 -0.307 18496 1106 1 3 . 1 1 61 61 GLU CA C 61 59.118 59.118 58.964 0.154 18496 1107 1 3 . 1 1 61 61 GLU CB C 61 30.976 30.976 29.354 1.622 18496 1108 1 3 . 1 1 61 61 GLU H H 61 8.013 8.013 8.366 -0.353 18496 1109 1 3 . 1 1 62 62 PHE N N 62 119.925 119.925 120.632 -0.707 18496 1110 1 3 . 1 1 62 62 PHE HA H 62 3.927 3.927 4.098 -0.171 18496 1111 1 3 . 1 1 62 62 PHE C C 62 176.783 176.783 177.644 -0.861 18496 1112 1 3 . 1 1 62 62 PHE CA C 62 61.827 61.827 61.497 0.330 18496 1113 1 3 . 1 1 62 62 PHE CB C 62 40.216 40.216 38.912 1.304 18496 1114 1 3 . 1 1 62 62 PHE H H 62 9.192 9.192 8.920 0.272 18496 1115 1 3 . 1 1 63 63 GLY N N 63 104.854 104.854 107.277 -2.423 18496 1116 1 3 . 1 1 63 63 GLY C C 63 176.854 176.854 176.097 0.757 18496 1117 1 3 . 1 1 63 63 GLY CA C 63 47.178 47.178 47.483 -0.305 18496 1118 1 3 . 1 1 63 63 GLY H H 63 8.316 8.316 8.670 -0.354 18496 1119 1 3 . 1 1 64 64 VAL N N 64 123.719 123.719 123.090 0.629 18496 1120 1 3 . 1 1 64 64 VAL HA H 64 3.663 3.663 3.719 -0.056 18496 1121 1 3 . 1 1 64 64 VAL C C 64 177.644 177.644 177.876 -0.232 18496 1122 1 3 . 1 1 64 64 VAL CA C 64 67.090 67.090 65.853 1.237 18496 1123 1 3 . 1 1 64 64 VAL CB C 64 31.367 31.367 31.114 0.253 18496 1124 1 3 . 1 1 64 64 VAL H H 64 7.759 7.759 7.712 0.047 18496 1125 1 3 . 1 1 65 65 LEU N N 65 120.099 120.099 121.361 -1.262 18496 1126 1 3 . 1 1 65 65 LEU HA H 65 3.672 3.672 3.911 -0.239 18496 1127 1 3 . 1 1 65 65 LEU C C 65 177.636 177.636 178.672 -1.036 18496 1128 1 3 . 1 1 65 65 LEU CA C 65 58.552 58.552 58.476 0.076 18496 1129 1 3 . 1 1 65 65 LEU CB C 65 41.358 41.358 41.688 -0.330 18496 1130 1 3 . 1 1 65 65 LEU H H 65 7.660 7.660 8.209 -0.549 18496 1131 1 3 . 1 1 66 66 LEU N N 66 115.733 115.733 118.100 -2.367 18496 1132 1 3 . 1 1 66 66 LEU HA H 66 3.556 3.556 3.619 -0.063 18496 1133 1 3 . 1 1 66 66 LEU C C 66 179.729 179.729 178.823 0.906 18496 1134 1 3 . 1 1 66 66 LEU CA C 66 58.069 58.069 58.091 -0.022 18496 1135 1 3 . 1 1 66 66 LEU CB C 66 41.625 41.625 40.929 0.696 18496 1136 1 3 . 1 1 66 66 LEU H H 66 8.083 8.083 8.222 -0.139 18496 1137 1 3 . 1 1 67 67 LYS N N 67 119.120 119.120 119.984 -0.864 18496 1138 1 3 . 1 1 67 67 LYS HA H 67 3.965 3.965 3.808 0.157 18496 1139 1 3 . 1 1 67 67 LYS C C 67 179.379 179.379 178.947 0.432 18496 1140 1 3 . 1 1 67 67 LYS CA C 67 59.227 59.227 59.825 -0.598 18496 1141 1 3 . 1 1 67 67 LYS CB C 67 32.737 32.737 32.233 0.504 18496 1142 1 3 . 1 1 67 67 LYS H H 67 7.861 7.861 8.137 -0.276 18496 1143 1 3 . 1 1 68 68 GLU N N 68 116.924 116.924 118.551 -1.627 18496 1144 1 3 . 1 1 68 68 GLU HA H 68 4.409 4.409 4.089 0.320 18496 1145 1 3 . 1 1 68 68 GLU CA C 68 57.712 57.712 58.860 -1.148 18496 1146 1 3 . 1 1 68 68 GLU CB C 68 29.586 29.586 29.501 0.085 18496 1147 1 3 . 1 1 68 68 GLU H H 68 8.319 8.319 7.972 0.347 18496 1148 1 3 . 1 1 69 69 LEU N N 69 120.032 120.032 119.781 0.251 18496 1149 1 3 . 1 1 69 69 LEU HA H 69 4.107 4.107 3.925 0.182 18496 1150 1 3 . 1 1 69 69 LEU CA C 69 57.563 57.563 57.491 0.072 18496 1151 1 3 . 1 1 69 69 LEU CB C 69 41.373 41.373 41.499 -0.126 18496 1152 1 3 . 1 1 69 69 LEU H H 69 8.233 8.233 8.538 -0.305 18496 1153 1 3 . 1 1 70 70 GLY N N 70 105.472 105.472 105.420 0.052 18496 1154 1 3 . 1 1 70 70 GLY C C 70 174.986 174.986 175.617 -0.631 18496 1155 1 3 . 1 1 70 70 GLY CA C 70 46.704 46.704 46.847 -0.144 18496 1156 1 3 . 1 1 70 70 GLY H H 70 7.960 7.960 8.536 -0.576 18496 1157 1 3 . 1 1 71 71 ASN N N 71 118.596 118.596 118.409 0.187 18496 1158 1 3 . 1 1 71 71 ASN HA H 71 4.681 4.681 4.833 -0.152 18496 1159 1 3 . 1 1 71 71 ASN C C 71 176.412 176.412 177.179 -0.767 18496 1160 1 3 . 1 1 71 71 ASN CA C 71 54.407 54.407 54.635 -0.228 18496 1161 1 3 . 1 1 71 71 ASN CB C 71 38.729 38.729 38.630 0.099 18496 1162 1 3 . 1 1 71 71 ASN H H 71 7.857 7.857 7.736 0.121 18496 1163 1 3 . 1 1 72 72 LYS N N 72 119.973 119.973 118.524 1.449 18496 1164 1 3 . 1 1 72 72 LYS HA H 72 4.282 4.282 4.221 0.061 18496 1165 1 3 . 1 1 72 72 LYS CA C 72 57.338 57.338 57.402 -0.064 18496 1166 1 3 . 1 1 72 72 LYS CB C 72 32.755 32.755 32.283 0.472 18496 1167 1 3 . 1 1 72 72 LYS H H 72 8.100 8.100 7.798 0.302 18496 1168 1 3 . 1 1 73 73 LEU HA H 73 4.281 4.281 4.215 0.066 18496 1169 1 3 . 1 1 73 73 LEU CA C 73 55.774 55.774 55.335 0.439 18496 1170 1 3 . 1 1 73 73 LEU CB C 73 41.983 41.983 42.365 -0.382 18496 1171 1 4 . 1 1 2 2 ALA HA H 2 4.074 4.074 4.528 -0.454 18496 1172 1 4 . 1 1 2 2 ALA CA C 2 51.966 51.966 51.490 0.476 18496 1173 1 4 . 1 1 2 2 ALA CB C 2 19.732 19.732 19.893 -0.161 18496 1174 1 4 . 1 1 3 3 ASP HA H 3 4.632 4.632 4.508 0.124 18496 1175 1 4 . 1 1 3 3 ASP C C 3 175.822 175.822 176.337 -0.515 18496 1176 1 4 . 1 1 3 3 ASP CA C 3 54.440 54.440 55.498 -1.058 18496 1177 1 4 . 1 1 3 3 ASP CB C 3 41.577 41.577 41.274 0.303 18496 1178 1 4 . 1 1 4 4 LYS N N 4 121.655 121.655 119.733 1.922 18496 1179 1 4 . 1 1 4 4 LYS HA H 4 4.379 4.379 4.510 -0.131 18496 1180 1 4 . 1 1 4 4 LYS C C 4 176.011 176.011 175.857 0.154 18496 1181 1 4 . 1 1 4 4 LYS CA C 4 56.213 56.213 54.834 1.379 18496 1182 1 4 . 1 1 4 4 LYS CB C 4 33.407 33.407 32.009 1.398 18496 1183 1 4 . 1 1 4 4 LYS H H 4 8.394 8.394 7.996 0.398 18496 1184 1 4 . 1 1 5 5 LEU N N 5 125.369 125.369 124.982 0.387 18496 1185 1 4 . 1 1 5 5 LEU HA H 5 4.351 4.351 4.311 0.040 18496 1186 1 4 . 1 1 5 5 LEU C C 5 175.682 175.682 176.352 -0.670 18496 1187 1 4 . 1 1 5 5 LEU CA C 5 55.117 55.117 54.953 0.164 18496 1188 1 4 . 1 1 5 5 LEU CB C 5 43.197 43.197 42.902 0.295 18496 1189 1 4 . 1 1 5 5 LEU H H 5 8.136 8.136 8.111 0.025 18496 1190 1 4 . 1 1 6 6 LYS N N 6 126.844 126.844 125.077 1.767 18496 1191 1 4 . 1 1 6 6 LYS HA H 6 4.451 4.451 4.556 -0.105 18496 1192 1 4 . 1 1 6 6 LYS C C 6 174.665 174.665 175.450 -0.785 18496 1193 1 4 . 1 1 6 6 LYS CA C 6 55.974 55.974 56.181 -0.207 18496 1194 1 4 . 1 1 6 6 LYS CB C 6 34.386 34.386 33.371 1.015 18496 1195 1 4 . 1 1 6 6 LYS H H 6 8.615 8.615 8.562 0.053 18496 1196 1 4 . 1 1 7 7 PHE N N 7 119.818 119.818 119.437 0.381 18496 1197 1 4 . 1 1 7 7 PHE HA H 7 5.343 5.343 5.487 -0.144 18496 1198 1 4 . 1 1 7 7 PHE C C 7 173.569 173.569 173.614 -0.045 18496 1199 1 4 . 1 1 7 7 PHE CA C 7 55.813 55.813 55.815 -0.002 18496 1200 1 4 . 1 1 7 7 PHE CB C 7 42.975 42.975 42.400 0.575 18496 1201 1 4 . 1 1 7 7 PHE H H 7 7.734 7.734 8.318 -0.584 18496 1202 1 4 . 1 1 8 8 GLU N N 8 119.165 119.165 119.742 -0.577 18496 1203 1 4 . 1 1 8 8 GLU HA H 8 4.158 4.158 4.200 -0.042 18496 1204 1 4 . 1 1 8 8 GLU C C 8 175.026 175.026 174.275 0.751 18496 1205 1 4 . 1 1 8 8 GLU CA C 8 55.221 55.221 54.356 0.865 18496 1206 1 4 . 1 1 8 8 GLU CB C 8 33.699 33.699 32.911 0.788 18496 1207 1 4 . 1 1 8 8 GLU H H 8 8.295 8.295 8.742 -0.447 18496 1208 1 4 . 1 1 9 9 ILE N N 9 127.619 127.619 127.781 -0.162 18496 1209 1 4 . 1 1 9 9 ILE HA H 9 3.768 3.768 4.122 -0.354 18496 1210 1 4 . 1 1 9 9 ILE C C 9 174.902 174.902 175.780 -0.878 18496 1211 1 4 . 1 1 9 9 ILE CA C 9 62.505 62.505 62.508 -0.003 18496 1212 1 4 . 1 1 9 9 ILE CB C 9 36.094 36.094 37.660 -1.566 18496 1213 1 4 . 1 1 9 9 ILE H H 9 9.157 9.157 8.634 0.523 18496 1214 1 4 . 1 1 10 10 ILE N N 10 131.245 131.245 128.977 2.268 18496 1215 1 4 . 1 1 10 10 ILE HA H 10 3.861 3.861 4.076 -0.215 18496 1216 1 4 . 1 1 10 10 ILE C C 10 176.247 176.247 176.334 -0.087 18496 1217 1 4 . 1 1 10 10 ILE CA C 10 60.554 60.554 62.247 -1.693 18496 1218 1 4 . 1 1 10 10 ILE CB C 10 37.406 37.406 38.455 -1.049 18496 1219 1 4 . 1 1 10 10 ILE H H 10 8.428 8.428 8.783 -0.355 18496 1220 1 4 . 1 1 11 11 GLU N N 11 117.669 117.669 118.743 -1.074 18496 1221 1 4 . 1 1 11 11 GLU HA H 11 4.315 4.315 4.488 -0.173 18496 1222 1 4 . 1 1 11 11 GLU C C 11 174.155 174.155 174.536 -0.381 18496 1223 1 4 . 1 1 11 11 GLU CA C 11 55.755 55.755 55.571 0.184 18496 1224 1 4 . 1 1 11 11 GLU CB C 11 34.386 34.386 32.751 1.635 18496 1225 1 4 . 1 1 11 11 GLU H H 11 7.551 7.551 7.905 -0.354 18496 1226 1 4 . 1 1 12 12 GLU N N 12 128.587 128.587 125.412 3.175 18496 1227 1 4 . 1 1 12 12 GLU HA H 12 5.214 5.214 4.463 0.751 18496 1228 1 4 . 1 1 12 12 GLU C C 12 176.877 176.877 175.496 1.381 18496 1229 1 4 . 1 1 12 12 GLU CA C 12 54.801 54.801 57.485 -2.684 18496 1230 1 4 . 1 1 12 12 GLU CB C 12 30.137 30.137 30.377 -0.240 18496 1231 1 4 . 1 1 12 12 GLU H H 12 8.762 8.762 8.920 -0.158 18496 1232 1 4 . 1 1 13 13 LEU N N 13 122.508 122.508 123.958 -1.450 18496 1233 1 4 . 1 1 13 13 LEU HA H 13 4.872 4.872 4.511 0.361 18496 1234 1 4 . 1 1 13 13 LEU C C 13 176.060 176.060 176.804 -0.744 18496 1235 1 4 . 1 1 13 13 LEU CA C 13 57.372 57.372 55.647 1.725 18496 1236 1 4 . 1 1 13 13 LEU CB C 13 42.284 42.284 43.195 -0.911 18496 1237 1 4 . 1 1 13 13 LEU H H 13 8.058 8.058 8.749 -0.691 18496 1238 1 4 . 1 1 14 14 ILE N N 14 115.422 115.422 118.248 -2.826 18496 1239 1 4 . 1 1 14 14 ILE HA H 14 4.553 4.553 4.452 0.101 18496 1240 1 4 . 1 1 14 14 ILE C C 14 174.893 174.893 174.039 0.854 18496 1241 1 4 . 1 1 14 14 ILE CA C 14 60.586 60.586 59.677 0.909 18496 1242 1 4 . 1 1 14 14 ILE CB C 14 44.329 44.329 41.277 3.052 18496 1243 1 4 . 1 1 14 14 ILE H H 14 8.450 8.450 8.367 0.083 18496 1244 1 4 . 1 1 15 15 VAL N N 15 129.108 129.108 126.230 2.878 18496 1245 1 4 . 1 1 15 15 VAL HA H 15 4.196 4.196 4.434 -0.238 18496 1246 1 4 . 1 1 15 15 VAL C C 15 175.180 175.180 175.112 0.068 18496 1247 1 4 . 1 1 15 15 VAL CA C 15 63.288 63.288 60.970 2.318 18496 1248 1 4 . 1 1 15 15 VAL CB C 15 32.117 32.117 32.497 -0.380 18496 1249 1 4 . 1 1 15 15 VAL H H 15 8.867 8.867 8.554 0.313 18496 1250 1 4 . 1 1 16 16 LEU N N 16 127.846 127.846 129.316 -1.470 18496 1251 1 4 . 1 1 16 16 LEU HA H 16 4.317 4.317 4.595 -0.278 18496 1252 1 4 . 1 1 16 16 LEU C C 16 176.070 176.070 177.336 -1.266 18496 1253 1 4 . 1 1 16 16 LEU CA C 16 57.252 57.252 56.579 0.673 18496 1254 1 4 . 1 1 16 16 LEU CB C 16 42.035 42.035 42.544 -0.509 18496 1255 1 4 . 1 1 16 16 LEU H H 16 9.555 9.555 8.728 0.827 18496 1256 1 4 . 1 1 17 17 SER N N 17 107.073 107.073 110.383 -3.310 18496 1257 1 4 . 1 1 17 17 SER HA H 17 4.540 4.540 4.634 -0.094 18496 1258 1 4 . 1 1 17 17 SER C C 17 172.277 172.277 172.297 -0.020 18496 1259 1 4 . 1 1 17 17 SER CA C 17 57.882 57.882 57.967 -0.085 18496 1260 1 4 . 1 1 17 17 SER CB C 17 64.046 64.046 64.996 -0.950 18496 1261 1 4 . 1 1 17 17 SER H H 17 7.699 7.699 7.873 -0.174 18496 1262 1 4 . 1 1 18 18 GLU N N 18 119.235 119.235 120.125 -0.890 18496 1263 1 4 . 1 1 18 18 GLU HA H 18 5.143 5.143 4.987 0.156 18496 1264 1 4 . 1 1 18 18 GLU C C 18 175.469 175.469 176.202 -0.733 18496 1265 1 4 . 1 1 18 18 GLU CA C 18 55.248 55.248 54.961 0.287 18496 1266 1 4 . 1 1 18 18 GLU CB C 18 33.454 33.454 31.061 2.393 18496 1267 1 4 . 1 1 18 18 GLU H H 18 8.437 8.437 8.508 -0.071 18496 1268 1 4 . 1 1 19 19 ASN N N 19 123.988 123.988 121.311 2.677 18496 1269 1 4 . 1 1 19 19 ASN HA H 19 5.097 5.097 4.744 0.353 18496 1270 1 4 . 1 1 19 19 ASN CA C 19 50.916 50.916 53.159 -2.243 18496 1271 1 4 . 1 1 19 19 ASN CB C 19 39.482 39.482 39.695 -0.213 18496 1272 1 4 . 1 1 19 19 ASN H H 19 8.779 8.779 8.449 0.330 18496 1273 1 4 . 1 1 20 20 ALA N N 20 120.854 120.854 122.691 -1.837 18496 1274 1 4 . 1 1 20 20 ALA HA H 20 4.239 4.239 4.184 0.055 18496 1275 1 4 . 1 1 20 20 ALA C C 20 179.032 179.032 178.121 0.911 18496 1276 1 4 . 1 1 20 20 ALA CA C 20 54.924 54.924 54.272 0.652 18496 1277 1 4 . 1 1 20 20 ALA CB C 20 18.621 18.621 18.706 -0.085 18496 1278 1 4 . 1 1 20 20 ALA H H 20 8.616 8.616 8.642 -0.026 18496 1279 1 4 . 1 1 21 21 LYS N N 21 115.771 115.771 116.692 -0.921 18496 1280 1 4 . 1 1 21 21 LYS HA H 21 4.497 4.497 4.281 0.216 18496 1281 1 4 . 1 1 21 21 LYS C C 21 176.615 176.615 176.874 -0.259 18496 1282 1 4 . 1 1 21 21 LYS CA C 21 55.503 55.503 55.350 0.153 18496 1283 1 4 . 1 1 21 21 LYS CB C 21 32.742 32.742 32.041 0.701 18496 1284 1 4 . 1 1 21 21 LYS H H 21 7.767 7.767 7.738 0.029 18496 1285 1 4 . 1 1 22 22 GLY N N 22 107.695 107.695 106.452 1.243 18496 1286 1 4 . 1 1 22 22 GLY C C 22 174.843 174.843 174.432 0.411 18496 1287 1 4 . 1 1 22 22 GLY CA C 22 45.297 45.297 45.204 0.093 18496 1288 1 4 . 1 1 22 22 GLY H H 22 8.317 8.317 7.813 0.504 18496 1289 1 4 . 1 1 23 23 TRP N N 23 121.316 121.316 121.238 0.078 18496 1290 1 4 . 1 1 23 23 TRP HA H 23 4.815 4.815 4.827 -0.012 18496 1291 1 4 . 1 1 23 23 TRP C C 23 176.754 176.754 176.548 0.206 18496 1292 1 4 . 1 1 23 23 TRP CA C 23 58.291 58.291 54.948 3.343 18496 1293 1 4 . 1 1 23 23 TRP CB C 23 28.127 28.127 28.062 0.065 18496 1294 1 4 . 1 1 23 23 TRP H H 23 7.983 7.983 8.021 -0.038 18496 1295 1 4 . 1 1 24 24 ARG N N 24 120.789 120.789 127.111 -6.322 18496 1296 1 4 . 1 1 24 24 ARG HA H 24 5.496 5.496 4.943 0.553 18496 1297 1 4 . 1 1 24 24 ARG C C 24 175.831 175.831 176.129 -0.298 18496 1298 1 4 . 1 1 24 24 ARG CA C 24 54.755 54.755 54.640 0.115 18496 1299 1 4 . 1 1 24 24 ARG CB C 24 33.735 33.735 30.057 3.678 18496 1300 1 4 . 1 1 24 24 ARG H H 24 9.046 9.046 9.429 -0.383 18496 1301 1 4 . 1 1 25 25 LYS N N 25 126.507 126.507 129.136 -2.629 18496 1302 1 4 . 1 1 25 25 LYS HA H 25 5.081 5.081 4.859 0.222 18496 1303 1 4 . 1 1 25 25 LYS C C 25 175.648 175.648 175.716 -0.068 18496 1304 1 4 . 1 1 25 25 LYS CA C 25 56.071 56.071 57.049 -0.978 18496 1305 1 4 . 1 1 25 25 LYS CB C 25 32.214 32.214 33.077 -0.863 18496 1306 1 4 . 1 1 25 25 LYS H H 25 8.526 8.526 8.587 -0.061 18496 1307 1 4 . 1 1 26 26 GLU N N 26 126.009 126.009 123.599 2.410 18496 1308 1 4 . 1 1 26 26 GLU HA H 26 5.275 5.275 5.147 0.128 18496 1309 1 4 . 1 1 26 26 GLU C C 26 174.894 174.894 174.149 0.745 18496 1310 1 4 . 1 1 26 26 GLU CA C 26 55.271 55.271 55.066 0.205 18496 1311 1 4 . 1 1 26 26 GLU CB C 26 33.781 33.781 34.834 -1.053 18496 1312 1 4 . 1 1 26 26 GLU H H 26 9.125 9.125 9.208 -0.083 18496 1313 1 4 . 1 1 27 27 LEU N N 27 121.930 121.930 124.102 -2.172 18496 1314 1 4 . 1 1 27 27 LEU HA H 27 5.788 5.788 4.873 0.915 18496 1315 1 4 . 1 1 27 27 LEU C C 27 173.941 173.941 174.334 -0.393 18496 1316 1 4 . 1 1 27 27 LEU CA C 27 53.859 53.859 54.001 -0.142 18496 1317 1 4 . 1 1 27 27 LEU CB C 27 44.020 44.020 44.332 -0.312 18496 1318 1 4 . 1 1 27 27 LEU H H 27 8.938 8.938 9.091 -0.153 18496 1319 1 4 . 1 1 28 28 ASN N N 28 124.630 124.630 124.964 -0.334 18496 1320 1 4 . 1 1 28 28 ASN HA H 28 5.411 5.411 5.230 0.181 18496 1321 1 4 . 1 1 28 28 ASN C C 28 174.366 174.366 173.264 1.102 18496 1322 1 4 . 1 1 28 28 ASN CA C 28 52.063 52.063 52.338 -0.275 18496 1323 1 4 . 1 1 28 28 ASN CB C 28 44.430 44.430 43.391 1.039 18496 1324 1 4 . 1 1 28 28 ASN H H 28 9.345 9.345 8.169 1.176 18496 1325 1 4 . 1 1 29 29 ARG N N 29 118.443 118.443 122.416 -3.973 18496 1326 1 4 . 1 1 29 29 ARG HA H 29 5.058 5.058 4.834 0.224 18496 1327 1 4 . 1 1 29 29 ARG C C 29 175.779 175.779 174.657 1.122 18496 1328 1 4 . 1 1 29 29 ARG CA C 29 56.091 56.091 55.791 0.300 18496 1329 1 4 . 1 1 29 29 ARG CB C 29 31.710 31.710 31.009 0.702 18496 1330 1 4 . 1 1 29 29 ARG H H 29 9.109 9.109 9.150 -0.041 18496 1331 1 4 . 1 1 30 30 VAL N N 30 124.605 124.605 122.478 2.127 18496 1332 1 4 . 1 1 30 30 VAL HA H 30 4.535 4.535 5.321 -0.786 18496 1333 1 4 . 1 1 30 30 VAL C C 30 174.775 174.775 174.383 0.392 18496 1334 1 4 . 1 1 30 30 VAL CA C 30 60.921 60.921 59.104 1.817 18496 1335 1 4 . 1 1 30 30 VAL CB C 30 37.790 37.790 36.112 1.678 18496 1336 1 4 . 1 1 30 30 VAL H H 30 9.054 9.054 8.358 0.696 18496 1337 1 4 . 1 1 31 31 SER N N 31 120.794 120.794 114.812 5.982 18496 1338 1 4 . 1 1 31 31 SER HA H 31 4.652 4.652 5.077 -0.425 18496 1339 1 4 . 1 1 31 31 SER C C 31 174.214 174.214 175.405 -1.191 18496 1340 1 4 . 1 1 31 31 SER CA C 31 56.279 56.279 57.122 -0.843 18496 1341 1 4 . 1 1 31 31 SER CB C 31 64.128 64.128 64.007 0.121 18496 1342 1 4 . 1 1 31 31 SER H H 31 8.667 8.667 8.867 -0.200 18496 1343 1 4 . 1 1 32 32 TRP N N 32 132.303 132.303 128.250 4.053 18496 1344 1 4 . 1 1 32 32 TRP HA H 32 5.105 5.105 4.534 0.571 18496 1345 1 4 . 1 1 32 32 TRP C C 32 177.276 177.276 177.139 0.137 18496 1346 1 4 . 1 1 32 32 TRP CA C 32 56.198 56.198 58.324 -2.126 18496 1347 1 4 . 1 1 32 32 TRP CB C 32 29.968 29.968 28.022 1.946 18496 1348 1 4 . 1 1 32 32 TRP H H 32 9.282 9.282 9.347 -0.065 18496 1349 1 4 . 1 1 33 33 ASN N N 33 124.979 124.979 123.617 1.362 18496 1350 1 4 . 1 1 33 33 ASN HA H 33 4.257 4.257 4.385 -0.128 18496 1351 1 4 . 1 1 33 33 ASN C C 33 174.030 174.030 174.739 -0.709 18496 1352 1 4 . 1 1 33 33 ASN CA C 33 54.709 54.709 54.782 -0.073 18496 1353 1 4 . 1 1 33 33 ASN CB C 33 37.921 37.921 36.971 0.950 18496 1354 1 4 . 1 1 33 33 ASN H H 33 9.813 9.813 8.826 0.987 18496 1355 1 4 . 1 1 34 34 ASP N N 34 111.880 111.880 113.965 -2.085 18496 1356 1 4 . 1 1 34 34 ASP HA H 34 4.126 4.126 4.219 -0.093 18496 1357 1 4 . 1 1 34 34 ASP CA C 34 56.130 56.130 55.840 0.290 18496 1358 1 4 . 1 1 34 34 ASP CB C 34 39.760 39.760 40.253 -0.493 18496 1359 1 4 . 1 1 34 34 ASP H H 34 9.251 9.251 8.335 0.916 18496 1360 1 4 . 1 1 35 35 ALA N N 35 121.811 121.811 120.825 0.986 18496 1361 1 4 . 1 1 35 35 ALA HA H 35 4.477 4.477 4.502 -0.025 18496 1362 1 4 . 1 1 35 35 ALA C C 35 177.778 177.778 177.241 0.537 18496 1363 1 4 . 1 1 35 35 ALA CA C 35 51.528 51.528 52.526 -0.998 18496 1364 1 4 . 1 1 35 35 ALA CB C 35 20.445 20.445 20.245 0.200 18496 1365 1 4 . 1 1 35 35 ALA H H 35 7.625 7.625 7.798 -0.173 18496 1366 1 4 . 1 1 36 36 GLU N N 36 121.068 121.068 122.112 -1.044 18496 1367 1 4 . 1 1 36 36 GLU HA H 36 4.390 4.390 4.721 -0.331 18496 1368 1 4 . 1 1 36 36 GLU CA C 36 55.276 55.276 52.340 2.936 18496 1369 1 4 . 1 1 36 36 GLU CB C 36 28.575 28.575 30.897 -2.322 18496 1370 1 4 . 1 1 36 36 GLU H H 36 8.658 8.658 8.139 0.519 18496 1371 1 4 . 1 1 37 37 PRO HA H 37 4.289 4.289 4.701 -0.412 18496 1372 1 4 . 1 1 37 37 PRO C C 37 175.799 175.799 175.961 -0.162 18496 1373 1 4 . 1 1 37 37 PRO CA C 37 63.105 63.105 62.326 0.779 18496 1374 1 4 . 1 1 37 37 PRO CB C 37 32.076 32.076 31.725 0.351 18496 1375 1 4 . 1 1 38 38 LYS N N 38 120.881 120.881 123.293 -2.412 18496 1376 1 4 . 1 1 38 38 LYS HA H 38 4.700 4.700 4.409 0.291 18496 1377 1 4 . 1 1 38 38 LYS C C 38 176.906 176.906 174.682 2.224 18496 1378 1 4 . 1 1 38 38 LYS CA C 38 54.399 54.399 54.764 -0.365 18496 1379 1 4 . 1 1 38 38 LYS CB C 38 37.217 37.217 36.520 0.696 18496 1380 1 4 . 1 1 38 38 LYS H H 38 8.316 8.316 8.891 -0.575 18496 1381 1 4 . 1 1 39 39 TYR N N 39 119.792 119.792 119.154 0.638 18496 1382 1 4 . 1 1 39 39 TYR HA H 39 4.636 4.636 4.535 0.101 18496 1383 1 4 . 1 1 39 39 TYR C C 39 175.834 175.834 174.740 1.094 18496 1384 1 4 . 1 1 39 39 TYR CA C 39 60.228 60.228 57.990 2.238 18496 1385 1 4 . 1 1 39 39 TYR CB C 39 38.683 38.683 38.946 -0.263 18496 1386 1 4 . 1 1 39 39 TYR H H 39 8.508 8.508 8.051 0.457 18496 1387 1 4 . 1 1 40 40 ASP N N 40 126.502 126.502 123.395 3.107 18496 1388 1 4 . 1 1 40 40 ASP HA H 40 5.597 5.597 5.325 0.272 18496 1389 1 4 . 1 1 40 40 ASP C C 40 175.283 175.283 174.072 1.211 18496 1390 1 4 . 1 1 40 40 ASP CA C 40 55.053 55.053 53.627 1.427 18496 1391 1 4 . 1 1 40 40 ASP CB C 40 48.656 48.656 45.411 3.245 18496 1392 1 4 . 1 1 40 40 ASP H H 40 9.219 9.219 8.310 0.909 18496 1393 1 4 . 1 1 41 41 ILE N N 41 125.910 125.910 124.979 0.931 18496 1394 1 4 . 1 1 41 41 ILE HA H 41 5.722 5.722 4.950 0.772 18496 1395 1 4 . 1 1 41 41 ILE C C 41 174.167 174.167 173.634 0.533 18496 1396 1 4 . 1 1 41 41 ILE CA C 41 60.734 60.734 59.936 0.798 18496 1397 1 4 . 1 1 41 41 ILE CB C 41 40.198 40.198 39.981 0.217 18496 1398 1 4 . 1 1 41 41 ILE H H 41 8.972 8.972 8.742 0.230 18496 1399 1 4 . 1 1 42 42 ARG N N 42 120.300 120.300 126.616 -6.316 18496 1400 1 4 . 1 1 42 42 ARG HA H 42 4.716 4.716 4.771 -0.055 18496 1401 1 4 . 1 1 42 42 ARG CA C 42 54.826 54.826 54.898 -0.072 18496 1402 1 4 . 1 1 42 42 ARG CB C 42 32.665 32.665 35.411 -2.746 18496 1403 1 4 . 1 1 42 42 ARG H H 42 8.320 8.320 8.594 -0.274 18496 1404 1 4 . 1 1 43 43 THR HA H 43 5.585 5.585 5.457 0.128 18496 1405 1 4 . 1 1 43 43 THR C C 43 173.294 173.294 173.199 0.095 18496 1406 1 4 . 1 1 43 43 THR CA C 43 60.847 60.847 59.791 1.056 18496 1407 1 4 . 1 1 43 43 THR CB C 43 69.961 69.961 71.027 -1.066 18496 1408 1 4 . 1 1 44 44 TRP N N 44 122.747 122.747 123.868 -1.121 18496 1409 1 4 . 1 1 44 44 TRP HA H 44 4.945 4.945 4.801 0.144 18496 1410 1 4 . 1 1 44 44 TRP C C 44 175.056 175.056 176.058 -1.002 18496 1411 1 4 . 1 1 44 44 TRP CA C 44 56.107 56.107 55.688 0.418 18496 1412 1 4 . 1 1 44 44 TRP CB C 44 34.506 34.506 32.556 1.950 18496 1413 1 4 . 1 1 44 44 TRP H H 44 9.180 9.180 8.992 0.188 18496 1414 1 4 . 1 1 45 45 SER N N 45 117.385 117.385 116.284 1.101 18496 1415 1 4 . 1 1 45 45 SER HA H 45 2.300 2.300 4.921 -2.621 18496 1416 1 4 . 1 1 45 45 SER CA C 45 56.481 56.481 56.876 -0.395 18496 1417 1 4 . 1 1 45 45 SER CB C 45 60.743 60.743 62.360 -1.617 18496 1418 1 4 . 1 1 45 45 SER H H 45 7.879 7.879 8.309 -0.430 18496 1419 1 4 . 1 1 46 46 PRO HA H 46 4.104 4.104 4.470 -0.366 18496 1420 1 4 . 1 1 46 46 PRO CA C 46 64.990 64.990 65.628 -0.638 18496 1421 1 4 . 1 1 46 46 PRO CB C 46 31.272 31.272 31.820 -0.548 18496 1422 1 4 . 1 1 47 47 ASP HA H 47 4.520 4.520 4.627 -0.107 18496 1423 1 4 . 1 1 47 47 ASP C C 47 175.629 175.629 175.548 0.081 18496 1424 1 4 . 1 1 47 47 ASP CA C 47 53.453 53.453 53.060 0.393 18496 1425 1 4 . 1 1 47 47 ASP CB C 47 40.239 40.239 41.205 -0.966 18496 1426 1 4 . 1 1 48 48 HIS N N 48 111.320 111.320 116.493 -5.173 18496 1427 1 4 . 1 1 48 48 HIS HA H 48 3.916 3.916 4.484 -0.568 18496 1428 1 4 . 1 1 48 48 HIS CA C 48 60.347 60.347 57.341 3.006 18496 1429 1 4 . 1 1 48 48 HIS CB C 48 25.499 25.499 27.829 -2.330 18496 1430 1 4 . 1 1 48 48 HIS H H 48 8.269 8.269 8.249 0.020 18496 1431 1 4 . 1 1 49 49 GLU N N 49 114.659 114.659 117.023 -2.364 18496 1432 1 4 . 1 1 49 49 GLU HA H 49 4.447 4.447 4.327 0.120 18496 1433 1 4 . 1 1 49 49 GLU C C 49 176.394 176.394 176.290 0.104 18496 1434 1 4 . 1 1 49 49 GLU CA C 49 57.940 57.940 57.946 -0.006 18496 1435 1 4 . 1 1 49 49 GLU CB C 49 30.641 30.641 30.954 -0.313 18496 1436 1 4 . 1 1 49 49 GLU H H 49 7.381 7.381 8.269 -0.888 18496 1437 1 4 . 1 1 50 50 LYS N N 50 118.126 118.126 117.857 0.269 18496 1438 1 4 . 1 1 50 50 LYS HA H 50 4.665 4.665 4.698 -0.033 18496 1439 1 4 . 1 1 50 50 LYS CA C 50 54.431 54.431 54.276 0.154 18496 1440 1 4 . 1 1 50 50 LYS CB C 50 36.543 36.543 36.453 0.090 18496 1441 1 4 . 1 1 50 50 LYS H H 50 8.067 8.067 7.998 0.069 18496 1442 1 4 . 1 1 51 51 MET HA H 51 4.936 4.936 4.436 0.500 18496 1443 1 4 . 1 1 51 51 MET CA C 51 54.048 54.048 52.868 1.180 18496 1444 1 4 . 1 1 51 51 MET CB C 51 33.768 33.768 34.940 -1.172 18496 1445 1 4 . 1 1 52 52 GLY C C 52 173.534 173.534 172.214 1.320 18496 1446 1 4 . 1 1 52 52 GLY CA C 52 43.060 43.060 44.425 -1.365 18496 1447 1 4 . 1 1 53 53 LYS N N 53 118.012 118.012 119.742 -1.730 18496 1448 1 4 . 1 1 53 53 LYS HA H 53 4.155 4.155 4.465 -0.310 18496 1449 1 4 . 1 1 53 53 LYS C C 53 176.818 176.818 176.150 0.668 18496 1450 1 4 . 1 1 53 53 LYS CA C 53 56.478 56.478 56.081 0.397 18496 1451 1 4 . 1 1 53 53 LYS CB C 53 33.117 33.117 33.331 -0.214 18496 1452 1 4 . 1 1 53 53 LYS H H 53 8.132 8.132 8.169 -0.037 18496 1453 1 4 . 1 1 54 54 GLY N N 54 109.836 109.836 108.448 1.388 18496 1454 1 4 . 1 1 54 54 GLY C C 54 170.848 170.848 172.756 -1.908 18496 1455 1 4 . 1 1 54 54 GLY CA C 54 46.701 46.701 44.752 1.949 18496 1456 1 4 . 1 1 54 54 GLY H H 54 8.079 8.079 8.167 -0.088 18496 1457 1 4 . 1 1 55 55 ILE N N 55 119.382 119.382 121.629 -2.247 18496 1458 1 4 . 1 1 55 55 ILE HA H 55 4.956 4.956 4.631 0.325 18496 1459 1 4 . 1 1 55 55 ILE C C 55 171.737 171.737 173.718 -1.981 18496 1460 1 4 . 1 1 55 55 ILE CA C 55 57.059 57.059 60.459 -3.400 18496 1461 1 4 . 1 1 55 55 ILE CB C 55 44.241 44.241 41.562 2.679 18496 1462 1 4 . 1 1 55 55 ILE H H 55 8.661 8.661 8.353 0.308 18496 1463 1 4 . 1 1 56 56 THR N N 56 113.795 113.795 122.154 -8.359 18496 1464 1 4 . 1 1 56 56 THR HA H 56 5.607 5.607 4.891 0.716 18496 1465 1 4 . 1 1 56 56 THR C C 56 174.417 174.417 173.612 0.805 18496 1466 1 4 . 1 1 56 56 THR CA C 56 59.098 59.098 61.598 -2.500 18496 1467 1 4 . 1 1 56 56 THR CB C 56 72.153 72.153 70.324 1.829 18496 1468 1 4 . 1 1 56 56 THR H H 56 7.916 7.916 8.392 -0.476 18496 1469 1 4 . 1 1 57 57 LEU N N 57 121.044 121.044 127.275 -6.231 18496 1470 1 4 . 1 1 57 57 LEU HA H 57 5.311 5.311 4.975 0.336 18496 1471 1 4 . 1 1 57 57 LEU C C 57 176.150 176.150 175.692 0.458 18496 1472 1 4 . 1 1 57 57 LEU CA C 57 53.264 53.264 53.632 -0.367 18496 1473 1 4 . 1 1 57 57 LEU CB C 57 45.901 45.901 45.427 0.474 18496 1474 1 4 . 1 1 57 57 LEU H H 57 9.421 9.421 9.129 0.292 18496 1475 1 4 . 1 1 58 58 SER N N 58 119.548 119.548 118.729 0.819 18496 1476 1 4 . 1 1 58 58 SER HA H 58 4.734 4.734 4.449 0.285 18496 1477 1 4 . 1 1 58 58 SER C C 58 174.786 174.786 175.362 -0.576 18496 1478 1 4 . 1 1 58 58 SER CA C 58 56.948 56.948 58.110 -1.162 18496 1479 1 4 . 1 1 58 58 SER CB C 58 65.726 65.726 64.076 1.650 18496 1480 1 4 . 1 1 58 58 SER H H 58 9.771 9.771 9.486 0.285 18496 1481 1 4 . 1 1 59 59 GLU N N 59 120.827 120.827 123.312 -2.485 18496 1482 1 4 . 1 1 59 59 GLU HA H 59 4.319 4.319 4.190 0.129 18496 1483 1 4 . 1 1 59 59 GLU C C 59 179.806 179.806 178.917 0.889 18496 1484 1 4 . 1 1 59 59 GLU CA C 59 60.913 60.913 60.586 0.327 18496 1485 1 4 . 1 1 59 59 GLU CB C 59 29.538 29.538 29.372 0.166 18496 1486 1 4 . 1 1 59 59 GLU H H 59 9.394 9.394 9.020 0.374 18496 1487 1 4 . 1 1 60 60 GLU N N 60 119.587 119.587 119.452 0.135 18496 1488 1 4 . 1 1 60 60 GLU HA H 60 4.188 4.188 4.122 0.066 18496 1489 1 4 . 1 1 60 60 GLU C C 60 179.686 179.686 178.783 0.903 18496 1490 1 4 . 1 1 60 60 GLU CA C 60 60.279 60.279 59.480 0.799 18496 1491 1 4 . 1 1 60 60 GLU CB C 60 29.559 29.559 28.764 0.795 18496 1492 1 4 . 1 1 60 60 GLU H H 60 8.905 8.905 8.836 0.069 18496 1493 1 4 . 1 1 61 61 GLU N N 61 120.145 120.145 120.086 0.059 18496 1494 1 4 . 1 1 61 61 GLU HA H 61 4.037 4.037 4.077 -0.040 18496 1495 1 4 . 1 1 61 61 GLU C C 61 178.530 178.530 178.858 -0.328 18496 1496 1 4 . 1 1 61 61 GLU CA C 61 59.118 59.118 58.989 0.129 18496 1497 1 4 . 1 1 61 61 GLU CB C 61 30.976 30.976 29.277 1.698 18496 1498 1 4 . 1 1 61 61 GLU H H 61 8.013 8.013 8.405 -0.392 18496 1499 1 4 . 1 1 62 62 PHE N N 62 119.925 119.925 120.349 -0.424 18496 1500 1 4 . 1 1 62 62 PHE HA H 62 3.927 3.927 4.054 -0.127 18496 1501 1 4 . 1 1 62 62 PHE C C 62 176.783 176.783 177.547 -0.764 18496 1502 1 4 . 1 1 62 62 PHE CA C 62 61.827 61.827 61.348 0.479 18496 1503 1 4 . 1 1 62 62 PHE CB C 62 40.216 40.216 38.841 1.375 18496 1504 1 4 . 1 1 62 62 PHE H H 62 9.192 9.192 8.761 0.431 18496 1505 1 4 . 1 1 63 63 GLY N N 63 104.854 104.854 107.577 -2.723 18496 1506 1 4 . 1 1 63 63 GLY C C 63 176.854 176.854 175.964 0.890 18496 1507 1 4 . 1 1 63 63 GLY CA C 63 47.178 47.178 47.434 -0.256 18496 1508 1 4 . 1 1 63 63 GLY H H 63 8.316 8.316 8.264 0.052 18496 1509 1 4 . 1 1 64 64 VAL N N 64 123.719 123.719 123.126 0.593 18496 1510 1 4 . 1 1 64 64 VAL HA H 64 3.663 3.663 3.697 -0.034 18496 1511 1 4 . 1 1 64 64 VAL C C 64 177.644 177.644 177.946 -0.302 18496 1512 1 4 . 1 1 64 64 VAL CA C 64 67.090 67.090 65.928 1.162 18496 1513 1 4 . 1 1 64 64 VAL CB C 64 31.367 31.367 31.039 0.328 18496 1514 1 4 . 1 1 64 64 VAL H H 64 7.759 7.759 7.879 -0.120 18496 1515 1 4 . 1 1 65 65 LEU N N 65 120.099 120.099 121.186 -1.087 18496 1516 1 4 . 1 1 65 65 LEU HA H 65 3.672 3.672 3.901 -0.229 18496 1517 1 4 . 1 1 65 65 LEU C C 65 177.636 177.636 178.662 -1.026 18496 1518 1 4 . 1 1 65 65 LEU CA C 65 58.552 58.552 58.460 0.092 18496 1519 1 4 . 1 1 65 65 LEU CB C 65 41.358 41.358 41.679 -0.321 18496 1520 1 4 . 1 1 65 65 LEU H H 65 7.660 7.660 8.134 -0.474 18496 1521 1 4 . 1 1 66 66 LEU N N 66 115.733 115.733 118.263 -2.530 18496 1522 1 4 . 1 1 66 66 LEU HA H 66 3.556 3.556 3.622 -0.066 18496 1523 1 4 . 1 1 66 66 LEU C C 66 179.729 179.729 178.838 0.891 18496 1524 1 4 . 1 1 66 66 LEU CA C 66 58.069 58.069 58.100 -0.031 18496 1525 1 4 . 1 1 66 66 LEU CB C 66 41.625 41.625 41.028 0.597 18496 1526 1 4 . 1 1 66 66 LEU H H 66 8.083 8.083 8.144 -0.061 18496 1527 1 4 . 1 1 67 67 LYS N N 67 119.120 119.120 119.991 -0.871 18496 1528 1 4 . 1 1 67 67 LYS HA H 67 3.965 3.965 3.808 0.157 18496 1529 1 4 . 1 1 67 67 LYS C C 67 179.379 179.379 178.997 0.382 18496 1530 1 4 . 1 1 67 67 LYS CA C 67 59.227 59.227 59.859 -0.632 18496 1531 1 4 . 1 1 67 67 LYS CB C 67 32.737 32.737 32.249 0.488 18496 1532 1 4 . 1 1 67 67 LYS H H 67 7.861 7.861 8.280 -0.419 18496 1533 1 4 . 1 1 68 68 GLU N N 68 116.924 116.924 118.918 -1.994 18496 1534 1 4 . 1 1 68 68 GLU HA H 68 4.409 4.409 4.069 0.340 18496 1535 1 4 . 1 1 68 68 GLU CA C 68 57.712 57.712 58.768 -1.056 18496 1536 1 4 . 1 1 68 68 GLU CB C 68 29.586 29.586 29.378 0.208 18496 1537 1 4 . 1 1 68 68 GLU H H 68 8.319 8.319 7.943 0.376 18496 1538 1 4 . 1 1 69 69 LEU N N 69 120.032 120.032 119.973 0.059 18496 1539 1 4 . 1 1 69 69 LEU HA H 69 4.107 4.107 3.947 0.160 18496 1540 1 4 . 1 1 69 69 LEU CA C 69 57.563 57.563 57.501 0.062 18496 1541 1 4 . 1 1 69 69 LEU CB C 69 41.373 41.373 41.520 -0.147 18496 1542 1 4 . 1 1 69 69 LEU H H 69 8.233 8.233 8.547 -0.314 18496 1543 1 4 . 1 1 70 70 GLY N N 70 105.472 105.472 105.466 0.006 18496 1544 1 4 . 1 1 70 70 GLY C C 70 174.986 174.986 175.987 -1.001 18496 1545 1 4 . 1 1 70 70 GLY CA C 70 46.704 46.704 46.780 -0.076 18496 1546 1 4 . 1 1 70 70 GLY H H 70 7.960 7.960 8.586 -0.626 18496 1547 1 4 . 1 1 71 71 ASN N N 71 118.596 118.596 119.869 -1.273 18496 1548 1 4 . 1 1 71 71 ASN HA H 71 4.681 4.681 4.830 -0.148 18496 1549 1 4 . 1 1 71 71 ASN C C 71 176.412 176.412 177.800 -1.388 18496 1550 1 4 . 1 1 71 71 ASN CA C 71 54.407 54.407 55.341 -0.934 18496 1551 1 4 . 1 1 71 71 ASN CB C 71 38.729 38.729 38.686 0.043 18496 1552 1 4 . 1 1 71 71 ASN H H 71 7.857 7.857 7.783 0.074 18496 1553 1 4 . 1 1 72 72 LYS N N 72 119.973 119.973 120.797 -0.824 18496 1554 1 4 . 1 1 72 72 LYS HA H 72 4.282 4.282 4.116 0.166 18496 1555 1 4 . 1 1 72 72 LYS CA C 72 57.338 57.338 58.152 -0.814 18496 1556 1 4 . 1 1 72 72 LYS CB C 72 32.755 32.755 31.943 0.812 18496 1557 1 4 . 1 1 72 72 LYS H H 72 8.100 8.100 8.066 0.034 18496 1558 1 4 . 1 1 73 73 LEU HA H 73 4.281 4.281 4.329 -0.048 18496 1559 1 4 . 1 1 73 73 LEU CA C 73 55.774 55.774 54.731 1.043 18496 1560 1 4 . 1 1 73 73 LEU CB C 73 41.983 41.983 42.109 -0.126 18496 1561 1 5 . 1 1 2 2 ALA HA H 2 4.074 4.074 4.558 -0.484 18496 1562 1 5 . 1 1 2 2 ALA CA C 2 51.966 51.966 51.609 0.357 18496 1563 1 5 . 1 1 2 2 ALA CB C 2 19.732 19.732 20.073 -0.341 18496 1564 1 5 . 1 1 3 3 ASP HA H 3 4.632 4.632 4.417 0.215 18496 1565 1 5 . 1 1 3 3 ASP C C 3 175.822 175.822 176.422 -0.600 18496 1566 1 5 . 1 1 3 3 ASP CA C 3 54.440 54.440 55.660 -1.220 18496 1567 1 5 . 1 1 3 3 ASP CB C 3 41.577 41.577 41.330 0.247 18496 1568 1 5 . 1 1 4 4 LYS N N 4 121.655 121.655 119.635 2.020 18496 1569 1 5 . 1 1 4 4 LYS HA H 4 4.379 4.379 4.513 -0.134 18496 1570 1 5 . 1 1 4 4 LYS C C 4 176.011 176.011 175.664 0.347 18496 1571 1 5 . 1 1 4 4 LYS CA C 4 56.213 56.213 55.112 1.101 18496 1572 1 5 . 1 1 4 4 LYS CB C 4 33.407 33.407 31.363 2.044 18496 1573 1 5 . 1 1 4 4 LYS H H 4 8.394 8.394 8.013 0.381 18496 1574 1 5 . 1 1 5 5 LEU N N 5 125.369 125.369 124.444 0.925 18496 1575 1 5 . 1 1 5 5 LEU HA H 5 4.351 4.351 4.290 0.061 18496 1576 1 5 . 1 1 5 5 LEU C C 5 175.682 175.682 176.719 -1.037 18496 1577 1 5 . 1 1 5 5 LEU CA C 5 55.117 55.117 55.000 0.117 18496 1578 1 5 . 1 1 5 5 LEU CB C 5 43.197 43.197 42.922 0.274 18496 1579 1 5 . 1 1 5 5 LEU H H 5 8.136 8.136 8.190 -0.054 18496 1580 1 5 . 1 1 6 6 LYS N N 6 126.844 126.844 124.020 2.824 18496 1581 1 5 . 1 1 6 6 LYS HA H 6 4.451 4.451 4.452 -0.001 18496 1582 1 5 . 1 1 6 6 LYS C C 6 174.665 174.665 175.704 -1.039 18496 1583 1 5 . 1 1 6 6 LYS CA C 6 55.974 55.974 56.458 -0.484 18496 1584 1 5 . 1 1 6 6 LYS CB C 6 34.386 34.386 32.935 1.451 18496 1585 1 5 . 1 1 6 6 LYS H H 6 8.615 8.615 8.547 0.068 18496 1586 1 5 . 1 1 7 7 PHE N N 7 119.818 119.818 119.437 0.381 18496 1587 1 5 . 1 1 7 7 PHE HA H 7 5.343 5.343 5.537 -0.194 18496 1588 1 5 . 1 1 7 7 PHE C C 7 173.569 173.569 173.715 -0.146 18496 1589 1 5 . 1 1 7 7 PHE CA C 7 55.813 55.813 55.719 0.094 18496 1590 1 5 . 1 1 7 7 PHE CB C 7 42.975 42.975 42.472 0.503 18496 1591 1 5 . 1 1 7 7 PHE H H 7 7.734 7.734 8.312 -0.578 18496 1592 1 5 . 1 1 8 8 GLU N N 8 119.165 119.165 119.669 -0.504 18496 1593 1 5 . 1 1 8 8 GLU HA H 8 4.158 4.158 4.210 -0.052 18496 1594 1 5 . 1 1 8 8 GLU C C 8 175.026 175.026 174.280 0.746 18496 1595 1 5 . 1 1 8 8 GLU CA C 8 55.221 55.221 54.618 0.603 18496 1596 1 5 . 1 1 8 8 GLU CB C 8 33.699 33.699 32.834 0.865 18496 1597 1 5 . 1 1 8 8 GLU H H 8 8.295 8.295 8.733 -0.438 18496 1598 1 5 . 1 1 9 9 ILE N N 9 127.619 127.619 127.893 -0.274 18496 1599 1 5 . 1 1 9 9 ILE HA H 9 3.768 3.768 4.287 -0.519 18496 1600 1 5 . 1 1 9 9 ILE C C 9 174.902 174.902 175.967 -1.065 18496 1601 1 5 . 1 1 9 9 ILE CA C 9 62.505 62.505 62.528 -0.023 18496 1602 1 5 . 1 1 9 9 ILE CB C 9 36.094 36.094 37.613 -1.519 18496 1603 1 5 . 1 1 9 9 ILE H H 9 9.157 9.157 8.687 0.470 18496 1604 1 5 . 1 1 10 10 ILE N N 10 131.245 131.245 128.561 2.684 18496 1605 1 5 . 1 1 10 10 ILE HA H 10 3.861 3.861 4.063 -0.202 18496 1606 1 5 . 1 1 10 10 ILE C C 10 176.247 176.247 176.370 -0.123 18496 1607 1 5 . 1 1 10 10 ILE CA C 10 60.554 60.554 62.176 -1.622 18496 1608 1 5 . 1 1 10 10 ILE CB C 10 37.406 37.406 38.192 -0.786 18496 1609 1 5 . 1 1 10 10 ILE H H 10 8.428 8.428 8.975 -0.547 18496 1610 1 5 . 1 1 11 11 GLU N N 11 117.669 117.669 118.397 -0.728 18496 1611 1 5 . 1 1 11 11 GLU HA H 11 4.315 4.315 4.477 -0.162 18496 1612 1 5 . 1 1 11 11 GLU C C 11 174.155 174.155 174.438 -0.283 18496 1613 1 5 . 1 1 11 11 GLU CA C 11 55.755 55.755 55.581 0.174 18496 1614 1 5 . 1 1 11 11 GLU CB C 11 34.386 34.386 32.831 1.555 18496 1615 1 5 . 1 1 11 11 GLU H H 11 7.551 7.551 7.775 -0.224 18496 1616 1 5 . 1 1 12 12 GLU N N 12 128.587 128.587 124.644 3.943 18496 1617 1 5 . 1 1 12 12 GLU HA H 12 5.214 5.214 4.641 0.573 18496 1618 1 5 . 1 1 12 12 GLU C C 12 176.877 176.877 175.653 1.224 18496 1619 1 5 . 1 1 12 12 GLU CA C 12 54.801 54.801 56.738 -1.937 18496 1620 1 5 . 1 1 12 12 GLU CB C 12 30.137 30.137 30.511 -0.374 18496 1621 1 5 . 1 1 12 12 GLU H H 12 8.762 8.762 8.829 -0.067 18496 1622 1 5 . 1 1 13 13 LEU N N 13 122.508 122.508 124.074 -1.566 18496 1623 1 5 . 1 1 13 13 LEU HA H 13 4.872 4.872 4.730 0.142 18496 1624 1 5 . 1 1 13 13 LEU C C 13 176.060 176.060 177.080 -1.020 18496 1625 1 5 . 1 1 13 13 LEU CA C 13 57.372 57.372 55.886 1.486 18496 1626 1 5 . 1 1 13 13 LEU CB C 13 42.284 42.284 43.416 -1.132 18496 1627 1 5 . 1 1 13 13 LEU H H 13 8.058 8.058 8.552 -0.494 18496 1628 1 5 . 1 1 14 14 ILE N N 14 115.422 115.422 117.811 -2.389 18496 1629 1 5 . 1 1 14 14 ILE HA H 14 4.553 4.553 4.446 0.107 18496 1630 1 5 . 1 1 14 14 ILE C C 14 174.893 174.893 174.052 0.841 18496 1631 1 5 . 1 1 14 14 ILE CA C 14 60.586 60.586 59.629 0.957 18496 1632 1 5 . 1 1 14 14 ILE CB C 14 44.329 44.329 41.306 3.023 18496 1633 1 5 . 1 1 14 14 ILE H H 14 8.450 8.450 8.318 0.132 18496 1634 1 5 . 1 1 15 15 VAL N N 15 129.108 129.108 125.662 3.446 18496 1635 1 5 . 1 1 15 15 VAL HA H 15 4.196 4.196 4.439 -0.243 18496 1636 1 5 . 1 1 15 15 VAL C C 15 175.180 175.180 175.018 0.162 18496 1637 1 5 . 1 1 15 15 VAL CA C 15 63.288 63.288 60.920 2.368 18496 1638 1 5 . 1 1 15 15 VAL CB C 15 32.117 32.117 32.910 -0.793 18496 1639 1 5 . 1 1 15 15 VAL H H 15 8.867 8.867 8.526 0.341 18496 1640 1 5 . 1 1 16 16 LEU N N 16 127.846 127.846 128.958 -1.112 18496 1641 1 5 . 1 1 16 16 LEU HA H 16 4.317 4.317 4.669 -0.352 18496 1642 1 5 . 1 1 16 16 LEU C C 16 176.070 176.070 177.301 -1.231 18496 1643 1 5 . 1 1 16 16 LEU CA C 16 57.252 57.252 56.215 1.037 18496 1644 1 5 . 1 1 16 16 LEU CB C 16 42.035 42.035 42.660 -0.625 18496 1645 1 5 . 1 1 16 16 LEU H H 16 9.555 9.555 8.700 0.855 18496 1646 1 5 . 1 1 17 17 SER N N 17 107.073 107.073 110.492 -3.419 18496 1647 1 5 . 1 1 17 17 SER HA H 17 4.540 4.540 4.607 -0.067 18496 1648 1 5 . 1 1 17 17 SER C C 17 172.277 172.277 172.235 0.042 18496 1649 1 5 . 1 1 17 17 SER CA C 17 57.882 57.882 58.053 -0.171 18496 1650 1 5 . 1 1 17 17 SER CB C 17 64.046 64.046 65.079 -1.033 18496 1651 1 5 . 1 1 17 17 SER H H 17 7.699 7.699 7.905 -0.206 18496 1652 1 5 . 1 1 18 18 GLU N N 18 119.235 119.235 120.120 -0.885 18496 1653 1 5 . 1 1 18 18 GLU HA H 18 5.143 5.143 4.852 0.291 18496 1654 1 5 . 1 1 18 18 GLU C C 18 175.469 175.469 176.229 -0.760 18496 1655 1 5 . 1 1 18 18 GLU CA C 18 55.248 55.248 55.188 0.060 18496 1656 1 5 . 1 1 18 18 GLU CB C 18 33.454 33.454 30.814 2.640 18496 1657 1 5 . 1 1 18 18 GLU H H 18 8.437 8.437 8.509 -0.072 18496 1658 1 5 . 1 1 19 19 ASN N N 19 123.988 123.988 121.729 2.259 18496 1659 1 5 . 1 1 19 19 ASN HA H 19 5.097 5.097 4.733 0.364 18496 1660 1 5 . 1 1 19 19 ASN CA C 19 50.916 50.916 53.225 -2.309 18496 1661 1 5 . 1 1 19 19 ASN CB C 19 39.482 39.482 39.705 -0.223 18496 1662 1 5 . 1 1 19 19 ASN H H 19 8.779 8.779 8.430 0.349 18496 1663 1 5 . 1 1 20 20 ALA N N 20 120.854 120.854 122.619 -1.765 18496 1664 1 5 . 1 1 20 20 ALA HA H 20 4.239 4.239 4.172 0.067 18496 1665 1 5 . 1 1 20 20 ALA C C 20 179.032 179.032 178.045 0.987 18496 1666 1 5 . 1 1 20 20 ALA CA C 20 54.924 54.924 54.291 0.633 18496 1667 1 5 . 1 1 20 20 ALA CB C 20 18.621 18.621 18.685 -0.064 18496 1668 1 5 . 1 1 20 20 ALA H H 20 8.616 8.616 8.644 -0.028 18496 1669 1 5 . 1 1 21 21 LYS N N 21 115.771 115.771 116.544 -0.773 18496 1670 1 5 . 1 1 21 21 LYS HA H 21 4.497 4.497 4.246 0.251 18496 1671 1 5 . 1 1 21 21 LYS C C 21 176.615 176.615 176.652 -0.037 18496 1672 1 5 . 1 1 21 21 LYS CA C 21 55.503 55.503 55.305 0.198 18496 1673 1 5 . 1 1 21 21 LYS CB C 21 32.742 32.742 31.921 0.821 18496 1674 1 5 . 1 1 21 21 LYS H H 21 7.767 7.767 7.756 0.011 18496 1675 1 5 . 1 1 22 22 GLY N N 22 107.695 107.695 106.980 0.715 18496 1676 1 5 . 1 1 22 22 GLY C C 22 174.843 174.843 174.499 0.344 18496 1677 1 5 . 1 1 22 22 GLY CA C 22 45.297 45.297 45.328 -0.031 18496 1678 1 5 . 1 1 22 22 GLY H H 22 8.317 8.317 7.879 0.438 18496 1679 1 5 . 1 1 23 23 TRP N N 23 121.316 121.316 121.187 0.129 18496 1680 1 5 . 1 1 23 23 TRP HA H 23 4.815 4.815 4.815 0.000 18496 1681 1 5 . 1 1 23 23 TRP C C 23 176.754 176.754 176.519 0.235 18496 1682 1 5 . 1 1 23 23 TRP CA C 23 58.291 58.291 54.896 3.395 18496 1683 1 5 . 1 1 23 23 TRP CB C 23 28.127 28.127 28.050 0.077 18496 1684 1 5 . 1 1 23 23 TRP H H 23 7.983 7.983 8.004 -0.021 18496 1685 1 5 . 1 1 24 24 ARG N N 24 120.789 120.789 127.002 -6.213 18496 1686 1 5 . 1 1 24 24 ARG HA H 24 5.496 5.496 4.918 0.578 18496 1687 1 5 . 1 1 24 24 ARG C C 24 175.831 175.831 176.139 -0.308 18496 1688 1 5 . 1 1 24 24 ARG CA C 24 54.755 54.755 54.794 -0.039 18496 1689 1 5 . 1 1 24 24 ARG CB C 24 33.735 33.735 30.185 3.550 18496 1690 1 5 . 1 1 24 24 ARG H H 24 9.046 9.046 9.395 -0.349 18496 1691 1 5 . 1 1 25 25 LYS N N 25 126.507 126.507 129.248 -2.741 18496 1692 1 5 . 1 1 25 25 LYS HA H 25 5.081 5.081 4.779 0.302 18496 1693 1 5 . 1 1 25 25 LYS C C 25 175.648 175.648 175.628 0.020 18496 1694 1 5 . 1 1 25 25 LYS CA C 25 56.071 56.071 57.100 -1.029 18496 1695 1 5 . 1 1 25 25 LYS CB C 25 32.214 32.214 32.920 -0.706 18496 1696 1 5 . 1 1 25 25 LYS H H 25 8.526 8.526 8.393 0.133 18496 1697 1 5 . 1 1 26 26 GLU N N 26 126.009 126.009 124.024 1.985 18496 1698 1 5 . 1 1 26 26 GLU HA H 26 5.275 5.275 5.111 0.164 18496 1699 1 5 . 1 1 26 26 GLU C C 26 174.894 174.894 174.221 0.673 18496 1700 1 5 . 1 1 26 26 GLU CA C 26 55.271 55.271 55.083 0.188 18496 1701 1 5 . 1 1 26 26 GLU CB C 26 33.781 33.781 34.667 -0.887 18496 1702 1 5 . 1 1 26 26 GLU H H 26 9.125 9.125 9.206 -0.081 18496 1703 1 5 . 1 1 27 27 LEU N N 27 121.930 121.930 124.767 -2.837 18496 1704 1 5 . 1 1 27 27 LEU HA H 27 5.788 5.788 4.864 0.924 18496 1705 1 5 . 1 1 27 27 LEU C C 27 173.941 173.941 174.363 -0.422 18496 1706 1 5 . 1 1 27 27 LEU CA C 27 53.859 53.859 53.936 -0.077 18496 1707 1 5 . 1 1 27 27 LEU CB C 27 44.020 44.020 44.186 -0.166 18496 1708 1 5 . 1 1 27 27 LEU H H 27 8.938 8.938 9.118 -0.180 18496 1709 1 5 . 1 1 28 28 ASN N N 28 124.630 124.630 124.905 -0.275 18496 1710 1 5 . 1 1 28 28 ASN HA H 28 5.411 5.411 5.227 0.184 18496 1711 1 5 . 1 1 28 28 ASN C C 28 174.366 174.366 173.188 1.178 18496 1712 1 5 . 1 1 28 28 ASN CA C 28 52.063 52.063 52.351 -0.288 18496 1713 1 5 . 1 1 28 28 ASN CB C 28 44.430 44.430 43.366 1.064 18496 1714 1 5 . 1 1 28 28 ASN H H 28 9.345 9.345 8.173 1.172 18496 1715 1 5 . 1 1 29 29 ARG N N 29 118.443 118.443 121.871 -3.428 18496 1716 1 5 . 1 1 29 29 ARG HA H 29 5.058 5.058 4.782 0.276 18496 1717 1 5 . 1 1 29 29 ARG C C 29 175.779 175.779 174.522 1.257 18496 1718 1 5 . 1 1 29 29 ARG CA C 29 56.091 56.091 55.644 0.447 18496 1719 1 5 . 1 1 29 29 ARG CB C 29 31.710 31.710 31.177 0.532 18496 1720 1 5 . 1 1 29 29 ARG H H 29 9.109 9.109 9.124 -0.015 18496 1721 1 5 . 1 1 30 30 VAL N N 30 124.605 124.605 122.364 2.241 18496 1722 1 5 . 1 1 30 30 VAL HA H 30 4.535 4.535 5.403 -0.868 18496 1723 1 5 . 1 1 30 30 VAL C C 30 174.775 174.775 174.455 0.320 18496 1724 1 5 . 1 1 30 30 VAL CA C 30 60.921 60.921 59.181 1.740 18496 1725 1 5 . 1 1 30 30 VAL CB C 30 37.790 37.790 36.160 1.630 18496 1726 1 5 . 1 1 30 30 VAL H H 30 9.054 9.054 8.584 0.470 18496 1727 1 5 . 1 1 31 31 SER N N 31 120.794 120.794 115.158 5.636 18496 1728 1 5 . 1 1 31 31 SER HA H 31 4.652 4.652 5.141 -0.489 18496 1729 1 5 . 1 1 31 31 SER C C 31 174.214 174.214 175.407 -1.193 18496 1730 1 5 . 1 1 31 31 SER CA C 31 56.279 56.279 57.052 -0.773 18496 1731 1 5 . 1 1 31 31 SER CB C 31 64.128 64.128 64.115 0.013 18496 1732 1 5 . 1 1 31 31 SER H H 31 8.667 8.667 8.904 -0.237 18496 1733 1 5 . 1 1 32 32 TRP N N 32 132.303 132.303 128.200 4.103 18496 1734 1 5 . 1 1 32 32 TRP HA H 32 5.105 5.105 4.525 0.580 18496 1735 1 5 . 1 1 32 32 TRP C C 32 177.276 177.276 176.742 0.534 18496 1736 1 5 . 1 1 32 32 TRP CA C 32 56.198 56.198 58.253 -2.055 18496 1737 1 5 . 1 1 32 32 TRP CB C 32 29.968 29.968 28.068 1.900 18496 1738 1 5 . 1 1 32 32 TRP H H 32 9.282 9.282 9.186 0.096 18496 1739 1 5 . 1 1 33 33 ASN N N 33 124.979 124.979 122.179 2.800 18496 1740 1 5 . 1 1 33 33 ASN HA H 33 4.257 4.257 4.390 -0.133 18496 1741 1 5 . 1 1 33 33 ASN C C 33 174.030 174.030 174.711 -0.681 18496 1742 1 5 . 1 1 33 33 ASN CA C 33 54.709 54.709 54.725 -0.016 18496 1743 1 5 . 1 1 33 33 ASN CB C 33 37.921 37.921 37.218 0.703 18496 1744 1 5 . 1 1 33 33 ASN H H 33 9.813 9.813 8.729 1.084 18496 1745 1 5 . 1 1 34 34 ASP N N 34 111.880 111.880 113.883 -2.003 18496 1746 1 5 . 1 1 34 34 ASP HA H 34 4.126 4.126 4.242 -0.116 18496 1747 1 5 . 1 1 34 34 ASP CA C 34 56.130 56.130 55.339 0.791 18496 1748 1 5 . 1 1 34 34 ASP CB C 34 39.760 39.760 40.168 -0.408 18496 1749 1 5 . 1 1 34 34 ASP H H 34 9.251 9.251 8.213 1.038 18496 1750 1 5 . 1 1 35 35 ALA N N 35 121.811 121.811 121.150 0.661 18496 1751 1 5 . 1 1 35 35 ALA HA H 35 4.477 4.477 4.526 -0.049 18496 1752 1 5 . 1 1 35 35 ALA C C 35 177.778 177.778 176.986 0.792 18496 1753 1 5 . 1 1 35 35 ALA CA C 35 51.528 51.528 52.531 -1.003 18496 1754 1 5 . 1 1 35 35 ALA CB C 35 20.445 20.445 20.516 -0.071 18496 1755 1 5 . 1 1 35 35 ALA H H 35 7.625 7.625 7.605 0.020 18496 1756 1 5 . 1 1 36 36 GLU N N 36 121.068 121.068 122.502 -1.434 18496 1757 1 5 . 1 1 36 36 GLU HA H 36 4.390 4.390 4.732 -0.342 18496 1758 1 5 . 1 1 36 36 GLU CA C 36 55.276 55.276 52.405 2.871 18496 1759 1 5 . 1 1 36 36 GLU CB C 36 28.575 28.575 30.936 -2.361 18496 1760 1 5 . 1 1 36 36 GLU H H 36 8.658 8.658 8.146 0.512 18496 1761 1 5 . 1 1 37 37 PRO HA H 37 4.289 4.289 4.633 -0.344 18496 1762 1 5 . 1 1 37 37 PRO C C 37 175.799 175.799 175.775 0.024 18496 1763 1 5 . 1 1 37 37 PRO CA C 37 63.105 63.105 62.336 0.769 18496 1764 1 5 . 1 1 37 37 PRO CB C 37 32.076 32.076 31.588 0.488 18496 1765 1 5 . 1 1 38 38 LYS N N 38 120.881 120.881 122.506 -1.625 18496 1766 1 5 . 1 1 38 38 LYS HA H 38 4.700 4.700 4.214 0.486 18496 1767 1 5 . 1 1 38 38 LYS C C 38 176.906 176.906 174.489 2.417 18496 1768 1 5 . 1 1 38 38 LYS CA C 38 54.399 54.399 54.552 -0.153 18496 1769 1 5 . 1 1 38 38 LYS CB C 38 37.217 37.217 35.843 1.374 18496 1770 1 5 . 1 1 38 38 LYS H H 38 8.316 8.316 8.717 -0.401 18496 1771 1 5 . 1 1 39 39 TYR N N 39 119.792 119.792 119.036 0.756 18496 1772 1 5 . 1 1 39 39 TYR HA H 39 4.636 4.636 4.648 -0.012 18496 1773 1 5 . 1 1 39 39 TYR C C 39 175.834 175.834 175.089 0.745 18496 1774 1 5 . 1 1 39 39 TYR CA C 39 60.228 60.228 57.784 2.444 18496 1775 1 5 . 1 1 39 39 TYR CB C 39 38.683 38.683 39.145 -0.462 18496 1776 1 5 . 1 1 39 39 TYR H H 39 8.508 8.508 7.969 0.539 18496 1777 1 5 . 1 1 40 40 ASP N N 40 126.502 126.502 122.641 3.861 18496 1778 1 5 . 1 1 40 40 ASP HA H 40 5.597 5.597 5.324 0.273 18496 1779 1 5 . 1 1 40 40 ASP C C 40 175.283 175.283 174.052 1.231 18496 1780 1 5 . 1 1 40 40 ASP CA C 40 55.053 55.053 53.863 1.190 18496 1781 1 5 . 1 1 40 40 ASP CB C 40 48.656 48.656 45.451 3.205 18496 1782 1 5 . 1 1 40 40 ASP H H 40 9.219 9.219 8.471 0.748 18496 1783 1 5 . 1 1 41 41 ILE N N 41 125.910 125.910 124.897 1.013 18496 1784 1 5 . 1 1 41 41 ILE HA H 41 5.722 5.722 4.970 0.752 18496 1785 1 5 . 1 1 41 41 ILE C C 41 174.167 174.167 173.635 0.532 18496 1786 1 5 . 1 1 41 41 ILE CA C 41 60.734 60.734 59.865 0.869 18496 1787 1 5 . 1 1 41 41 ILE CB C 41 40.198 40.198 39.887 0.311 18496 1788 1 5 . 1 1 41 41 ILE H H 41 8.972 8.972 8.789 0.183 18496 1789 1 5 . 1 1 42 42 ARG N N 42 120.300 120.300 126.792 -6.492 18496 1790 1 5 . 1 1 42 42 ARG HA H 42 4.716 4.716 4.779 -0.063 18496 1791 1 5 . 1 1 42 42 ARG CA C 42 54.826 54.826 54.846 -0.020 18496 1792 1 5 . 1 1 42 42 ARG CB C 42 32.665 32.665 35.398 -2.733 18496 1793 1 5 . 1 1 42 42 ARG H H 42 8.320 8.320 8.683 -0.363 18496 1794 1 5 . 1 1 43 43 THR HA H 43 5.585 5.585 5.457 0.128 18496 1795 1 5 . 1 1 43 43 THR C C 43 173.294 173.294 173.207 0.087 18496 1796 1 5 . 1 1 43 43 THR CA C 43 60.847 60.847 59.798 1.049 18496 1797 1 5 . 1 1 43 43 THR CB C 43 69.961 69.961 71.073 -1.111 18496 1798 1 5 . 1 1 44 44 TRP N N 44 122.747 122.747 123.794 -1.047 18496 1799 1 5 . 1 1 44 44 TRP HA H 44 4.945 4.945 4.787 0.158 18496 1800 1 5 . 1 1 44 44 TRP C C 44 175.056 175.056 175.923 -0.867 18496 1801 1 5 . 1 1 44 44 TRP CA C 44 56.107 56.107 55.824 0.283 18496 1802 1 5 . 1 1 44 44 TRP CB C 44 34.506 34.506 32.797 1.709 18496 1803 1 5 . 1 1 44 44 TRP H H 44 9.180 9.180 8.948 0.232 18496 1804 1 5 . 1 1 45 45 SER N N 45 117.385 117.385 116.199 1.186 18496 1805 1 5 . 1 1 45 45 SER HA H 45 2.300 2.300 4.925 -2.625 18496 1806 1 5 . 1 1 45 45 SER CA C 45 56.481 56.481 56.778 -0.297 18496 1807 1 5 . 1 1 45 45 SER CB C 45 60.743 60.743 62.354 -1.611 18496 1808 1 5 . 1 1 45 45 SER H H 45 7.879 7.879 8.357 -0.478 18496 1809 1 5 . 1 1 46 46 PRO HA H 46 4.104 4.104 4.462 -0.358 18496 1810 1 5 . 1 1 46 46 PRO CA C 46 64.990 64.990 65.638 -0.648 18496 1811 1 5 . 1 1 46 46 PRO CB C 46 31.272 31.272 31.807 -0.535 18496 1812 1 5 . 1 1 47 47 ASP HA H 47 4.520 4.520 4.630 -0.110 18496 1813 1 5 . 1 1 47 47 ASP C C 47 175.629 175.629 175.610 0.019 18496 1814 1 5 . 1 1 47 47 ASP CA C 47 53.453 53.453 52.952 0.501 18496 1815 1 5 . 1 1 47 47 ASP CB C 47 40.239 40.239 40.957 -0.718 18496 1816 1 5 . 1 1 48 48 HIS N N 48 111.320 111.320 116.470 -5.150 18496 1817 1 5 . 1 1 48 48 HIS HA H 48 3.916 3.916 4.466 -0.550 18496 1818 1 5 . 1 1 48 48 HIS CA C 48 60.347 60.347 57.875 2.472 18496 1819 1 5 . 1 1 48 48 HIS CB C 48 25.499 25.499 27.969 -2.470 18496 1820 1 5 . 1 1 48 48 HIS H H 48 8.269 8.269 8.241 0.028 18496 1821 1 5 . 1 1 49 49 GLU N N 49 114.659 114.659 115.323 -0.664 18496 1822 1 5 . 1 1 49 49 GLU HA H 49 4.447 4.447 4.423 0.024 18496 1823 1 5 . 1 1 49 49 GLU C C 49 176.394 176.394 175.953 0.441 18496 1824 1 5 . 1 1 49 49 GLU CA C 49 57.940 57.940 58.108 -0.168 18496 1825 1 5 . 1 1 49 49 GLU CB C 49 30.641 30.641 31.658 -1.017 18496 1826 1 5 . 1 1 49 49 GLU H H 49 7.381 7.381 8.272 -0.891 18496 1827 1 5 . 1 1 50 50 LYS N N 50 118.126 118.126 118.218 -0.092 18496 1828 1 5 . 1 1 50 50 LYS HA H 50 4.665 4.665 4.688 -0.023 18496 1829 1 5 . 1 1 50 50 LYS CA C 50 54.431 54.431 54.325 0.106 18496 1830 1 5 . 1 1 50 50 LYS CB C 50 36.543 36.543 36.430 0.113 18496 1831 1 5 . 1 1 50 50 LYS H H 50 8.067 8.067 8.010 0.057 18496 1832 1 5 . 1 1 51 51 MET HA H 51 4.936 4.936 4.420 0.516 18496 1833 1 5 . 1 1 51 51 MET CA C 51 54.048 54.048 53.337 0.711 18496 1834 1 5 . 1 1 51 51 MET CB C 51 33.768 33.768 34.713 -0.945 18496 1835 1 5 . 1 1 52 52 GLY C C 52 173.534 173.534 172.351 1.183 18496 1836 1 5 . 1 1 52 52 GLY CA C 52 43.060 43.060 44.331 -1.271 18496 1837 1 5 . 1 1 53 53 LYS N N 53 118.012 118.012 119.573 -1.561 18496 1838 1 5 . 1 1 53 53 LYS HA H 53 4.155 4.155 4.443 -0.288 18496 1839 1 5 . 1 1 53 53 LYS C C 53 176.818 176.818 176.233 0.585 18496 1840 1 5 . 1 1 53 53 LYS CA C 53 56.478 56.478 56.122 0.356 18496 1841 1 5 . 1 1 53 53 LYS CB C 53 33.117 33.117 33.362 -0.245 18496 1842 1 5 . 1 1 53 53 LYS H H 53 8.132 8.132 8.148 -0.016 18496 1843 1 5 . 1 1 54 54 GLY N N 54 109.836 109.836 107.769 2.067 18496 1844 1 5 . 1 1 54 54 GLY C C 54 170.848 170.848 172.763 -1.915 18496 1845 1 5 . 1 1 54 54 GLY CA C 54 46.701 46.701 44.809 1.892 18496 1846 1 5 . 1 1 54 54 GLY H H 54 8.079 8.079 8.140 -0.061 18496 1847 1 5 . 1 1 55 55 ILE N N 55 119.382 119.382 121.842 -2.460 18496 1848 1 5 . 1 1 55 55 ILE HA H 55 4.956 4.956 4.633 0.323 18496 1849 1 5 . 1 1 55 55 ILE C C 55 171.737 171.737 173.762 -2.025 18496 1850 1 5 . 1 1 55 55 ILE CA C 55 57.059 57.059 60.466 -3.407 18496 1851 1 5 . 1 1 55 55 ILE CB C 55 44.241 44.241 41.492 2.749 18496 1852 1 5 . 1 1 55 55 ILE H H 55 8.661 8.661 8.364 0.297 18496 1853 1 5 . 1 1 56 56 THR N N 56 113.795 113.795 122.496 -8.701 18496 1854 1 5 . 1 1 56 56 THR HA H 56 5.607 5.607 4.868 0.739 18496 1855 1 5 . 1 1 56 56 THR C C 56 174.417 174.417 173.639 0.778 18496 1856 1 5 . 1 1 56 56 THR CA C 56 59.098 59.098 61.650 -2.552 18496 1857 1 5 . 1 1 56 56 THR CB C 56 72.153 72.153 70.215 1.938 18496 1858 1 5 . 1 1 56 56 THR H H 56 7.916 7.916 8.421 -0.505 18496 1859 1 5 . 1 1 57 57 LEU N N 57 121.044 121.044 127.271 -6.227 18496 1860 1 5 . 1 1 57 57 LEU HA H 57 5.311 5.311 4.953 0.358 18496 1861 1 5 . 1 1 57 57 LEU C C 57 176.150 176.150 175.597 0.553 18496 1862 1 5 . 1 1 57 57 LEU CA C 57 53.264 53.264 53.811 -0.547 18496 1863 1 5 . 1 1 57 57 LEU CB C 57 45.901 45.901 45.239 0.662 18496 1864 1 5 . 1 1 57 57 LEU H H 57 9.421 9.421 9.124 0.297 18496 1865 1 5 . 1 1 58 58 SER N N 58 119.548 119.548 118.521 1.027 18496 1866 1 5 . 1 1 58 58 SER HA H 58 4.734 4.734 4.525 0.209 18496 1867 1 5 . 1 1 58 58 SER C C 58 174.786 174.786 175.566 -0.780 18496 1868 1 5 . 1 1 58 58 SER CA C 58 56.948 56.948 58.160 -1.212 18496 1869 1 5 . 1 1 58 58 SER CB C 58 65.726 65.726 64.231 1.495 18496 1870 1 5 . 1 1 58 58 SER H H 58 9.771 9.771 9.508 0.263 18496 1871 1 5 . 1 1 59 59 GLU N N 59 120.827 120.827 123.188 -2.361 18496 1872 1 5 . 1 1 59 59 GLU HA H 59 4.319 4.319 4.130 0.189 18496 1873 1 5 . 1 1 59 59 GLU C C 59 179.806 179.806 178.708 1.098 18496 1874 1 5 . 1 1 59 59 GLU CA C 59 60.913 60.913 61.160 -0.247 18496 1875 1 5 . 1 1 59 59 GLU CB C 59 29.538 29.538 29.309 0.229 18496 1876 1 5 . 1 1 59 59 GLU H H 59 9.394 9.394 9.181 0.213 18496 1877 1 5 . 1 1 60 60 GLU N N 60 119.587 119.587 119.478 0.109 18496 1878 1 5 . 1 1 60 60 GLU HA H 60 4.188 4.188 4.114 0.074 18496 1879 1 5 . 1 1 60 60 GLU C C 60 179.686 179.686 178.823 0.863 18496 1880 1 5 . 1 1 60 60 GLU CA C 60 60.279 60.279 59.546 0.733 18496 1881 1 5 . 1 1 60 60 GLU CB C 60 29.559 29.559 28.728 0.831 18496 1882 1 5 . 1 1 60 60 GLU H H 60 8.905 8.905 8.863 0.042 18496 1883 1 5 . 1 1 61 61 GLU N N 61 120.145 120.145 120.037 0.108 18496 1884 1 5 . 1 1 61 61 GLU HA H 61 4.037 4.037 4.084 -0.047 18496 1885 1 5 . 1 1 61 61 GLU C C 61 178.530 178.530 178.882 -0.352 18496 1886 1 5 . 1 1 61 61 GLU CA C 61 59.118 59.118 58.950 0.168 18496 1887 1 5 . 1 1 61 61 GLU CB C 61 30.976 30.976 29.292 1.684 18496 1888 1 5 . 1 1 61 61 GLU H H 61 8.013 8.013 8.398 -0.385 18496 1889 1 5 . 1 1 62 62 PHE N N 62 119.925 119.925 120.555 -0.630 18496 1890 1 5 . 1 1 62 62 PHE HA H 62 3.927 3.927 4.054 -0.127 18496 1891 1 5 . 1 1 62 62 PHE C C 62 176.783 176.783 177.551 -0.768 18496 1892 1 5 . 1 1 62 62 PHE CA C 62 61.827 61.827 61.425 0.402 18496 1893 1 5 . 1 1 62 62 PHE CB C 62 40.216 40.216 38.933 1.283 18496 1894 1 5 . 1 1 62 62 PHE H H 62 9.192 9.192 8.905 0.287 18496 1895 1 5 . 1 1 63 63 GLY N N 63 104.854 104.854 107.483 -2.629 18496 1896 1 5 . 1 1 63 63 GLY C C 63 176.854 176.854 176.073 0.781 18496 1897 1 5 . 1 1 63 63 GLY CA C 63 47.178 47.178 47.498 -0.320 18496 1898 1 5 . 1 1 63 63 GLY H H 63 8.316 8.316 8.730 -0.414 18496 1899 1 5 . 1 1 64 64 VAL N N 64 123.719 123.719 123.205 0.514 18496 1900 1 5 . 1 1 64 64 VAL HA H 64 3.663 3.663 3.715 -0.052 18496 1901 1 5 . 1 1 64 64 VAL C C 64 177.644 177.644 177.981 -0.337 18496 1902 1 5 . 1 1 64 64 VAL CA C 64 67.090 67.090 65.889 1.200 18496 1903 1 5 . 1 1 64 64 VAL CB C 64 31.367 31.367 31.059 0.308 18496 1904 1 5 . 1 1 64 64 VAL H H 64 7.759 7.759 7.952 -0.193 18496 1905 1 5 . 1 1 65 65 LEU N N 65 120.099 120.099 121.237 -1.138 18496 1906 1 5 . 1 1 65 65 LEU HA H 65 3.672 3.672 3.893 -0.221 18496 1907 1 5 . 1 1 65 65 LEU C C 65 177.636 177.636 178.730 -1.094 18496 1908 1 5 . 1 1 65 65 LEU CA C 65 58.552 58.552 58.439 0.113 18496 1909 1 5 . 1 1 65 65 LEU CB C 65 41.358 41.358 41.645 -0.286 18496 1910 1 5 . 1 1 65 65 LEU H H 65 7.660 7.660 8.109 -0.449 18496 1911 1 5 . 1 1 66 66 LEU N N 66 115.733 115.733 118.127 -2.394 18496 1912 1 5 . 1 1 66 66 LEU HA H 66 3.556 3.556 3.647 -0.091 18496 1913 1 5 . 1 1 66 66 LEU C C 66 179.729 179.729 178.820 0.909 18496 1914 1 5 . 1 1 66 66 LEU CA C 66 58.069 58.069 58.122 -0.053 18496 1915 1 5 . 1 1 66 66 LEU CB C 66 41.625 41.625 41.029 0.596 18496 1916 1 5 . 1 1 66 66 LEU H H 66 8.083 8.083 8.264 -0.181 18496 1917 1 5 . 1 1 67 67 LYS N N 67 119.120 119.120 120.027 -0.907 18496 1918 1 5 . 1 1 67 67 LYS HA H 67 3.965 3.965 3.816 0.149 18496 1919 1 5 . 1 1 67 67 LYS C C 67 179.379 179.379 178.979 0.400 18496 1920 1 5 . 1 1 67 67 LYS CA C 67 59.227 59.227 59.861 -0.634 18496 1921 1 5 . 1 1 67 67 LYS CB C 67 32.737 32.737 32.237 0.500 18496 1922 1 5 . 1 1 67 67 LYS H H 67 7.861 7.861 8.306 -0.445 18496 1923 1 5 . 1 1 68 68 GLU N N 68 116.924 116.924 118.843 -1.919 18496 1924 1 5 . 1 1 68 68 GLU HA H 68 4.409 4.409 4.063 0.346 18496 1925 1 5 . 1 1 68 68 GLU CA C 68 57.712 57.712 58.866 -1.154 18496 1926 1 5 . 1 1 68 68 GLU CB C 68 29.586 29.586 29.413 0.173 18496 1927 1 5 . 1 1 68 68 GLU H H 68 8.319 8.319 8.006 0.313 18496 1928 1 5 . 1 1 69 69 LEU N N 69 120.032 120.032 120.004 0.028 18496 1929 1 5 . 1 1 69 69 LEU HA H 69 4.107 4.107 3.935 0.172 18496 1930 1 5 . 1 1 69 69 LEU CA C 69 57.563 57.563 57.475 0.088 18496 1931 1 5 . 1 1 69 69 LEU CB C 69 41.373 41.373 41.434 -0.061 18496 1932 1 5 . 1 1 69 69 LEU H H 69 8.233 8.233 8.493 -0.260 18496 1933 1 5 . 1 1 70 70 GLY N N 70 105.472 105.472 105.726 -0.254 18496 1934 1 5 . 1 1 70 70 GLY C C 70 174.986 174.986 175.672 -0.686 18496 1935 1 5 . 1 1 70 70 GLY CA C 70 46.704 46.704 46.929 -0.225 18496 1936 1 5 . 1 1 70 70 GLY H H 70 7.960 7.960 8.643 -0.683 18496 1937 1 5 . 1 1 71 71 ASN N N 71 118.596 118.596 119.339 -0.743 18496 1938 1 5 . 1 1 71 71 ASN HA H 71 4.681 4.681 4.847 -0.166 18496 1939 1 5 . 1 1 71 71 ASN C C 71 176.412 176.412 178.015 -1.603 18496 1940 1 5 . 1 1 71 71 ASN CA C 71 54.407 54.407 55.094 -0.687 18496 1941 1 5 . 1 1 71 71 ASN CB C 71 38.729 38.729 38.635 0.094 18496 1942 1 5 . 1 1 71 71 ASN H H 71 7.857 7.857 7.659 0.198 18496 1943 1 5 . 1 1 72 72 LYS N N 72 119.973 119.973 120.391 -0.418 18496 1944 1 5 . 1 1 72 72 LYS HA H 72 4.282 4.282 4.116 0.166 18496 1945 1 5 . 1 1 72 72 LYS CA C 72 57.338 57.338 58.293 -0.955 18496 1946 1 5 . 1 1 72 72 LYS CB C 72 32.755 32.755 32.115 0.640 18496 1947 1 5 . 1 1 72 72 LYS H H 72 8.100 8.100 7.969 0.131 18496 1948 1 5 . 1 1 73 73 LEU HA H 73 4.281 4.281 4.283 -0.002 18496 1949 1 5 . 1 1 73 73 LEU CA C 73 55.774 55.774 55.089 0.685 18496 1950 1 5 . 1 1 73 73 LEU CB C 73 41.983 41.983 42.314 -0.331 18496 1951 1 6 . 1 1 2 2 ALA HA H 2 4.074 4.074 4.472 -0.398 18496 1952 1 6 . 1 1 2 2 ALA CA C 2 51.966 51.966 51.529 0.437 18496 1953 1 6 . 1 1 2 2 ALA CB C 2 19.732 19.732 19.612 0.120 18496 1954 1 6 . 1 1 3 3 ASP HA H 3 4.632 4.632 4.516 0.116 18496 1955 1 6 . 1 1 3 3 ASP C C 3 175.822 175.822 176.348 -0.526 18496 1956 1 6 . 1 1 3 3 ASP CA C 3 54.440 54.440 55.559 -1.119 18496 1957 1 6 . 1 1 3 3 ASP CB C 3 41.577 41.577 41.260 0.318 18496 1958 1 6 . 1 1 4 4 LYS N N 4 121.655 121.655 119.977 1.678 18496 1959 1 6 . 1 1 4 4 LYS HA H 4 4.379 4.379 4.572 -0.193 18496 1960 1 6 . 1 1 4 4 LYS C C 4 176.011 176.011 175.783 0.228 18496 1961 1 6 . 1 1 4 4 LYS CA C 4 56.213 56.213 55.001 1.212 18496 1962 1 6 . 1 1 4 4 LYS CB C 4 33.407 33.407 31.921 1.486 18496 1963 1 6 . 1 1 4 4 LYS H H 4 8.394 8.394 7.979 0.415 18496 1964 1 6 . 1 1 5 5 LEU N N 5 125.369 125.369 124.437 0.932 18496 1965 1 6 . 1 1 5 5 LEU HA H 5 4.351 4.351 4.290 0.061 18496 1966 1 6 . 1 1 5 5 LEU C C 5 175.682 175.682 176.813 -1.131 18496 1967 1 6 . 1 1 5 5 LEU CA C 5 55.117 55.117 55.037 0.080 18496 1968 1 6 . 1 1 5 5 LEU CB C 5 43.197 43.197 42.826 0.371 18496 1969 1 6 . 1 1 5 5 LEU H H 5 8.136 8.136 8.153 -0.017 18496 1970 1 6 . 1 1 6 6 LYS N N 6 126.844 126.844 125.104 1.740 18496 1971 1 6 . 1 1 6 6 LYS HA H 6 4.451 4.451 4.451 0.000 18496 1972 1 6 . 1 1 6 6 LYS C C 6 174.665 174.665 175.648 -0.983 18496 1973 1 6 . 1 1 6 6 LYS CA C 6 55.974 55.974 56.255 -0.282 18496 1974 1 6 . 1 1 6 6 LYS CB C 6 34.386 34.386 32.777 1.609 18496 1975 1 6 . 1 1 6 6 LYS H H 6 8.615 8.615 8.591 0.024 18496 1976 1 6 . 1 1 7 7 PHE N N 7 119.818 119.818 119.737 0.081 18496 1977 1 6 . 1 1 7 7 PHE HA H 7 5.343 5.343 5.547 -0.204 18496 1978 1 6 . 1 1 7 7 PHE C C 7 173.569 173.569 173.768 -0.199 18496 1979 1 6 . 1 1 7 7 PHE CA C 7 55.813 55.813 55.671 0.142 18496 1980 1 6 . 1 1 7 7 PHE CB C 7 42.975 42.975 42.447 0.528 18496 1981 1 6 . 1 1 7 7 PHE H H 7 7.734 7.734 8.271 -0.537 18496 1982 1 6 . 1 1 8 8 GLU N N 8 119.165 119.165 119.172 -0.007 18496 1983 1 6 . 1 1 8 8 GLU HA H 8 4.158 4.158 4.232 -0.074 18496 1984 1 6 . 1 1 8 8 GLU C C 8 175.026 175.026 174.260 0.766 18496 1985 1 6 . 1 1 8 8 GLU CA C 8 55.221 55.221 54.462 0.759 18496 1986 1 6 . 1 1 8 8 GLU CB C 8 33.699 33.699 32.917 0.782 18496 1987 1 6 . 1 1 8 8 GLU H H 8 8.295 8.295 8.771 -0.476 18496 1988 1 6 . 1 1 9 9 ILE N N 9 127.619 127.619 127.601 0.018 18496 1989 1 6 . 1 1 9 9 ILE HA H 9 3.768 3.768 4.188 -0.420 18496 1990 1 6 . 1 1 9 9 ILE C C 9 174.902 174.902 175.848 -0.946 18496 1991 1 6 . 1 1 9 9 ILE CA C 9 62.505 62.505 62.394 0.111 18496 1992 1 6 . 1 1 9 9 ILE CB C 9 36.094 36.094 37.679 -1.585 18496 1993 1 6 . 1 1 9 9 ILE H H 9 9.157 9.157 8.677 0.480 18496 1994 1 6 . 1 1 10 10 ILE N N 10 131.245 131.245 128.845 2.400 18496 1995 1 6 . 1 1 10 10 ILE HA H 10 3.861 3.861 4.076 -0.215 18496 1996 1 6 . 1 1 10 10 ILE C C 10 176.247 176.247 176.328 -0.081 18496 1997 1 6 . 1 1 10 10 ILE CA C 10 60.554 60.554 62.285 -1.731 18496 1998 1 6 . 1 1 10 10 ILE CB C 10 37.406 37.406 38.461 -1.055 18496 1999 1 6 . 1 1 10 10 ILE H H 10 8.428 8.428 8.965 -0.537 18496 2000 1 6 . 1 1 11 11 GLU N N 11 117.669 117.669 118.493 -0.824 18496 2001 1 6 . 1 1 11 11 GLU HA H 11 4.315 4.315 4.505 -0.190 18496 2002 1 6 . 1 1 11 11 GLU C C 11 174.155 174.155 174.614 -0.459 18496 2003 1 6 . 1 1 11 11 GLU CA C 11 55.755 55.755 55.345 0.410 18496 2004 1 6 . 1 1 11 11 GLU CB C 11 34.386 34.386 33.034 1.352 18496 2005 1 6 . 1 1 11 11 GLU H H 11 7.551 7.551 7.815 -0.264 18496 2006 1 6 . 1 1 12 12 GLU N N 12 128.587 128.587 125.172 3.415 18496 2007 1 6 . 1 1 12 12 GLU HA H 12 5.214 5.214 4.627 0.587 18496 2008 1 6 . 1 1 12 12 GLU C C 12 176.877 176.877 175.960 0.917 18496 2009 1 6 . 1 1 12 12 GLU CA C 12 54.801 54.801 56.968 -2.167 18496 2010 1 6 . 1 1 12 12 GLU CB C 12 30.137 30.137 29.702 0.435 18496 2011 1 6 . 1 1 12 12 GLU H H 12 8.762 8.762 8.826 -0.064 18496 2012 1 6 . 1 1 13 13 LEU N N 13 122.508 122.508 124.070 -1.562 18496 2013 1 6 . 1 1 13 13 LEU HA H 13 4.872 4.872 4.437 0.435 18496 2014 1 6 . 1 1 13 13 LEU C C 13 176.060 176.060 177.212 -1.152 18496 2015 1 6 . 1 1 13 13 LEU CA C 13 57.372 57.372 55.669 1.703 18496 2016 1 6 . 1 1 13 13 LEU CB C 13 42.284 42.284 43.311 -1.027 18496 2017 1 6 . 1 1 13 13 LEU H H 13 8.058 8.058 8.386 -0.328 18496 2018 1 6 . 1 1 14 14 ILE N N 14 115.422 115.422 117.526 -2.104 18496 2019 1 6 . 1 1 14 14 ILE HA H 14 4.553 4.553 4.438 0.115 18496 2020 1 6 . 1 1 14 14 ILE C C 14 174.893 174.893 174.051 0.842 18496 2021 1 6 . 1 1 14 14 ILE CA C 14 60.586 60.586 59.739 0.848 18496 2022 1 6 . 1 1 14 14 ILE CB C 14 44.329 44.329 41.511 2.818 18496 2023 1 6 . 1 1 14 14 ILE H H 14 8.450 8.450 8.373 0.077 18496 2024 1 6 . 1 1 15 15 VAL N N 15 129.108 129.108 125.551 3.557 18496 2025 1 6 . 1 1 15 15 VAL HA H 15 4.196 4.196 4.420 -0.224 18496 2026 1 6 . 1 1 15 15 VAL C C 15 175.180 175.180 175.036 0.144 18496 2027 1 6 . 1 1 15 15 VAL CA C 15 63.288 63.288 60.957 2.331 18496 2028 1 6 . 1 1 15 15 VAL CB C 15 32.117 32.117 32.712 -0.595 18496 2029 1 6 . 1 1 15 15 VAL H H 15 8.867 8.867 8.520 0.347 18496 2030 1 6 . 1 1 16 16 LEU N N 16 127.846 127.846 129.072 -1.226 18496 2031 1 6 . 1 1 16 16 LEU HA H 16 4.317 4.317 4.640 -0.323 18496 2032 1 6 . 1 1 16 16 LEU C C 16 176.070 176.070 177.341 -1.271 18496 2033 1 6 . 1 1 16 16 LEU CA C 16 57.252 57.252 56.372 0.880 18496 2034 1 6 . 1 1 16 16 LEU CB C 16 42.035 42.035 42.615 -0.580 18496 2035 1 6 . 1 1 16 16 LEU H H 16 9.555 9.555 8.800 0.755 18496 2036 1 6 . 1 1 17 17 SER N N 17 107.073 107.073 110.539 -3.466 18496 2037 1 6 . 1 1 17 17 SER HA H 17 4.540 4.540 4.630 -0.090 18496 2038 1 6 . 1 1 17 17 SER C C 17 172.277 172.277 172.239 0.038 18496 2039 1 6 . 1 1 17 17 SER CA C 17 57.882 57.882 58.063 -0.181 18496 2040 1 6 . 1 1 17 17 SER CB C 17 64.046 64.046 65.178 -1.132 18496 2041 1 6 . 1 1 17 17 SER H H 17 7.699 7.699 7.861 -0.162 18496 2042 1 6 . 1 1 18 18 GLU N N 18 119.235 119.235 119.980 -0.745 18496 2043 1 6 . 1 1 18 18 GLU HA H 18 5.143 5.143 5.035 0.108 18496 2044 1 6 . 1 1 18 18 GLU C C 18 175.469 175.469 176.048 -0.579 18496 2045 1 6 . 1 1 18 18 GLU CA C 18 55.248 55.248 55.066 0.182 18496 2046 1 6 . 1 1 18 18 GLU CB C 18 33.454 33.454 31.323 2.131 18496 2047 1 6 . 1 1 18 18 GLU H H 18 8.437 8.437 8.510 -0.073 18496 2048 1 6 . 1 1 19 19 ASN N N 19 123.988 123.988 122.206 1.782 18496 2049 1 6 . 1 1 19 19 ASN HA H 19 5.097 5.097 4.696 0.401 18496 2050 1 6 . 1 1 19 19 ASN CA C 19 50.916 50.916 53.536 -2.620 18496 2051 1 6 . 1 1 19 19 ASN CB C 19 39.482 39.482 39.709 -0.227 18496 2052 1 6 . 1 1 19 19 ASN H H 19 8.779 8.779 8.429 0.350 18496 2053 1 6 . 1 1 20 20 ALA N N 20 120.854 120.854 122.737 -1.883 18496 2054 1 6 . 1 1 20 20 ALA HA H 20 4.239 4.239 4.178 0.061 18496 2055 1 6 . 1 1 20 20 ALA C C 20 179.032 179.032 178.147 0.885 18496 2056 1 6 . 1 1 20 20 ALA CA C 20 54.924 54.924 54.245 0.679 18496 2057 1 6 . 1 1 20 20 ALA CB C 20 18.621 18.621 18.724 -0.103 18496 2058 1 6 . 1 1 20 20 ALA H H 20 8.616 8.616 8.660 -0.044 18496 2059 1 6 . 1 1 21 21 LYS N N 21 115.771 115.771 116.586 -0.815 18496 2060 1 6 . 1 1 21 21 LYS HA H 21 4.497 4.497 4.211 0.286 18496 2061 1 6 . 1 1 21 21 LYS C C 21 176.615 176.615 176.769 -0.154 18496 2062 1 6 . 1 1 21 21 LYS CA C 21 55.503 55.503 55.589 -0.086 18496 2063 1 6 . 1 1 21 21 LYS CB C 21 32.742 32.742 32.146 0.596 18496 2064 1 6 . 1 1 21 21 LYS H H 21 7.767 7.767 7.666 0.101 18496 2065 1 6 . 1 1 22 22 GLY N N 22 107.695 107.695 106.836 0.859 18496 2066 1 6 . 1 1 22 22 GLY C C 22 174.843 174.843 174.484 0.359 18496 2067 1 6 . 1 1 22 22 GLY CA C 22 45.297 45.297 45.248 0.049 18496 2068 1 6 . 1 1 22 22 GLY H H 22 8.317 8.317 7.878 0.439 18496 2069 1 6 . 1 1 23 23 TRP N N 23 121.316 121.316 121.348 -0.032 18496 2070 1 6 . 1 1 23 23 TRP HA H 23 4.815 4.815 4.891 -0.076 18496 2071 1 6 . 1 1 23 23 TRP C C 23 176.754 176.754 176.487 0.267 18496 2072 1 6 . 1 1 23 23 TRP CA C 23 58.291 58.291 54.917 3.374 18496 2073 1 6 . 1 1 23 23 TRP CB C 23 28.127 28.127 28.061 0.066 18496 2074 1 6 . 1 1 23 23 TRP H H 23 7.983 7.983 8.035 -0.052 18496 2075 1 6 . 1 1 24 24 ARG N N 24 120.789 120.789 126.945 -6.156 18496 2076 1 6 . 1 1 24 24 ARG HA H 24 5.496 5.496 4.888 0.608 18496 2077 1 6 . 1 1 24 24 ARG C C 24 175.831 175.831 176.273 -0.442 18496 2078 1 6 . 1 1 24 24 ARG CA C 24 54.755 54.755 54.776 -0.021 18496 2079 1 6 . 1 1 24 24 ARG CB C 24 33.735 33.735 30.068 3.667 18496 2080 1 6 . 1 1 24 24 ARG H H 24 9.046 9.046 9.289 -0.243 18496 2081 1 6 . 1 1 25 25 LYS N N 25 126.507 126.507 129.406 -2.899 18496 2082 1 6 . 1 1 25 25 LYS HA H 25 5.081 5.081 4.845 0.236 18496 2083 1 6 . 1 1 25 25 LYS C C 25 175.648 175.648 175.635 0.013 18496 2084 1 6 . 1 1 25 25 LYS CA C 25 56.071 56.071 57.002 -0.931 18496 2085 1 6 . 1 1 25 25 LYS CB C 25 32.214 32.214 32.784 -0.570 18496 2086 1 6 . 1 1 25 25 LYS H H 25 8.526 8.526 8.586 -0.060 18496 2087 1 6 . 1 1 26 26 GLU N N 26 126.009 126.009 124.091 1.918 18496 2088 1 6 . 1 1 26 26 GLU HA H 26 5.275 5.275 5.125 0.150 18496 2089 1 6 . 1 1 26 26 GLU C C 26 174.894 174.894 174.177 0.717 18496 2090 1 6 . 1 1 26 26 GLU CA C 26 55.271 55.271 55.017 0.254 18496 2091 1 6 . 1 1 26 26 GLU CB C 26 33.781 33.781 34.720 -0.939 18496 2092 1 6 . 1 1 26 26 GLU H H 26 9.125 9.125 9.168 -0.043 18496 2093 1 6 . 1 1 27 27 LEU N N 27 121.930 121.930 124.630 -2.700 18496 2094 1 6 . 1 1 27 27 LEU HA H 27 5.788 5.788 5.017 0.771 18496 2095 1 6 . 1 1 27 27 LEU C C 27 173.941 173.941 174.402 -0.461 18496 2096 1 6 . 1 1 27 27 LEU CA C 27 53.859 53.859 53.842 0.017 18496 2097 1 6 . 1 1 27 27 LEU CB C 27 44.020 44.020 44.214 -0.194 18496 2098 1 6 . 1 1 27 27 LEU H H 27 8.938 8.938 9.080 -0.142 18496 2099 1 6 . 1 1 28 28 ASN N N 28 124.630 124.630 125.158 -0.528 18496 2100 1 6 . 1 1 28 28 ASN HA H 28 5.411 5.411 5.247 0.164 18496 2101 1 6 . 1 1 28 28 ASN C C 28 174.366 174.366 173.321 1.045 18496 2102 1 6 . 1 1 28 28 ASN CA C 28 52.063 52.063 52.342 -0.279 18496 2103 1 6 . 1 1 28 28 ASN CB C 28 44.430 44.430 43.459 0.971 18496 2104 1 6 . 1 1 28 28 ASN H H 28 9.345 9.345 8.403 0.942 18496 2105 1 6 . 1 1 29 29 ARG N N 29 118.443 118.443 122.427 -3.984 18496 2106 1 6 . 1 1 29 29 ARG HA H 29 5.058 5.058 4.935 0.123 18496 2107 1 6 . 1 1 29 29 ARG C C 29 175.779 175.779 174.611 1.168 18496 2108 1 6 . 1 1 29 29 ARG CA C 29 56.091 56.091 55.670 0.421 18496 2109 1 6 . 1 1 29 29 ARG CB C 29 31.710 31.710 31.120 0.590 18496 2110 1 6 . 1 1 29 29 ARG H H 29 9.109 9.109 9.007 0.102 18496 2111 1 6 . 1 1 30 30 VAL N N 30 124.605 124.605 122.367 2.238 18496 2112 1 6 . 1 1 30 30 VAL HA H 30 4.535 4.535 5.359 -0.824 18496 2113 1 6 . 1 1 30 30 VAL C C 30 174.775 174.775 174.323 0.452 18496 2114 1 6 . 1 1 30 30 VAL CA C 30 60.921 60.921 59.174 1.747 18496 2115 1 6 . 1 1 30 30 VAL CB C 30 37.790 37.790 36.240 1.550 18496 2116 1 6 . 1 1 30 30 VAL H H 30 9.054 9.054 8.757 0.297 18496 2117 1 6 . 1 1 31 31 SER N N 31 120.794 120.794 115.151 5.643 18496 2118 1 6 . 1 1 31 31 SER HA H 31 4.652 4.652 5.158 -0.506 18496 2119 1 6 . 1 1 31 31 SER C C 31 174.214 174.214 175.377 -1.163 18496 2120 1 6 . 1 1 31 31 SER CA C 31 56.279 56.279 57.089 -0.810 18496 2121 1 6 . 1 1 31 31 SER CB C 31 64.128 64.128 64.049 0.079 18496 2122 1 6 . 1 1 31 31 SER H H 31 8.667 8.667 8.861 -0.194 18496 2123 1 6 . 1 1 32 32 TRP N N 32 132.303 132.303 127.960 4.343 18496 2124 1 6 . 1 1 32 32 TRP HA H 32 5.105 5.105 4.535 0.570 18496 2125 1 6 . 1 1 32 32 TRP C C 32 177.276 177.276 177.223 0.053 18496 2126 1 6 . 1 1 32 32 TRP CA C 32 56.198 56.198 57.996 -1.798 18496 2127 1 6 . 1 1 32 32 TRP CB C 32 29.968 29.968 28.101 1.867 18496 2128 1 6 . 1 1 32 32 TRP H H 32 9.282 9.282 9.180 0.102 18496 2129 1 6 . 1 1 33 33 ASN N N 33 124.979 124.979 123.548 1.431 18496 2130 1 6 . 1 1 33 33 ASN HA H 33 4.257 4.257 4.382 -0.125 18496 2131 1 6 . 1 1 33 33 ASN C C 33 174.030 174.030 174.745 -0.715 18496 2132 1 6 . 1 1 33 33 ASN CA C 33 54.709 54.709 54.785 -0.076 18496 2133 1 6 . 1 1 33 33 ASN CB C 33 37.921 37.921 36.998 0.923 18496 2134 1 6 . 1 1 33 33 ASN H H 33 9.813 9.813 8.865 0.948 18496 2135 1 6 . 1 1 34 34 ASP N N 34 111.880 111.880 114.079 -2.199 18496 2136 1 6 . 1 1 34 34 ASP HA H 34 4.126 4.126 4.226 -0.100 18496 2137 1 6 . 1 1 34 34 ASP CA C 34 56.130 56.130 55.769 0.361 18496 2138 1 6 . 1 1 34 34 ASP CB C 34 39.760 39.760 40.133 -0.373 18496 2139 1 6 . 1 1 34 34 ASP H H 34 9.251 9.251 8.294 0.957 18496 2140 1 6 . 1 1 35 35 ALA N N 35 121.811 121.811 120.736 1.075 18496 2141 1 6 . 1 1 35 35 ALA HA H 35 4.477 4.477 4.521 -0.044 18496 2142 1 6 . 1 1 35 35 ALA C C 35 177.778 177.778 177.091 0.687 18496 2143 1 6 . 1 1 35 35 ALA CA C 35 51.528 51.528 52.337 -0.809 18496 2144 1 6 . 1 1 35 35 ALA CB C 35 20.445 20.445 20.303 0.142 18496 2145 1 6 . 1 1 35 35 ALA H H 35 7.625 7.625 7.770 -0.145 18496 2146 1 6 . 1 1 36 36 GLU N N 36 121.068 121.068 121.648 -0.580 18496 2147 1 6 . 1 1 36 36 GLU HA H 36 4.390 4.390 4.682 -0.292 18496 2148 1 6 . 1 1 36 36 GLU CA C 36 55.276 55.276 52.346 2.930 18496 2149 1 6 . 1 1 36 36 GLU CB C 36 28.575 28.575 30.764 -2.189 18496 2150 1 6 . 1 1 36 36 GLU H H 36 8.658 8.658 8.466 0.192 18496 2151 1 6 . 1 1 37 37 PRO HA H 37 4.289 4.289 4.634 -0.345 18496 2152 1 6 . 1 1 37 37 PRO C C 37 175.799 175.799 175.741 0.058 18496 2153 1 6 . 1 1 37 37 PRO CA C 37 63.105 63.105 62.156 0.949 18496 2154 1 6 . 1 1 37 37 PRO CB C 37 32.076 32.076 31.881 0.195 18496 2155 1 6 . 1 1 38 38 LYS N N 38 120.881 120.881 122.808 -1.927 18496 2156 1 6 . 1 1 38 38 LYS HA H 38 4.700 4.700 4.321 0.379 18496 2157 1 6 . 1 1 38 38 LYS C C 38 176.906 176.906 174.836 2.070 18496 2158 1 6 . 1 1 38 38 LYS CA C 38 54.399 54.399 54.262 0.137 18496 2159 1 6 . 1 1 38 38 LYS CB C 38 37.217 37.217 36.501 0.716 18496 2160 1 6 . 1 1 38 38 LYS H H 38 8.316 8.316 8.850 -0.534 18496 2161 1 6 . 1 1 39 39 TYR N N 39 119.792 119.792 118.823 0.969 18496 2162 1 6 . 1 1 39 39 TYR HA H 39 4.636 4.636 4.780 -0.144 18496 2163 1 6 . 1 1 39 39 TYR C C 39 175.834 175.834 174.819 1.015 18496 2164 1 6 . 1 1 39 39 TYR CA C 39 60.228 60.228 57.198 3.030 18496 2165 1 6 . 1 1 39 39 TYR CB C 39 38.683 38.683 38.910 -0.227 18496 2166 1 6 . 1 1 39 39 TYR H H 39 8.508 8.508 7.787 0.721 18496 2167 1 6 . 1 1 40 40 ASP N N 40 126.502 126.502 123.021 3.481 18496 2168 1 6 . 1 1 40 40 ASP HA H 40 5.597 5.597 5.381 0.216 18496 2169 1 6 . 1 1 40 40 ASP C C 40 175.283 175.283 174.162 1.121 18496 2170 1 6 . 1 1 40 40 ASP CA C 40 55.053 55.053 53.503 1.550 18496 2171 1 6 . 1 1 40 40 ASP CB C 40 48.656 48.656 45.486 3.170 18496 2172 1 6 . 1 1 40 40 ASP H H 40 9.219 9.219 8.705 0.514 18496 2173 1 6 . 1 1 41 41 ILE N N 41 125.910 125.910 125.210 0.700 18496 2174 1 6 . 1 1 41 41 ILE HA H 41 5.722 5.722 5.049 0.673 18496 2175 1 6 . 1 1 41 41 ILE C C 41 174.167 174.167 173.663 0.504 18496 2176 1 6 . 1 1 41 41 ILE CA C 41 60.734 60.734 59.829 0.905 18496 2177 1 6 . 1 1 41 41 ILE CB C 41 40.198 40.198 39.836 0.362 18496 2178 1 6 . 1 1 41 41 ILE H H 41 8.972 8.972 8.698 0.274 18496 2179 1 6 . 1 1 42 42 ARG N N 42 120.300 120.300 127.091 -6.791 18496 2180 1 6 . 1 1 42 42 ARG HA H 42 4.716 4.716 4.809 -0.093 18496 2181 1 6 . 1 1 42 42 ARG CA C 42 54.826 54.826 54.954 -0.128 18496 2182 1 6 . 1 1 42 42 ARG CB C 42 32.665 32.665 35.326 -2.661 18496 2183 1 6 . 1 1 42 42 ARG H H 42 8.320 8.320 8.801 -0.481 18496 2184 1 6 . 1 1 43 43 THR HA H 43 5.585 5.585 5.505 0.080 18496 2185 1 6 . 1 1 43 43 THR C C 43 173.294 173.294 173.185 0.109 18496 2186 1 6 . 1 1 43 43 THR CA C 43 60.847 60.847 59.178 1.669 18496 2187 1 6 . 1 1 43 43 THR CB C 43 69.961 69.961 70.996 -1.036 18496 2188 1 6 . 1 1 44 44 TRP N N 44 122.747 122.747 123.230 -0.483 18496 2189 1 6 . 1 1 44 44 TRP HA H 44 4.945 4.945 4.798 0.147 18496 2190 1 6 . 1 1 44 44 TRP C C 44 175.056 175.056 176.296 -1.240 18496 2191 1 6 . 1 1 44 44 TRP CA C 44 56.107 56.107 55.809 0.297 18496 2192 1 6 . 1 1 44 44 TRP CB C 44 34.506 34.506 32.482 2.024 18496 2193 1 6 . 1 1 44 44 TRP H H 44 9.180 9.180 8.861 0.319 18496 2194 1 6 . 1 1 45 45 SER N N 45 117.385 117.385 116.226 1.159 18496 2195 1 6 . 1 1 45 45 SER HA H 45 2.300 2.300 4.956 -2.656 18496 2196 1 6 . 1 1 45 45 SER CA C 45 56.481 56.481 56.531 -0.050 18496 2197 1 6 . 1 1 45 45 SER CB C 45 60.743 60.743 62.162 -1.419 18496 2198 1 6 . 1 1 45 45 SER H H 45 7.879 7.879 8.355 -0.476 18496 2199 1 6 . 1 1 46 46 PRO HA H 46 4.104 4.104 4.456 -0.352 18496 2200 1 6 . 1 1 46 46 PRO CA C 46 64.990 64.990 65.421 -0.431 18496 2201 1 6 . 1 1 46 46 PRO CB C 46 31.272 31.272 31.910 -0.638 18496 2202 1 6 . 1 1 47 47 ASP HA H 47 4.520 4.520 4.634 -0.114 18496 2203 1 6 . 1 1 47 47 ASP C C 47 175.629 175.629 175.414 0.215 18496 2204 1 6 . 1 1 47 47 ASP CA C 47 53.453 53.453 53.367 0.086 18496 2205 1 6 . 1 1 47 47 ASP CB C 47 40.239 40.239 40.796 -0.557 18496 2206 1 6 . 1 1 48 48 HIS N N 48 111.320 111.320 116.354 -5.034 18496 2207 1 6 . 1 1 48 48 HIS HA H 48 3.916 3.916 4.558 -0.642 18496 2208 1 6 . 1 1 48 48 HIS CA C 48 60.347 60.347 57.642 2.705 18496 2209 1 6 . 1 1 48 48 HIS CB C 48 25.499 25.499 27.792 -2.293 18496 2210 1 6 . 1 1 48 48 HIS H H 48 8.269 8.269 8.207 0.062 18496 2211 1 6 . 1 1 49 49 GLU N N 49 114.659 114.659 117.614 -2.955 18496 2212 1 6 . 1 1 49 49 GLU HA H 49 4.447 4.447 4.477 -0.030 18496 2213 1 6 . 1 1 49 49 GLU C C 49 176.394 176.394 176.716 -0.322 18496 2214 1 6 . 1 1 49 49 GLU CA C 49 57.940 57.940 57.374 0.566 18496 2215 1 6 . 1 1 49 49 GLU CB C 49 30.641 30.641 31.221 -0.580 18496 2216 1 6 . 1 1 49 49 GLU H H 49 7.381 7.381 8.512 -1.131 18496 2217 1 6 . 1 1 50 50 LYS N N 50 118.126 118.126 118.533 -0.407 18496 2218 1 6 . 1 1 50 50 LYS HA H 50 4.665 4.665 4.559 0.106 18496 2219 1 6 . 1 1 50 50 LYS CA C 50 54.431 54.431 54.474 -0.043 18496 2220 1 6 . 1 1 50 50 LYS CB C 50 36.543 36.543 36.253 0.290 18496 2221 1 6 . 1 1 50 50 LYS H H 50 8.067 8.067 8.173 -0.106 18496 2222 1 6 . 1 1 51 51 MET HA H 51 4.936 4.936 4.480 0.456 18496 2223 1 6 . 1 1 51 51 MET CA C 51 54.048 54.048 53.235 0.813 18496 2224 1 6 . 1 1 51 51 MET CB C 51 33.768 33.768 34.930 -1.162 18496 2225 1 6 . 1 1 52 52 GLY C C 52 173.534 173.534 172.305 1.229 18496 2226 1 6 . 1 1 52 52 GLY CA C 52 43.060 43.060 44.275 -1.214 18496 2227 1 6 . 1 1 53 53 LYS N N 53 118.012 118.012 119.769 -1.757 18496 2228 1 6 . 1 1 53 53 LYS HA H 53 4.155 4.155 4.428 -0.273 18496 2229 1 6 . 1 1 53 53 LYS C C 53 176.818 176.818 176.219 0.599 18496 2230 1 6 . 1 1 53 53 LYS CA C 53 56.478 56.478 56.342 0.136 18496 2231 1 6 . 1 1 53 53 LYS CB C 53 33.117 33.117 33.225 -0.108 18496 2232 1 6 . 1 1 53 53 LYS H H 53 8.132 8.132 8.202 -0.070 18496 2233 1 6 . 1 1 54 54 GLY N N 54 109.836 109.836 108.239 1.597 18496 2234 1 6 . 1 1 54 54 GLY C C 54 170.848 170.848 172.739 -1.891 18496 2235 1 6 . 1 1 54 54 GLY CA C 54 46.701 46.701 44.791 1.910 18496 2236 1 6 . 1 1 54 54 GLY H H 54 8.079 8.079 8.144 -0.065 18496 2237 1 6 . 1 1 55 55 ILE N N 55 119.382 119.382 121.987 -2.605 18496 2238 1 6 . 1 1 55 55 ILE HA H 55 4.956 4.956 4.592 0.364 18496 2239 1 6 . 1 1 55 55 ILE C C 55 171.737 171.737 173.768 -2.031 18496 2240 1 6 . 1 1 55 55 ILE CA C 55 57.059 57.059 60.365 -3.306 18496 2241 1 6 . 1 1 55 55 ILE CB C 55 44.241 44.241 41.334 2.908 18496 2242 1 6 . 1 1 55 55 ILE H H 55 8.661 8.661 8.332 0.329 18496 2243 1 6 . 1 1 56 56 THR N N 56 113.795 113.795 122.392 -8.597 18496 2244 1 6 . 1 1 56 56 THR HA H 56 5.607 5.607 4.948 0.659 18496 2245 1 6 . 1 1 56 56 THR C C 56 174.417 174.417 173.646 0.771 18496 2246 1 6 . 1 1 56 56 THR CA C 56 59.098 59.098 61.494 -2.396 18496 2247 1 6 . 1 1 56 56 THR CB C 56 72.153 72.153 70.249 1.904 18496 2248 1 6 . 1 1 56 56 THR H H 56 7.916 7.916 8.453 -0.537 18496 2249 1 6 . 1 1 57 57 LEU N N 57 121.044 121.044 127.615 -6.571 18496 2250 1 6 . 1 1 57 57 LEU HA H 57 5.311 5.311 4.945 0.366 18496 2251 1 6 . 1 1 57 57 LEU C C 57 176.150 176.150 175.618 0.532 18496 2252 1 6 . 1 1 57 57 LEU CA C 57 53.264 53.264 53.894 -0.630 18496 2253 1 6 . 1 1 57 57 LEU CB C 57 45.901 45.901 44.896 1.005 18496 2254 1 6 . 1 1 57 57 LEU H H 57 9.421 9.421 9.254 0.167 18496 2255 1 6 . 1 1 58 58 SER N N 58 119.548 119.548 118.135 1.413 18496 2256 1 6 . 1 1 58 58 SER HA H 58 4.734 4.734 4.655 0.079 18496 2257 1 6 . 1 1 58 58 SER C C 58 174.786 174.786 175.795 -1.009 18496 2258 1 6 . 1 1 58 58 SER CA C 58 56.948 56.948 57.498 -0.549 18496 2259 1 6 . 1 1 58 58 SER CB C 58 65.726 65.726 64.997 0.729 18496 2260 1 6 . 1 1 58 58 SER H H 58 9.771 9.771 9.529 0.242 18496 2261 1 6 . 1 1 59 59 GLU N N 59 120.827 120.827 122.831 -2.004 18496 2262 1 6 . 1 1 59 59 GLU HA H 59 4.319 4.319 4.126 0.193 18496 2263 1 6 . 1 1 59 59 GLU C C 59 179.806 179.806 178.746 1.060 18496 2264 1 6 . 1 1 59 59 GLU CA C 59 60.913 60.913 61.416 -0.503 18496 2265 1 6 . 1 1 59 59 GLU CB C 59 29.538 29.538 29.370 0.168 18496 2266 1 6 . 1 1 59 59 GLU H H 59 9.394 9.394 9.222 0.172 18496 2267 1 6 . 1 1 60 60 GLU N N 60 119.587 119.587 119.269 0.318 18496 2268 1 6 . 1 1 60 60 GLU HA H 60 4.188 4.188 4.111 0.077 18496 2269 1 6 . 1 1 60 60 GLU C C 60 179.686 179.686 178.804 0.882 18496 2270 1 6 . 1 1 60 60 GLU CA C 60 60.279 60.279 59.531 0.748 18496 2271 1 6 . 1 1 60 60 GLU CB C 60 29.559 29.559 28.758 0.801 18496 2272 1 6 . 1 1 60 60 GLU H H 60 8.905 8.905 8.844 0.061 18496 2273 1 6 . 1 1 61 61 GLU N N 61 120.145 120.145 120.117 0.028 18496 2274 1 6 . 1 1 61 61 GLU HA H 61 4.037 4.037 4.089 -0.052 18496 2275 1 6 . 1 1 61 61 GLU C C 61 178.530 178.530 178.935 -0.405 18496 2276 1 6 . 1 1 61 61 GLU CA C 61 59.118 59.118 58.893 0.225 18496 2277 1 6 . 1 1 61 61 GLU CB C 61 30.976 30.976 29.323 1.653 18496 2278 1 6 . 1 1 61 61 GLU H H 61 8.013 8.013 8.382 -0.369 18496 2279 1 6 . 1 1 62 62 PHE N N 62 119.925 119.925 120.535 -0.610 18496 2280 1 6 . 1 1 62 62 PHE HA H 62 3.927 3.927 4.074 -0.147 18496 2281 1 6 . 1 1 62 62 PHE C C 62 176.783 176.783 177.484 -0.701 18496 2282 1 6 . 1 1 62 62 PHE CA C 62 61.827 61.827 61.273 0.554 18496 2283 1 6 . 1 1 62 62 PHE CB C 62 40.216 40.216 38.916 1.300 18496 2284 1 6 . 1 1 62 62 PHE H H 62 9.192 9.192 8.953 0.239 18496 2285 1 6 . 1 1 63 63 GLY N N 63 104.854 104.854 107.592 -2.738 18496 2286 1 6 . 1 1 63 63 GLY C C 63 176.854 176.854 175.839 1.015 18496 2287 1 6 . 1 1 63 63 GLY CA C 63 47.178 47.178 47.427 -0.249 18496 2288 1 6 . 1 1 63 63 GLY H H 63 8.316 8.316 8.603 -0.287 18496 2289 1 6 . 1 1 64 64 VAL N N 64 123.719 123.719 123.099 0.620 18496 2290 1 6 . 1 1 64 64 VAL HA H 64 3.663 3.663 3.576 0.087 18496 2291 1 6 . 1 1 64 64 VAL C C 64 177.644 177.644 177.648 -0.004 18496 2292 1 6 . 1 1 64 64 VAL CA C 64 67.090 67.090 66.184 0.905 18496 2293 1 6 . 1 1 64 64 VAL CB C 64 31.367 31.367 31.664 -0.297 18496 2294 1 6 . 1 1 64 64 VAL H H 64 7.759 7.759 7.783 -0.024 18496 2295 1 6 . 1 1 65 65 LEU N N 65 120.099 120.099 120.870 -0.771 18496 2296 1 6 . 1 1 65 65 LEU HA H 65 3.672 3.672 3.906 -0.234 18496 2297 1 6 . 1 1 65 65 LEU C C 65 177.636 177.636 178.358 -0.722 18496 2298 1 6 . 1 1 65 65 LEU CA C 65 58.552 58.552 58.306 0.246 18496 2299 1 6 . 1 1 65 65 LEU CB C 65 41.358 41.358 41.674 -0.316 18496 2300 1 6 . 1 1 65 65 LEU H H 65 7.660 7.660 7.720 -0.060 18496 2301 1 6 . 1 1 66 66 LEU N N 66 115.733 115.733 118.447 -2.714 18496 2302 1 6 . 1 1 66 66 LEU HA H 66 3.556 3.556 3.605 -0.049 18496 2303 1 6 . 1 1 66 66 LEU C C 66 179.729 179.729 178.818 0.911 18496 2304 1 6 . 1 1 66 66 LEU CA C 66 58.069 58.069 58.177 -0.108 18496 2305 1 6 . 1 1 66 66 LEU CB C 66 41.625 41.625 41.030 0.595 18496 2306 1 6 . 1 1 66 66 LEU H H 66 8.083 8.083 8.247 -0.164 18496 2307 1 6 . 1 1 67 67 LYS N N 67 119.120 119.120 119.882 -0.762 18496 2308 1 6 . 1 1 67 67 LYS HA H 67 3.965 3.965 3.796 0.169 18496 2309 1 6 . 1 1 67 67 LYS C C 67 179.379 179.379 179.049 0.330 18496 2310 1 6 . 1 1 67 67 LYS CA C 67 59.227 59.227 59.852 -0.625 18496 2311 1 6 . 1 1 67 67 LYS CB C 67 32.737 32.737 32.236 0.501 18496 2312 1 6 . 1 1 67 67 LYS H H 67 7.861 7.861 8.278 -0.417 18496 2313 1 6 . 1 1 68 68 GLU N N 68 116.924 116.924 118.711 -1.787 18496 2314 1 6 . 1 1 68 68 GLU HA H 68 4.409 4.409 4.095 0.314 18496 2315 1 6 . 1 1 68 68 GLU CA C 68 57.712 57.712 58.548 -0.836 18496 2316 1 6 . 1 1 68 68 GLU CB C 68 29.586 29.586 29.421 0.165 18496 2317 1 6 . 1 1 68 68 GLU H H 68 8.319 8.319 7.750 0.569 18496 2318 1 6 . 1 1 69 69 LEU N N 69 120.032 120.032 120.088 -0.056 18496 2319 1 6 . 1 1 69 69 LEU HA H 69 4.107 4.107 3.950 0.157 18496 2320 1 6 . 1 1 69 69 LEU CA C 69 57.563 57.563 57.518 0.045 18496 2321 1 6 . 1 1 69 69 LEU CB C 69 41.373 41.373 41.593 -0.220 18496 2322 1 6 . 1 1 69 69 LEU H H 69 8.233 8.233 8.576 -0.343 18496 2323 1 6 . 1 1 70 70 GLY N N 70 105.472 105.472 105.400 0.072 18496 2324 1 6 . 1 1 70 70 GLY C C 70 174.986 174.986 175.574 -0.588 18496 2325 1 6 . 1 1 70 70 GLY CA C 70 46.704 46.704 46.732 -0.028 18496 2326 1 6 . 1 1 70 70 GLY H H 70 7.960 7.960 8.566 -0.606 18496 2327 1 6 . 1 1 71 71 ASN N N 71 118.596 118.596 118.668 -0.072 18496 2328 1 6 . 1 1 71 71 ASN HA H 71 4.681 4.681 4.787 -0.106 18496 2329 1 6 . 1 1 71 71 ASN C C 71 176.412 176.412 177.261 -0.849 18496 2330 1 6 . 1 1 71 71 ASN CA C 71 54.407 54.407 54.831 -0.424 18496 2331 1 6 . 1 1 71 71 ASN CB C 71 38.729 38.729 38.610 0.119 18496 2332 1 6 . 1 1 71 71 ASN H H 71 7.857 7.857 7.645 0.212 18496 2333 1 6 . 1 1 72 72 LYS N N 72 119.973 119.973 118.356 1.617 18496 2334 1 6 . 1 1 72 72 LYS HA H 72 4.282 4.282 4.189 0.093 18496 2335 1 6 . 1 1 72 72 LYS CA C 72 57.338 57.338 57.634 -0.296 18496 2336 1 6 . 1 1 72 72 LYS CB C 72 32.755 32.755 32.349 0.406 18496 2337 1 6 . 1 1 72 72 LYS H H 72 8.100 8.100 7.757 0.343 18496 2338 1 6 . 1 1 73 73 LEU HA H 73 4.281 4.281 4.257 0.024 18496 2339 1 6 . 1 1 73 73 LEU CA C 73 55.774 55.774 55.052 0.722 18496 2340 1 6 . 1 1 73 73 LEU CB C 73 41.983 41.983 42.435 -0.452 18496 2341 1 7 . 1 1 2 2 ALA HA H 2 4.074 4.074 4.580 -0.506 18496 2342 1 7 . 1 1 2 2 ALA CA C 2 51.966 51.966 51.630 0.335 18496 2343 1 7 . 1 1 2 2 ALA CB C 2 19.732 19.732 20.236 -0.504 18496 2344 1 7 . 1 1 3 3 ASP HA H 3 4.632 4.632 4.439 0.193 18496 2345 1 7 . 1 1 3 3 ASP C C 3 175.822 175.822 176.105 -0.283 18496 2346 1 7 . 1 1 3 3 ASP CA C 3 54.440 54.440 55.490 -1.050 18496 2347 1 7 . 1 1 3 3 ASP CB C 3 41.577 41.577 41.380 0.197 18496 2348 1 7 . 1 1 4 4 LYS N N 4 121.655 121.655 118.993 2.662 18496 2349 1 7 . 1 1 4 4 LYS HA H 4 4.379 4.379 4.574 -0.195 18496 2350 1 7 . 1 1 4 4 LYS C C 4 176.011 176.011 175.515 0.496 18496 2351 1 7 . 1 1 4 4 LYS CA C 4 56.213 56.213 54.752 1.461 18496 2352 1 7 . 1 1 4 4 LYS CB C 4 33.407 33.407 32.178 1.229 18496 2353 1 7 . 1 1 4 4 LYS H H 4 8.394 8.394 7.892 0.502 18496 2354 1 7 . 1 1 5 5 LEU N N 5 125.369 125.369 124.830 0.539 18496 2355 1 7 . 1 1 5 5 LEU HA H 5 4.351 4.351 4.433 -0.082 18496 2356 1 7 . 1 1 5 5 LEU C C 5 175.682 175.682 176.404 -0.722 18496 2357 1 7 . 1 1 5 5 LEU CA C 5 55.117 55.117 54.480 0.637 18496 2358 1 7 . 1 1 5 5 LEU CB C 5 43.197 43.197 43.275 -0.078 18496 2359 1 7 . 1 1 5 5 LEU H H 5 8.136 8.136 8.249 -0.113 18496 2360 1 7 . 1 1 6 6 LYS N N 6 126.844 126.844 125.876 0.968 18496 2361 1 7 . 1 1 6 6 LYS HA H 6 4.451 4.451 4.480 -0.029 18496 2362 1 7 . 1 1 6 6 LYS C C 6 174.665 174.665 175.298 -0.633 18496 2363 1 7 . 1 1 6 6 LYS CA C 6 55.974 55.974 56.087 -0.113 18496 2364 1 7 . 1 1 6 6 LYS CB C 6 34.386 34.386 32.784 1.602 18496 2365 1 7 . 1 1 6 6 LYS H H 6 8.615 8.615 8.620 -0.005 18496 2366 1 7 . 1 1 7 7 PHE N N 7 119.818 119.818 120.189 -0.371 18496 2367 1 7 . 1 1 7 7 PHE HA H 7 5.343 5.343 5.495 -0.152 18496 2368 1 7 . 1 1 7 7 PHE C C 7 173.569 173.569 174.039 -0.470 18496 2369 1 7 . 1 1 7 7 PHE CA C 7 55.813 55.813 55.223 0.590 18496 2370 1 7 . 1 1 7 7 PHE CB C 7 42.975 42.975 42.589 0.386 18496 2371 1 7 . 1 1 7 7 PHE H H 7 7.734 7.734 8.215 -0.481 18496 2372 1 7 . 1 1 8 8 GLU N N 8 119.165 119.165 119.627 -0.462 18496 2373 1 7 . 1 1 8 8 GLU HA H 8 4.158 4.158 4.198 -0.040 18496 2374 1 7 . 1 1 8 8 GLU C C 8 175.026 175.026 174.469 0.557 18496 2375 1 7 . 1 1 8 8 GLU CA C 8 55.221 55.221 54.828 0.393 18496 2376 1 7 . 1 1 8 8 GLU CB C 8 33.699 33.699 32.560 1.139 18496 2377 1 7 . 1 1 8 8 GLU H H 8 8.295 8.295 8.834 -0.539 18496 2378 1 7 . 1 1 9 9 ILE N N 9 127.619 127.619 128.128 -0.509 18496 2379 1 7 . 1 1 9 9 ILE HA H 9 3.768 3.768 4.111 -0.343 18496 2380 1 7 . 1 1 9 9 ILE C C 9 174.902 174.902 175.965 -1.063 18496 2381 1 7 . 1 1 9 9 ILE CA C 9 62.505 62.505 62.878 -0.373 18496 2382 1 7 . 1 1 9 9 ILE CB C 9 36.094 36.094 37.580 -1.486 18496 2383 1 7 . 1 1 9 9 ILE H H 9 9.157 9.157 8.699 0.458 18496 2384 1 7 . 1 1 10 10 ILE N N 10 131.245 131.245 128.758 2.487 18496 2385 1 7 . 1 1 10 10 ILE HA H 10 3.861 3.861 4.136 -0.275 18496 2386 1 7 . 1 1 10 10 ILE C C 10 176.247 176.247 176.356 -0.109 18496 2387 1 7 . 1 1 10 10 ILE CA C 10 60.554 60.554 62.074 -1.520 18496 2388 1 7 . 1 1 10 10 ILE CB C 10 37.406 37.406 38.423 -1.017 18496 2389 1 7 . 1 1 10 10 ILE H H 10 8.428 8.428 9.013 -0.585 18496 2390 1 7 . 1 1 11 11 GLU N N 11 117.669 117.669 118.727 -1.058 18496 2391 1 7 . 1 1 11 11 GLU HA H 11 4.315 4.315 4.535 -0.220 18496 2392 1 7 . 1 1 11 11 GLU C C 11 174.155 174.155 174.539 -0.384 18496 2393 1 7 . 1 1 11 11 GLU CA C 11 55.755 55.755 55.676 0.079 18496 2394 1 7 . 1 1 11 11 GLU CB C 11 34.386 34.386 32.984 1.402 18496 2395 1 7 . 1 1 11 11 GLU H H 11 7.551 7.551 7.877 -0.326 18496 2396 1 7 . 1 1 12 12 GLU N N 12 128.587 128.587 125.662 2.925 18496 2397 1 7 . 1 1 12 12 GLU HA H 12 5.214 5.214 4.596 0.618 18496 2398 1 7 . 1 1 12 12 GLU C C 12 176.877 176.877 175.827 1.050 18496 2399 1 7 . 1 1 12 12 GLU CA C 12 54.801 54.801 57.048 -2.247 18496 2400 1 7 . 1 1 12 12 GLU CB C 12 30.137 30.137 30.482 -0.345 18496 2401 1 7 . 1 1 12 12 GLU H H 12 8.762 8.762 8.879 -0.117 18496 2402 1 7 . 1 1 13 13 LEU N N 13 122.508 122.508 124.804 -2.296 18496 2403 1 7 . 1 1 13 13 LEU HA H 13 4.872 4.872 4.742 0.130 18496 2404 1 7 . 1 1 13 13 LEU C C 13 176.060 176.060 177.141 -1.081 18496 2405 1 7 . 1 1 13 13 LEU CA C 13 57.372 57.372 55.919 1.453 18496 2406 1 7 . 1 1 13 13 LEU CB C 13 42.284 42.284 43.357 -1.073 18496 2407 1 7 . 1 1 13 13 LEU H H 13 8.058 8.058 8.911 -0.853 18496 2408 1 7 . 1 1 14 14 ILE N N 14 115.422 115.422 117.875 -2.453 18496 2409 1 7 . 1 1 14 14 ILE HA H 14 4.553 4.553 4.458 0.095 18496 2410 1 7 . 1 1 14 14 ILE C C 14 174.893 174.893 174.140 0.753 18496 2411 1 7 . 1 1 14 14 ILE CA C 14 60.586 60.586 59.524 1.062 18496 2412 1 7 . 1 1 14 14 ILE CB C 14 44.329 44.329 41.215 3.114 18496 2413 1 7 . 1 1 14 14 ILE H H 14 8.450 8.450 8.327 0.123 18496 2414 1 7 . 1 1 15 15 VAL N N 15 129.108 129.108 126.135 2.973 18496 2415 1 7 . 1 1 15 15 VAL HA H 15 4.196 4.196 4.370 -0.174 18496 2416 1 7 . 1 1 15 15 VAL C C 15 175.180 175.180 175.194 -0.014 18496 2417 1 7 . 1 1 15 15 VAL CA C 15 63.288 63.288 61.133 2.155 18496 2418 1 7 . 1 1 15 15 VAL CB C 15 32.117 32.117 32.827 -0.710 18496 2419 1 7 . 1 1 15 15 VAL H H 15 8.867 8.867 8.524 0.343 18496 2420 1 7 . 1 1 16 16 LEU N N 16 127.846 127.846 129.683 -1.837 18496 2421 1 7 . 1 1 16 16 LEU HA H 16 4.317 4.317 4.592 -0.275 18496 2422 1 7 . 1 1 16 16 LEU C C 16 176.070 176.070 177.299 -1.229 18496 2423 1 7 . 1 1 16 16 LEU CA C 16 57.252 57.252 56.327 0.925 18496 2424 1 7 . 1 1 16 16 LEU CB C 16 42.035 42.035 42.637 -0.602 18496 2425 1 7 . 1 1 16 16 LEU H H 16 9.555 9.555 8.523 1.032 18496 2426 1 7 . 1 1 17 17 SER N N 17 107.073 107.073 110.312 -3.239 18496 2427 1 7 . 1 1 17 17 SER HA H 17 4.540 4.540 4.604 -0.064 18496 2428 1 7 . 1 1 17 17 SER C C 17 172.277 172.277 172.225 0.052 18496 2429 1 7 . 1 1 17 17 SER CA C 17 57.882 57.882 58.075 -0.193 18496 2430 1 7 . 1 1 17 17 SER CB C 17 64.046 64.046 65.021 -0.975 18496 2431 1 7 . 1 1 17 17 SER H H 17 7.699 7.699 7.804 -0.105 18496 2432 1 7 . 1 1 18 18 GLU N N 18 119.235 119.235 119.709 -0.474 18496 2433 1 7 . 1 1 18 18 GLU HA H 18 5.143 5.143 5.245 -0.102 18496 2434 1 7 . 1 1 18 18 GLU C C 18 175.469 175.469 176.359 -0.890 18496 2435 1 7 . 1 1 18 18 GLU CA C 18 55.248 55.248 55.156 0.092 18496 2436 1 7 . 1 1 18 18 GLU CB C 18 33.454 33.454 31.372 2.082 18496 2437 1 7 . 1 1 18 18 GLU H H 18 8.437 8.437 8.464 -0.027 18496 2438 1 7 . 1 1 19 19 ASN N N 19 123.988 123.988 122.099 1.889 18496 2439 1 7 . 1 1 19 19 ASN HA H 19 5.097 5.097 4.736 0.361 18496 2440 1 7 . 1 1 19 19 ASN CA C 19 50.916 50.916 53.242 -2.326 18496 2441 1 7 . 1 1 19 19 ASN CB C 19 39.482 39.482 38.987 0.495 18496 2442 1 7 . 1 1 19 19 ASN H H 19 8.779 8.779 8.403 0.376 18496 2443 1 7 . 1 1 20 20 ALA N N 20 120.854 120.854 122.989 -2.135 18496 2444 1 7 . 1 1 20 20 ALA HA H 20 4.239 4.239 4.129 0.110 18496 2445 1 7 . 1 1 20 20 ALA C C 20 179.032 179.032 177.891 1.141 18496 2446 1 7 . 1 1 20 20 ALA CA C 20 54.924 54.924 54.302 0.622 18496 2447 1 7 . 1 1 20 20 ALA CB C 20 18.621 18.621 18.191 0.430 18496 2448 1 7 . 1 1 20 20 ALA H H 20 8.616 8.616 8.444 0.172 18496 2449 1 7 . 1 1 21 21 LYS N N 21 115.771 115.771 116.700 -0.929 18496 2450 1 7 . 1 1 21 21 LYS HA H 21 4.497 4.497 4.243 0.254 18496 2451 1 7 . 1 1 21 21 LYS C C 21 176.615 176.615 176.611 0.004 18496 2452 1 7 . 1 1 21 21 LYS CA C 21 55.503 55.503 55.493 0.010 18496 2453 1 7 . 1 1 21 21 LYS CB C 21 32.742 32.742 32.026 0.716 18496 2454 1 7 . 1 1 21 21 LYS H H 21 7.767 7.767 7.746 0.021 18496 2455 1 7 . 1 1 22 22 GLY N N 22 107.695 107.695 106.533 1.162 18496 2456 1 7 . 1 1 22 22 GLY C C 22 174.843 174.843 173.837 1.006 18496 2457 1 7 . 1 1 22 22 GLY CA C 22 45.297 45.297 45.153 0.144 18496 2458 1 7 . 1 1 22 22 GLY H H 22 8.317 8.317 7.888 0.429 18496 2459 1 7 . 1 1 23 23 TRP N N 23 121.316 121.316 120.905 0.411 18496 2460 1 7 . 1 1 23 23 TRP HA H 23 4.815 4.815 4.741 0.074 18496 2461 1 7 . 1 1 23 23 TRP C C 23 176.754 176.754 176.247 0.507 18496 2462 1 7 . 1 1 23 23 TRP CA C 23 58.291 58.291 55.271 3.020 18496 2463 1 7 . 1 1 23 23 TRP CB C 23 28.127 28.127 27.996 0.131 18496 2464 1 7 . 1 1 23 23 TRP H H 23 7.983 7.983 7.983 -0.000 18496 2465 1 7 . 1 1 24 24 ARG N N 24 120.789 120.789 126.767 -5.978 18496 2466 1 7 . 1 1 24 24 ARG HA H 24 5.496 5.496 4.878 0.618 18496 2467 1 7 . 1 1 24 24 ARG C C 24 175.831 175.831 175.602 0.229 18496 2468 1 7 . 1 1 24 24 ARG CA C 24 54.755 54.755 54.611 0.144 18496 2469 1 7 . 1 1 24 24 ARG CB C 24 33.735 33.735 30.469 3.266 18496 2470 1 7 . 1 1 24 24 ARG H H 24 9.046 9.046 9.322 -0.276 18496 2471 1 7 . 1 1 25 25 LYS N N 25 126.507 126.507 129.075 -2.568 18496 2472 1 7 . 1 1 25 25 LYS HA H 25 5.081 5.081 4.704 0.377 18496 2473 1 7 . 1 1 25 25 LYS C C 25 175.648 175.648 175.361 0.287 18496 2474 1 7 . 1 1 25 25 LYS CA C 25 56.071 56.071 56.262 -0.191 18496 2475 1 7 . 1 1 25 25 LYS CB C 25 32.214 32.214 33.215 -1.001 18496 2476 1 7 . 1 1 25 25 LYS H H 25 8.526 8.526 8.412 0.114 18496 2477 1 7 . 1 1 26 26 GLU N N 26 126.009 126.009 123.593 2.416 18496 2478 1 7 . 1 1 26 26 GLU HA H 26 5.275 5.275 4.933 0.342 18496 2479 1 7 . 1 1 26 26 GLU C C 26 174.894 174.894 173.897 0.997 18496 2480 1 7 . 1 1 26 26 GLU CA C 26 55.271 55.271 54.861 0.410 18496 2481 1 7 . 1 1 26 26 GLU CB C 26 33.781 33.781 34.552 -0.771 18496 2482 1 7 . 1 1 26 26 GLU H H 26 9.125 9.125 8.329 0.796 18496 2483 1 7 . 1 1 27 27 LEU N N 27 121.930 121.930 124.790 -2.860 18496 2484 1 7 . 1 1 27 27 LEU HA H 27 5.788 5.788 4.640 1.148 18496 2485 1 7 . 1 1 27 27 LEU C C 27 173.941 173.941 174.314 -0.373 18496 2486 1 7 . 1 1 27 27 LEU CA C 27 53.859 53.859 53.747 0.112 18496 2487 1 7 . 1 1 27 27 LEU CB C 27 44.020 44.020 43.654 0.366 18496 2488 1 7 . 1 1 27 27 LEU H H 27 8.938 8.938 9.009 -0.071 18496 2489 1 7 . 1 1 28 28 ASN N N 28 124.630 124.630 125.096 -0.466 18496 2490 1 7 . 1 1 28 28 ASN HA H 28 5.411 5.411 5.269 0.142 18496 2491 1 7 . 1 1 28 28 ASN C C 28 174.366 174.366 173.129 1.237 18496 2492 1 7 . 1 1 28 28 ASN CA C 28 52.063 52.063 52.309 -0.246 18496 2493 1 7 . 1 1 28 28 ASN CB C 28 44.430 44.430 43.519 0.911 18496 2494 1 7 . 1 1 28 28 ASN H H 28 9.345 9.345 8.183 1.162 18496 2495 1 7 . 1 1 29 29 ARG N N 29 118.443 118.443 121.909 -3.466 18496 2496 1 7 . 1 1 29 29 ARG HA H 29 5.058 5.058 5.104 -0.046 18496 2497 1 7 . 1 1 29 29 ARG C C 29 175.779 175.779 174.445 1.334 18496 2498 1 7 . 1 1 29 29 ARG CA C 29 56.091 56.091 55.378 0.713 18496 2499 1 7 . 1 1 29 29 ARG CB C 29 31.710 31.710 31.932 -0.222 18496 2500 1 7 . 1 1 29 29 ARG H H 29 9.109 9.109 9.225 -0.116 18496 2501 1 7 . 1 1 30 30 VAL N N 30 124.605 124.605 122.551 2.054 18496 2502 1 7 . 1 1 30 30 VAL HA H 30 4.535 4.535 5.424 -0.889 18496 2503 1 7 . 1 1 30 30 VAL C C 30 174.775 174.775 174.278 0.497 18496 2504 1 7 . 1 1 30 30 VAL CA C 30 60.921 60.921 58.726 2.195 18496 2505 1 7 . 1 1 30 30 VAL CB C 30 37.790 37.790 36.213 1.577 18496 2506 1 7 . 1 1 30 30 VAL H H 30 9.054 9.054 8.596 0.458 18496 2507 1 7 . 1 1 31 31 SER N N 31 120.794 120.794 115.118 5.676 18496 2508 1 7 . 1 1 31 31 SER HA H 31 4.652 4.652 5.088 -0.436 18496 2509 1 7 . 1 1 31 31 SER C C 31 174.214 174.214 175.513 -1.299 18496 2510 1 7 . 1 1 31 31 SER CA C 31 56.279 56.279 57.173 -0.894 18496 2511 1 7 . 1 1 31 31 SER CB C 31 64.128 64.128 64.047 0.081 18496 2512 1 7 . 1 1 31 31 SER H H 31 8.667 8.667 8.638 0.029 18496 2513 1 7 . 1 1 32 32 TRP N N 32 132.303 132.303 128.234 4.069 18496 2514 1 7 . 1 1 32 32 TRP HA H 32 5.105 5.105 4.547 0.558 18496 2515 1 7 . 1 1 32 32 TRP C C 32 177.276 177.276 177.173 0.103 18496 2516 1 7 . 1 1 32 32 TRP CA C 32 56.198 56.198 58.261 -2.063 18496 2517 1 7 . 1 1 32 32 TRP CB C 32 29.968 29.968 28.041 1.927 18496 2518 1 7 . 1 1 32 32 TRP H H 32 9.282 9.282 9.172 0.110 18496 2519 1 7 . 1 1 33 33 ASN N N 33 124.979 124.979 123.229 1.750 18496 2520 1 7 . 1 1 33 33 ASN HA H 33 4.257 4.257 4.392 -0.135 18496 2521 1 7 . 1 1 33 33 ASN C C 33 174.030 174.030 174.746 -0.716 18496 2522 1 7 . 1 1 33 33 ASN CA C 33 54.709 54.709 54.829 -0.120 18496 2523 1 7 . 1 1 33 33 ASN CB C 33 37.921 37.921 37.057 0.864 18496 2524 1 7 . 1 1 33 33 ASN H H 33 9.813 9.813 8.827 0.986 18496 2525 1 7 . 1 1 34 34 ASP N N 34 111.880 111.880 113.797 -1.917 18496 2526 1 7 . 1 1 34 34 ASP HA H 34 4.126 4.126 4.251 -0.125 18496 2527 1 7 . 1 1 34 34 ASP CA C 34 56.130 56.130 55.387 0.743 18496 2528 1 7 . 1 1 34 34 ASP CB C 34 39.760 39.760 40.235 -0.475 18496 2529 1 7 . 1 1 34 34 ASP H H 34 9.251 9.251 8.226 1.025 18496 2530 1 7 . 1 1 35 35 ALA N N 35 121.811 121.811 121.300 0.511 18496 2531 1 7 . 1 1 35 35 ALA HA H 35 4.477 4.477 4.422 0.055 18496 2532 1 7 . 1 1 35 35 ALA C C 35 177.778 177.778 177.115 0.663 18496 2533 1 7 . 1 1 35 35 ALA CA C 35 51.528 51.528 52.879 -1.351 18496 2534 1 7 . 1 1 35 35 ALA CB C 35 20.445 20.445 20.535 -0.090 18496 2535 1 7 . 1 1 35 35 ALA H H 35 7.625 7.625 7.791 -0.166 18496 2536 1 7 . 1 1 36 36 GLU N N 36 121.068 121.068 120.565 0.503 18496 2537 1 7 . 1 1 36 36 GLU HA H 36 4.390 4.390 4.759 -0.369 18496 2538 1 7 . 1 1 36 36 GLU CA C 36 55.276 55.276 52.178 3.099 18496 2539 1 7 . 1 1 36 36 GLU CB C 36 28.575 28.575 30.760 -2.185 18496 2540 1 7 . 1 1 36 36 GLU H H 36 8.658 8.658 8.419 0.239 18496 2541 1 7 . 1 1 37 37 PRO HA H 37 4.289 4.289 4.777 -0.488 18496 2542 1 7 . 1 1 37 37 PRO C C 37 175.799 175.799 176.131 -0.332 18496 2543 1 7 . 1 1 37 37 PRO CA C 37 63.105 63.105 62.176 0.929 18496 2544 1 7 . 1 1 37 37 PRO CB C 37 32.076 32.076 32.156 -0.080 18496 2545 1 7 . 1 1 38 38 LYS N N 38 120.881 120.881 123.190 -2.309 18496 2546 1 7 . 1 1 38 38 LYS HA H 38 4.700 4.700 4.404 0.296 18496 2547 1 7 . 1 1 38 38 LYS C C 38 176.906 176.906 174.749 2.157 18496 2548 1 7 . 1 1 38 38 LYS CA C 38 54.399 54.399 54.767 -0.368 18496 2549 1 7 . 1 1 38 38 LYS CB C 38 37.217 37.217 36.573 0.644 18496 2550 1 7 . 1 1 38 38 LYS H H 38 8.316 8.316 8.911 -0.595 18496 2551 1 7 . 1 1 39 39 TYR N N 39 119.792 119.792 119.037 0.755 18496 2552 1 7 . 1 1 39 39 TYR HA H 39 4.636 4.636 4.757 -0.121 18496 2553 1 7 . 1 1 39 39 TYR C C 39 175.834 175.834 174.895 0.939 18496 2554 1 7 . 1 1 39 39 TYR CA C 39 60.228 60.228 57.693 2.535 18496 2555 1 7 . 1 1 39 39 TYR CB C 39 38.683 38.683 38.888 -0.205 18496 2556 1 7 . 1 1 39 39 TYR H H 39 8.508 8.508 8.059 0.449 18496 2557 1 7 . 1 1 40 40 ASP N N 40 126.502 126.502 123.002 3.500 18496 2558 1 7 . 1 1 40 40 ASP HA H 40 5.597 5.597 5.193 0.404 18496 2559 1 7 . 1 1 40 40 ASP C C 40 175.283 175.283 174.066 1.217 18496 2560 1 7 . 1 1 40 40 ASP CA C 40 55.053 55.053 53.554 1.499 18496 2561 1 7 . 1 1 40 40 ASP CB C 40 48.656 48.656 45.254 3.402 18496 2562 1 7 . 1 1 40 40 ASP H H 40 9.219 9.219 8.802 0.417 18496 2563 1 7 . 1 1 41 41 ILE N N 41 125.910 125.910 125.336 0.574 18496 2564 1 7 . 1 1 41 41 ILE HA H 41 5.722 5.722 4.769 0.953 18496 2565 1 7 . 1 1 41 41 ILE C C 41 174.167 174.167 173.448 0.719 18496 2566 1 7 . 1 1 41 41 ILE CA C 41 60.734 60.734 59.712 1.022 18496 2567 1 7 . 1 1 41 41 ILE CB C 41 40.198 40.198 39.690 0.509 18496 2568 1 7 . 1 1 41 41 ILE H H 41 8.972 8.972 8.496 0.476 18496 2569 1 7 . 1 1 42 42 ARG N N 42 120.300 120.300 127.236 -6.936 18496 2570 1 7 . 1 1 42 42 ARG HA H 42 4.716 4.716 4.577 0.139 18496 2571 1 7 . 1 1 42 42 ARG CA C 42 54.826 54.826 54.562 0.264 18496 2572 1 7 . 1 1 42 42 ARG CB C 42 32.665 32.665 35.000 -2.335 18496 2573 1 7 . 1 1 42 42 ARG H H 42 8.320 8.320 8.268 0.052 18496 2574 1 7 . 1 1 43 43 THR HA H 43 5.585 5.585 4.878 0.707 18496 2575 1 7 . 1 1 43 43 THR C C 43 173.294 173.294 173.042 0.252 18496 2576 1 7 . 1 1 43 43 THR CA C 43 60.847 60.847 60.837 0.010 18496 2577 1 7 . 1 1 43 43 THR CB C 43 69.961 69.961 70.296 -0.335 18496 2578 1 7 . 1 1 44 44 TRP N N 44 122.747 122.747 123.290 -0.543 18496 2579 1 7 . 1 1 44 44 TRP HA H 44 4.945 4.945 4.721 0.224 18496 2580 1 7 . 1 1 44 44 TRP C C 44 175.056 175.056 175.644 -0.588 18496 2581 1 7 . 1 1 44 44 TRP CA C 44 56.107 56.107 55.197 0.910 18496 2582 1 7 . 1 1 44 44 TRP CB C 44 34.506 34.506 32.132 2.374 18496 2583 1 7 . 1 1 44 44 TRP H H 44 9.180 9.180 8.685 0.495 18496 2584 1 7 . 1 1 45 45 SER N N 45 117.385 117.385 116.693 0.692 18496 2585 1 7 . 1 1 45 45 SER HA H 45 2.300 2.300 4.763 -2.463 18496 2586 1 7 . 1 1 45 45 SER CA C 45 56.481 56.481 57.439 -0.958 18496 2587 1 7 . 1 1 45 45 SER CB C 45 60.743 60.743 62.194 -1.451 18496 2588 1 7 . 1 1 45 45 SER H H 45 7.879 7.879 8.239 -0.360 18496 2589 1 7 . 1 1 46 46 PRO HA H 46 4.104 4.104 4.497 -0.393 18496 2590 1 7 . 1 1 46 46 PRO CA C 46 64.990 64.990 65.632 -0.642 18496 2591 1 7 . 1 1 46 46 PRO CB C 46 31.272 31.272 31.988 -0.716 18496 2592 1 7 . 1 1 47 47 ASP HA H 47 4.520 4.520 4.611 -0.091 18496 2593 1 7 . 1 1 47 47 ASP C C 47 175.629 175.629 175.727 -0.098 18496 2594 1 7 . 1 1 47 47 ASP CA C 47 53.453 53.453 53.402 0.051 18496 2595 1 7 . 1 1 47 47 ASP CB C 47 40.239 40.239 41.039 -0.800 18496 2596 1 7 . 1 1 48 48 HIS N N 48 111.320 111.320 115.713 -4.393 18496 2597 1 7 . 1 1 48 48 HIS HA H 48 3.916 3.916 4.392 -0.476 18496 2598 1 7 . 1 1 48 48 HIS CA C 48 60.347 60.347 57.106 3.241 18496 2599 1 7 . 1 1 48 48 HIS CB C 48 25.499 25.499 28.169 -2.670 18496 2600 1 7 . 1 1 48 48 HIS H H 48 8.269 8.269 8.119 0.150 18496 2601 1 7 . 1 1 49 49 GLU N N 49 114.659 114.659 117.686 -3.027 18496 2602 1 7 . 1 1 49 49 GLU HA H 49 4.447 4.447 4.234 0.213 18496 2603 1 7 . 1 1 49 49 GLU C C 49 176.394 176.394 176.226 0.168 18496 2604 1 7 . 1 1 49 49 GLU CA C 49 57.940 57.940 57.378 0.562 18496 2605 1 7 . 1 1 49 49 GLU CB C 49 30.641 30.641 30.531 0.110 18496 2606 1 7 . 1 1 49 49 GLU H H 49 7.381 7.381 8.468 -1.087 18496 2607 1 7 . 1 1 50 50 LYS N N 50 118.126 118.126 118.128 -0.002 18496 2608 1 7 . 1 1 50 50 LYS HA H 50 4.665 4.665 4.497 0.168 18496 2609 1 7 . 1 1 50 50 LYS CA C 50 54.431 54.431 55.037 -0.606 18496 2610 1 7 . 1 1 50 50 LYS CB C 50 36.543 36.543 35.652 0.891 18496 2611 1 7 . 1 1 50 50 LYS H H 50 8.067 8.067 7.590 0.477 18496 2612 1 7 . 1 1 51 51 MET HA H 51 4.936 4.936 4.990 -0.054 18496 2613 1 7 . 1 1 51 51 MET CA C 51 54.048 54.048 53.414 0.634 18496 2614 1 7 . 1 1 51 51 MET CB C 51 33.768 33.768 35.610 -1.842 18496 2615 1 7 . 1 1 52 52 GLY C C 52 173.534 173.534 172.342 1.192 18496 2616 1 7 . 1 1 52 52 GLY CA C 52 43.060 43.060 44.413 -1.353 18496 2617 1 7 . 1 1 53 53 LYS N N 53 118.012 118.012 119.226 -1.214 18496 2618 1 7 . 1 1 53 53 LYS HA H 53 4.155 4.155 4.490 -0.335 18496 2619 1 7 . 1 1 53 53 LYS C C 53 176.818 176.818 176.246 0.572 18496 2620 1 7 . 1 1 53 53 LYS CA C 53 56.478 56.478 56.181 0.297 18496 2621 1 7 . 1 1 53 53 LYS CB C 53 33.117 33.117 33.504 -0.387 18496 2622 1 7 . 1 1 53 53 LYS H H 53 8.132 8.132 8.261 -0.129 18496 2623 1 7 . 1 1 54 54 GLY N N 54 109.836 109.836 108.581 1.255 18496 2624 1 7 . 1 1 54 54 GLY C C 54 170.848 170.848 172.876 -2.028 18496 2625 1 7 . 1 1 54 54 GLY CA C 54 46.701 46.701 44.701 2.000 18496 2626 1 7 . 1 1 54 54 GLY H H 54 8.079 8.079 8.181 -0.102 18496 2627 1 7 . 1 1 55 55 ILE N N 55 119.382 119.382 122.149 -2.767 18496 2628 1 7 . 1 1 55 55 ILE HA H 55 4.956 4.956 4.483 0.473 18496 2629 1 7 . 1 1 55 55 ILE C C 55 171.737 171.737 173.851 -2.114 18496 2630 1 7 . 1 1 55 55 ILE CA C 55 57.059 57.059 60.489 -3.430 18496 2631 1 7 . 1 1 55 55 ILE CB C 55 44.241 44.241 41.239 3.002 18496 2632 1 7 . 1 1 55 55 ILE H H 55 8.661 8.661 8.264 0.397 18496 2633 1 7 . 1 1 56 56 THR N N 56 113.795 113.795 122.334 -8.539 18496 2634 1 7 . 1 1 56 56 THR HA H 56 5.607 5.607 4.749 0.858 18496 2635 1 7 . 1 1 56 56 THR C C 56 174.417 174.417 173.615 0.802 18496 2636 1 7 . 1 1 56 56 THR CA C 56 59.098 59.098 61.616 -2.518 18496 2637 1 7 . 1 1 56 56 THR CB C 56 72.153 72.153 70.053 2.100 18496 2638 1 7 . 1 1 56 56 THR H H 56 7.916 7.916 8.389 -0.473 18496 2639 1 7 . 1 1 57 57 LEU N N 57 121.044 121.044 127.350 -6.306 18496 2640 1 7 . 1 1 57 57 LEU HA H 57 5.311 5.311 4.770 0.541 18496 2641 1 7 . 1 1 57 57 LEU C C 57 176.150 176.150 175.688 0.462 18496 2642 1 7 . 1 1 57 57 LEU CA C 57 53.264 53.264 53.711 -0.447 18496 2643 1 7 . 1 1 57 57 LEU CB C 57 45.901 45.901 44.301 1.600 18496 2644 1 7 . 1 1 57 57 LEU H H 57 9.421 9.421 9.020 0.401 18496 2645 1 7 . 1 1 58 58 SER N N 58 119.548 119.548 118.762 0.786 18496 2646 1 7 . 1 1 58 58 SER HA H 58 4.734 4.734 4.488 0.246 18496 2647 1 7 . 1 1 58 58 SER C C 58 174.786 174.786 175.819 -1.033 18496 2648 1 7 . 1 1 58 58 SER CA C 58 56.948 56.948 57.902 -0.954 18496 2649 1 7 . 1 1 58 58 SER CB C 58 65.726 65.726 64.039 1.687 18496 2650 1 7 . 1 1 58 58 SER H H 58 9.771 9.771 9.543 0.228 18496 2651 1 7 . 1 1 59 59 GLU N N 59 120.827 120.827 123.506 -2.679 18496 2652 1 7 . 1 1 59 59 GLU HA H 59 4.319 4.319 4.263 0.056 18496 2653 1 7 . 1 1 59 59 GLU C C 59 179.806 179.806 178.963 0.843 18496 2654 1 7 . 1 1 59 59 GLU CA C 59 60.913 60.913 60.755 0.158 18496 2655 1 7 . 1 1 59 59 GLU CB C 59 29.538 29.538 29.461 0.077 18496 2656 1 7 . 1 1 59 59 GLU H H 59 9.394 9.394 9.047 0.347 18496 2657 1 7 . 1 1 60 60 GLU N N 60 119.587 119.587 119.365 0.222 18496 2658 1 7 . 1 1 60 60 GLU HA H 60 4.188 4.188 4.114 0.074 18496 2659 1 7 . 1 1 60 60 GLU C C 60 179.686 179.686 178.781 0.905 18496 2660 1 7 . 1 1 60 60 GLU CA C 60 60.279 60.279 59.453 0.826 18496 2661 1 7 . 1 1 60 60 GLU CB C 60 29.559 29.559 28.799 0.760 18496 2662 1 7 . 1 1 60 60 GLU H H 60 8.905 8.905 8.820 0.085 18496 2663 1 7 . 1 1 61 61 GLU N N 61 120.145 120.145 120.428 -0.283 18496 2664 1 7 . 1 1 61 61 GLU HA H 61 4.037 4.037 4.101 -0.064 18496 2665 1 7 . 1 1 61 61 GLU C C 61 178.530 178.530 178.964 -0.434 18496 2666 1 7 . 1 1 61 61 GLU CA C 61 59.118 59.118 59.055 0.063 18496 2667 1 7 . 1 1 61 61 GLU CB C 61 30.976 30.976 29.351 1.625 18496 2668 1 7 . 1 1 61 61 GLU H H 61 8.013 8.013 8.366 -0.353 18496 2669 1 7 . 1 1 62 62 PHE N N 62 119.925 119.925 120.383 -0.458 18496 2670 1 7 . 1 1 62 62 PHE HA H 62 3.927 3.927 4.212 -0.285 18496 2671 1 7 . 1 1 62 62 PHE C C 62 176.783 176.783 177.640 -0.857 18496 2672 1 7 . 1 1 62 62 PHE CA C 62 61.827 61.827 59.651 2.176 18496 2673 1 7 . 1 1 62 62 PHE CB C 62 40.216 40.216 38.594 1.621 18496 2674 1 7 . 1 1 62 62 PHE H H 62 9.192 9.192 8.891 0.301 18496 2675 1 7 . 1 1 63 63 GLY N N 63 104.854 104.854 107.970 -3.116 18496 2676 1 7 . 1 1 63 63 GLY C C 63 176.854 176.854 175.963 0.891 18496 2677 1 7 . 1 1 63 63 GLY CA C 63 47.178 47.178 47.317 -0.139 18496 2678 1 7 . 1 1 63 63 GLY H H 63 8.316 8.316 8.310 0.006 18496 2679 1 7 . 1 1 64 64 VAL N N 64 123.719 123.719 123.143 0.576 18496 2680 1 7 . 1 1 64 64 VAL HA H 64 3.663 3.663 3.592 0.071 18496 2681 1 7 . 1 1 64 64 VAL C C 64 177.644 177.644 177.579 0.065 18496 2682 1 7 . 1 1 64 64 VAL CA C 64 67.090 67.090 66.217 0.873 18496 2683 1 7 . 1 1 64 64 VAL CB C 64 31.367 31.367 31.702 -0.335 18496 2684 1 7 . 1 1 64 64 VAL H H 64 7.759 7.759 7.860 -0.101 18496 2685 1 7 . 1 1 65 65 LEU N N 65 120.099 120.099 121.082 -0.983 18496 2686 1 7 . 1 1 65 65 LEU HA H 65 3.672 3.672 3.959 -0.287 18496 2687 1 7 . 1 1 65 65 LEU C C 65 177.636 177.636 178.457 -0.821 18496 2688 1 7 . 1 1 65 65 LEU CA C 65 58.552 58.552 58.568 -0.016 18496 2689 1 7 . 1 1 65 65 LEU CB C 65 41.358 41.358 41.925 -0.567 18496 2690 1 7 . 1 1 65 65 LEU H H 65 7.660 7.660 8.113 -0.453 18496 2691 1 7 . 1 1 66 66 LEU N N 66 115.733 115.733 118.325 -2.592 18496 2692 1 7 . 1 1 66 66 LEU HA H 66 3.556 3.556 3.679 -0.123 18496 2693 1 7 . 1 1 66 66 LEU C C 66 179.729 179.729 178.816 0.913 18496 2694 1 7 . 1 1 66 66 LEU CA C 66 58.069 58.069 58.117 -0.048 18496 2695 1 7 . 1 1 66 66 LEU CB C 66 41.625 41.625 40.978 0.647 18496 2696 1 7 . 1 1 66 66 LEU H H 66 8.083 8.083 8.225 -0.142 18496 2697 1 7 . 1 1 67 67 LYS N N 67 119.120 119.120 119.840 -0.720 18496 2698 1 7 . 1 1 67 67 LYS HA H 67 3.965 3.965 3.778 0.187 18496 2699 1 7 . 1 1 67 67 LYS C C 67 179.379 179.379 179.003 0.376 18496 2700 1 7 . 1 1 67 67 LYS CA C 67 59.227 59.227 59.807 -0.580 18496 2701 1 7 . 1 1 67 67 LYS CB C 67 32.737 32.737 32.218 0.519 18496 2702 1 7 . 1 1 67 67 LYS H H 67 7.861 7.861 8.116 -0.255 18496 2703 1 7 . 1 1 68 68 GLU N N 68 116.924 116.924 118.888 -1.964 18496 2704 1 7 . 1 1 68 68 GLU HA H 68 4.409 4.409 4.080 0.329 18496 2705 1 7 . 1 1 68 68 GLU CA C 68 57.712 57.712 58.797 -1.085 18496 2706 1 7 . 1 1 68 68 GLU CB C 68 29.586 29.586 29.473 0.113 18496 2707 1 7 . 1 1 68 68 GLU H H 68 8.319 8.319 7.885 0.434 18496 2708 1 7 . 1 1 69 69 LEU N N 69 120.032 120.032 120.052 -0.020 18496 2709 1 7 . 1 1 69 69 LEU HA H 69 4.107 4.107 3.942 0.165 18496 2710 1 7 . 1 1 69 69 LEU CA C 69 57.563 57.563 57.600 -0.037 18496 2711 1 7 . 1 1 69 69 LEU CB C 69 41.373 41.373 41.512 -0.139 18496 2712 1 7 . 1 1 69 69 LEU H H 69 8.233 8.233 8.625 -0.392 18496 2713 1 7 . 1 1 70 70 GLY N N 70 105.472 105.472 105.465 0.007 18496 2714 1 7 . 1 1 70 70 GLY C C 70 174.986 174.986 175.663 -0.677 18496 2715 1 7 . 1 1 70 70 GLY CA C 70 46.704 46.704 46.883 -0.179 18496 2716 1 7 . 1 1 70 70 GLY H H 70 7.960 7.960 8.577 -0.617 18496 2717 1 7 . 1 1 71 71 ASN N N 71 118.596 118.596 119.220 -0.624 18496 2718 1 7 . 1 1 71 71 ASN HA H 71 4.681 4.681 4.817 -0.136 18496 2719 1 7 . 1 1 71 71 ASN C C 71 176.412 176.412 177.666 -1.254 18496 2720 1 7 . 1 1 71 71 ASN CA C 71 54.407 54.407 55.084 -0.677 18496 2721 1 7 . 1 1 71 71 ASN CB C 71 38.729 38.729 38.612 0.117 18496 2722 1 7 . 1 1 71 71 ASN H H 71 7.857 7.857 7.653 0.204 18496 2723 1 7 . 1 1 72 72 LYS N N 72 119.973 119.973 119.886 0.087 18496 2724 1 7 . 1 1 72 72 LYS HA H 72 4.282 4.282 4.137 0.145 18496 2725 1 7 . 1 1 72 72 LYS CA C 72 57.338 57.338 58.132 -0.794 18496 2726 1 7 . 1 1 72 72 LYS CB C 72 32.755 32.755 32.097 0.658 18496 2727 1 7 . 1 1 72 72 LYS H H 72 8.100 8.100 8.061 0.039 18496 2728 1 7 . 1 1 73 73 LEU HA H 73 4.281 4.281 4.196 0.085 18496 2729 1 7 . 1 1 73 73 LEU CA C 73 55.774 55.774 55.628 0.146 18496 2730 1 7 . 1 1 73 73 LEU CB C 73 41.983 41.983 42.153 -0.170 18496 2731 1 8 . 1 1 2 2 ALA HA H 2 4.074 4.074 4.588 -0.514 18496 2732 1 8 . 1 1 2 2 ALA CA C 2 51.966 51.966 51.552 0.414 18496 2733 1 8 . 1 1 2 2 ALA CB C 2 19.732 19.732 20.433 -0.701 18496 2734 1 8 . 1 1 3 3 ASP HA H 3 4.632 4.632 4.516 0.116 18496 2735 1 8 . 1 1 3 3 ASP C C 3 175.822 175.822 176.140 -0.318 18496 2736 1 8 . 1 1 3 3 ASP CA C 3 54.440 54.440 55.420 -0.980 18496 2737 1 8 . 1 1 3 3 ASP CB C 3 41.577 41.577 41.318 0.259 18496 2738 1 8 . 1 1 4 4 LYS N N 4 121.655 121.655 119.414 2.241 18496 2739 1 8 . 1 1 4 4 LYS HA H 4 4.379 4.379 4.558 -0.179 18496 2740 1 8 . 1 1 4 4 LYS C C 4 176.011 176.011 175.288 0.723 18496 2741 1 8 . 1 1 4 4 LYS CA C 4 56.213 56.213 55.153 1.060 18496 2742 1 8 . 1 1 4 4 LYS CB C 4 33.407 33.407 32.761 0.646 18496 2743 1 8 . 1 1 4 4 LYS H H 4 8.394 8.394 7.903 0.491 18496 2744 1 8 . 1 1 5 5 LEU N N 5 125.369 125.369 124.567 0.802 18496 2745 1 8 . 1 1 5 5 LEU HA H 5 4.351 4.351 4.453 -0.102 18496 2746 1 8 . 1 1 5 5 LEU C C 5 175.682 175.682 176.487 -0.805 18496 2747 1 8 . 1 1 5 5 LEU CA C 5 55.117 55.117 54.531 0.586 18496 2748 1 8 . 1 1 5 5 LEU CB C 5 43.197 43.197 43.251 -0.054 18496 2749 1 8 . 1 1 5 5 LEU H H 5 8.136 8.136 8.287 -0.151 18496 2750 1 8 . 1 1 6 6 LYS N N 6 126.844 126.844 126.421 0.423 18496 2751 1 8 . 1 1 6 6 LYS HA H 6 4.451 4.451 4.478 -0.027 18496 2752 1 8 . 1 1 6 6 LYS C C 6 174.665 174.665 175.277 -0.612 18496 2753 1 8 . 1 1 6 6 LYS CA C 6 55.974 55.974 56.354 -0.380 18496 2754 1 8 . 1 1 6 6 LYS CB C 6 34.386 34.386 32.938 1.448 18496 2755 1 8 . 1 1 6 6 LYS H H 6 8.615 8.615 8.639 -0.024 18496 2756 1 8 . 1 1 7 7 PHE N N 7 119.818 119.818 121.173 -1.355 18496 2757 1 8 . 1 1 7 7 PHE HA H 7 5.343 5.343 5.469 -0.126 18496 2758 1 8 . 1 1 7 7 PHE C C 7 173.569 173.569 173.785 -0.216 18496 2759 1 8 . 1 1 7 7 PHE CA C 7 55.813 55.813 55.823 -0.010 18496 2760 1 8 . 1 1 7 7 PHE CB C 7 42.975 42.975 42.832 0.143 18496 2761 1 8 . 1 1 7 7 PHE H H 7 7.734 7.734 8.176 -0.442 18496 2762 1 8 . 1 1 8 8 GLU N N 8 119.165 119.165 120.361 -1.196 18496 2763 1 8 . 1 1 8 8 GLU HA H 8 4.158 4.158 4.388 -0.230 18496 2764 1 8 . 1 1 8 8 GLU C C 8 175.026 175.026 174.879 0.147 18496 2765 1 8 . 1 1 8 8 GLU CA C 8 55.221 55.221 54.322 0.899 18496 2766 1 8 . 1 1 8 8 GLU CB C 8 33.699 33.699 33.611 0.088 18496 2767 1 8 . 1 1 8 8 GLU H H 8 8.295 8.295 8.427 -0.132 18496 2768 1 8 . 1 1 9 9 ILE N N 9 127.619 127.619 126.787 0.832 18496 2769 1 8 . 1 1 9 9 ILE HA H 9 3.768 3.768 4.179 -0.411 18496 2770 1 8 . 1 1 9 9 ILE C C 9 174.902 174.902 175.831 -0.929 18496 2771 1 8 . 1 1 9 9 ILE CA C 9 62.505 62.505 61.819 0.686 18496 2772 1 8 . 1 1 9 9 ILE CB C 9 36.094 36.094 37.498 -1.404 18496 2773 1 8 . 1 1 9 9 ILE H H 9 9.157 9.157 8.579 0.578 18496 2774 1 8 . 1 1 10 10 ILE N N 10 131.245 131.245 128.512 2.733 18496 2775 1 8 . 1 1 10 10 ILE HA H 10 3.861 3.861 4.037 -0.176 18496 2776 1 8 . 1 1 10 10 ILE C C 10 176.247 176.247 176.642 -0.395 18496 2777 1 8 . 1 1 10 10 ILE CA C 10 60.554 60.554 61.907 -1.353 18496 2778 1 8 . 1 1 10 10 ILE CB C 10 37.406 37.406 38.303 -0.897 18496 2779 1 8 . 1 1 10 10 ILE H H 10 8.428 8.428 8.914 -0.486 18496 2780 1 8 . 1 1 11 11 GLU N N 11 117.669 117.669 117.766 -0.097 18496 2781 1 8 . 1 1 11 11 GLU HA H 11 4.315 4.315 4.539 -0.224 18496 2782 1 8 . 1 1 11 11 GLU C C 11 174.155 174.155 174.325 -0.170 18496 2783 1 8 . 1 1 11 11 GLU CA C 11 55.755 55.755 55.363 0.392 18496 2784 1 8 . 1 1 11 11 GLU CB C 11 34.386 34.386 32.611 1.776 18496 2785 1 8 . 1 1 11 11 GLU H H 11 7.551 7.551 7.942 -0.391 18496 2786 1 8 . 1 1 12 12 GLU N N 12 128.587 128.587 125.145 3.442 18496 2787 1 8 . 1 1 12 12 GLU HA H 12 5.214 5.214 4.595 0.619 18496 2788 1 8 . 1 1 12 12 GLU C C 12 176.877 176.877 175.748 1.129 18496 2789 1 8 . 1 1 12 12 GLU CA C 12 54.801 54.801 57.327 -2.526 18496 2790 1 8 . 1 1 12 12 GLU CB C 12 30.137 30.137 30.255 -0.118 18496 2791 1 8 . 1 1 12 12 GLU H H 12 8.762 8.762 8.851 -0.089 18496 2792 1 8 . 1 1 13 13 LEU N N 13 122.508 122.508 124.089 -1.581 18496 2793 1 8 . 1 1 13 13 LEU HA H 13 4.872 4.872 4.491 0.381 18496 2794 1 8 . 1 1 13 13 LEU C C 13 176.060 176.060 176.942 -0.882 18496 2795 1 8 . 1 1 13 13 LEU CA C 13 57.372 57.372 55.691 1.681 18496 2796 1 8 . 1 1 13 13 LEU CB C 13 42.284 42.284 43.152 -0.868 18496 2797 1 8 . 1 1 13 13 LEU H H 13 8.058 8.058 8.584 -0.526 18496 2798 1 8 . 1 1 14 14 ILE N N 14 115.422 115.422 117.734 -2.312 18496 2799 1 8 . 1 1 14 14 ILE HA H 14 4.553 4.553 4.466 0.087 18496 2800 1 8 . 1 1 14 14 ILE C C 14 174.893 174.893 174.165 0.728 18496 2801 1 8 . 1 1 14 14 ILE CA C 14 60.586 60.586 59.616 0.970 18496 2802 1 8 . 1 1 14 14 ILE CB C 14 44.329 44.329 41.406 2.923 18496 2803 1 8 . 1 1 14 14 ILE H H 14 8.450 8.450 8.411 0.039 18496 2804 1 8 . 1 1 15 15 VAL N N 15 129.108 129.108 125.410 3.698 18496 2805 1 8 . 1 1 15 15 VAL HA H 15 4.196 4.196 4.383 -0.187 18496 2806 1 8 . 1 1 15 15 VAL C C 15 175.180 175.180 175.036 0.144 18496 2807 1 8 . 1 1 15 15 VAL CA C 15 63.288 63.288 61.092 2.196 18496 2808 1 8 . 1 1 15 15 VAL CB C 15 32.117 32.117 32.978 -0.861 18496 2809 1 8 . 1 1 15 15 VAL H H 15 8.867 8.867 8.510 0.357 18496 2810 1 8 . 1 1 16 16 LEU N N 16 127.846 127.846 129.393 -1.547 18496 2811 1 8 . 1 1 16 16 LEU HA H 16 4.317 4.317 4.681 -0.364 18496 2812 1 8 . 1 1 16 16 LEU C C 16 176.070 176.070 177.264 -1.194 18496 2813 1 8 . 1 1 16 16 LEU CA C 16 57.252 57.252 56.030 1.222 18496 2814 1 8 . 1 1 16 16 LEU CB C 16 42.035 42.035 42.785 -0.750 18496 2815 1 8 . 1 1 16 16 LEU H H 16 9.555 9.555 8.691 0.864 18496 2816 1 8 . 1 1 17 17 SER N N 17 107.073 107.073 109.636 -2.563 18496 2817 1 8 . 1 1 17 17 SER HA H 17 4.540 4.540 4.600 -0.060 18496 2818 1 8 . 1 1 17 17 SER C C 17 172.277 172.277 172.357 -0.080 18496 2819 1 8 . 1 1 17 17 SER CA C 17 57.882 57.882 58.063 -0.181 18496 2820 1 8 . 1 1 17 17 SER CB C 17 64.046 64.046 64.882 -0.836 18496 2821 1 8 . 1 1 17 17 SER H H 17 7.699 7.699 8.018 -0.319 18496 2822 1 8 . 1 1 18 18 GLU N N 18 119.235 119.235 119.407 -0.172 18496 2823 1 8 . 1 1 18 18 GLU HA H 18 5.143 5.143 5.191 -0.048 18496 2824 1 8 . 1 1 18 18 GLU C C 18 175.469 175.469 176.150 -0.681 18496 2825 1 8 . 1 1 18 18 GLU CA C 18 55.248 55.248 55.074 0.174 18496 2826 1 8 . 1 1 18 18 GLU CB C 18 33.454 33.454 31.945 1.508 18496 2827 1 8 . 1 1 18 18 GLU H H 18 8.437 8.437 8.448 -0.011 18496 2828 1 8 . 1 1 19 19 ASN N N 19 123.988 123.988 121.031 2.957 18496 2829 1 8 . 1 1 19 19 ASN HA H 19 5.097 5.097 4.789 0.308 18496 2830 1 8 . 1 1 19 19 ASN CA C 19 50.916 50.916 53.055 -2.139 18496 2831 1 8 . 1 1 19 19 ASN CB C 19 39.482 39.482 39.086 0.396 18496 2832 1 8 . 1 1 19 19 ASN H H 19 8.779 8.779 8.353 0.426 18496 2833 1 8 . 1 1 20 20 ALA N N 20 120.854 120.854 123.253 -2.399 18496 2834 1 8 . 1 1 20 20 ALA HA H 20 4.239 4.239 4.156 0.083 18496 2835 1 8 . 1 1 20 20 ALA C C 20 179.032 179.032 177.852 1.180 18496 2836 1 8 . 1 1 20 20 ALA CA C 20 54.924 54.924 54.237 0.687 18496 2837 1 8 . 1 1 20 20 ALA CB C 20 18.621 18.621 18.199 0.422 18496 2838 1 8 . 1 1 20 20 ALA H H 20 8.616 8.616 8.509 0.107 18496 2839 1 8 . 1 1 21 21 LYS N N 21 115.771 115.771 116.435 -0.664 18496 2840 1 8 . 1 1 21 21 LYS HA H 21 4.497 4.497 4.215 0.282 18496 2841 1 8 . 1 1 21 21 LYS C C 21 176.615 176.615 176.655 -0.040 18496 2842 1 8 . 1 1 21 21 LYS CA C 21 55.503 55.503 55.660 -0.157 18496 2843 1 8 . 1 1 21 21 LYS CB C 21 32.742 32.742 32.121 0.621 18496 2844 1 8 . 1 1 21 21 LYS H H 21 7.767 7.767 7.827 -0.060 18496 2845 1 8 . 1 1 22 22 GLY N N 22 107.695 107.695 106.828 0.867 18496 2846 1 8 . 1 1 22 22 GLY C C 22 174.843 174.843 173.820 1.023 18496 2847 1 8 . 1 1 22 22 GLY CA C 22 45.297 45.297 45.162 0.135 18496 2848 1 8 . 1 1 22 22 GLY H H 22 8.317 8.317 7.929 0.388 18496 2849 1 8 . 1 1 23 23 TRP N N 23 121.316 121.316 120.987 0.329 18496 2850 1 8 . 1 1 23 23 TRP HA H 23 4.815 4.815 4.847 -0.032 18496 2851 1 8 . 1 1 23 23 TRP C C 23 176.754 176.754 176.322 0.432 18496 2852 1 8 . 1 1 23 23 TRP CA C 23 58.291 58.291 55.013 3.279 18496 2853 1 8 . 1 1 23 23 TRP CB C 23 28.127 28.127 28.117 0.010 18496 2854 1 8 . 1 1 23 23 TRP H H 23 7.983 7.983 7.993 -0.010 18496 2855 1 8 . 1 1 24 24 ARG N N 24 120.789 120.789 126.754 -5.965 18496 2856 1 8 . 1 1 24 24 ARG HA H 24 5.496 5.496 4.864 0.632 18496 2857 1 8 . 1 1 24 24 ARG C C 24 175.831 175.831 176.135 -0.304 18496 2858 1 8 . 1 1 24 24 ARG CA C 24 54.755 54.755 54.645 0.110 18496 2859 1 8 . 1 1 24 24 ARG CB C 24 33.735 33.735 30.119 3.616 18496 2860 1 8 . 1 1 24 24 ARG H H 24 9.046 9.046 9.323 -0.277 18496 2861 1 8 . 1 1 25 25 LYS N N 25 126.507 126.507 129.271 -2.764 18496 2862 1 8 . 1 1 25 25 LYS HA H 25 5.081 5.081 4.833 0.248 18496 2863 1 8 . 1 1 25 25 LYS C C 25 175.648 175.648 175.606 0.042 18496 2864 1 8 . 1 1 25 25 LYS CA C 25 56.071 56.071 56.906 -0.835 18496 2865 1 8 . 1 1 25 25 LYS CB C 25 32.214 32.214 32.886 -0.672 18496 2866 1 8 . 1 1 25 25 LYS H H 25 8.526 8.526 8.605 -0.079 18496 2867 1 8 . 1 1 26 26 GLU N N 26 126.009 126.009 124.046 1.963 18496 2868 1 8 . 1 1 26 26 GLU HA H 26 5.275 5.275 5.090 0.185 18496 2869 1 8 . 1 1 26 26 GLU C C 26 174.894 174.894 174.169 0.725 18496 2870 1 8 . 1 1 26 26 GLU CA C 26 55.271 55.271 55.086 0.185 18496 2871 1 8 . 1 1 26 26 GLU CB C 26 33.781 33.781 34.707 -0.926 18496 2872 1 8 . 1 1 26 26 GLU H H 26 9.125 9.125 8.968 0.157 18496 2873 1 8 . 1 1 27 27 LEU N N 27 121.930 121.930 124.887 -2.957 18496 2874 1 8 . 1 1 27 27 LEU HA H 27 5.788 5.788 4.870 0.918 18496 2875 1 8 . 1 1 27 27 LEU C C 27 173.941 173.941 174.415 -0.474 18496 2876 1 8 . 1 1 27 27 LEU CA C 27 53.859 53.859 53.833 0.027 18496 2877 1 8 . 1 1 27 27 LEU CB C 27 44.020 44.020 44.177 -0.157 18496 2878 1 8 . 1 1 27 27 LEU H H 27 8.938 8.938 9.098 -0.160 18496 2879 1 8 . 1 1 28 28 ASN N N 28 124.630 124.630 125.112 -0.482 18496 2880 1 8 . 1 1 28 28 ASN HA H 28 5.411 5.411 5.222 0.189 18496 2881 1 8 . 1 1 28 28 ASN C C 28 174.366 174.366 173.283 1.083 18496 2882 1 8 . 1 1 28 28 ASN CA C 28 52.063 52.063 52.242 -0.179 18496 2883 1 8 . 1 1 28 28 ASN CB C 28 44.430 44.430 43.355 1.075 18496 2884 1 8 . 1 1 28 28 ASN H H 28 9.345 9.345 8.246 1.099 18496 2885 1 8 . 1 1 29 29 ARG N N 29 118.443 118.443 122.687 -4.244 18496 2886 1 8 . 1 1 29 29 ARG HA H 29 5.058 5.058 4.838 0.221 18496 2887 1 8 . 1 1 29 29 ARG C C 29 175.779 175.779 174.581 1.198 18496 2888 1 8 . 1 1 29 29 ARG CA C 29 56.091 56.091 55.801 0.290 18496 2889 1 8 . 1 1 29 29 ARG CB C 29 31.710 31.710 31.181 0.529 18496 2890 1 8 . 1 1 29 29 ARG H H 29 9.109 9.109 9.089 0.020 18496 2891 1 8 . 1 1 30 30 VAL N N 30 124.605 124.605 122.601 2.004 18496 2892 1 8 . 1 1 30 30 VAL HA H 30 4.535 4.535 5.411 -0.876 18496 2893 1 8 . 1 1 30 30 VAL C C 30 174.775 174.775 174.330 0.445 18496 2894 1 8 . 1 1 30 30 VAL CA C 30 60.921 60.921 58.791 2.130 18496 2895 1 8 . 1 1 30 30 VAL CB C 30 37.790 37.790 36.078 1.712 18496 2896 1 8 . 1 1 30 30 VAL H H 30 9.054 9.054 8.618 0.436 18496 2897 1 8 . 1 1 31 31 SER N N 31 120.794 120.794 115.456 5.338 18496 2898 1 8 . 1 1 31 31 SER HA H 31 4.652 4.652 5.061 -0.408 18496 2899 1 8 . 1 1 31 31 SER C C 31 174.214 174.214 175.426 -1.212 18496 2900 1 8 . 1 1 31 31 SER CA C 31 56.279 56.279 57.083 -0.804 18496 2901 1 8 . 1 1 31 31 SER CB C 31 64.128 64.128 64.007 0.121 18496 2902 1 8 . 1 1 31 31 SER H H 31 8.667 8.667 8.786 -0.119 18496 2903 1 8 . 1 1 32 32 TRP N N 32 132.303 132.303 128.130 4.173 18496 2904 1 8 . 1 1 32 32 TRP HA H 32 5.105 5.105 4.534 0.571 18496 2905 1 8 . 1 1 32 32 TRP C C 32 177.276 177.276 177.154 0.122 18496 2906 1 8 . 1 1 32 32 TRP CA C 32 56.198 56.198 58.293 -2.095 18496 2907 1 8 . 1 1 32 32 TRP CB C 32 29.968 29.968 28.036 1.932 18496 2908 1 8 . 1 1 32 32 TRP H H 32 9.282 9.282 9.296 -0.014 18496 2909 1 8 . 1 1 33 33 ASN N N 33 124.979 124.979 123.269 1.710 18496 2910 1 8 . 1 1 33 33 ASN HA H 33 4.257 4.257 4.402 -0.145 18496 2911 1 8 . 1 1 33 33 ASN C C 33 174.030 174.030 174.783 -0.753 18496 2912 1 8 . 1 1 33 33 ASN CA C 33 54.709 54.709 54.773 -0.064 18496 2913 1 8 . 1 1 33 33 ASN CB C 33 37.921 37.921 36.971 0.950 18496 2914 1 8 . 1 1 33 33 ASN H H 33 9.813 9.813 8.824 0.989 18496 2915 1 8 . 1 1 34 34 ASP N N 34 111.880 111.880 114.455 -2.575 18496 2916 1 8 . 1 1 34 34 ASP HA H 34 4.126 4.126 4.242 -0.116 18496 2917 1 8 . 1 1 34 34 ASP CA C 34 56.130 56.130 55.727 0.403 18496 2918 1 8 . 1 1 34 34 ASP CB C 34 39.760 39.760 40.097 -0.337 18496 2919 1 8 . 1 1 34 34 ASP H H 34 9.251 9.251 8.329 0.922 18496 2920 1 8 . 1 1 35 35 ALA N N 35 121.811 121.811 119.741 2.070 18496 2921 1 8 . 1 1 35 35 ALA HA H 35 4.477 4.477 4.507 -0.030 18496 2922 1 8 . 1 1 35 35 ALA C C 35 177.778 177.778 177.069 0.709 18496 2923 1 8 . 1 1 35 35 ALA CA C 35 51.528 51.528 52.531 -1.003 18496 2924 1 8 . 1 1 35 35 ALA CB C 35 20.445 20.445 20.961 -0.516 18496 2925 1 8 . 1 1 35 35 ALA H H 35 7.625 7.625 7.812 -0.187 18496 2926 1 8 . 1 1 36 36 GLU N N 36 121.068 121.068 121.426 -0.358 18496 2927 1 8 . 1 1 36 36 GLU HA H 36 4.390 4.390 4.722 -0.332 18496 2928 1 8 . 1 1 36 36 GLU CA C 36 55.276 55.276 52.476 2.800 18496 2929 1 8 . 1 1 36 36 GLU CB C 36 28.575 28.575 30.489 -1.914 18496 2930 1 8 . 1 1 36 36 GLU H H 36 8.658 8.658 8.062 0.596 18496 2931 1 8 . 1 1 37 37 PRO HA H 37 4.289 4.289 4.692 -0.403 18496 2932 1 8 . 1 1 37 37 PRO C C 37 175.799 175.799 175.870 -0.071 18496 2933 1 8 . 1 1 37 37 PRO CA C 37 63.105 63.105 62.528 0.577 18496 2934 1 8 . 1 1 37 37 PRO CB C 37 32.076 32.076 31.871 0.205 18496 2935 1 8 . 1 1 38 38 LYS N N 38 120.881 120.881 123.590 -2.709 18496 2936 1 8 . 1 1 38 38 LYS HA H 38 4.700 4.700 4.367 0.333 18496 2937 1 8 . 1 1 38 38 LYS C C 38 176.906 176.906 174.596 2.310 18496 2938 1 8 . 1 1 38 38 LYS CA C 38 54.399 54.399 54.980 -0.581 18496 2939 1 8 . 1 1 38 38 LYS CB C 38 37.217 37.217 36.617 0.600 18496 2940 1 8 . 1 1 38 38 LYS H H 38 8.316 8.316 8.834 -0.518 18496 2941 1 8 . 1 1 39 39 TYR N N 39 119.792 119.792 118.451 1.341 18496 2942 1 8 . 1 1 39 39 TYR HA H 39 4.636 4.636 4.650 -0.014 18496 2943 1 8 . 1 1 39 39 TYR C C 39 175.834 175.834 174.951 0.883 18496 2944 1 8 . 1 1 39 39 TYR CA C 39 60.228 60.228 57.297 2.931 18496 2945 1 8 . 1 1 39 39 TYR CB C 39 38.683 38.683 39.145 -0.462 18496 2946 1 8 . 1 1 39 39 TYR H H 39 8.508 8.508 7.862 0.646 18496 2947 1 8 . 1 1 40 40 ASP N N 40 126.502 126.502 122.556 3.946 18496 2948 1 8 . 1 1 40 40 ASP HA H 40 5.597 5.597 5.316 0.281 18496 2949 1 8 . 1 1 40 40 ASP C C 40 175.283 175.283 174.005 1.278 18496 2950 1 8 . 1 1 40 40 ASP CA C 40 55.053 55.053 53.798 1.255 18496 2951 1 8 . 1 1 40 40 ASP CB C 40 48.656 48.656 45.477 3.179 18496 2952 1 8 . 1 1 40 40 ASP H H 40 9.219 9.219 8.445 0.774 18496 2953 1 8 . 1 1 41 41 ILE N N 41 125.910 125.910 124.659 1.251 18496 2954 1 8 . 1 1 41 41 ILE HA H 41 5.722 5.722 4.941 0.781 18496 2955 1 8 . 1 1 41 41 ILE C C 41 174.167 174.167 173.592 0.575 18496 2956 1 8 . 1 1 41 41 ILE CA C 41 60.734 60.734 59.774 0.960 18496 2957 1 8 . 1 1 41 41 ILE CB C 41 40.198 40.198 39.984 0.214 18496 2958 1 8 . 1 1 41 41 ILE H H 41 8.972 8.972 8.714 0.258 18496 2959 1 8 . 1 1 42 42 ARG N N 42 120.300 120.300 126.903 -6.603 18496 2960 1 8 . 1 1 42 42 ARG HA H 42 4.716 4.716 4.747 -0.031 18496 2961 1 8 . 1 1 42 42 ARG CA C 42 54.826 54.826 55.006 -0.180 18496 2962 1 8 . 1 1 42 42 ARG CB C 42 32.665 32.665 35.162 -2.497 18496 2963 1 8 . 1 1 42 42 ARG H H 42 8.320 8.320 8.566 -0.246 18496 2964 1 8 . 1 1 43 43 THR HA H 43 5.585 5.585 5.382 0.203 18496 2965 1 8 . 1 1 43 43 THR C C 43 173.294 173.294 172.974 0.320 18496 2966 1 8 . 1 1 43 43 THR CA C 43 60.847 60.847 59.802 1.045 18496 2967 1 8 . 1 1 43 43 THR CB C 43 69.961 69.961 70.806 -0.845 18496 2968 1 8 . 1 1 44 44 TRP N N 44 122.747 122.747 123.749 -1.002 18496 2969 1 8 . 1 1 44 44 TRP HA H 44 4.945 4.945 4.769 0.176 18496 2970 1 8 . 1 1 44 44 TRP C C 44 175.056 175.056 176.158 -1.102 18496 2971 1 8 . 1 1 44 44 TRP CA C 44 56.107 56.107 55.653 0.454 18496 2972 1 8 . 1 1 44 44 TRP CB C 44 34.506 34.506 32.408 2.098 18496 2973 1 8 . 1 1 44 44 TRP H H 44 9.180 9.180 8.764 0.416 18496 2974 1 8 . 1 1 45 45 SER N N 45 117.385 117.385 116.783 0.602 18496 2975 1 8 . 1 1 45 45 SER HA H 45 2.300 2.300 4.720 -2.420 18496 2976 1 8 . 1 1 45 45 SER CA C 45 56.481 56.481 56.870 -0.389 18496 2977 1 8 . 1 1 45 45 SER CB C 45 60.743 60.743 61.834 -1.091 18496 2978 1 8 . 1 1 45 45 SER H H 45 7.879 7.879 8.502 -0.623 18496 2979 1 8 . 1 1 46 46 PRO HA H 46 4.104 4.104 4.409 -0.305 18496 2980 1 8 . 1 1 46 46 PRO CA C 46 64.990 64.990 65.119 -0.129 18496 2981 1 8 . 1 1 46 46 PRO CB C 46 31.272 31.272 32.099 -0.827 18496 2982 1 8 . 1 1 47 47 ASP HA H 47 4.520 4.520 4.650 -0.130 18496 2983 1 8 . 1 1 47 47 ASP C C 47 175.629 175.629 176.235 -0.606 18496 2984 1 8 . 1 1 47 47 ASP CA C 47 53.453 53.453 53.156 0.297 18496 2985 1 8 . 1 1 47 47 ASP CB C 47 40.239 40.239 41.130 -0.891 18496 2986 1 8 . 1 1 48 48 HIS N N 48 111.320 111.320 115.127 -3.807 18496 2987 1 8 . 1 1 48 48 HIS HA H 48 3.916 3.916 4.493 -0.577 18496 2988 1 8 . 1 1 48 48 HIS CA C 48 60.347 60.347 57.782 2.565 18496 2989 1 8 . 1 1 48 48 HIS CB C 48 25.499 25.499 28.360 -2.861 18496 2990 1 8 . 1 1 48 48 HIS H H 48 8.269 8.269 8.085 0.184 18496 2991 1 8 . 1 1 49 49 GLU N N 49 114.659 114.659 114.535 0.124 18496 2992 1 8 . 1 1 49 49 GLU HA H 49 4.447 4.447 4.334 0.113 18496 2993 1 8 . 1 1 49 49 GLU C C 49 176.394 176.394 176.678 -0.284 18496 2994 1 8 . 1 1 49 49 GLU CA C 49 57.940 57.940 58.000 -0.060 18496 2995 1 8 . 1 1 49 49 GLU CB C 49 30.641 30.641 30.389 0.252 18496 2996 1 8 . 1 1 49 49 GLU H H 49 7.381 7.381 8.730 -1.349 18496 2997 1 8 . 1 1 50 50 LYS N N 50 118.126 118.126 117.528 0.598 18496 2998 1 8 . 1 1 50 50 LYS HA H 50 4.665 4.665 4.599 0.066 18496 2999 1 8 . 1 1 50 50 LYS CA C 50 54.431 54.431 54.800 -0.369 18496 3000 1 8 . 1 1 50 50 LYS CB C 50 36.543 36.543 36.363 0.180 18496 3001 1 8 . 1 1 50 50 LYS H H 50 8.067 8.067 7.719 0.348 18496 3002 1 8 . 1 1 51 51 MET HA H 51 4.936 4.936 4.552 0.384 18496 3003 1 8 . 1 1 51 51 MET CA C 51 54.048 54.048 52.606 1.442 18496 3004 1 8 . 1 1 51 51 MET CB C 51 33.768 33.768 35.121 -1.353 18496 3005 1 8 . 1 1 52 52 GLY C C 52 173.534 173.534 172.084 1.450 18496 3006 1 8 . 1 1 52 52 GLY CA C 52 43.060 43.060 44.490 -1.430 18496 3007 1 8 . 1 1 53 53 LYS N N 53 118.012 118.012 119.967 -1.955 18496 3008 1 8 . 1 1 53 53 LYS HA H 53 4.155 4.155 4.476 -0.321 18496 3009 1 8 . 1 1 53 53 LYS C C 53 176.818 176.818 176.099 0.719 18496 3010 1 8 . 1 1 53 53 LYS CA C 53 56.478 56.478 56.166 0.312 18496 3011 1 8 . 1 1 53 53 LYS CB C 53 33.117 33.117 33.264 -0.147 18496 3012 1 8 . 1 1 53 53 LYS H H 53 8.132 8.132 8.211 -0.079 18496 3013 1 8 . 1 1 54 54 GLY N N 54 109.836 109.836 109.037 0.799 18496 3014 1 8 . 1 1 54 54 GLY C C 54 170.848 170.848 172.877 -2.029 18496 3015 1 8 . 1 1 54 54 GLY CA C 54 46.701 46.701 44.798 1.903 18496 3016 1 8 . 1 1 54 54 GLY H H 54 8.079 8.079 8.231 -0.152 18496 3017 1 8 . 1 1 55 55 ILE N N 55 119.382 119.382 121.980 -2.598 18496 3018 1 8 . 1 1 55 55 ILE HA H 55 4.956 4.956 4.574 0.382 18496 3019 1 8 . 1 1 55 55 ILE C C 55 171.737 171.737 173.596 -1.859 18496 3020 1 8 . 1 1 55 55 ILE CA C 55 57.059 57.059 60.698 -3.639 18496 3021 1 8 . 1 1 55 55 ILE CB C 55 44.241 44.241 41.577 2.664 18496 3022 1 8 . 1 1 55 55 ILE H H 55 8.661 8.661 8.356 0.305 18496 3023 1 8 . 1 1 56 56 THR N N 56 113.795 113.795 122.660 -8.865 18496 3024 1 8 . 1 1 56 56 THR HA H 56 5.607 5.607 4.881 0.726 18496 3025 1 8 . 1 1 56 56 THR C C 56 174.417 174.417 173.725 0.692 18496 3026 1 8 . 1 1 56 56 THR CA C 56 59.098 59.098 61.717 -2.619 18496 3027 1 8 . 1 1 56 56 THR CB C 56 72.153 72.153 69.980 2.173 18496 3028 1 8 . 1 1 56 56 THR H H 56 7.916 7.916 8.453 -0.537 18496 3029 1 8 . 1 1 57 57 LEU N N 57 121.044 121.044 127.739 -6.695 18496 3030 1 8 . 1 1 57 57 LEU HA H 57 5.311 5.311 4.990 0.321 18496 3031 1 8 . 1 1 57 57 LEU C C 57 176.150 176.150 175.552 0.598 18496 3032 1 8 . 1 1 57 57 LEU CA C 57 53.264 53.264 53.615 -0.351 18496 3033 1 8 . 1 1 57 57 LEU CB C 57 45.901 45.901 44.848 1.053 18496 3034 1 8 . 1 1 57 57 LEU H H 57 9.421 9.421 9.039 0.382 18496 3035 1 8 . 1 1 58 58 SER N N 58 119.548 119.548 117.648 1.900 18496 3036 1 8 . 1 1 58 58 SER HA H 58 4.734 4.734 4.488 0.246 18496 3037 1 8 . 1 1 58 58 SER C C 58 174.786 174.786 175.776 -0.990 18496 3038 1 8 . 1 1 58 58 SER CA C 58 56.948 56.948 56.577 0.371 18496 3039 1 8 . 1 1 58 58 SER CB C 58 65.726 65.726 64.710 1.016 18496 3040 1 8 . 1 1 58 58 SER H H 58 9.771 9.771 9.476 0.295 18496 3041 1 8 . 1 1 59 59 GLU N N 59 120.827 120.827 122.914 -2.087 18496 3042 1 8 . 1 1 59 59 GLU HA H 59 4.319 4.319 4.256 0.063 18496 3043 1 8 . 1 1 59 59 GLU C C 59 179.806 179.806 178.597 1.209 18496 3044 1 8 . 1 1 59 59 GLU CA C 59 60.913 60.913 60.483 0.430 18496 3045 1 8 . 1 1 59 59 GLU CB C 59 29.538 29.538 29.682 -0.144 18496 3046 1 8 . 1 1 59 59 GLU H H 59 9.394 9.394 9.128 0.266 18496 3047 1 8 . 1 1 60 60 GLU N N 60 119.587 119.587 118.580 1.007 18496 3048 1 8 . 1 1 60 60 GLU HA H 60 4.188 4.188 4.104 0.084 18496 3049 1 8 . 1 1 60 60 GLU C C 60 179.686 179.686 178.825 0.861 18496 3050 1 8 . 1 1 60 60 GLU CA C 60 60.279 60.279 59.497 0.782 18496 3051 1 8 . 1 1 60 60 GLU CB C 60 29.559 29.559 28.702 0.857 18496 3052 1 8 . 1 1 60 60 GLU H H 60 8.905 8.905 8.857 0.048 18496 3053 1 8 . 1 1 61 61 GLU N N 61 120.145 120.145 120.183 -0.038 18496 3054 1 8 . 1 1 61 61 GLU HA H 61 4.037 4.037 4.095 -0.058 18496 3055 1 8 . 1 1 61 61 GLU C C 61 178.530 178.530 178.847 -0.317 18496 3056 1 8 . 1 1 61 61 GLU CA C 61 59.118 59.118 58.910 0.208 18496 3057 1 8 . 1 1 61 61 GLU CB C 61 30.976 30.976 29.343 1.633 18496 3058 1 8 . 1 1 61 61 GLU H H 61 8.013 8.013 8.330 -0.317 18496 3059 1 8 . 1 1 62 62 PHE N N 62 119.925 119.925 120.534 -0.609 18496 3060 1 8 . 1 1 62 62 PHE HA H 62 3.927 3.927 4.058 -0.131 18496 3061 1 8 . 1 1 62 62 PHE C C 62 176.783 176.783 177.601 -0.818 18496 3062 1 8 . 1 1 62 62 PHE CA C 62 61.827 61.827 61.340 0.487 18496 3063 1 8 . 1 1 62 62 PHE CB C 62 40.216 40.216 38.852 1.364 18496 3064 1 8 . 1 1 62 62 PHE H H 62 9.192 9.192 8.875 0.317 18496 3065 1 8 . 1 1 63 63 GLY N N 63 104.854 104.854 107.253 -2.399 18496 3066 1 8 . 1 1 63 63 GLY C C 63 176.854 176.854 175.900 0.954 18496 3067 1 8 . 1 1 63 63 GLY CA C 63 47.178 47.178 47.368 -0.190 18496 3068 1 8 . 1 1 63 63 GLY H H 63 8.316 8.316 8.392 -0.076 18496 3069 1 8 . 1 1 64 64 VAL N N 64 123.719 123.719 123.235 0.484 18496 3070 1 8 . 1 1 64 64 VAL HA H 64 3.663 3.663 3.593 0.070 18496 3071 1 8 . 1 1 64 64 VAL C C 64 177.644 177.644 177.564 0.080 18496 3072 1 8 . 1 1 64 64 VAL CA C 64 67.090 67.090 66.167 0.923 18496 3073 1 8 . 1 1 64 64 VAL CB C 64 31.367 31.367 31.739 -0.372 18496 3074 1 8 . 1 1 64 64 VAL H H 64 7.759 7.759 7.599 0.160 18496 3075 1 8 . 1 1 65 65 LEU N N 65 120.099 120.099 120.967 -0.868 18496 3076 1 8 . 1 1 65 65 LEU HA H 65 3.672 3.672 3.896 -0.224 18496 3077 1 8 . 1 1 65 65 LEU C C 65 177.636 177.636 178.363 -0.727 18496 3078 1 8 . 1 1 65 65 LEU CA C 65 58.552 58.552 58.427 0.125 18496 3079 1 8 . 1 1 65 65 LEU CB C 65 41.358 41.358 41.711 -0.353 18496 3080 1 8 . 1 1 65 65 LEU H H 65 7.660 7.660 8.055 -0.395 18496 3081 1 8 . 1 1 66 66 LEU N N 66 115.733 115.733 118.072 -2.339 18496 3082 1 8 . 1 1 66 66 LEU HA H 66 3.556 3.556 3.621 -0.065 18496 3083 1 8 . 1 1 66 66 LEU C C 66 179.729 179.729 178.779 0.950 18496 3084 1 8 . 1 1 66 66 LEU CA C 66 58.069 58.069 58.059 0.010 18496 3085 1 8 . 1 1 66 66 LEU CB C 66 41.625 41.625 40.961 0.664 18496 3086 1 8 . 1 1 66 66 LEU H H 66 8.083 8.083 8.101 -0.018 18496 3087 1 8 . 1 1 67 67 LYS N N 67 119.120 119.120 119.942 -0.822 18496 3088 1 8 . 1 1 67 67 LYS HA H 67 3.965 3.965 3.793 0.172 18496 3089 1 8 . 1 1 67 67 LYS C C 67 179.379 179.379 178.922 0.457 18496 3090 1 8 . 1 1 67 67 LYS CA C 67 59.227 59.227 59.822 -0.595 18496 3091 1 8 . 1 1 67 67 LYS CB C 67 32.737 32.737 32.215 0.522 18496 3092 1 8 . 1 1 67 67 LYS H H 67 7.861 7.861 7.958 -0.097 18496 3093 1 8 . 1 1 68 68 GLU N N 68 116.924 116.924 118.759 -1.835 18496 3094 1 8 . 1 1 68 68 GLU HA H 68 4.409 4.409 4.047 0.362 18496 3095 1 8 . 1 1 68 68 GLU CA C 68 57.712 57.712 58.955 -1.243 18496 3096 1 8 . 1 1 68 68 GLU CB C 68 29.586 29.586 29.426 0.160 18496 3097 1 8 . 1 1 68 68 GLU H H 68 8.319 8.319 7.901 0.418 18496 3098 1 8 . 1 1 69 69 LEU N N 69 120.032 120.032 119.835 0.197 18496 3099 1 8 . 1 1 69 69 LEU HA H 69 4.107 4.107 3.940 0.167 18496 3100 1 8 . 1 1 69 69 LEU CA C 69 57.563 57.563 57.453 0.110 18496 3101 1 8 . 1 1 69 69 LEU CB C 69 41.373 41.373 41.504 -0.131 18496 3102 1 8 . 1 1 69 69 LEU H H 69 8.233 8.233 8.355 -0.122 18496 3103 1 8 . 1 1 70 70 GLY N N 70 105.472 105.472 105.459 0.013 18496 3104 1 8 . 1 1 70 70 GLY C C 70 174.986 174.986 176.333 -1.347 18496 3105 1 8 . 1 1 70 70 GLY CA C 70 46.704 46.704 46.744 -0.040 18496 3106 1 8 . 1 1 70 70 GLY H H 70 7.960 7.960 8.565 -0.605 18496 3107 1 8 . 1 1 71 71 ASN N N 71 118.596 118.596 119.994 -1.398 18496 3108 1 8 . 1 1 71 71 ASN HA H 71 4.681 4.681 4.802 -0.121 18496 3109 1 8 . 1 1 71 71 ASN C C 71 176.412 176.412 177.896 -1.484 18496 3110 1 8 . 1 1 71 71 ASN CA C 71 54.407 54.407 55.417 -1.010 18496 3111 1 8 . 1 1 71 71 ASN CB C 71 38.729 38.729 38.561 0.168 18496 3112 1 8 . 1 1 71 71 ASN H H 71 7.857 7.857 7.874 -0.017 18496 3113 1 8 . 1 1 72 72 LYS N N 72 119.973 119.973 120.317 -0.344 18496 3114 1 8 . 1 1 72 72 LYS HA H 72 4.282 4.282 4.141 0.141 18496 3115 1 8 . 1 1 72 72 LYS CA C 72 57.338 57.338 58.102 -0.764 18496 3116 1 8 . 1 1 72 72 LYS CB C 72 32.755 32.755 32.068 0.687 18496 3117 1 8 . 1 1 72 72 LYS H H 72 8.100 8.100 7.872 0.228 18496 3118 1 8 . 1 1 73 73 LEU HA H 73 4.281 4.281 4.351 -0.070 18496 3119 1 8 . 1 1 73 73 LEU CA C 73 55.774 55.774 54.560 1.214 18496 3120 1 8 . 1 1 73 73 LEU CB C 73 41.983 41.983 42.168 -0.185 18496 3121 1 9 . 1 1 2 2 ALA HA H 2 4.074 4.074 4.582 -0.508 18496 3122 1 9 . 1 1 2 2 ALA CA C 2 51.966 51.966 51.594 0.372 18496 3123 1 9 . 1 1 2 2 ALA CB C 2 19.732 19.732 20.206 -0.474 18496 3124 1 9 . 1 1 3 3 ASP HA H 3 4.632 4.632 4.423 0.209 18496 3125 1 9 . 1 1 3 3 ASP C C 3 175.822 175.822 176.318 -0.496 18496 3126 1 9 . 1 1 3 3 ASP CA C 3 54.440 54.440 55.589 -1.149 18496 3127 1 9 . 1 1 3 3 ASP CB C 3 41.577 41.577 41.341 0.236 18496 3128 1 9 . 1 1 4 4 LYS N N 4 121.655 121.655 119.552 2.103 18496 3129 1 9 . 1 1 4 4 LYS HA H 4 4.379 4.379 4.524 -0.145 18496 3130 1 9 . 1 1 4 4 LYS C C 4 176.011 176.011 175.409 0.602 18496 3131 1 9 . 1 1 4 4 LYS CA C 4 56.213 56.213 55.174 1.039 18496 3132 1 9 . 1 1 4 4 LYS CB C 4 33.407 33.407 31.669 1.738 18496 3133 1 9 . 1 1 4 4 LYS H H 4 8.394 8.394 7.942 0.452 18496 3134 1 9 . 1 1 5 5 LEU N N 5 125.369 125.369 124.875 0.494 18496 3135 1 9 . 1 1 5 5 LEU HA H 5 4.351 4.351 4.346 0.005 18496 3136 1 9 . 1 1 5 5 LEU C C 5 175.682 175.682 176.711 -1.029 18496 3137 1 9 . 1 1 5 5 LEU CA C 5 55.117 55.117 54.792 0.325 18496 3138 1 9 . 1 1 5 5 LEU CB C 5 43.197 43.197 42.872 0.325 18496 3139 1 9 . 1 1 5 5 LEU H H 5 8.136 8.136 8.211 -0.075 18496 3140 1 9 . 1 1 6 6 LYS N N 6 126.844 126.844 126.019 0.825 18496 3141 1 9 . 1 1 6 6 LYS HA H 6 4.451 4.451 4.520 -0.069 18496 3142 1 9 . 1 1 6 6 LYS C C 6 174.665 174.665 175.429 -0.764 18496 3143 1 9 . 1 1 6 6 LYS CA C 6 55.974 55.974 56.331 -0.357 18496 3144 1 9 . 1 1 6 6 LYS CB C 6 34.386 34.386 33.333 1.054 18496 3145 1 9 . 1 1 6 6 LYS H H 6 8.615 8.615 8.579 0.036 18496 3146 1 9 . 1 1 7 7 PHE N N 7 119.818 119.818 119.204 0.614 18496 3147 1 9 . 1 1 7 7 PHE HA H 7 5.343 5.343 5.485 -0.142 18496 3148 1 9 . 1 1 7 7 PHE C C 7 173.569 173.569 173.731 -0.162 18496 3149 1 9 . 1 1 7 7 PHE CA C 7 55.813 55.813 55.749 0.064 18496 3150 1 9 . 1 1 7 7 PHE CB C 7 42.975 42.975 42.436 0.539 18496 3151 1 9 . 1 1 7 7 PHE H H 7 7.734 7.734 8.242 -0.508 18496 3152 1 9 . 1 1 8 8 GLU N N 8 119.165 119.165 119.272 -0.107 18496 3153 1 9 . 1 1 8 8 GLU HA H 8 4.158 4.158 4.232 -0.074 18496 3154 1 9 . 1 1 8 8 GLU C C 8 175.026 175.026 174.261 0.765 18496 3155 1 9 . 1 1 8 8 GLU CA C 8 55.221 55.221 54.717 0.504 18496 3156 1 9 . 1 1 8 8 GLU CB C 8 33.699 33.699 32.731 0.968 18496 3157 1 9 . 1 1 8 8 GLU H H 8 8.295 8.295 8.769 -0.474 18496 3158 1 9 . 1 1 9 9 ILE N N 9 127.619 127.619 127.744 -0.125 18496 3159 1 9 . 1 1 9 9 ILE HA H 9 3.768 3.768 4.172 -0.404 18496 3160 1 9 . 1 1 9 9 ILE C C 9 174.902 174.902 175.818 -0.916 18496 3161 1 9 . 1 1 9 9 ILE CA C 9 62.505 62.505 62.598 -0.093 18496 3162 1 9 . 1 1 9 9 ILE CB C 9 36.094 36.094 37.894 -1.800 18496 3163 1 9 . 1 1 9 9 ILE H H 9 9.157 9.157 8.672 0.485 18496 3164 1 9 . 1 1 10 10 ILE N N 10 131.245 131.245 128.687 2.558 18496 3165 1 9 . 1 1 10 10 ILE HA H 10 3.861 3.861 4.193 -0.332 18496 3166 1 9 . 1 1 10 10 ILE C C 10 176.247 176.247 176.251 -0.004 18496 3167 1 9 . 1 1 10 10 ILE CA C 10 60.554 60.554 62.501 -1.947 18496 3168 1 9 . 1 1 10 10 ILE CB C 10 37.406 37.406 38.799 -1.393 18496 3169 1 9 . 1 1 10 10 ILE H H 10 8.428 8.428 8.887 -0.459 18496 3170 1 9 . 1 1 11 11 GLU N N 11 117.669 117.669 118.772 -1.103 18496 3171 1 9 . 1 1 11 11 GLU HA H 11 4.315 4.315 4.513 -0.198 18496 3172 1 9 . 1 1 11 11 GLU C C 11 174.155 174.155 174.639 -0.484 18496 3173 1 9 . 1 1 11 11 GLU CA C 11 55.755 55.755 55.440 0.315 18496 3174 1 9 . 1 1 11 11 GLU CB C 11 34.386 34.386 32.916 1.470 18496 3175 1 9 . 1 1 11 11 GLU H H 11 7.551 7.551 7.845 -0.294 18496 3176 1 9 . 1 1 12 12 GLU N N 12 128.587 128.587 125.341 3.246 18496 3177 1 9 . 1 1 12 12 GLU HA H 12 5.214 5.214 4.444 0.770 18496 3178 1 9 . 1 1 12 12 GLU C C 12 176.877 176.877 175.960 0.917 18496 3179 1 9 . 1 1 12 12 GLU CA C 12 54.801 54.801 57.189 -2.388 18496 3180 1 9 . 1 1 12 12 GLU CB C 12 30.137 30.137 30.027 0.110 18496 3181 1 9 . 1 1 12 12 GLU H H 12 8.762 8.762 8.826 -0.064 18496 3182 1 9 . 1 1 13 13 LEU N N 13 122.508 122.508 121.772 0.736 18496 3183 1 9 . 1 1 13 13 LEU HA H 13 4.872 4.872 4.535 0.337 18496 3184 1 9 . 1 1 13 13 LEU C C 13 176.060 176.060 176.944 -0.884 18496 3185 1 9 . 1 1 13 13 LEU CA C 13 57.372 57.372 55.352 2.020 18496 3186 1 9 . 1 1 13 13 LEU CB C 13 42.284 42.284 43.627 -1.343 18496 3187 1 9 . 1 1 13 13 LEU H H 13 8.058 8.058 8.505 -0.447 18496 3188 1 9 . 1 1 14 14 ILE N N 14 115.422 115.422 118.111 -2.689 18496 3189 1 9 . 1 1 14 14 ILE HA H 14 4.553 4.553 4.484 0.069 18496 3190 1 9 . 1 1 14 14 ILE C C 14 174.893 174.893 174.172 0.721 18496 3191 1 9 . 1 1 14 14 ILE CA C 14 60.586 60.586 59.643 0.943 18496 3192 1 9 . 1 1 14 14 ILE CB C 14 44.329 44.329 41.505 2.824 18496 3193 1 9 . 1 1 14 14 ILE H H 14 8.450 8.450 8.387 0.063 18496 3194 1 9 . 1 1 15 15 VAL N N 15 129.108 129.108 125.886 3.222 18496 3195 1 9 . 1 1 15 15 VAL HA H 15 4.196 4.196 4.453 -0.257 18496 3196 1 9 . 1 1 15 15 VAL C C 15 175.180 175.180 175.152 0.028 18496 3197 1 9 . 1 1 15 15 VAL CA C 15 63.288 63.288 61.044 2.244 18496 3198 1 9 . 1 1 15 15 VAL CB C 15 32.117 32.117 32.913 -0.796 18496 3199 1 9 . 1 1 15 15 VAL H H 15 8.867 8.867 8.498 0.369 18496 3200 1 9 . 1 1 16 16 LEU N N 16 127.846 127.846 129.595 -1.749 18496 3201 1 9 . 1 1 16 16 LEU HA H 16 4.317 4.317 4.632 -0.315 18496 3202 1 9 . 1 1 16 16 LEU C C 16 176.070 176.070 177.303 -1.233 18496 3203 1 9 . 1 1 16 16 LEU CA C 16 57.252 57.252 56.310 0.942 18496 3204 1 9 . 1 1 16 16 LEU CB C 16 42.035 42.035 42.708 -0.673 18496 3205 1 9 . 1 1 16 16 LEU H H 16 9.555 9.555 8.706 0.849 18496 3206 1 9 . 1 1 17 17 SER N N 17 107.073 107.073 110.312 -3.239 18496 3207 1 9 . 1 1 17 17 SER HA H 17 4.540 4.540 4.602 -0.062 18496 3208 1 9 . 1 1 17 17 SER C C 17 172.277 172.277 172.212 0.065 18496 3209 1 9 . 1 1 17 17 SER CA C 17 57.882 57.882 58.128 -0.246 18496 3210 1 9 . 1 1 17 17 SER CB C 17 64.046 64.046 65.031 -0.985 18496 3211 1 9 . 1 1 17 17 SER H H 17 7.699 7.699 7.858 -0.159 18496 3212 1 9 . 1 1 18 18 GLU N N 18 119.235 119.235 119.560 -0.325 18496 3213 1 9 . 1 1 18 18 GLU HA H 18 5.143 5.143 5.117 0.026 18496 3214 1 9 . 1 1 18 18 GLU C C 18 175.469 175.469 176.312 -0.843 18496 3215 1 9 . 1 1 18 18 GLU CA C 18 55.248 55.248 55.153 0.095 18496 3216 1 9 . 1 1 18 18 GLU CB C 18 33.454 33.454 31.445 2.009 18496 3217 1 9 . 1 1 18 18 GLU H H 18 8.437 8.437 8.471 -0.034 18496 3218 1 9 . 1 1 19 19 ASN N N 19 123.988 123.988 121.502 2.486 18496 3219 1 9 . 1 1 19 19 ASN HA H 19 5.097 5.097 4.798 0.299 18496 3220 1 9 . 1 1 19 19 ASN CA C 19 50.916 50.916 53.048 -2.132 18496 3221 1 9 . 1 1 19 19 ASN CB C 19 39.482 39.482 39.070 0.412 18496 3222 1 9 . 1 1 19 19 ASN H H 19 8.779 8.779 8.363 0.416 18496 3223 1 9 . 1 1 20 20 ALA N N 20 120.854 120.854 122.357 -1.503 18496 3224 1 9 . 1 1 20 20 ALA HA H 20 4.239 4.239 4.127 0.112 18496 3225 1 9 . 1 1 20 20 ALA C C 20 179.032 179.032 177.989 1.043 18496 3226 1 9 . 1 1 20 20 ALA CA C 20 54.924 54.924 54.388 0.536 18496 3227 1 9 . 1 1 20 20 ALA CB C 20 18.621 18.621 18.511 0.110 18496 3228 1 9 . 1 1 20 20 ALA H H 20 8.616 8.616 8.584 0.032 18496 3229 1 9 . 1 1 21 21 LYS N N 21 115.771 115.771 116.519 -0.748 18496 3230 1 9 . 1 1 21 21 LYS HA H 21 4.497 4.497 4.204 0.293 18496 3231 1 9 . 1 1 21 21 LYS C C 21 176.615 176.615 176.866 -0.251 18496 3232 1 9 . 1 1 21 21 LYS CA C 21 55.503 55.503 55.327 0.176 18496 3233 1 9 . 1 1 21 21 LYS CB C 21 32.742 32.742 31.693 1.049 18496 3234 1 9 . 1 1 21 21 LYS H H 21 7.767 7.767 7.742 0.025 18496 3235 1 9 . 1 1 22 22 GLY N N 22 107.695 107.695 106.843 0.852 18496 3236 1 9 . 1 1 22 22 GLY C C 22 174.843 174.843 174.395 0.448 18496 3237 1 9 . 1 1 22 22 GLY CA C 22 45.297 45.297 45.219 0.077 18496 3238 1 9 . 1 1 22 22 GLY H H 22 8.317 8.317 7.856 0.461 18496 3239 1 9 . 1 1 23 23 TRP N N 23 121.316 121.316 121.388 -0.072 18496 3240 1 9 . 1 1 23 23 TRP HA H 23 4.815 4.815 4.844 -0.029 18496 3241 1 9 . 1 1 23 23 TRP C C 23 176.754 176.754 176.425 0.329 18496 3242 1 9 . 1 1 23 23 TRP CA C 23 58.291 58.291 54.908 3.383 18496 3243 1 9 . 1 1 23 23 TRP CB C 23 28.127 28.127 28.113 0.014 18496 3244 1 9 . 1 1 23 23 TRP H H 23 7.983 7.983 8.016 -0.033 18496 3245 1 9 . 1 1 24 24 ARG N N 24 120.789 120.789 126.937 -6.148 18496 3246 1 9 . 1 1 24 24 ARG HA H 24 5.496 5.496 4.937 0.559 18496 3247 1 9 . 1 1 24 24 ARG C C 24 175.831 175.831 176.201 -0.370 18496 3248 1 9 . 1 1 24 24 ARG CA C 24 54.755 54.755 54.531 0.224 18496 3249 1 9 . 1 1 24 24 ARG CB C 24 33.735 33.735 30.107 3.628 18496 3250 1 9 . 1 1 24 24 ARG H H 24 9.046 9.046 9.372 -0.326 18496 3251 1 9 . 1 1 25 25 LYS N N 25 126.507 126.507 129.335 -2.828 18496 3252 1 9 . 1 1 25 25 LYS HA H 25 5.081 5.081 4.849 0.232 18496 3253 1 9 . 1 1 25 25 LYS C C 25 175.648 175.648 175.690 -0.042 18496 3254 1 9 . 1 1 25 25 LYS CA C 25 56.071 56.071 56.972 -0.901 18496 3255 1 9 . 1 1 25 25 LYS CB C 25 32.214 32.214 32.739 -0.525 18496 3256 1 9 . 1 1 25 25 LYS H H 25 8.526 8.526 8.588 -0.062 18496 3257 1 9 . 1 1 26 26 GLU N N 26 126.009 126.009 124.091 1.918 18496 3258 1 9 . 1 1 26 26 GLU HA H 26 5.275 5.275 5.172 0.103 18496 3259 1 9 . 1 1 26 26 GLU C C 26 174.894 174.894 174.244 0.650 18496 3260 1 9 . 1 1 26 26 GLU CA C 26 55.271 55.271 55.069 0.202 18496 3261 1 9 . 1 1 26 26 GLU CB C 26 33.781 33.781 34.682 -0.901 18496 3262 1 9 . 1 1 26 26 GLU H H 26 9.125 9.125 9.218 -0.093 18496 3263 1 9 . 1 1 27 27 LEU N N 27 121.930 121.930 124.897 -2.967 18496 3264 1 9 . 1 1 27 27 LEU HA H 27 5.788 5.788 4.881 0.907 18496 3265 1 9 . 1 1 27 27 LEU C C 27 173.941 173.941 174.399 -0.458 18496 3266 1 9 . 1 1 27 27 LEU CA C 27 53.859 53.859 53.914 -0.055 18496 3267 1 9 . 1 1 27 27 LEU CB C 27 44.020 44.020 44.260 -0.240 18496 3268 1 9 . 1 1 27 27 LEU H H 27 8.938 8.938 9.110 -0.172 18496 3269 1 9 . 1 1 28 28 ASN N N 28 124.630 124.630 125.150 -0.520 18496 3270 1 9 . 1 1 28 28 ASN HA H 28 5.411 5.411 5.241 0.170 18496 3271 1 9 . 1 1 28 28 ASN C C 28 174.366 174.366 173.281 1.085 18496 3272 1 9 . 1 1 28 28 ASN CA C 28 52.063 52.063 52.222 -0.159 18496 3273 1 9 . 1 1 28 28 ASN CB C 28 44.430 44.430 43.317 1.113 18496 3274 1 9 . 1 1 28 28 ASN H H 28 9.345 9.345 8.217 1.128 18496 3275 1 9 . 1 1 29 29 ARG N N 29 118.443 118.443 122.498 -4.055 18496 3276 1 9 . 1 1 29 29 ARG HA H 29 5.058 5.058 4.960 0.098 18496 3277 1 9 . 1 1 29 29 ARG C C 29 175.779 175.779 174.601 1.178 18496 3278 1 9 . 1 1 29 29 ARG CA C 29 56.091 56.091 55.742 0.349 18496 3279 1 9 . 1 1 29 29 ARG CB C 29 31.710 31.710 31.234 0.476 18496 3280 1 9 . 1 1 29 29 ARG H H 29 9.109 9.109 9.055 0.054 18496 3281 1 9 . 1 1 30 30 VAL N N 30 124.605 124.605 122.731 1.874 18496 3282 1 9 . 1 1 30 30 VAL HA H 30 4.535 4.535 5.383 -0.848 18496 3283 1 9 . 1 1 30 30 VAL C C 30 174.775 174.775 174.231 0.544 18496 3284 1 9 . 1 1 30 30 VAL CA C 30 60.921 60.921 58.815 2.106 18496 3285 1 9 . 1 1 30 30 VAL CB C 30 37.790 37.790 36.089 1.701 18496 3286 1 9 . 1 1 30 30 VAL H H 30 9.054 9.054 8.670 0.384 18496 3287 1 9 . 1 1 31 31 SER N N 31 120.794 120.794 115.856 4.938 18496 3288 1 9 . 1 1 31 31 SER HA H 31 4.652 4.652 5.039 -0.387 18496 3289 1 9 . 1 1 31 31 SER C C 31 174.214 174.214 175.299 -1.085 18496 3290 1 9 . 1 1 31 31 SER CA C 31 56.279 56.279 57.285 -1.006 18496 3291 1 9 . 1 1 31 31 SER CB C 31 64.128 64.128 63.976 0.152 18496 3292 1 9 . 1 1 31 31 SER H H 31 8.667 8.667 8.844 -0.177 18496 3293 1 9 . 1 1 32 32 TRP N N 32 132.303 132.303 127.873 4.430 18496 3294 1 9 . 1 1 32 32 TRP HA H 32 5.105 5.105 4.527 0.578 18496 3295 1 9 . 1 1 32 32 TRP C C 32 177.276 177.276 177.184 0.092 18496 3296 1 9 . 1 1 32 32 TRP CA C 32 56.198 56.198 58.142 -1.944 18496 3297 1 9 . 1 1 32 32 TRP CB C 32 29.968 29.968 28.271 1.697 18496 3298 1 9 . 1 1 32 32 TRP H H 32 9.282 9.282 9.110 0.172 18496 3299 1 9 . 1 1 33 33 ASN N N 33 124.979 124.979 123.460 1.519 18496 3300 1 9 . 1 1 33 33 ASN HA H 33 4.257 4.257 4.392 -0.135 18496 3301 1 9 . 1 1 33 33 ASN C C 33 174.030 174.030 174.751 -0.721 18496 3302 1 9 . 1 1 33 33 ASN CA C 33 54.709 54.709 54.738 -0.029 18496 3303 1 9 . 1 1 33 33 ASN CB C 33 37.921 37.921 37.007 0.914 18496 3304 1 9 . 1 1 33 33 ASN H H 33 9.813 9.813 8.834 0.979 18496 3305 1 9 . 1 1 34 34 ASP N N 34 111.880 111.880 113.463 -1.583 18496 3306 1 9 . 1 1 34 34 ASP HA H 34 4.126 4.126 4.241 -0.115 18496 3307 1 9 . 1 1 34 34 ASP CA C 34 56.130 56.130 55.415 0.715 18496 3308 1 9 . 1 1 34 34 ASP CB C 34 39.760 39.760 40.310 -0.550 18496 3309 1 9 . 1 1 34 34 ASP H H 34 9.251 9.251 8.191 1.060 18496 3310 1 9 . 1 1 35 35 ALA N N 35 121.811 121.811 120.916 0.895 18496 3311 1 9 . 1 1 35 35 ALA HA H 35 4.477 4.477 4.481 -0.004 18496 3312 1 9 . 1 1 35 35 ALA C C 35 177.778 177.778 176.914 0.864 18496 3313 1 9 . 1 1 35 35 ALA CA C 35 51.528 51.528 52.700 -1.172 18496 3314 1 9 . 1 1 35 35 ALA CB C 35 20.445 20.445 20.754 -0.309 18496 3315 1 9 . 1 1 35 35 ALA H H 35 7.625 7.625 7.840 -0.215 18496 3316 1 9 . 1 1 36 36 GLU N N 36 121.068 121.068 120.935 0.133 18496 3317 1 9 . 1 1 36 36 GLU HA H 36 4.390 4.390 4.757 -0.367 18496 3318 1 9 . 1 1 36 36 GLU CA C 36 55.276 55.276 52.185 3.091 18496 3319 1 9 . 1 1 36 36 GLU CB C 36 28.575 28.575 30.692 -2.116 18496 3320 1 9 . 1 1 36 36 GLU H H 36 8.658 8.658 8.470 0.188 18496 3321 1 9 . 1 1 37 37 PRO HA H 37 4.289 4.289 4.630 -0.341 18496 3322 1 9 . 1 1 37 37 PRO C C 37 175.799 175.799 175.940 -0.141 18496 3323 1 9 . 1 1 37 37 PRO CA C 37 63.105 63.105 62.404 0.701 18496 3324 1 9 . 1 1 37 37 PRO CB C 37 32.076 32.076 32.375 -0.299 18496 3325 1 9 . 1 1 38 38 LYS N N 38 120.881 120.881 122.483 -1.602 18496 3326 1 9 . 1 1 38 38 LYS HA H 38 4.700 4.700 4.335 0.365 18496 3327 1 9 . 1 1 38 38 LYS C C 38 176.906 176.906 174.522 2.384 18496 3328 1 9 . 1 1 38 38 LYS CA C 38 54.399 54.399 55.108 -0.709 18496 3329 1 9 . 1 1 38 38 LYS CB C 38 37.217 37.217 36.481 0.736 18496 3330 1 9 . 1 1 38 38 LYS H H 38 8.316 8.316 8.753 -0.437 18496 3331 1 9 . 1 1 39 39 TYR N N 39 119.792 119.792 118.797 0.995 18496 3332 1 9 . 1 1 39 39 TYR HA H 39 4.636 4.636 4.709 -0.073 18496 3333 1 9 . 1 1 39 39 TYR C C 39 175.834 175.834 174.681 1.153 18496 3334 1 9 . 1 1 39 39 TYR CA C 39 60.228 60.228 57.178 3.050 18496 3335 1 9 . 1 1 39 39 TYR CB C 39 38.683 38.683 38.938 -0.255 18496 3336 1 9 . 1 1 39 39 TYR H H 39 8.508 8.508 7.947 0.561 18496 3337 1 9 . 1 1 40 40 ASP N N 40 126.502 126.502 123.461 3.041 18496 3338 1 9 . 1 1 40 40 ASP HA H 40 5.597 5.597 5.388 0.209 18496 3339 1 9 . 1 1 40 40 ASP C C 40 175.283 175.283 174.144 1.139 18496 3340 1 9 . 1 1 40 40 ASP CA C 40 55.053 55.053 53.414 1.639 18496 3341 1 9 . 1 1 40 40 ASP CB C 40 48.656 48.656 45.377 3.279 18496 3342 1 9 . 1 1 40 40 ASP H H 40 9.219 9.219 8.367 0.852 18496 3343 1 9 . 1 1 41 41 ILE N N 41 125.910 125.910 125.167 0.743 18496 3344 1 9 . 1 1 41 41 ILE HA H 41 5.722 5.722 4.959 0.763 18496 3345 1 9 . 1 1 41 41 ILE C C 41 174.167 174.167 173.630 0.537 18496 3346 1 9 . 1 1 41 41 ILE CA C 41 60.734 60.734 59.859 0.875 18496 3347 1 9 . 1 1 41 41 ILE CB C 41 40.198 40.198 39.869 0.329 18496 3348 1 9 . 1 1 41 41 ILE H H 41 8.972 8.972 8.656 0.316 18496 3349 1 9 . 1 1 42 42 ARG N N 42 120.300 120.300 127.026 -6.726 18496 3350 1 9 . 1 1 42 42 ARG HA H 42 4.716 4.716 4.782 -0.066 18496 3351 1 9 . 1 1 42 42 ARG CA C 42 54.826 54.826 54.930 -0.104 18496 3352 1 9 . 1 1 42 42 ARG CB C 42 32.665 32.665 35.272 -2.607 18496 3353 1 9 . 1 1 42 42 ARG H H 42 8.320 8.320 8.736 -0.416 18496 3354 1 9 . 1 1 43 43 THR HA H 43 5.585 5.585 5.489 0.096 18496 3355 1 9 . 1 1 43 43 THR C C 43 173.294 173.294 173.053 0.241 18496 3356 1 9 . 1 1 43 43 THR CA C 43 60.847 60.847 59.164 1.683 18496 3357 1 9 . 1 1 43 43 THR CB C 43 69.961 69.961 70.995 -1.034 18496 3358 1 9 . 1 1 44 44 TRP N N 44 122.747 122.747 123.274 -0.527 18496 3359 1 9 . 1 1 44 44 TRP HA H 44 4.945 4.945 4.789 0.156 18496 3360 1 9 . 1 1 44 44 TRP C C 44 175.056 175.056 176.294 -1.238 18496 3361 1 9 . 1 1 44 44 TRP CA C 44 56.107 56.107 55.752 0.355 18496 3362 1 9 . 1 1 44 44 TRP CB C 44 34.506 34.506 32.054 2.452 18496 3363 1 9 . 1 1 44 44 TRP H H 44 9.180 9.180 8.843 0.337 18496 3364 1 9 . 1 1 45 45 SER N N 45 117.385 117.385 116.914 0.471 18496 3365 1 9 . 1 1 45 45 SER HA H 45 2.300 2.300 4.765 -2.465 18496 3366 1 9 . 1 1 45 45 SER CA C 45 56.481 56.481 56.960 -0.479 18496 3367 1 9 . 1 1 45 45 SER CB C 45 60.743 60.743 61.813 -1.070 18496 3368 1 9 . 1 1 45 45 SER H H 45 7.879 7.879 8.588 -0.709 18496 3369 1 9 . 1 1 46 46 PRO HA H 46 4.104 4.104 4.475 -0.371 18496 3370 1 9 . 1 1 46 46 PRO CA C 46 64.990 64.990 65.662 -0.672 18496 3371 1 9 . 1 1 46 46 PRO CB C 46 31.272 31.272 31.928 -0.656 18496 3372 1 9 . 1 1 47 47 ASP HA H 47 4.520 4.520 4.613 -0.093 18496 3373 1 9 . 1 1 47 47 ASP C C 47 175.629 175.629 175.692 -0.063 18496 3374 1 9 . 1 1 47 47 ASP CA C 47 53.453 53.453 53.167 0.286 18496 3375 1 9 . 1 1 47 47 ASP CB C 47 40.239 40.239 40.894 -0.655 18496 3376 1 9 . 1 1 48 48 HIS N N 48 111.320 111.320 115.187 -3.867 18496 3377 1 9 . 1 1 48 48 HIS HA H 48 3.916 3.916 4.457 -0.541 18496 3378 1 9 . 1 1 48 48 HIS CA C 48 60.347 60.347 57.465 2.882 18496 3379 1 9 . 1 1 48 48 HIS CB C 48 25.499 25.499 28.624 -3.125 18496 3380 1 9 . 1 1 48 48 HIS H H 48 8.269 8.269 8.217 0.052 18496 3381 1 9 . 1 1 49 49 GLU N N 49 114.659 114.659 115.257 -0.598 18496 3382 1 9 . 1 1 49 49 GLU HA H 49 4.447 4.447 4.394 0.053 18496 3383 1 9 . 1 1 49 49 GLU C C 49 176.394 176.394 176.260 0.134 18496 3384 1 9 . 1 1 49 49 GLU CA C 49 57.940 57.940 57.893 0.047 18496 3385 1 9 . 1 1 49 49 GLU CB C 49 30.641 30.641 30.477 0.164 18496 3386 1 9 . 1 1 49 49 GLU H H 49 7.381 7.381 8.599 -1.218 18496 3387 1 9 . 1 1 50 50 LYS N N 50 118.126 118.126 117.772 0.354 18496 3388 1 9 . 1 1 50 50 LYS HA H 50 4.665 4.665 4.595 0.070 18496 3389 1 9 . 1 1 50 50 LYS CA C 50 54.431 54.431 55.061 -0.630 18496 3390 1 9 . 1 1 50 50 LYS CB C 50 36.543 36.543 36.151 0.391 18496 3391 1 9 . 1 1 50 50 LYS H H 50 8.067 8.067 7.356 0.711 18496 3392 1 9 . 1 1 51 51 MET HA H 51 4.936 4.936 4.640 0.296 18496 3393 1 9 . 1 1 51 51 MET CA C 51 54.048 54.048 52.810 1.238 18496 3394 1 9 . 1 1 51 51 MET CB C 51 33.768 33.768 35.191 -1.423 18496 3395 1 9 . 1 1 52 52 GLY C C 52 173.534 173.534 172.357 1.177 18496 3396 1 9 . 1 1 52 52 GLY CA C 52 43.060 43.060 44.510 -1.450 18496 3397 1 9 . 1 1 53 53 LYS N N 53 118.012 118.012 120.111 -2.099 18496 3398 1 9 . 1 1 53 53 LYS HA H 53 4.155 4.155 4.497 -0.342 18496 3399 1 9 . 1 1 53 53 LYS C C 53 176.818 176.818 176.158 0.660 18496 3400 1 9 . 1 1 53 53 LYS CA C 53 56.478 56.478 56.112 0.366 18496 3401 1 9 . 1 1 53 53 LYS CB C 53 33.117 33.117 33.457 -0.340 18496 3402 1 9 . 1 1 53 53 LYS H H 53 8.132 8.132 8.170 -0.038 18496 3403 1 9 . 1 1 54 54 GLY N N 54 109.836 109.836 108.408 1.428 18496 3404 1 9 . 1 1 54 54 GLY C C 54 170.848 170.848 172.837 -1.989 18496 3405 1 9 . 1 1 54 54 GLY CA C 54 46.701 46.701 44.834 1.867 18496 3406 1 9 . 1 1 54 54 GLY H H 54 8.079 8.079 8.216 -0.137 18496 3407 1 9 . 1 1 55 55 ILE N N 55 119.382 119.382 121.844 -2.462 18496 3408 1 9 . 1 1 55 55 ILE HA H 55 4.956 4.956 4.597 0.359 18496 3409 1 9 . 1 1 55 55 ILE C C 55 171.737 171.737 173.660 -1.923 18496 3410 1 9 . 1 1 55 55 ILE CA C 55 57.059 57.059 60.710 -3.651 18496 3411 1 9 . 1 1 55 55 ILE CB C 55 44.241 44.241 41.358 2.884 18496 3412 1 9 . 1 1 55 55 ILE H H 55 8.661 8.661 8.305 0.356 18496 3413 1 9 . 1 1 56 56 THR N N 56 113.795 113.795 122.597 -8.802 18496 3414 1 9 . 1 1 56 56 THR HA H 56 5.607 5.607 4.937 0.670 18496 3415 1 9 . 1 1 56 56 THR C C 56 174.417 174.417 173.674 0.743 18496 3416 1 9 . 1 1 56 56 THR CA C 56 59.098 59.098 61.438 -2.340 18496 3417 1 9 . 1 1 56 56 THR CB C 56 72.153 72.153 70.338 1.815 18496 3418 1 9 . 1 1 56 56 THR H H 56 7.916 7.916 8.374 -0.458 18496 3419 1 9 . 1 1 57 57 LEU N N 57 121.044 121.044 127.655 -6.611 18496 3420 1 9 . 1 1 57 57 LEU HA H 57 5.311 5.311 5.041 0.270 18496 3421 1 9 . 1 1 57 57 LEU C C 57 176.150 176.150 175.891 0.259 18496 3422 1 9 . 1 1 57 57 LEU CA C 57 53.264 53.264 53.586 -0.322 18496 3423 1 9 . 1 1 57 57 LEU CB C 57 45.901 45.901 45.278 0.623 18496 3424 1 9 . 1 1 57 57 LEU H H 57 9.421 9.421 9.186 0.235 18496 3425 1 9 . 1 1 58 58 SER N N 58 119.548 119.548 118.192 1.356 18496 3426 1 9 . 1 1 58 58 SER HA H 58 4.734 4.734 4.472 0.262 18496 3427 1 9 . 1 1 58 58 SER C C 58 174.786 174.786 175.839 -1.053 18496 3428 1 9 . 1 1 58 58 SER CA C 58 56.948 56.948 58.199 -1.251 18496 3429 1 9 . 1 1 58 58 SER CB C 58 65.726 65.726 64.184 1.542 18496 3430 1 9 . 1 1 58 58 SER H H 58 9.771 9.771 9.365 0.406 18496 3431 1 9 . 1 1 59 59 GLU N N 59 120.827 120.827 123.405 -2.578 18496 3432 1 9 . 1 1 59 59 GLU HA H 59 4.319 4.319 4.212 0.107 18496 3433 1 9 . 1 1 59 59 GLU C C 59 179.806 179.806 178.906 0.900 18496 3434 1 9 . 1 1 59 59 GLU CA C 59 60.913 60.913 60.788 0.125 18496 3435 1 9 . 1 1 59 59 GLU CB C 59 29.538 29.538 29.401 0.137 18496 3436 1 9 . 1 1 59 59 GLU H H 59 9.394 9.394 9.020 0.374 18496 3437 1 9 . 1 1 60 60 GLU N N 60 119.587 119.587 119.393 0.194 18496 3438 1 9 . 1 1 60 60 GLU HA H 60 4.188 4.188 4.108 0.080 18496 3439 1 9 . 1 1 60 60 GLU C C 60 179.686 179.686 178.805 0.881 18496 3440 1 9 . 1 1 60 60 GLU CA C 60 60.279 60.279 59.547 0.732 18496 3441 1 9 . 1 1 60 60 GLU CB C 60 29.559 29.559 28.781 0.778 18496 3442 1 9 . 1 1 60 60 GLU H H 60 8.905 8.905 8.860 0.045 18496 3443 1 9 . 1 1 61 61 GLU N N 61 120.145 120.145 120.083 0.062 18496 3444 1 9 . 1 1 61 61 GLU HA H 61 4.037 4.037 4.091 -0.054 18496 3445 1 9 . 1 1 61 61 GLU C C 61 178.530 178.530 178.841 -0.311 18496 3446 1 9 . 1 1 61 61 GLU CA C 61 59.118 59.118 58.978 0.140 18496 3447 1 9 . 1 1 61 61 GLU CB C 61 30.976 30.976 29.325 1.651 18496 3448 1 9 . 1 1 61 61 GLU H H 61 8.013 8.013 8.337 -0.324 18496 3449 1 9 . 1 1 62 62 PHE N N 62 119.925 119.925 120.542 -0.617 18496 3450 1 9 . 1 1 62 62 PHE HA H 62 3.927 3.927 4.058 -0.131 18496 3451 1 9 . 1 1 62 62 PHE C C 62 176.783 176.783 177.649 -0.866 18496 3452 1 9 . 1 1 62 62 PHE CA C 62 61.827 61.827 61.465 0.362 18496 3453 1 9 . 1 1 62 62 PHE CB C 62 40.216 40.216 38.882 1.334 18496 3454 1 9 . 1 1 62 62 PHE H H 62 9.192 9.192 8.907 0.285 18496 3455 1 9 . 1 1 63 63 GLY N N 63 104.854 104.854 107.097 -2.243 18496 3456 1 9 . 1 1 63 63 GLY C C 63 176.854 176.854 176.177 0.677 18496 3457 1 9 . 1 1 63 63 GLY CA C 63 47.178 47.178 47.418 -0.240 18496 3458 1 9 . 1 1 63 63 GLY H H 63 8.316 8.316 8.666 -0.350 18496 3459 1 9 . 1 1 64 64 VAL N N 64 123.719 123.719 123.127 0.592 18496 3460 1 9 . 1 1 64 64 VAL HA H 64 3.663 3.663 3.751 -0.088 18496 3461 1 9 . 1 1 64 64 VAL C C 64 177.644 177.644 177.751 -0.107 18496 3462 1 9 . 1 1 64 64 VAL CA C 64 67.090 67.090 65.827 1.263 18496 3463 1 9 . 1 1 64 64 VAL CB C 64 31.367 31.367 31.238 0.129 18496 3464 1 9 . 1 1 64 64 VAL H H 64 7.759 7.759 7.840 -0.081 18496 3465 1 9 . 1 1 65 65 LEU N N 65 120.099 120.099 121.540 -1.441 18496 3466 1 9 . 1 1 65 65 LEU HA H 65 3.672 3.672 3.911 -0.239 18496 3467 1 9 . 1 1 65 65 LEU C C 65 177.636 177.636 178.709 -1.073 18496 3468 1 9 . 1 1 65 65 LEU CA C 65 58.552 58.552 58.520 0.032 18496 3469 1 9 . 1 1 65 65 LEU CB C 65 41.358 41.358 41.690 -0.332 18496 3470 1 9 . 1 1 65 65 LEU H H 65 7.660 7.660 8.269 -0.609 18496 3471 1 9 . 1 1 66 66 LEU N N 66 115.733 115.733 118.033 -2.300 18496 3472 1 9 . 1 1 66 66 LEU HA H 66 3.556 3.556 3.644 -0.088 18496 3473 1 9 . 1 1 66 66 LEU C C 66 179.729 179.729 178.814 0.915 18496 3474 1 9 . 1 1 66 66 LEU CA C 66 58.069 58.069 58.088 -0.019 18496 3475 1 9 . 1 1 66 66 LEU CB C 66 41.625 41.625 40.984 0.641 18496 3476 1 9 . 1 1 66 66 LEU H H 66 8.083 8.083 8.258 -0.175 18496 3477 1 9 . 1 1 67 67 LYS N N 67 119.120 119.120 120.036 -0.916 18496 3478 1 9 . 1 1 67 67 LYS HA H 67 3.965 3.965 3.828 0.137 18496 3479 1 9 . 1 1 67 67 LYS C C 67 179.379 179.379 179.035 0.344 18496 3480 1 9 . 1 1 67 67 LYS CA C 67 59.227 59.227 59.794 -0.567 18496 3481 1 9 . 1 1 67 67 LYS CB C 67 32.737 32.737 32.235 0.502 18496 3482 1 9 . 1 1 67 67 LYS H H 67 7.861 7.861 7.859 0.002 18496 3483 1 9 . 1 1 68 68 GLU N N 68 116.924 116.924 119.001 -2.077 18496 3484 1 9 . 1 1 68 68 GLU HA H 68 4.409 4.409 4.074 0.335 18496 3485 1 9 . 1 1 68 68 GLU CA C 68 57.712 57.712 58.732 -1.020 18496 3486 1 9 . 1 1 68 68 GLU CB C 68 29.586 29.586 29.402 0.184 18496 3487 1 9 . 1 1 68 68 GLU H H 68 8.319 8.319 8.030 0.289 18496 3488 1 9 . 1 1 69 69 LEU N N 69 120.032 120.032 119.892 0.140 18496 3489 1 9 . 1 1 69 69 LEU HA H 69 4.107 4.107 3.954 0.153 18496 3490 1 9 . 1 1 69 69 LEU CA C 69 57.563 57.563 57.469 0.094 18496 3491 1 9 . 1 1 69 69 LEU CB C 69 41.373 41.373 41.539 -0.166 18496 3492 1 9 . 1 1 69 69 LEU H H 69 8.233 8.233 8.594 -0.361 18496 3493 1 9 . 1 1 70 70 GLY N N 70 105.472 105.472 105.375 0.097 18496 3494 1 9 . 1 1 70 70 GLY C C 70 174.986 174.986 176.356 -1.370 18496 3495 1 9 . 1 1 70 70 GLY CA C 70 46.704 46.704 46.728 -0.024 18496 3496 1 9 . 1 1 70 70 GLY H H 70 7.960 7.960 8.559 -0.599 18496 3497 1 9 . 1 1 71 71 ASN N N 71 118.596 118.596 119.848 -1.252 18496 3498 1 9 . 1 1 71 71 ASN HA H 71 4.681 4.681 4.805 -0.124 18496 3499 1 9 . 1 1 71 71 ASN C C 71 176.412 176.412 177.915 -1.503 18496 3500 1 9 . 1 1 71 71 ASN CA C 71 54.407 54.407 55.195 -0.788 18496 3501 1 9 . 1 1 71 71 ASN CB C 71 38.729 38.729 38.532 0.197 18496 3502 1 9 . 1 1 71 71 ASN H H 71 7.857 7.857 7.840 0.017 18496 3503 1 9 . 1 1 72 72 LYS N N 72 119.973 119.973 120.317 -0.344 18496 3504 1 9 . 1 1 72 72 LYS HA H 72 4.282 4.282 4.127 0.155 18496 3505 1 9 . 1 1 72 72 LYS CA C 72 57.338 57.338 58.194 -0.856 18496 3506 1 9 . 1 1 72 72 LYS CB C 72 32.755 32.755 32.065 0.690 18496 3507 1 9 . 1 1 72 72 LYS H H 72 8.100 8.100 7.960 0.140 18496 3508 1 9 . 1 1 73 73 LEU HA H 73 4.281 4.281 4.319 -0.038 18496 3509 1 9 . 1 1 73 73 LEU CA C 73 55.774 55.774 54.777 0.997 18496 3510 1 9 . 1 1 73 73 LEU CB C 73 41.983 41.983 42.301 -0.318 18496 3511 1 10 . 1 1 2 2 ALA HA H 2 4.074 4.074 4.511 -0.437 18496 3512 1 10 . 1 1 2 2 ALA CA C 2 51.966 51.966 51.303 0.663 18496 3513 1 10 . 1 1 2 2 ALA CB C 2 19.732 19.732 20.103 -0.371 18496 3514 1 10 . 1 1 3 3 ASP HA H 3 4.632 4.632 4.514 0.118 18496 3515 1 10 . 1 1 3 3 ASP C C 3 175.822 175.822 176.149 -0.327 18496 3516 1 10 . 1 1 3 3 ASP CA C 3 54.440 54.440 55.389 -0.949 18496 3517 1 10 . 1 1 3 3 ASP CB C 3 41.577 41.577 41.264 0.313 18496 3518 1 10 . 1 1 4 4 LYS N N 4 121.655 121.655 120.200 1.455 18496 3519 1 10 . 1 1 4 4 LYS HA H 4 4.379 4.379 4.534 -0.155 18496 3520 1 10 . 1 1 4 4 LYS C C 4 176.011 176.011 175.403 0.608 18496 3521 1 10 . 1 1 4 4 LYS CA C 4 56.213 56.213 55.248 0.966 18496 3522 1 10 . 1 1 4 4 LYS CB C 4 33.407 33.407 31.682 1.725 18496 3523 1 10 . 1 1 4 4 LYS H H 4 8.394 8.394 8.011 0.383 18496 3524 1 10 . 1 1 5 5 LEU N N 5 125.369 125.369 124.980 0.389 18496 3525 1 10 . 1 1 5 5 LEU HA H 5 4.351 4.351 4.355 -0.004 18496 3526 1 10 . 1 1 5 5 LEU C C 5 175.682 175.682 176.731 -1.049 18496 3527 1 10 . 1 1 5 5 LEU CA C 5 55.117 55.117 54.708 0.409 18496 3528 1 10 . 1 1 5 5 LEU CB C 5 43.197 43.197 42.910 0.287 18496 3529 1 10 . 1 1 5 5 LEU H H 5 8.136 8.136 8.255 -0.119 18496 3530 1 10 . 1 1 6 6 LYS N N 6 126.844 126.844 125.993 0.851 18496 3531 1 10 . 1 1 6 6 LYS HA H 6 4.451 4.451 4.444 0.007 18496 3532 1 10 . 1 1 6 6 LYS C C 6 174.665 174.665 175.452 -0.787 18496 3533 1 10 . 1 1 6 6 LYS CA C 6 55.974 55.974 56.498 -0.524 18496 3534 1 10 . 1 1 6 6 LYS CB C 6 34.386 34.386 33.074 1.312 18496 3535 1 10 . 1 1 6 6 LYS H H 6 8.615 8.615 8.587 0.028 18496 3536 1 10 . 1 1 7 7 PHE N N 7 119.818 119.818 120.784 -0.966 18496 3537 1 10 . 1 1 7 7 PHE HA H 7 5.343 5.343 5.476 -0.133 18496 3538 1 10 . 1 1 7 7 PHE C C 7 173.569 173.569 173.845 -0.276 18496 3539 1 10 . 1 1 7 7 PHE CA C 7 55.813 55.813 55.831 -0.018 18496 3540 1 10 . 1 1 7 7 PHE CB C 7 42.975 42.975 42.843 0.132 18496 3541 1 10 . 1 1 7 7 PHE H H 7 7.734 7.734 8.102 -0.368 18496 3542 1 10 . 1 1 8 8 GLU N N 8 119.165 119.165 120.787 -1.622 18496 3543 1 10 . 1 1 8 8 GLU HA H 8 4.158 4.158 4.458 -0.300 18496 3544 1 10 . 1 1 8 8 GLU C C 8 175.026 175.026 174.956 0.070 18496 3545 1 10 . 1 1 8 8 GLU CA C 8 55.221 55.221 54.531 0.690 18496 3546 1 10 . 1 1 8 8 GLU CB C 8 33.699 33.699 33.314 0.385 18496 3547 1 10 . 1 1 8 8 GLU H H 8 8.295 8.295 8.529 -0.234 18496 3548 1 10 . 1 1 9 9 ILE N N 9 127.619 127.619 127.575 0.044 18496 3549 1 10 . 1 1 9 9 ILE HA H 9 3.768 3.768 4.192 -0.424 18496 3550 1 10 . 1 1 9 9 ILE C C 9 174.902 174.902 175.874 -0.972 18496 3551 1 10 . 1 1 9 9 ILE CA C 9 62.505 62.505 61.848 0.657 18496 3552 1 10 . 1 1 9 9 ILE CB C 9 36.094 36.094 37.386 -1.292 18496 3553 1 10 . 1 1 9 9 ILE H H 9 9.157 9.157 8.659 0.498 18496 3554 1 10 . 1 1 10 10 ILE N N 10 131.245 131.245 128.625 2.620 18496 3555 1 10 . 1 1 10 10 ILE HA H 10 3.861 3.861 3.969 -0.108 18496 3556 1 10 . 1 1 10 10 ILE C C 10 176.247 176.247 176.600 -0.353 18496 3557 1 10 . 1 1 10 10 ILE CA C 10 60.554 60.554 62.474 -1.920 18496 3558 1 10 . 1 1 10 10 ILE CB C 10 37.406 37.406 38.315 -0.909 18496 3559 1 10 . 1 1 10 10 ILE H H 10 8.428 8.428 8.747 -0.319 18496 3560 1 10 . 1 1 11 11 GLU N N 11 117.669 117.669 118.413 -0.744 18496 3561 1 10 . 1 1 11 11 GLU HA H 11 4.315 4.315 4.484 -0.169 18496 3562 1 10 . 1 1 11 11 GLU C C 11 174.155 174.155 174.209 -0.054 18496 3563 1 10 . 1 1 11 11 GLU CA C 11 55.755 55.755 55.931 -0.176 18496 3564 1 10 . 1 1 11 11 GLU CB C 11 34.386 34.386 32.242 2.144 18496 3565 1 10 . 1 1 11 11 GLU H H 11 7.551 7.551 7.813 -0.262 18496 3566 1 10 . 1 1 12 12 GLU N N 12 128.587 128.587 125.780 2.807 18496 3567 1 10 . 1 1 12 12 GLU HA H 12 5.214 5.214 4.344 0.870 18496 3568 1 10 . 1 1 12 12 GLU C C 12 176.877 176.877 176.251 0.626 18496 3569 1 10 . 1 1 12 12 GLU CA C 12 54.801 54.801 57.499 -2.698 18496 3570 1 10 . 1 1 12 12 GLU CB C 12 30.137 30.137 29.932 0.205 18496 3571 1 10 . 1 1 12 12 GLU H H 12 8.762 8.762 8.704 0.058 18496 3572 1 10 . 1 1 13 13 LEU N N 13 122.508 122.508 122.847 -0.339 18496 3573 1 10 . 1 1 13 13 LEU HA H 13 4.872 4.872 4.486 0.386 18496 3574 1 10 . 1 1 13 13 LEU C C 13 176.060 176.060 177.027 -0.967 18496 3575 1 10 . 1 1 13 13 LEU CA C 13 57.372 57.372 55.482 1.890 18496 3576 1 10 . 1 1 13 13 LEU CB C 13 42.284 42.284 43.379 -1.095 18496 3577 1 10 . 1 1 13 13 LEU H H 13 8.058 8.058 8.350 -0.292 18496 3578 1 10 . 1 1 14 14 ILE N N 14 115.422 115.422 118.229 -2.807 18496 3579 1 10 . 1 1 14 14 ILE HA H 14 4.553 4.553 4.467 0.086 18496 3580 1 10 . 1 1 14 14 ILE C C 14 174.893 174.893 174.183 0.710 18496 3581 1 10 . 1 1 14 14 ILE CA C 14 60.586 60.586 59.556 1.030 18496 3582 1 10 . 1 1 14 14 ILE CB C 14 44.329 44.329 41.063 3.266 18496 3583 1 10 . 1 1 14 14 ILE H H 14 8.450 8.450 8.355 0.095 18496 3584 1 10 . 1 1 15 15 VAL N N 15 129.108 129.108 126.133 2.975 18496 3585 1 10 . 1 1 15 15 VAL HA H 15 4.196 4.196 4.401 -0.205 18496 3586 1 10 . 1 1 15 15 VAL C C 15 175.180 175.180 175.139 0.041 18496 3587 1 10 . 1 1 15 15 VAL CA C 15 63.288 63.288 61.173 2.115 18496 3588 1 10 . 1 1 15 15 VAL CB C 15 32.117 32.117 32.885 -0.768 18496 3589 1 10 . 1 1 15 15 VAL H H 15 8.867 8.867 8.518 0.349 18496 3590 1 10 . 1 1 16 16 LEU N N 16 127.846 127.846 129.585 -1.739 18496 3591 1 10 . 1 1 16 16 LEU HA H 16 4.317 4.317 4.661 -0.344 18496 3592 1 10 . 1 1 16 16 LEU C C 16 176.070 176.070 177.277 -1.207 18496 3593 1 10 . 1 1 16 16 LEU CA C 16 57.252 57.252 56.117 1.135 18496 3594 1 10 . 1 1 16 16 LEU CB C 16 42.035 42.035 42.732 -0.697 18496 3595 1 10 . 1 1 16 16 LEU H H 16 9.555 9.555 8.591 0.964 18496 3596 1 10 . 1 1 17 17 SER N N 17 107.073 107.073 110.309 -3.236 18496 3597 1 10 . 1 1 17 17 SER HA H 17 4.540 4.540 4.597 -0.057 18496 3598 1 10 . 1 1 17 17 SER C C 17 172.277 172.277 172.202 0.075 18496 3599 1 10 . 1 1 17 17 SER CA C 17 57.882 57.882 58.096 -0.214 18496 3600 1 10 . 1 1 17 17 SER CB C 17 64.046 64.046 65.011 -0.966 18496 3601 1 10 . 1 1 17 17 SER H H 17 7.699 7.699 7.851 -0.152 18496 3602 1 10 . 1 1 18 18 GLU N N 18 119.235 119.235 119.446 -0.211 18496 3603 1 10 . 1 1 18 18 GLU HA H 18 5.143 5.143 5.103 0.040 18496 3604 1 10 . 1 1 18 18 GLU C C 18 175.469 175.469 176.335 -0.866 18496 3605 1 10 . 1 1 18 18 GLU CA C 18 55.248 55.248 55.080 0.168 18496 3606 1 10 . 1 1 18 18 GLU CB C 18 33.454 33.454 31.297 2.157 18496 3607 1 10 . 1 1 18 18 GLU H H 18 8.437 8.437 8.468 -0.031 18496 3608 1 10 . 1 1 19 19 ASN N N 19 123.988 123.988 121.111 2.877 18496 3609 1 10 . 1 1 19 19 ASN HA H 19 5.097 5.097 4.795 0.302 18496 3610 1 10 . 1 1 19 19 ASN CA C 19 50.916 50.916 53.060 -2.144 18496 3611 1 10 . 1 1 19 19 ASN CB C 19 39.482 39.482 39.014 0.468 18496 3612 1 10 . 1 1 19 19 ASN H H 19 8.779 8.779 8.347 0.432 18496 3613 1 10 . 1 1 20 20 ALA N N 20 120.854 120.854 122.137 -1.283 18496 3614 1 10 . 1 1 20 20 ALA HA H 20 4.239 4.239 4.142 0.097 18496 3615 1 10 . 1 1 20 20 ALA C C 20 179.032 179.032 177.928 1.104 18496 3616 1 10 . 1 1 20 20 ALA CA C 20 54.924 54.924 54.312 0.612 18496 3617 1 10 . 1 1 20 20 ALA CB C 20 18.621 18.621 18.514 0.107 18496 3618 1 10 . 1 1 20 20 ALA H H 20 8.616 8.616 8.554 0.062 18496 3619 1 10 . 1 1 21 21 LYS N N 21 115.771 115.771 116.491 -0.720 18496 3620 1 10 . 1 1 21 21 LYS HA H 21 4.497 4.497 4.264 0.233 18496 3621 1 10 . 1 1 21 21 LYS C C 21 176.615 176.615 177.046 -0.431 18496 3622 1 10 . 1 1 21 21 LYS CA C 21 55.503 55.503 55.094 0.409 18496 3623 1 10 . 1 1 21 21 LYS CB C 21 32.742 32.742 31.674 1.068 18496 3624 1 10 . 1 1 21 21 LYS H H 21 7.767 7.767 7.768 -0.001 18496 3625 1 10 . 1 1 22 22 GLY N N 22 107.695 107.695 106.540 1.155 18496 3626 1 10 . 1 1 22 22 GLY C C 22 174.843 174.843 174.391 0.452 18496 3627 1 10 . 1 1 22 22 GLY CA C 22 45.297 45.297 45.204 0.093 18496 3628 1 10 . 1 1 22 22 GLY H H 22 8.317 8.317 7.702 0.615 18496 3629 1 10 . 1 1 23 23 TRP N N 23 121.316 121.316 121.282 0.034 18496 3630 1 10 . 1 1 23 23 TRP HA H 23 4.815 4.815 4.763 0.052 18496 3631 1 10 . 1 1 23 23 TRP C C 23 176.754 176.754 176.402 0.352 18496 3632 1 10 . 1 1 23 23 TRP CA C 23 58.291 58.291 54.949 3.342 18496 3633 1 10 . 1 1 23 23 TRP CB C 23 28.127 28.127 27.980 0.147 18496 3634 1 10 . 1 1 23 23 TRP H H 23 7.983 7.983 8.002 -0.019 18496 3635 1 10 . 1 1 24 24 ARG N N 24 120.789 120.789 126.906 -6.117 18496 3636 1 10 . 1 1 24 24 ARG HA H 24 5.496 5.496 4.896 0.600 18496 3637 1 10 . 1 1 24 24 ARG C C 24 175.831 175.831 176.031 -0.200 18496 3638 1 10 . 1 1 24 24 ARG CA C 24 54.755 54.755 54.471 0.284 18496 3639 1 10 . 1 1 24 24 ARG CB C 24 33.735 33.735 29.993 3.742 18496 3640 1 10 . 1 1 24 24 ARG H H 24 9.046 9.046 9.272 -0.226 18496 3641 1 10 . 1 1 25 25 LYS N N 25 126.507 126.507 129.254 -2.747 18496 3642 1 10 . 1 1 25 25 LYS HA H 25 5.081 5.081 4.824 0.257 18496 3643 1 10 . 1 1 25 25 LYS C C 25 175.648 175.648 175.649 -0.001 18496 3644 1 10 . 1 1 25 25 LYS CA C 25 56.071 56.071 56.915 -0.844 18496 3645 1 10 . 1 1 25 25 LYS CB C 25 32.214 32.214 32.791 -0.577 18496 3646 1 10 . 1 1 25 25 LYS H H 25 8.526 8.526 8.529 -0.003 18496 3647 1 10 . 1 1 26 26 GLU N N 26 126.009 126.009 124.184 1.825 18496 3648 1 10 . 1 1 26 26 GLU HA H 26 5.275 5.275 5.113 0.162 18496 3649 1 10 . 1 1 26 26 GLU C C 26 174.894 174.894 174.293 0.601 18496 3650 1 10 . 1 1 26 26 GLU CA C 26 55.271 55.271 55.109 0.162 18496 3651 1 10 . 1 1 26 26 GLU CB C 26 33.781 33.781 34.517 -0.736 18496 3652 1 10 . 1 1 26 26 GLU H H 26 9.125 9.125 9.193 -0.068 18496 3653 1 10 . 1 1 27 27 LEU N N 27 121.930 121.930 125.705 -3.775 18496 3654 1 10 . 1 1 27 27 LEU HA H 27 5.788 5.788 4.829 0.959 18496 3655 1 10 . 1 1 27 27 LEU C C 27 173.941 173.941 174.430 -0.489 18496 3656 1 10 . 1 1 27 27 LEU CA C 27 53.859 53.859 53.819 0.040 18496 3657 1 10 . 1 1 27 27 LEU CB C 27 44.020 44.020 43.823 0.197 18496 3658 1 10 . 1 1 27 27 LEU H H 27 8.938 8.938 9.069 -0.131 18496 3659 1 10 . 1 1 28 28 ASN N N 28 124.630 124.630 125.303 -0.673 18496 3660 1 10 . 1 1 28 28 ASN HA H 28 5.411 5.411 5.223 0.188 18496 3661 1 10 . 1 1 28 28 ASN C C 28 174.366 174.366 173.341 1.025 18496 3662 1 10 . 1 1 28 28 ASN CA C 28 52.063 52.063 52.221 -0.159 18496 3663 1 10 . 1 1 28 28 ASN CB C 28 44.430 44.430 43.220 1.210 18496 3664 1 10 . 1 1 28 28 ASN H H 28 9.345 9.345 8.197 1.148 18496 3665 1 10 . 1 1 29 29 ARG N N 29 118.443 118.443 122.493 -4.050 18496 3666 1 10 . 1 1 29 29 ARG HA H 29 5.058 5.058 4.927 0.131 18496 3667 1 10 . 1 1 29 29 ARG C C 29 175.779 175.779 174.562 1.217 18496 3668 1 10 . 1 1 29 29 ARG CA C 29 56.091 56.091 55.795 0.296 18496 3669 1 10 . 1 1 29 29 ARG CB C 29 31.710 31.710 31.217 0.493 18496 3670 1 10 . 1 1 29 29 ARG H H 29 9.109 9.109 9.047 0.062 18496 3671 1 10 . 1 1 30 30 VAL N N 30 124.605 124.605 122.624 1.981 18496 3672 1 10 . 1 1 30 30 VAL HA H 30 4.535 4.535 5.414 -0.879 18496 3673 1 10 . 1 1 30 30 VAL C C 30 174.775 174.775 174.357 0.418 18496 3674 1 10 . 1 1 30 30 VAL CA C 30 60.921 60.921 58.584 2.337 18496 3675 1 10 . 1 1 30 30 VAL CB C 30 37.790 37.790 35.914 1.876 18496 3676 1 10 . 1 1 30 30 VAL H H 30 9.054 9.054 8.522 0.532 18496 3677 1 10 . 1 1 31 31 SER N N 31 120.794 120.794 115.570 5.224 18496 3678 1 10 . 1 1 31 31 SER HA H 31 4.652 4.652 5.065 -0.413 18496 3679 1 10 . 1 1 31 31 SER C C 31 174.214 174.214 175.419 -1.205 18496 3680 1 10 . 1 1 31 31 SER CA C 31 56.279 56.279 57.131 -0.852 18496 3681 1 10 . 1 1 31 31 SER CB C 31 64.128 64.128 64.021 0.107 18496 3682 1 10 . 1 1 31 31 SER H H 31 8.667 8.667 8.790 -0.123 18496 3683 1 10 . 1 1 32 32 TRP N N 32 132.303 132.303 127.807 4.496 18496 3684 1 10 . 1 1 32 32 TRP HA H 32 5.105 5.105 4.536 0.569 18496 3685 1 10 . 1 1 32 32 TRP C C 32 177.276 177.276 177.197 0.079 18496 3686 1 10 . 1 1 32 32 TRP CA C 32 56.198 56.198 57.841 -1.643 18496 3687 1 10 . 1 1 32 32 TRP CB C 32 29.968 29.968 27.953 2.015 18496 3688 1 10 . 1 1 32 32 TRP H H 32 9.282 9.282 9.133 0.149 18496 3689 1 10 . 1 1 33 33 ASN N N 33 124.979 124.979 123.493 1.486 18496 3690 1 10 . 1 1 33 33 ASN HA H 33 4.257 4.257 4.368 -0.111 18496 3691 1 10 . 1 1 33 33 ASN C C 33 174.030 174.030 174.743 -0.713 18496 3692 1 10 . 1 1 33 33 ASN CA C 33 54.709 54.709 54.770 -0.061 18496 3693 1 10 . 1 1 33 33 ASN CB C 33 37.921 37.921 36.999 0.922 18496 3694 1 10 . 1 1 33 33 ASN H H 33 9.813 9.813 8.848 0.965 18496 3695 1 10 . 1 1 34 34 ASP N N 34 111.880 111.880 113.298 -1.418 18496 3696 1 10 . 1 1 34 34 ASP HA H 34 4.126 4.126 4.242 -0.116 18496 3697 1 10 . 1 1 34 34 ASP CA C 34 56.130 56.130 55.421 0.709 18496 3698 1 10 . 1 1 34 34 ASP CB C 34 39.760 39.760 40.365 -0.605 18496 3699 1 10 . 1 1 34 34 ASP H H 34 9.251 9.251 8.216 1.035 18496 3700 1 10 . 1 1 35 35 ALA N N 35 121.811 121.811 121.374 0.437 18496 3701 1 10 . 1 1 35 35 ALA HA H 35 4.477 4.477 4.491 -0.014 18496 3702 1 10 . 1 1 35 35 ALA C C 35 177.778 177.778 177.080 0.698 18496 3703 1 10 . 1 1 35 35 ALA CA C 35 51.528 51.528 52.648 -1.120 18496 3704 1 10 . 1 1 35 35 ALA CB C 35 20.445 20.445 20.404 0.041 18496 3705 1 10 . 1 1 35 35 ALA H H 35 7.625 7.625 7.743 -0.118 18496 3706 1 10 . 1 1 36 36 GLU N N 36 121.068 121.068 121.586 -0.518 18496 3707 1 10 . 1 1 36 36 GLU HA H 36 4.390 4.390 4.737 -0.347 18496 3708 1 10 . 1 1 36 36 GLU CA C 36 55.276 55.276 52.178 3.098 18496 3709 1 10 . 1 1 36 36 GLU CB C 36 28.575 28.575 31.040 -2.465 18496 3710 1 10 . 1 1 36 36 GLU H H 36 8.658 8.658 8.324 0.334 18496 3711 1 10 . 1 1 37 37 PRO HA H 37 4.289 4.289 4.706 -0.417 18496 3712 1 10 . 1 1 37 37 PRO C C 37 175.799 175.799 175.827 -0.028 18496 3713 1 10 . 1 1 37 37 PRO CA C 37 63.105 63.105 62.382 0.723 18496 3714 1 10 . 1 1 37 37 PRO CB C 37 32.076 32.076 32.182 -0.106 18496 3715 1 10 . 1 1 38 38 LYS N N 38 120.881 120.881 123.290 -2.409 18496 3716 1 10 . 1 1 38 38 LYS HA H 38 4.700 4.700 4.323 0.377 18496 3717 1 10 . 1 1 38 38 LYS C C 38 176.906 176.906 174.502 2.404 18496 3718 1 10 . 1 1 38 38 LYS CA C 38 54.399 54.399 54.678 -0.279 18496 3719 1 10 . 1 1 38 38 LYS CB C 38 37.217 37.217 36.573 0.644 18496 3720 1 10 . 1 1 38 38 LYS H H 38 8.316 8.316 8.779 -0.463 18496 3721 1 10 . 1 1 39 39 TYR N N 39 119.792 119.792 118.299 1.493 18496 3722 1 10 . 1 1 39 39 TYR HA H 39 4.636 4.636 4.717 -0.081 18496 3723 1 10 . 1 1 39 39 TYR C C 39 175.834 175.834 174.697 1.137 18496 3724 1 10 . 1 1 39 39 TYR CA C 39 60.228 60.228 57.055 3.173 18496 3725 1 10 . 1 1 39 39 TYR CB C 39 38.683 38.683 39.158 -0.475 18496 3726 1 10 . 1 1 39 39 TYR H H 39 8.508 8.508 7.845 0.663 18496 3727 1 10 . 1 1 40 40 ASP N N 40 126.502 126.502 123.219 3.283 18496 3728 1 10 . 1 1 40 40 ASP HA H 40 5.597 5.597 5.384 0.213 18496 3729 1 10 . 1 1 40 40 ASP C C 40 175.283 175.283 174.162 1.121 18496 3730 1 10 . 1 1 40 40 ASP CA C 40 55.053 55.053 53.524 1.529 18496 3731 1 10 . 1 1 40 40 ASP CB C 40 48.656 48.656 45.424 3.232 18496 3732 1 10 . 1 1 40 40 ASP H H 40 9.219 9.219 8.421 0.798 18496 3733 1 10 . 1 1 41 41 ILE N N 41 125.910 125.910 125.106 0.804 18496 3734 1 10 . 1 1 41 41 ILE HA H 41 5.722 5.722 4.948 0.774 18496 3735 1 10 . 1 1 41 41 ILE C C 41 174.167 174.167 173.644 0.523 18496 3736 1 10 . 1 1 41 41 ILE CA C 41 60.734 60.734 59.880 0.854 18496 3737 1 10 . 1 1 41 41 ILE CB C 41 40.198 40.198 39.935 0.263 18496 3738 1 10 . 1 1 41 41 ILE H H 41 8.972 8.972 8.612 0.360 18496 3739 1 10 . 1 1 42 42 ARG N N 42 120.300 120.300 127.036 -6.736 18496 3740 1 10 . 1 1 42 42 ARG HA H 42 4.716 4.716 4.808 -0.092 18496 3741 1 10 . 1 1 42 42 ARG CA C 42 54.826 54.826 54.962 -0.137 18496 3742 1 10 . 1 1 42 42 ARG CB C 42 32.665 32.665 35.359 -2.695 18496 3743 1 10 . 1 1 42 42 ARG H H 42 8.320 8.320 8.720 -0.400 18496 3744 1 10 . 1 1 43 43 THR HA H 43 5.585 5.585 5.544 0.041 18496 3745 1 10 . 1 1 43 43 THR C C 43 173.294 173.294 173.223 0.071 18496 3746 1 10 . 1 1 43 43 THR CA C 43 60.847 60.847 59.247 1.600 18496 3747 1 10 . 1 1 43 43 THR CB C 43 69.961 69.961 70.889 -0.928 18496 3748 1 10 . 1 1 44 44 TRP N N 44 122.747 122.747 124.039 -1.292 18496 3749 1 10 . 1 1 44 44 TRP HA H 44 4.945 4.945 4.835 0.110 18496 3750 1 10 . 1 1 44 44 TRP C C 44 175.056 175.056 176.218 -1.162 18496 3751 1 10 . 1 1 44 44 TRP CA C 44 56.107 56.107 55.310 0.797 18496 3752 1 10 . 1 1 44 44 TRP CB C 44 34.506 34.506 31.887 2.619 18496 3753 1 10 . 1 1 44 44 TRP H H 44 9.180 9.180 8.777 0.403 18496 3754 1 10 . 1 1 45 45 SER N N 45 117.385 117.385 116.984 0.401 18496 3755 1 10 . 1 1 45 45 SER HA H 45 2.300 2.300 4.700 -2.400 18496 3756 1 10 . 1 1 45 45 SER CA C 45 56.481 56.481 58.245 -1.764 18496 3757 1 10 . 1 1 45 45 SER CB C 45 60.743 60.743 62.325 -1.582 18496 3758 1 10 . 1 1 45 45 SER H H 45 7.879 7.879 8.360 -0.481 18496 3759 1 10 . 1 1 46 46 PRO HA H 46 4.104 4.104 4.466 -0.362 18496 3760 1 10 . 1 1 46 46 PRO CA C 46 64.990 64.990 65.568 -0.578 18496 3761 1 10 . 1 1 46 46 PRO CB C 46 31.272 31.272 31.878 -0.606 18496 3762 1 10 . 1 1 47 47 ASP HA H 47 4.520 4.520 4.604 -0.084 18496 3763 1 10 . 1 1 47 47 ASP C C 47 175.629 175.629 175.696 -0.067 18496 3764 1 10 . 1 1 47 47 ASP CA C 47 53.453 53.453 53.162 0.291 18496 3765 1 10 . 1 1 47 47 ASP CB C 47 40.239 40.239 40.977 -0.738 18496 3766 1 10 . 1 1 48 48 HIS N N 48 111.320 111.320 115.174 -3.854 18496 3767 1 10 . 1 1 48 48 HIS HA H 48 3.916 3.916 4.481 -0.565 18496 3768 1 10 . 1 1 48 48 HIS CA C 48 60.347 60.347 57.707 2.640 18496 3769 1 10 . 1 1 48 48 HIS CB C 48 25.499 25.499 28.434 -2.935 18496 3770 1 10 . 1 1 48 48 HIS H H 48 8.269 8.269 8.139 0.130 18496 3771 1 10 . 1 1 49 49 GLU N N 49 114.659 114.659 114.394 0.265 18496 3772 1 10 . 1 1 49 49 GLU HA H 49 4.447 4.447 4.391 0.056 18496 3773 1 10 . 1 1 49 49 GLU C C 49 176.394 176.394 176.583 -0.189 18496 3774 1 10 . 1 1 49 49 GLU CA C 49 57.940 57.940 57.770 0.169 18496 3775 1 10 . 1 1 49 49 GLU CB C 49 30.641 30.641 30.604 0.037 18496 3776 1 10 . 1 1 49 49 GLU H H 49 7.381 7.381 8.696 -1.315 18496 3777 1 10 . 1 1 50 50 LYS N N 50 118.126 118.126 118.473 -0.347 18496 3778 1 10 . 1 1 50 50 LYS HA H 50 4.665 4.665 4.648 0.017 18496 3779 1 10 . 1 1 50 50 LYS CA C 50 54.431 54.431 54.673 -0.242 18496 3780 1 10 . 1 1 50 50 LYS CB C 50 36.543 36.543 36.399 0.144 18496 3781 1 10 . 1 1 50 50 LYS H H 50 8.067 8.067 7.772 0.295 18496 3782 1 10 . 1 1 51 51 MET HA H 51 4.936 4.936 4.567 0.369 18496 3783 1 10 . 1 1 51 51 MET CA C 51 54.048 54.048 53.088 0.960 18496 3784 1 10 . 1 1 51 51 MET CB C 51 33.768 33.768 34.979 -1.211 18496 3785 1 10 . 1 1 52 52 GLY C C 52 173.534 173.534 172.454 1.080 18496 3786 1 10 . 1 1 52 52 GLY CA C 52 43.060 43.060 44.484 -1.424 18496 3787 1 10 . 1 1 53 53 LYS N N 53 118.012 118.012 119.785 -1.773 18496 3788 1 10 . 1 1 53 53 LYS HA H 53 4.155 4.155 4.473 -0.318 18496 3789 1 10 . 1 1 53 53 LYS C C 53 176.818 176.818 176.112 0.706 18496 3790 1 10 . 1 1 53 53 LYS CA C 53 56.478 56.478 56.069 0.409 18496 3791 1 10 . 1 1 53 53 LYS CB C 53 33.117 33.117 33.356 -0.239 18496 3792 1 10 . 1 1 53 53 LYS H H 53 8.132 8.132 8.172 -0.040 18496 3793 1 10 . 1 1 54 54 GLY N N 54 109.836 109.836 108.545 1.291 18496 3794 1 10 . 1 1 54 54 GLY C C 54 170.848 170.848 172.775 -1.927 18496 3795 1 10 . 1 1 54 54 GLY CA C 54 46.701 46.701 44.793 1.908 18496 3796 1 10 . 1 1 54 54 GLY H H 54 8.079 8.079 8.190 -0.111 18496 3797 1 10 . 1 1 55 55 ILE N N 55 119.382 119.382 121.836 -2.454 18496 3798 1 10 . 1 1 55 55 ILE HA H 55 4.956 4.956 4.617 0.339 18496 3799 1 10 . 1 1 55 55 ILE C C 55 171.737 171.737 173.720 -1.983 18496 3800 1 10 . 1 1 55 55 ILE CA C 55 57.059 57.059 60.466 -3.407 18496 3801 1 10 . 1 1 55 55 ILE CB C 55 44.241 44.241 41.417 2.824 18496 3802 1 10 . 1 1 55 55 ILE H H 55 8.661 8.661 8.295 0.366 18496 3803 1 10 . 1 1 56 56 THR N N 56 113.795 113.795 122.422 -8.627 18496 3804 1 10 . 1 1 56 56 THR HA H 56 5.607 5.607 4.932 0.675 18496 3805 1 10 . 1 1 56 56 THR C C 56 174.417 174.417 173.635 0.782 18496 3806 1 10 . 1 1 56 56 THR CA C 56 59.098 59.098 61.474 -2.376 18496 3807 1 10 . 1 1 56 56 THR CB C 56 72.153 72.153 70.293 1.860 18496 3808 1 10 . 1 1 56 56 THR H H 56 7.916 7.916 8.386 -0.470 18496 3809 1 10 . 1 1 57 57 LEU N N 57 121.044 121.044 127.857 -6.813 18496 3810 1 10 . 1 1 57 57 LEU HA H 57 5.311 5.311 5.054 0.257 18496 3811 1 10 . 1 1 57 57 LEU C C 57 176.150 176.150 175.876 0.274 18496 3812 1 10 . 1 1 57 57 LEU CA C 57 53.264 53.264 53.591 -0.327 18496 3813 1 10 . 1 1 57 57 LEU CB C 57 45.901 45.901 45.234 0.667 18496 3814 1 10 . 1 1 57 57 LEU H H 57 9.421 9.421 9.227 0.194 18496 3815 1 10 . 1 1 58 58 SER N N 58 119.548 119.548 118.347 1.201 18496 3816 1 10 . 1 1 58 58 SER HA H 58 4.734 4.734 4.508 0.226 18496 3817 1 10 . 1 1 58 58 SER C C 58 174.786 174.786 175.861 -1.075 18496 3818 1 10 . 1 1 58 58 SER CA C 58 56.948 56.948 58.078 -1.130 18496 3819 1 10 . 1 1 58 58 SER CB C 58 65.726 65.726 64.219 1.506 18496 3820 1 10 . 1 1 58 58 SER H H 58 9.771 9.771 9.448 0.323 18496 3821 1 10 . 1 1 59 59 GLU N N 59 120.827 120.827 122.924 -2.097 18496 3822 1 10 . 1 1 59 59 GLU HA H 59 4.319 4.319 4.185 0.134 18496 3823 1 10 . 1 1 59 59 GLU C C 59 179.806 179.806 178.922 0.884 18496 3824 1 10 . 1 1 59 59 GLU CA C 59 60.913 60.913 60.664 0.249 18496 3825 1 10 . 1 1 59 59 GLU CB C 59 29.538 29.538 29.353 0.185 18496 3826 1 10 . 1 1 59 59 GLU H H 59 9.394 9.394 9.008 0.386 18496 3827 1 10 . 1 1 60 60 GLU N N 60 119.587 119.587 119.538 0.049 18496 3828 1 10 . 1 1 60 60 GLU HA H 60 4.188 4.188 4.111 0.077 18496 3829 1 10 . 1 1 60 60 GLU C C 60 179.686 179.686 178.796 0.890 18496 3830 1 10 . 1 1 60 60 GLU CA C 60 60.279 60.279 59.531 0.748 18496 3831 1 10 . 1 1 60 60 GLU CB C 60 29.559 29.559 28.763 0.796 18496 3832 1 10 . 1 1 60 60 GLU H H 60 8.905 8.905 8.861 0.044 18496 3833 1 10 . 1 1 61 61 GLU N N 61 120.145 120.145 120.069 0.076 18496 3834 1 10 . 1 1 61 61 GLU HA H 61 4.037 4.037 4.089 -0.052 18496 3835 1 10 . 1 1 61 61 GLU C C 61 178.530 178.530 178.845 -0.315 18496 3836 1 10 . 1 1 61 61 GLU CA C 61 59.118 59.118 58.981 0.137 18496 3837 1 10 . 1 1 61 61 GLU CB C 61 30.976 30.976 29.307 1.669 18496 3838 1 10 . 1 1 61 61 GLU H H 61 8.013 8.013 8.389 -0.376 18496 3839 1 10 . 1 1 62 62 PHE N N 62 119.925 119.925 120.497 -0.572 18496 3840 1 10 . 1 1 62 62 PHE HA H 62 3.927 3.927 4.052 -0.125 18496 3841 1 10 . 1 1 62 62 PHE C C 62 176.783 176.783 177.624 -0.841 18496 3842 1 10 . 1 1 62 62 PHE CA C 62 61.827 61.827 61.471 0.356 18496 3843 1 10 . 1 1 62 62 PHE CB C 62 40.216 40.216 38.857 1.359 18496 3844 1 10 . 1 1 62 62 PHE H H 62 9.192 9.192 8.806 0.386 18496 3845 1 10 . 1 1 63 63 GLY N N 63 104.854 104.854 107.210 -2.356 18496 3846 1 10 . 1 1 63 63 GLY C C 63 176.854 176.854 176.073 0.781 18496 3847 1 10 . 1 1 63 63 GLY CA C 63 47.178 47.178 47.424 -0.246 18496 3848 1 10 . 1 1 63 63 GLY H H 63 8.316 8.316 8.518 -0.202 18496 3849 1 10 . 1 1 64 64 VAL N N 64 123.719 123.719 122.994 0.725 18496 3850 1 10 . 1 1 64 64 VAL HA H 64 3.663 3.663 3.740 -0.077 18496 3851 1 10 . 1 1 64 64 VAL C C 64 177.644 177.644 177.762 -0.118 18496 3852 1 10 . 1 1 64 64 VAL CA C 64 67.090 67.090 65.842 1.248 18496 3853 1 10 . 1 1 64 64 VAL CB C 64 31.367 31.367 31.153 0.214 18496 3854 1 10 . 1 1 64 64 VAL H H 64 7.759 7.759 7.953 -0.194 18496 3855 1 10 . 1 1 65 65 LEU N N 65 120.099 120.099 121.445 -1.346 18496 3856 1 10 . 1 1 65 65 LEU HA H 65 3.672 3.672 3.923 -0.251 18496 3857 1 10 . 1 1 65 65 LEU C C 65 177.636 177.636 178.660 -1.024 18496 3858 1 10 . 1 1 65 65 LEU CA C 65 58.552 58.552 58.505 0.047 18496 3859 1 10 . 1 1 65 65 LEU CB C 65 41.358 41.358 41.722 -0.364 18496 3860 1 10 . 1 1 65 65 LEU H H 65 7.660 7.660 8.183 -0.523 18496 3861 1 10 . 1 1 66 66 LEU N N 66 115.733 115.733 118.191 -2.458 18496 3862 1 10 . 1 1 66 66 LEU HA H 66 3.556 3.556 3.635 -0.079 18496 3863 1 10 . 1 1 66 66 LEU C C 66 179.729 179.729 178.837 0.892 18496 3864 1 10 . 1 1 66 66 LEU CA C 66 58.069 58.069 58.073 -0.004 18496 3865 1 10 . 1 1 66 66 LEU CB C 66 41.625 41.625 40.970 0.655 18496 3866 1 10 . 1 1 66 66 LEU H H 66 8.083 8.083 8.163 -0.080 18496 3867 1 10 . 1 1 67 67 LYS N N 67 119.120 119.120 119.967 -0.847 18496 3868 1 10 . 1 1 67 67 LYS HA H 67 3.965 3.965 3.812 0.153 18496 3869 1 10 . 1 1 67 67 LYS C C 67 179.379 179.379 179.031 0.348 18496 3870 1 10 . 1 1 67 67 LYS CA C 67 59.227 59.227 59.838 -0.611 18496 3871 1 10 . 1 1 67 67 LYS CB C 67 32.737 32.737 32.240 0.497 18496 3872 1 10 . 1 1 67 67 LYS H H 67 7.861 7.861 8.112 -0.251 18496 3873 1 10 . 1 1 68 68 GLU N N 68 116.924 116.924 118.767 -1.843 18496 3874 1 10 . 1 1 68 68 GLU HA H 68 4.409 4.409 4.089 0.320 18496 3875 1 10 . 1 1 68 68 GLU CA C 68 57.712 57.712 58.545 -0.833 18496 3876 1 10 . 1 1 68 68 GLU CB C 68 29.586 29.586 29.497 0.089 18496 3877 1 10 . 1 1 68 68 GLU H H 68 8.319 8.319 7.948 0.371 18496 3878 1 10 . 1 1 69 69 LEU N N 69 120.032 120.032 120.020 0.012 18496 3879 1 10 . 1 1 69 69 LEU HA H 69 4.107 4.107 3.944 0.163 18496 3880 1 10 . 1 1 69 69 LEU CA C 69 57.563 57.563 57.505 0.058 18496 3881 1 10 . 1 1 69 69 LEU CB C 69 41.373 41.373 41.551 -0.178 18496 3882 1 10 . 1 1 69 69 LEU H H 69 8.233 8.233 8.546 -0.313 18496 3883 1 10 . 1 1 70 70 GLY N N 70 105.472 105.472 105.612 -0.140 18496 3884 1 10 . 1 1 70 70 GLY C C 70 174.986 174.986 175.617 -0.631 18496 3885 1 10 . 1 1 70 70 GLY CA C 70 46.704 46.704 46.839 -0.135 18496 3886 1 10 . 1 1 70 70 GLY H H 70 7.960 7.960 8.563 -0.603 18496 3887 1 10 . 1 1 71 71 ASN N N 71 118.596 118.596 118.854 -0.258 18496 3888 1 10 . 1 1 71 71 ASN HA H 71 4.681 4.681 4.776 -0.095 18496 3889 1 10 . 1 1 71 71 ASN C C 71 176.412 176.412 177.304 -0.892 18496 3890 1 10 . 1 1 71 71 ASN CA C 71 54.407 54.407 54.871 -0.464 18496 3891 1 10 . 1 1 71 71 ASN CB C 71 38.729 38.729 38.639 0.090 18496 3892 1 10 . 1 1 71 71 ASN H H 71 7.857 7.857 7.690 0.167 18496 3893 1 10 . 1 1 72 72 LYS N N 72 119.973 119.973 118.486 1.487 18496 3894 1 10 . 1 1 72 72 LYS HA H 72 4.282 4.282 4.174 0.108 18496 3895 1 10 . 1 1 72 72 LYS CA C 72 57.338 57.338 57.631 -0.293 18496 3896 1 10 . 1 1 72 72 LYS CB C 72 32.755 32.755 32.278 0.477 18496 3897 1 10 . 1 1 72 72 LYS H H 72 8.100 8.100 7.906 0.194 18496 3898 1 10 . 1 1 73 73 LEU HA H 73 4.281 4.281 4.198 0.083 18496 3899 1 10 . 1 1 73 73 LEU CA C 73 55.774 55.774 55.424 0.350 18496 3900 1 10 . 1 1 73 73 LEU CB C 73 41.983 41.983 42.431 -0.448 18496 3901 1 11 . 1 1 2 2 ALA HA H 2 4.074 4.074 4.565 -0.491 18496 3902 1 11 . 1 1 2 2 ALA CA C 2 51.966 51.966 51.437 0.529 18496 3903 1 11 . 1 1 2 2 ALA CB C 2 19.732 19.732 19.910 -0.178 18496 3904 1 11 . 1 1 3 3 ASP HA H 3 4.632 4.632 4.546 0.086 18496 3905 1 11 . 1 1 3 3 ASP C C 3 175.822 175.822 176.257 -0.435 18496 3906 1 11 . 1 1 3 3 ASP CA C 3 54.440 54.440 55.390 -0.950 18496 3907 1 11 . 1 1 3 3 ASP CB C 3 41.577 41.577 41.285 0.292 18496 3908 1 11 . 1 1 4 4 LYS N N 4 121.655 121.655 120.305 1.350 18496 3909 1 11 . 1 1 4 4 LYS HA H 4 4.379 4.379 4.533 -0.154 18496 3910 1 11 . 1 1 4 4 LYS C C 4 176.011 176.011 175.583 0.428 18496 3911 1 11 . 1 1 4 4 LYS CA C 4 56.213 56.213 54.999 1.214 18496 3912 1 11 . 1 1 4 4 LYS CB C 4 33.407 33.407 31.528 1.879 18496 3913 1 11 . 1 1 4 4 LYS H H 4 8.394 8.394 8.022 0.372 18496 3914 1 11 . 1 1 5 5 LEU N N 5 125.369 125.369 124.762 0.607 18496 3915 1 11 . 1 1 5 5 LEU HA H 5 4.351 4.351 4.300 0.051 18496 3916 1 11 . 1 1 5 5 LEU C C 5 175.682 175.682 176.756 -1.074 18496 3917 1 11 . 1 1 5 5 LEU CA C 5 55.117 55.117 54.829 0.288 18496 3918 1 11 . 1 1 5 5 LEU CB C 5 43.197 43.197 42.790 0.407 18496 3919 1 11 . 1 1 5 5 LEU H H 5 8.136 8.136 8.174 -0.038 18496 3920 1 11 . 1 1 6 6 LYS N N 6 126.844 126.844 126.338 0.506 18496 3921 1 11 . 1 1 6 6 LYS HA H 6 4.451 4.451 4.430 0.021 18496 3922 1 11 . 1 1 6 6 LYS C C 6 174.665 174.665 175.393 -0.728 18496 3923 1 11 . 1 1 6 6 LYS CA C 6 55.974 55.974 56.498 -0.524 18496 3924 1 11 . 1 1 6 6 LYS CB C 6 34.386 34.386 33.285 1.101 18496 3925 1 11 . 1 1 6 6 LYS H H 6 8.615 8.615 8.557 0.058 18496 3926 1 11 . 1 1 7 7 PHE N N 7 119.818 119.818 118.485 1.333 18496 3927 1 11 . 1 1 7 7 PHE HA H 7 5.343 5.343 5.495 -0.152 18496 3928 1 11 . 1 1 7 7 PHE C C 7 173.569 173.569 173.626 -0.057 18496 3929 1 11 . 1 1 7 7 PHE CA C 7 55.813 55.813 55.807 0.006 18496 3930 1 11 . 1 1 7 7 PHE CB C 7 42.975 42.975 42.457 0.518 18496 3931 1 11 . 1 1 7 7 PHE H H 7 7.734 7.734 8.099 -0.365 18496 3932 1 11 . 1 1 8 8 GLU N N 8 119.165 119.165 119.100 0.065 18496 3933 1 11 . 1 1 8 8 GLU HA H 8 4.158 4.158 4.277 -0.119 18496 3934 1 11 . 1 1 8 8 GLU C C 8 175.026 175.026 174.225 0.801 18496 3935 1 11 . 1 1 8 8 GLU CA C 8 55.221 55.221 54.502 0.719 18496 3936 1 11 . 1 1 8 8 GLU CB C 8 33.699 33.699 33.159 0.540 18496 3937 1 11 . 1 1 8 8 GLU H H 8 8.295 8.295 8.716 -0.421 18496 3938 1 11 . 1 1 9 9 ILE N N 9 127.619 127.619 127.329 0.290 18496 3939 1 11 . 1 1 9 9 ILE HA H 9 3.768 3.768 4.236 -0.468 18496 3940 1 11 . 1 1 9 9 ILE C C 9 174.902 174.902 175.756 -0.854 18496 3941 1 11 . 1 1 9 9 ILE CA C 9 62.505 62.505 62.286 0.219 18496 3942 1 11 . 1 1 9 9 ILE CB C 9 36.094 36.094 37.889 -1.795 18496 3943 1 11 . 1 1 9 9 ILE H H 9 9.157 9.157 8.695 0.462 18496 3944 1 11 . 1 1 10 10 ILE N N 10 131.245 131.245 128.728 2.517 18496 3945 1 11 . 1 1 10 10 ILE HA H 10 3.861 3.861 4.122 -0.261 18496 3946 1 11 . 1 1 10 10 ILE C C 10 176.247 176.247 176.296 -0.049 18496 3947 1 11 . 1 1 10 10 ILE CA C 10 60.554 60.554 62.085 -1.531 18496 3948 1 11 . 1 1 10 10 ILE CB C 10 37.406 37.406 38.503 -1.097 18496 3949 1 11 . 1 1 10 10 ILE H H 10 8.428 8.428 8.853 -0.425 18496 3950 1 11 . 1 1 11 11 GLU N N 11 117.669 117.669 118.526 -0.857 18496 3951 1 11 . 1 1 11 11 GLU HA H 11 4.315 4.315 4.488 -0.173 18496 3952 1 11 . 1 1 11 11 GLU C C 11 174.155 174.155 174.567 -0.412 18496 3953 1 11 . 1 1 11 11 GLU CA C 11 55.755 55.755 55.658 0.097 18496 3954 1 11 . 1 1 11 11 GLU CB C 11 34.386 34.386 32.898 1.488 18496 3955 1 11 . 1 1 11 11 GLU H H 11 7.551 7.551 7.998 -0.447 18496 3956 1 11 . 1 1 12 12 GLU N N 12 128.587 128.587 125.480 3.107 18496 3957 1 11 . 1 1 12 12 GLU HA H 12 5.214 5.214 4.449 0.765 18496 3958 1 11 . 1 1 12 12 GLU C C 12 176.877 176.877 175.485 1.392 18496 3959 1 11 . 1 1 12 12 GLU CA C 12 54.801 54.801 57.448 -2.647 18496 3960 1 11 . 1 1 12 12 GLU CB C 12 30.137 30.137 30.128 0.009 18496 3961 1 11 . 1 1 12 12 GLU H H 12 8.762 8.762 8.928 -0.166 18496 3962 1 11 . 1 1 13 13 LEU N N 13 122.508 122.508 124.378 -1.870 18496 3963 1 11 . 1 1 13 13 LEU HA H 13 4.872 4.872 4.723 0.149 18496 3964 1 11 . 1 1 13 13 LEU C C 13 176.060 176.060 177.088 -1.028 18496 3965 1 11 . 1 1 13 13 LEU CA C 13 57.372 57.372 55.723 1.649 18496 3966 1 11 . 1 1 13 13 LEU CB C 13 42.284 42.284 43.368 -1.084 18496 3967 1 11 . 1 1 13 13 LEU H H 13 8.058 8.058 8.814 -0.756 18496 3968 1 11 . 1 1 14 14 ILE N N 14 115.422 115.422 118.128 -2.706 18496 3969 1 11 . 1 1 14 14 ILE HA H 14 4.553 4.553 4.456 0.097 18496 3970 1 11 . 1 1 14 14 ILE C C 14 174.893 174.893 174.124 0.769 18496 3971 1 11 . 1 1 14 14 ILE CA C 14 60.586 60.586 59.339 1.247 18496 3972 1 11 . 1 1 14 14 ILE CB C 14 44.329 44.329 40.947 3.382 18496 3973 1 11 . 1 1 14 14 ILE H H 14 8.450 8.450 8.345 0.105 18496 3974 1 11 . 1 1 15 15 VAL N N 15 129.108 129.108 125.474 3.634 18496 3975 1 11 . 1 1 15 15 VAL HA H 15 4.196 4.196 4.314 -0.118 18496 3976 1 11 . 1 1 15 15 VAL C C 15 175.180 175.180 174.881 0.299 18496 3977 1 11 . 1 1 15 15 VAL CA C 15 63.288 63.288 61.422 1.866 18496 3978 1 11 . 1 1 15 15 VAL CB C 15 32.117 32.117 33.148 -1.031 18496 3979 1 11 . 1 1 15 15 VAL H H 15 8.867 8.867 8.463 0.404 18496 3980 1 11 . 1 1 16 16 LEU N N 16 127.846 127.846 129.496 -1.650 18496 3981 1 11 . 1 1 16 16 LEU HA H 16 4.317 4.317 4.647 -0.330 18496 3982 1 11 . 1 1 16 16 LEU C C 16 176.070 176.070 177.225 -1.155 18496 3983 1 11 . 1 1 16 16 LEU CA C 16 57.252 57.252 56.322 0.930 18496 3984 1 11 . 1 1 16 16 LEU CB C 16 42.035 42.035 42.665 -0.630 18496 3985 1 11 . 1 1 16 16 LEU H H 16 9.555 9.555 9.021 0.534 18496 3986 1 11 . 1 1 17 17 SER N N 17 107.073 107.073 110.114 -3.041 18496 3987 1 11 . 1 1 17 17 SER HA H 17 4.540 4.540 4.594 -0.054 18496 3988 1 11 . 1 1 17 17 SER C C 17 172.277 172.277 172.252 0.025 18496 3989 1 11 . 1 1 17 17 SER CA C 17 57.882 57.882 58.075 -0.193 18496 3990 1 11 . 1 1 17 17 SER CB C 17 64.046 64.046 65.110 -1.064 18496 3991 1 11 . 1 1 17 17 SER H H 17 7.699 7.699 7.694 0.005 18496 3992 1 11 . 1 1 18 18 GLU N N 18 119.235 119.235 119.548 -0.313 18496 3993 1 11 . 1 1 18 18 GLU HA H 18 5.143 5.143 5.280 -0.137 18496 3994 1 11 . 1 1 18 18 GLU C C 18 175.469 175.469 176.400 -0.931 18496 3995 1 11 . 1 1 18 18 GLU CA C 18 55.248 55.248 54.808 0.440 18496 3996 1 11 . 1 1 18 18 GLU CB C 18 33.454 33.454 31.475 1.979 18496 3997 1 11 . 1 1 18 18 GLU H H 18 8.437 8.437 8.503 -0.066 18496 3998 1 11 . 1 1 19 19 ASN N N 19 123.988 123.988 119.962 4.026 18496 3999 1 11 . 1 1 19 19 ASN HA H 19 5.097 5.097 4.921 0.176 18496 4000 1 11 . 1 1 19 19 ASN CA C 19 50.916 50.916 52.499 -1.583 18496 4001 1 11 . 1 1 19 19 ASN CB C 19 39.482 39.482 39.667 -0.185 18496 4002 1 11 . 1 1 19 19 ASN H H 19 8.779 8.779 8.304 0.475 18496 4003 1 11 . 1 1 20 20 ALA N N 20 120.854 120.854 123.370 -2.516 18496 4004 1 11 . 1 1 20 20 ALA HA H 20 4.239 4.239 4.175 0.064 18496 4005 1 11 . 1 1 20 20 ALA C C 20 179.032 179.032 177.852 1.180 18496 4006 1 11 . 1 1 20 20 ALA CA C 20 54.924 54.924 54.232 0.692 18496 4007 1 11 . 1 1 20 20 ALA CB C 20 18.621 18.621 18.180 0.441 18496 4008 1 11 . 1 1 20 20 ALA H H 20 8.616 8.616 8.502 0.114 18496 4009 1 11 . 1 1 21 21 LYS N N 21 115.771 115.771 116.597 -0.826 18496 4010 1 11 . 1 1 21 21 LYS HA H 21 4.497 4.497 4.251 0.246 18496 4011 1 11 . 1 1 21 21 LYS C C 21 176.615 176.615 176.642 -0.027 18496 4012 1 11 . 1 1 21 21 LYS CA C 21 55.503 55.503 55.641 -0.138 18496 4013 1 11 . 1 1 21 21 LYS CB C 21 32.742 32.742 32.132 0.610 18496 4014 1 11 . 1 1 21 21 LYS H H 21 7.767 7.767 7.780 -0.013 18496 4015 1 11 . 1 1 22 22 GLY N N 22 107.695 107.695 106.504 1.191 18496 4016 1 11 . 1 1 22 22 GLY C C 22 174.843 174.843 173.906 0.937 18496 4017 1 11 . 1 1 22 22 GLY CA C 22 45.297 45.297 45.175 0.122 18496 4018 1 11 . 1 1 22 22 GLY H H 22 8.317 8.317 7.853 0.464 18496 4019 1 11 . 1 1 23 23 TRP N N 23 121.316 121.316 121.074 0.242 18496 4020 1 11 . 1 1 23 23 TRP HA H 23 4.815 4.815 4.783 0.032 18496 4021 1 11 . 1 1 23 23 TRP C C 23 176.754 176.754 176.393 0.361 18496 4022 1 11 . 1 1 23 23 TRP CA C 23 58.291 58.291 55.209 3.082 18496 4023 1 11 . 1 1 23 23 TRP CB C 23 28.127 28.127 27.747 0.380 18496 4024 1 11 . 1 1 23 23 TRP H H 23 7.983 7.983 8.026 -0.043 18496 4025 1 11 . 1 1 24 24 ARG N N 24 120.789 120.789 127.021 -6.232 18496 4026 1 11 . 1 1 24 24 ARG HA H 24 5.496 5.496 4.693 0.803 18496 4027 1 11 . 1 1 24 24 ARG C C 24 175.831 175.831 175.842 -0.011 18496 4028 1 11 . 1 1 24 24 ARG CA C 24 54.755 54.755 54.690 0.065 18496 4029 1 11 . 1 1 24 24 ARG CB C 24 33.735 33.735 29.738 3.997 18496 4030 1 11 . 1 1 24 24 ARG H H 24 9.046 9.046 9.311 -0.265 18496 4031 1 11 . 1 1 25 25 LYS N N 25 126.507 126.507 128.988 -2.481 18496 4032 1 11 . 1 1 25 25 LYS HA H 25 5.081 5.081 4.573 0.508 18496 4033 1 11 . 1 1 25 25 LYS C C 25 175.648 175.648 175.573 0.075 18496 4034 1 11 . 1 1 25 25 LYS CA C 25 56.071 56.071 56.942 -0.871 18496 4035 1 11 . 1 1 25 25 LYS CB C 25 32.214 32.214 32.398 -0.184 18496 4036 1 11 . 1 1 25 25 LYS H H 25 8.526 8.526 8.918 -0.392 18496 4037 1 11 . 1 1 26 26 GLU N N 26 126.009 126.009 123.630 2.379 18496 4038 1 11 . 1 1 26 26 GLU HA H 26 5.275 5.275 4.990 0.285 18496 4039 1 11 . 1 1 26 26 GLU C C 26 174.894 174.894 173.794 1.100 18496 4040 1 11 . 1 1 26 26 GLU CA C 26 55.271 55.271 54.942 0.329 18496 4041 1 11 . 1 1 26 26 GLU CB C 26 33.781 33.781 34.737 -0.956 18496 4042 1 11 . 1 1 26 26 GLU H H 26 9.125 9.125 8.807 0.318 18496 4043 1 11 . 1 1 27 27 LEU N N 27 121.930 121.930 123.848 -1.918 18496 4044 1 11 . 1 1 27 27 LEU HA H 27 5.788 5.788 4.778 1.010 18496 4045 1 11 . 1 1 27 27 LEU C C 27 173.941 173.941 174.230 -0.289 18496 4046 1 11 . 1 1 27 27 LEU CA C 27 53.859 53.859 53.860 -0.001 18496 4047 1 11 . 1 1 27 27 LEU CB C 27 44.020 44.020 44.270 -0.250 18496 4048 1 11 . 1 1 27 27 LEU H H 27 8.938 8.938 8.987 -0.049 18496 4049 1 11 . 1 1 28 28 ASN N N 28 124.630 124.630 124.911 -0.281 18496 4050 1 11 . 1 1 28 28 ASN HA H 28 5.411 5.411 5.201 0.210 18496 4051 1 11 . 1 1 28 28 ASN C C 28 174.366 174.366 173.060 1.306 18496 4052 1 11 . 1 1 28 28 ASN CA C 28 52.063 52.063 52.229 -0.166 18496 4053 1 11 . 1 1 28 28 ASN CB C 28 44.430 44.430 43.386 1.044 18496 4054 1 11 . 1 1 28 28 ASN H H 28 9.345 9.345 8.223 1.122 18496 4055 1 11 . 1 1 29 29 ARG N N 29 118.443 118.443 121.682 -3.239 18496 4056 1 11 . 1 1 29 29 ARG HA H 29 5.058 5.058 4.927 0.131 18496 4057 1 11 . 1 1 29 29 ARG C C 29 175.779 175.779 174.497 1.282 18496 4058 1 11 . 1 1 29 29 ARG CA C 29 56.091 56.091 55.464 0.627 18496 4059 1 11 . 1 1 29 29 ARG CB C 29 31.710 31.710 31.348 0.362 18496 4060 1 11 . 1 1 29 29 ARG H H 29 9.109 9.109 9.049 0.060 18496 4061 1 11 . 1 1 30 30 VAL N N 30 124.605 124.605 122.395 2.210 18496 4062 1 11 . 1 1 30 30 VAL HA H 30 4.535 4.535 5.387 -0.852 18496 4063 1 11 . 1 1 30 30 VAL C C 30 174.775 174.775 174.215 0.560 18496 4064 1 11 . 1 1 30 30 VAL CA C 30 60.921 60.921 59.294 1.627 18496 4065 1 11 . 1 1 30 30 VAL CB C 30 37.790 37.790 36.310 1.480 18496 4066 1 11 . 1 1 30 30 VAL H H 30 9.054 9.054 8.583 0.471 18496 4067 1 11 . 1 1 31 31 SER N N 31 120.794 120.794 114.881 5.913 18496 4068 1 11 . 1 1 31 31 SER HA H 31 4.652 4.652 5.258 -0.606 18496 4069 1 11 . 1 1 31 31 SER C C 31 174.214 174.214 175.406 -1.192 18496 4070 1 11 . 1 1 31 31 SER CA C 31 56.279 56.279 56.935 -0.656 18496 4071 1 11 . 1 1 31 31 SER CB C 31 64.128 64.128 64.230 -0.102 18496 4072 1 11 . 1 1 31 31 SER H H 31 8.667 8.667 8.888 -0.221 18496 4073 1 11 . 1 1 32 32 TRP N N 32 132.303 132.303 127.873 4.430 18496 4074 1 11 . 1 1 32 32 TRP HA H 32 5.105 5.105 4.548 0.557 18496 4075 1 11 . 1 1 32 32 TRP C C 32 177.276 177.276 177.206 0.070 18496 4076 1 11 . 1 1 32 32 TRP CA C 32 56.198 56.198 57.724 -1.526 18496 4077 1 11 . 1 1 32 32 TRP CB C 32 29.968 29.968 28.044 1.924 18496 4078 1 11 . 1 1 32 32 TRP H H 32 9.282 9.282 9.207 0.075 18496 4079 1 11 . 1 1 33 33 ASN N N 33 124.979 124.979 123.420 1.559 18496 4080 1 11 . 1 1 33 33 ASN HA H 33 4.257 4.257 4.361 -0.104 18496 4081 1 11 . 1 1 33 33 ASN C C 33 174.030 174.030 174.729 -0.699 18496 4082 1 11 . 1 1 33 33 ASN CA C 33 54.709 54.709 54.806 -0.097 18496 4083 1 11 . 1 1 33 33 ASN CB C 33 37.921 37.921 37.125 0.796 18496 4084 1 11 . 1 1 33 33 ASN H H 33 9.813 9.813 8.866 0.947 18496 4085 1 11 . 1 1 34 34 ASP N N 34 111.880 111.880 113.823 -1.943 18496 4086 1 11 . 1 1 34 34 ASP HA H 34 4.126 4.126 4.257 -0.131 18496 4087 1 11 . 1 1 34 34 ASP CA C 34 56.130 56.130 55.416 0.714 18496 4088 1 11 . 1 1 34 34 ASP CB C 34 39.760 39.760 40.203 -0.443 18496 4089 1 11 . 1 1 34 34 ASP H H 34 9.251 9.251 8.223 1.028 18496 4090 1 11 . 1 1 35 35 ALA N N 35 121.811 121.811 121.409 0.402 18496 4091 1 11 . 1 1 35 35 ALA HA H 35 4.477 4.477 4.498 -0.021 18496 4092 1 11 . 1 1 35 35 ALA C C 35 177.778 177.778 177.114 0.664 18496 4093 1 11 . 1 1 35 35 ALA CA C 35 51.528 51.528 52.616 -1.088 18496 4094 1 11 . 1 1 35 35 ALA CB C 35 20.445 20.445 20.449 -0.004 18496 4095 1 11 . 1 1 35 35 ALA H H 35 7.625 7.625 7.795 -0.170 18496 4096 1 11 . 1 1 36 36 GLU N N 36 121.068 121.068 122.220 -1.152 18496 4097 1 11 . 1 1 36 36 GLU HA H 36 4.390 4.390 4.721 -0.331 18496 4098 1 11 . 1 1 36 36 GLU CA C 36 55.276 55.276 52.383 2.893 18496 4099 1 11 . 1 1 36 36 GLU CB C 36 28.575 28.575 31.044 -2.469 18496 4100 1 11 . 1 1 36 36 GLU H H 36 8.658 8.658 8.048 0.610 18496 4101 1 11 . 1 1 37 37 PRO HA H 37 4.289 4.289 4.702 -0.413 18496 4102 1 11 . 1 1 37 37 PRO C C 37 175.799 175.799 176.006 -0.207 18496 4103 1 11 . 1 1 37 37 PRO CA C 37 63.105 63.105 62.094 1.011 18496 4104 1 11 . 1 1 37 37 PRO CB C 37 32.076 32.076 31.830 0.246 18496 4105 1 11 . 1 1 38 38 LYS N N 38 120.881 120.881 123.486 -2.605 18496 4106 1 11 . 1 1 38 38 LYS HA H 38 4.700 4.700 4.298 0.402 18496 4107 1 11 . 1 1 38 38 LYS C C 38 176.906 176.906 174.684 2.222 18496 4108 1 11 . 1 1 38 38 LYS CA C 38 54.399 54.399 54.843 -0.444 18496 4109 1 11 . 1 1 38 38 LYS CB C 38 37.217 37.217 36.376 0.841 18496 4110 1 11 . 1 1 38 38 LYS H H 38 8.316 8.316 8.885 -0.569 18496 4111 1 11 . 1 1 39 39 TYR N N 39 119.792 119.792 118.801 0.991 18496 4112 1 11 . 1 1 39 39 TYR HA H 39 4.636 4.636 4.762 -0.126 18496 4113 1 11 . 1 1 39 39 TYR C C 39 175.834 175.834 175.349 0.485 18496 4114 1 11 . 1 1 39 39 TYR CA C 39 60.228 60.228 57.577 2.651 18496 4115 1 11 . 1 1 39 39 TYR CB C 39 38.683 38.683 39.148 -0.465 18496 4116 1 11 . 1 1 39 39 TYR H H 39 8.508 8.508 7.749 0.759 18496 4117 1 11 . 1 1 40 40 ASP N N 40 126.502 126.502 122.184 4.318 18496 4118 1 11 . 1 1 40 40 ASP HA H 40 5.597 5.597 5.243 0.354 18496 4119 1 11 . 1 1 40 40 ASP C C 40 175.283 175.283 173.962 1.321 18496 4120 1 11 . 1 1 40 40 ASP CA C 40 55.053 55.053 53.957 1.096 18496 4121 1 11 . 1 1 40 40 ASP CB C 40 48.656 48.656 45.357 3.299 18496 4122 1 11 . 1 1 40 40 ASP H H 40 9.219 9.219 8.749 0.470 18496 4123 1 11 . 1 1 41 41 ILE N N 41 125.910 125.910 124.830 1.080 18496 4124 1 11 . 1 1 41 41 ILE HA H 41 5.722 5.722 4.902 0.820 18496 4125 1 11 . 1 1 41 41 ILE C C 41 174.167 174.167 173.495 0.672 18496 4126 1 11 . 1 1 41 41 ILE CA C 41 60.734 60.734 59.714 1.020 18496 4127 1 11 . 1 1 41 41 ILE CB C 41 40.198 40.198 39.989 0.209 18496 4128 1 11 . 1 1 41 41 ILE H H 41 8.972 8.972 8.695 0.277 18496 4129 1 11 . 1 1 42 42 ARG N N 42 120.300 120.300 126.553 -6.253 18496 4130 1 11 . 1 1 42 42 ARG HA H 42 4.716 4.716 4.738 -0.022 18496 4131 1 11 . 1 1 42 42 ARG CA C 42 54.826 54.826 54.993 -0.167 18496 4132 1 11 . 1 1 42 42 ARG CB C 42 32.665 32.665 35.535 -2.870 18496 4133 1 11 . 1 1 42 42 ARG H H 42 8.320 8.320 8.552 -0.232 18496 4134 1 11 . 1 1 43 43 THR HA H 43 5.585 5.585 5.325 0.260 18496 4135 1 11 . 1 1 43 43 THR C C 43 173.294 173.294 173.760 -0.466 18496 4136 1 11 . 1 1 43 43 THR CA C 43 60.847 60.847 59.885 0.962 18496 4137 1 11 . 1 1 43 43 THR CB C 43 69.961 69.961 70.823 -0.862 18496 4138 1 11 . 1 1 44 44 TRP N N 44 122.747 122.747 124.228 -1.481 18496 4139 1 11 . 1 1 44 44 TRP HA H 44 4.945 4.945 4.974 -0.029 18496 4140 1 11 . 1 1 44 44 TRP C C 44 175.056 175.056 176.251 -1.195 18496 4141 1 11 . 1 1 44 44 TRP CA C 44 56.107 56.107 54.279 1.828 18496 4142 1 11 . 1 1 44 44 TRP CB C 44 34.506 34.506 31.378 3.128 18496 4143 1 11 . 1 1 44 44 TRP H H 44 9.180 9.180 8.460 0.720 18496 4144 1 11 . 1 1 45 45 SER N N 45 117.385 117.385 116.549 0.836 18496 4145 1 11 . 1 1 45 45 SER HA H 45 2.300 2.300 4.778 -2.478 18496 4146 1 11 . 1 1 45 45 SER CA C 45 56.481 56.481 57.279 -0.798 18496 4147 1 11 . 1 1 45 45 SER CB C 45 60.743 60.743 61.889 -1.147 18496 4148 1 11 . 1 1 45 45 SER H H 45 7.879 7.879 8.361 -0.482 18496 4149 1 11 . 1 1 46 46 PRO HA H 46 4.104 4.104 4.523 -0.419 18496 4150 1 11 . 1 1 46 46 PRO CA C 46 64.990 64.990 65.615 -0.625 18496 4151 1 11 . 1 1 46 46 PRO CB C 46 31.272 31.272 32.011 -0.739 18496 4152 1 11 . 1 1 47 47 ASP HA H 47 4.520 4.520 4.592 -0.072 18496 4153 1 11 . 1 1 47 47 ASP C C 47 175.629 175.629 175.777 -0.148 18496 4154 1 11 . 1 1 47 47 ASP CA C 47 53.453 53.453 53.408 0.045 18496 4155 1 11 . 1 1 47 47 ASP CB C 47 40.239 40.239 40.819 -0.580 18496 4156 1 11 . 1 1 48 48 HIS N N 48 111.320 111.320 114.286 -2.966 18496 4157 1 11 . 1 1 48 48 HIS HA H 48 3.916 3.916 4.450 -0.534 18496 4158 1 11 . 1 1 48 48 HIS CA C 48 60.347 60.347 57.200 3.147 18496 4159 1 11 . 1 1 48 48 HIS CB C 48 25.499 25.499 28.489 -2.990 18496 4160 1 11 . 1 1 48 48 HIS H H 48 8.269 8.269 8.075 0.194 18496 4161 1 11 . 1 1 49 49 GLU N N 49 114.659 114.659 116.920 -2.261 18496 4162 1 11 . 1 1 49 49 GLU HA H 49 4.447 4.447 4.247 0.200 18496 4163 1 11 . 1 1 49 49 GLU C C 49 176.394 176.394 176.215 0.179 18496 4164 1 11 . 1 1 49 49 GLU CA C 49 57.940 57.940 57.950 -0.010 18496 4165 1 11 . 1 1 49 49 GLU CB C 49 30.641 30.641 30.387 0.254 18496 4166 1 11 . 1 1 49 49 GLU H H 49 7.381 7.381 8.608 -1.227 18496 4167 1 11 . 1 1 50 50 LYS N N 50 118.126 118.126 117.862 0.264 18496 4168 1 11 . 1 1 50 50 LYS HA H 50 4.665 4.665 4.383 0.282 18496 4169 1 11 . 1 1 50 50 LYS CA C 50 54.431 54.431 54.946 -0.515 18496 4170 1 11 . 1 1 50 50 LYS CB C 50 36.543 36.543 35.516 1.027 18496 4171 1 11 . 1 1 50 50 LYS H H 50 8.067 8.067 7.567 0.500 18496 4172 1 11 . 1 1 51 51 MET HA H 51 4.936 4.936 4.547 0.389 18496 4173 1 11 . 1 1 51 51 MET CA C 51 54.048 54.048 53.042 1.006 18496 4174 1 11 . 1 1 51 51 MET CB C 51 33.768 33.768 35.023 -1.254 18496 4175 1 11 . 1 1 52 52 GLY C C 52 173.534 173.534 172.312 1.222 18496 4176 1 11 . 1 1 52 52 GLY CA C 52 43.060 43.060 44.520 -1.460 18496 4177 1 11 . 1 1 53 53 LYS N N 53 118.012 118.012 119.958 -1.946 18496 4178 1 11 . 1 1 53 53 LYS HA H 53 4.155 4.155 4.617 -0.462 18496 4179 1 11 . 1 1 53 53 LYS C C 53 176.818 176.818 176.141 0.677 18496 4180 1 11 . 1 1 53 53 LYS CA C 53 56.478 56.478 56.079 0.399 18496 4181 1 11 . 1 1 53 53 LYS CB C 53 33.117 33.117 33.466 -0.349 18496 4182 1 11 . 1 1 53 53 LYS H H 53 8.132 8.132 8.313 -0.181 18496 4183 1 11 . 1 1 54 54 GLY N N 54 109.836 109.836 109.640 0.196 18496 4184 1 11 . 1 1 54 54 GLY C C 54 170.848 170.848 172.772 -1.924 18496 4185 1 11 . 1 1 54 54 GLY CA C 54 46.701 46.701 45.003 1.698 18496 4186 1 11 . 1 1 54 54 GLY H H 54 8.079 8.079 8.303 -0.224 18496 4187 1 11 . 1 1 55 55 ILE N N 55 119.382 119.382 120.299 -0.917 18496 4188 1 11 . 1 1 55 55 ILE HA H 55 4.956 4.956 4.613 0.343 18496 4189 1 11 . 1 1 55 55 ILE C C 55 171.737 171.737 173.454 -1.717 18496 4190 1 11 . 1 1 55 55 ILE CA C 55 57.059 57.059 60.504 -3.445 18496 4191 1 11 . 1 1 55 55 ILE CB C 55 44.241 44.241 41.442 2.799 18496 4192 1 11 . 1 1 55 55 ILE H H 55 8.661 8.661 8.311 0.350 18496 4193 1 11 . 1 1 56 56 THR N N 56 113.795 113.795 123.135 -9.340 18496 4194 1 11 . 1 1 56 56 THR HA H 56 5.607 5.607 4.728 0.879 18496 4195 1 11 . 1 1 56 56 THR C C 56 174.417 174.417 173.548 0.869 18496 4196 1 11 . 1 1 56 56 THR CA C 56 59.098 59.098 61.747 -2.649 18496 4197 1 11 . 1 1 56 56 THR CB C 56 72.153 72.153 69.854 2.299 18496 4198 1 11 . 1 1 56 56 THR H H 56 7.916 7.916 8.315 -0.399 18496 4199 1 11 . 1 1 57 57 LEU N N 57 121.044 121.044 128.054 -7.010 18496 4200 1 11 . 1 1 57 57 LEU HA H 57 5.311 5.311 4.681 0.630 18496 4201 1 11 . 1 1 57 57 LEU C C 57 176.150 176.150 175.534 0.616 18496 4202 1 11 . 1 1 57 57 LEU CA C 57 53.264 53.264 53.900 -0.636 18496 4203 1 11 . 1 1 57 57 LEU CB C 57 45.901 45.901 44.337 1.564 18496 4204 1 11 . 1 1 57 57 LEU H H 57 9.421 9.421 8.998 0.423 18496 4205 1 11 . 1 1 58 58 SER N N 58 119.548 119.548 118.547 1.001 18496 4206 1 11 . 1 1 58 58 SER HA H 58 4.734 4.734 4.581 0.153 18496 4207 1 11 . 1 1 58 58 SER C C 58 174.786 174.786 175.710 -0.924 18496 4208 1 11 . 1 1 58 58 SER CA C 58 56.948 56.948 57.687 -0.739 18496 4209 1 11 . 1 1 58 58 SER CB C 58 65.726 65.726 64.733 0.993 18496 4210 1 11 . 1 1 58 58 SER H H 58 9.771 9.771 9.042 0.729 18496 4211 1 11 . 1 1 59 59 GLU N N 59 120.827 120.827 122.455 -1.628 18496 4212 1 11 . 1 1 59 59 GLU HA H 59 4.319 4.319 4.157 0.162 18496 4213 1 11 . 1 1 59 59 GLU C C 59 179.806 179.806 178.575 1.231 18496 4214 1 11 . 1 1 59 59 GLU CA C 59 60.913 60.913 61.143 -0.230 18496 4215 1 11 . 1 1 59 59 GLU CB C 59 29.538 29.538 29.389 0.149 18496 4216 1 11 . 1 1 59 59 GLU H H 59 9.394 9.394 9.155 0.239 18496 4217 1 11 . 1 1 60 60 GLU N N 60 119.587 119.587 119.674 -0.087 18496 4218 1 11 . 1 1 60 60 GLU HA H 60 4.188 4.188 4.099 0.089 18496 4219 1 11 . 1 1 60 60 GLU C C 60 179.686 179.686 178.801 0.885 18496 4220 1 11 . 1 1 60 60 GLU CA C 60 60.279 60.279 59.483 0.796 18496 4221 1 11 . 1 1 60 60 GLU CB C 60 29.559 29.559 28.764 0.795 18496 4222 1 11 . 1 1 60 60 GLU H H 60 8.905 8.905 8.868 0.037 18496 4223 1 11 . 1 1 61 61 GLU N N 61 120.145 120.145 120.011 0.134 18496 4224 1 11 . 1 1 61 61 GLU HA H 61 4.037 4.037 4.108 -0.071 18496 4225 1 11 . 1 1 61 61 GLU C C 61 178.530 178.530 178.800 -0.270 18496 4226 1 11 . 1 1 61 61 GLU CA C 61 59.118 59.118 58.816 0.302 18496 4227 1 11 . 1 1 61 61 GLU CB C 61 30.976 30.976 29.402 1.574 18496 4228 1 11 . 1 1 61 61 GLU H H 61 8.013 8.013 8.224 -0.211 18496 4229 1 11 . 1 1 62 62 PHE N N 62 119.925 119.925 120.431 -0.506 18496 4230 1 11 . 1 1 62 62 PHE HA H 62 3.927 3.927 3.981 -0.054 18496 4231 1 11 . 1 1 62 62 PHE C C 62 176.783 176.783 177.775 -0.992 18496 4232 1 11 . 1 1 62 62 PHE CA C 62 61.827 61.827 61.530 0.297 18496 4233 1 11 . 1 1 62 62 PHE CB C 62 40.216 40.216 38.733 1.483 18496 4234 1 11 . 1 1 62 62 PHE H H 62 9.192 9.192 8.968 0.224 18496 4235 1 11 . 1 1 63 63 GLY N N 63 104.854 104.854 106.784 -1.930 18496 4236 1 11 . 1 1 63 63 GLY C C 63 176.854 176.854 176.070 0.784 18496 4237 1 11 . 1 1 63 63 GLY CA C 63 47.178 47.178 47.398 -0.220 18496 4238 1 11 . 1 1 63 63 GLY H H 63 8.316 8.316 8.487 -0.171 18496 4239 1 11 . 1 1 64 64 VAL N N 64 123.719 123.719 122.822 0.897 18496 4240 1 11 . 1 1 64 64 VAL HA H 64 3.663 3.663 3.751 -0.088 18496 4241 1 11 . 1 1 64 64 VAL C C 64 177.644 177.644 177.744 -0.100 18496 4242 1 11 . 1 1 64 64 VAL CA C 64 67.090 67.090 65.379 1.711 18496 4243 1 11 . 1 1 64 64 VAL CB C 64 31.367 31.367 31.048 0.319 18496 4244 1 11 . 1 1 64 64 VAL H H 64 7.759 7.759 7.495 0.264 18496 4245 1 11 . 1 1 65 65 LEU N N 65 120.099 120.099 121.436 -1.337 18496 4246 1 11 . 1 1 65 65 LEU HA H 65 3.672 3.672 3.907 -0.235 18496 4247 1 11 . 1 1 65 65 LEU C C 65 177.636 177.636 178.681 -1.045 18496 4248 1 11 . 1 1 65 65 LEU CA C 65 58.552 58.552 58.569 -0.017 18496 4249 1 11 . 1 1 65 65 LEU CB C 65 41.358 41.358 41.648 -0.290 18496 4250 1 11 . 1 1 65 65 LEU H H 65 7.660 7.660 8.385 -0.725 18496 4251 1 11 . 1 1 66 66 LEU N N 66 115.733 115.733 117.990 -2.257 18496 4252 1 11 . 1 1 66 66 LEU HA H 66 3.556 3.556 3.622 -0.066 18496 4253 1 11 . 1 1 66 66 LEU C C 66 179.729 179.729 178.852 0.877 18496 4254 1 11 . 1 1 66 66 LEU CA C 66 58.069 58.069 58.058 0.011 18496 4255 1 11 . 1 1 66 66 LEU CB C 66 41.625 41.625 40.953 0.672 18496 4256 1 11 . 1 1 66 66 LEU H H 66 8.083 8.083 8.097 -0.014 18496 4257 1 11 . 1 1 67 67 LYS N N 67 119.120 119.120 119.983 -0.863 18496 4258 1 11 . 1 1 67 67 LYS HA H 67 3.965 3.965 3.815 0.150 18496 4259 1 11 . 1 1 67 67 LYS C C 67 179.379 179.379 179.042 0.337 18496 4260 1 11 . 1 1 67 67 LYS CA C 67 59.227 59.227 59.770 -0.543 18496 4261 1 11 . 1 1 67 67 LYS CB C 67 32.737 32.737 32.222 0.515 18496 4262 1 11 . 1 1 67 67 LYS H H 67 7.861 7.861 7.807 0.054 18496 4263 1 11 . 1 1 68 68 GLU N N 68 116.924 116.924 118.943 -2.019 18496 4264 1 11 . 1 1 68 68 GLU HA H 68 4.409 4.409 4.056 0.353 18496 4265 1 11 . 1 1 68 68 GLU CA C 68 57.712 57.712 58.953 -1.241 18496 4266 1 11 . 1 1 68 68 GLU CB C 68 29.586 29.586 29.561 0.025 18496 4267 1 11 . 1 1 68 68 GLU H H 68 8.319 8.319 8.084 0.235 18496 4268 1 11 . 1 1 69 69 LEU N N 69 120.032 120.032 119.718 0.314 18496 4269 1 11 . 1 1 69 69 LEU HA H 69 4.107 4.107 3.952 0.155 18496 4270 1 11 . 1 1 69 69 LEU CA C 69 57.563 57.563 57.450 0.113 18496 4271 1 11 . 1 1 69 69 LEU CB C 69 41.373 41.373 41.538 -0.165 18496 4272 1 11 . 1 1 69 69 LEU H H 69 8.233 8.233 8.519 -0.286 18496 4273 1 11 . 1 1 70 70 GLY N N 70 105.472 105.472 105.176 0.296 18496 4274 1 11 . 1 1 70 70 GLY C C 70 174.986 174.986 176.224 -1.238 18496 4275 1 11 . 1 1 70 70 GLY CA C 70 46.704 46.704 46.693 0.011 18496 4276 1 11 . 1 1 70 70 GLY H H 70 7.960 7.960 8.514 -0.554 18496 4277 1 11 . 1 1 71 71 ASN N N 71 118.596 118.596 119.103 -0.507 18496 4278 1 11 . 1 1 71 71 ASN HA H 71 4.681 4.681 4.847 -0.166 18496 4279 1 11 . 1 1 71 71 ASN C C 71 176.412 176.412 177.415 -1.003 18496 4280 1 11 . 1 1 71 71 ASN CA C 71 54.407 54.407 54.770 -0.363 18496 4281 1 11 . 1 1 71 71 ASN CB C 71 38.729 38.729 38.500 0.229 18496 4282 1 11 . 1 1 71 71 ASN H H 71 7.857 7.857 7.775 0.082 18496 4283 1 11 . 1 1 72 72 LYS N N 72 119.973 119.973 119.739 0.234 18496 4284 1 11 . 1 1 72 72 LYS HA H 72 4.282 4.282 4.193 0.089 18496 4285 1 11 . 1 1 72 72 LYS CA C 72 57.338 57.338 57.696 -0.358 18496 4286 1 11 . 1 1 72 72 LYS CB C 72 32.755 32.755 32.111 0.644 18496 4287 1 11 . 1 1 72 72 LYS H H 72 8.100 8.100 7.796 0.304 18496 4288 1 11 . 1 1 73 73 LEU HA H 73 4.281 4.281 4.315 -0.034 18496 4289 1 11 . 1 1 73 73 LEU CA C 73 55.774 55.774 54.719 1.055 18496 4290 1 11 . 1 1 73 73 LEU CB C 73 41.983 41.983 42.196 -0.212 18496 4291 1 12 . 1 1 2 2 ALA HA H 2 4.074 4.074 4.545 -0.471 18496 4292 1 12 . 1 1 2 2 ALA CA C 2 51.966 51.966 51.486 0.480 18496 4293 1 12 . 1 1 2 2 ALA CB C 2 19.732 19.732 20.051 -0.319 18496 4294 1 12 . 1 1 3 3 ASP HA H 3 4.632 4.632 4.498 0.134 18496 4295 1 12 . 1 1 3 3 ASP C C 3 175.822 175.822 176.337 -0.515 18496 4296 1 12 . 1 1 3 3 ASP CA C 3 54.440 54.440 55.482 -1.042 18496 4297 1 12 . 1 1 3 3 ASP CB C 3 41.577 41.577 41.254 0.323 18496 4298 1 12 . 1 1 4 4 LYS N N 4 121.655 121.655 119.652 2.003 18496 4299 1 12 . 1 1 4 4 LYS HA H 4 4.379 4.379 4.522 -0.143 18496 4300 1 12 . 1 1 4 4 LYS C C 4 176.011 176.011 175.569 0.442 18496 4301 1 12 . 1 1 4 4 LYS CA C 4 56.213 56.213 55.333 0.880 18496 4302 1 12 . 1 1 4 4 LYS CB C 4 33.407 33.407 31.921 1.486 18496 4303 1 12 . 1 1 4 4 LYS H H 4 8.394 8.394 7.974 0.420 18496 4304 1 12 . 1 1 5 5 LEU N N 5 125.369 125.369 124.328 1.041 18496 4305 1 12 . 1 1 5 5 LEU HA H 5 4.351 4.351 4.267 0.084 18496 4306 1 12 . 1 1 5 5 LEU C C 5 175.682 175.682 176.847 -1.165 18496 4307 1 12 . 1 1 5 5 LEU CA C 5 55.117 55.117 55.091 0.026 18496 4308 1 12 . 1 1 5 5 LEU CB C 5 43.197 43.197 42.771 0.426 18496 4309 1 12 . 1 1 5 5 LEU H H 5 8.136 8.136 8.126 0.010 18496 4310 1 12 . 1 1 6 6 LYS N N 6 126.844 126.844 124.893 1.951 18496 4311 1 12 . 1 1 6 6 LYS HA H 6 4.451 4.451 4.476 -0.025 18496 4312 1 12 . 1 1 6 6 LYS C C 6 174.665 174.665 175.683 -1.018 18496 4313 1 12 . 1 1 6 6 LYS CA C 6 55.974 55.974 56.270 -0.296 18496 4314 1 12 . 1 1 6 6 LYS CB C 6 34.386 34.386 33.089 1.297 18496 4315 1 12 . 1 1 6 6 LYS H H 6 8.615 8.615 8.565 0.050 18496 4316 1 12 . 1 1 7 7 PHE N N 7 119.818 119.818 120.384 -0.566 18496 4317 1 12 . 1 1 7 7 PHE HA H 7 5.343 5.343 5.380 -0.037 18496 4318 1 12 . 1 1 7 7 PHE C C 7 173.569 173.569 173.610 -0.041 18496 4319 1 12 . 1 1 7 7 PHE CA C 7 55.813 55.813 56.048 -0.235 18496 4320 1 12 . 1 1 7 7 PHE CB C 7 42.975 42.975 42.560 0.415 18496 4321 1 12 . 1 1 7 7 PHE H H 7 7.734 7.734 8.236 -0.502 18496 4322 1 12 . 1 1 8 8 GLU N N 8 119.165 119.165 120.659 -1.494 18496 4323 1 12 . 1 1 8 8 GLU HA H 8 4.158 4.158 4.361 -0.203 18496 4324 1 12 . 1 1 8 8 GLU C C 8 175.026 175.026 175.083 -0.057 18496 4325 1 12 . 1 1 8 8 GLU CA C 8 55.221 55.221 54.379 0.842 18496 4326 1 12 . 1 1 8 8 GLU CB C 8 33.699 33.699 33.263 0.436 18496 4327 1 12 . 1 1 8 8 GLU H H 8 8.295 8.295 8.430 -0.135 18496 4328 1 12 . 1 1 9 9 ILE N N 9 127.619 127.619 127.463 0.156 18496 4329 1 12 . 1 1 9 9 ILE HA H 9 3.768 3.768 4.101 -0.333 18496 4330 1 12 . 1 1 9 9 ILE C C 9 174.902 174.902 175.922 -1.020 18496 4331 1 12 . 1 1 9 9 ILE CA C 9 62.505 62.505 62.840 -0.335 18496 4332 1 12 . 1 1 9 9 ILE CB C 9 36.094 36.094 37.604 -1.510 18496 4333 1 12 . 1 1 9 9 ILE H H 9 9.157 9.157 8.632 0.525 18496 4334 1 12 . 1 1 10 10 ILE N N 10 131.245 131.245 129.059 2.186 18496 4335 1 12 . 1 1 10 10 ILE HA H 10 3.861 3.861 4.066 -0.205 18496 4336 1 12 . 1 1 10 10 ILE C C 10 176.247 176.247 176.413 -0.166 18496 4337 1 12 . 1 1 10 10 ILE CA C 10 60.554 60.554 62.344 -1.790 18496 4338 1 12 . 1 1 10 10 ILE CB C 10 37.406 37.406 38.426 -1.020 18496 4339 1 12 . 1 1 10 10 ILE H H 10 8.428 8.428 8.722 -0.294 18496 4340 1 12 . 1 1 11 11 GLU N N 11 117.669 117.669 118.634 -0.965 18496 4341 1 12 . 1 1 11 11 GLU HA H 11 4.315 4.315 4.502 -0.187 18496 4342 1 12 . 1 1 11 11 GLU C C 11 174.155 174.155 174.614 -0.459 18496 4343 1 12 . 1 1 11 11 GLU CA C 11 55.755 55.755 55.517 0.238 18496 4344 1 12 . 1 1 11 11 GLU CB C 11 34.386 34.386 32.788 1.598 18496 4345 1 12 . 1 1 11 11 GLU H H 11 7.551 7.551 7.971 -0.420 18496 4346 1 12 . 1 1 12 12 GLU N N 12 128.587 128.587 125.383 3.204 18496 4347 1 12 . 1 1 12 12 GLU HA H 12 5.214 5.214 4.451 0.763 18496 4348 1 12 . 1 1 12 12 GLU C C 12 176.877 176.877 175.486 1.391 18496 4349 1 12 . 1 1 12 12 GLU CA C 12 54.801 54.801 57.554 -2.753 18496 4350 1 12 . 1 1 12 12 GLU CB C 12 30.137 30.137 30.369 -0.232 18496 4351 1 12 . 1 1 12 12 GLU H H 12 8.762 8.762 8.936 -0.174 18496 4352 1 12 . 1 1 13 13 LEU N N 13 122.508 122.508 123.495 -0.987 18496 4353 1 12 . 1 1 13 13 LEU HA H 13 4.872 4.872 4.758 0.114 18496 4354 1 12 . 1 1 13 13 LEU C C 13 176.060 176.060 177.033 -0.973 18496 4355 1 12 . 1 1 13 13 LEU CA C 13 57.372 57.372 55.657 1.715 18496 4356 1 12 . 1 1 13 13 LEU CB C 13 42.284 42.284 43.518 -1.234 18496 4357 1 12 . 1 1 13 13 LEU H H 13 8.058 8.058 8.593 -0.535 18496 4358 1 12 . 1 1 14 14 ILE N N 14 115.422 115.422 118.058 -2.636 18496 4359 1 12 . 1 1 14 14 ILE HA H 14 4.553 4.553 4.455 0.098 18496 4360 1 12 . 1 1 14 14 ILE C C 14 174.893 174.893 174.105 0.788 18496 4361 1 12 . 1 1 14 14 ILE CA C 14 60.586 60.586 59.680 0.906 18496 4362 1 12 . 1 1 14 14 ILE CB C 14 44.329 44.329 41.305 3.024 18496 4363 1 12 . 1 1 14 14 ILE H H 14 8.450 8.450 8.369 0.081 18496 4364 1 12 . 1 1 15 15 VAL N N 15 129.108 129.108 125.805 3.303 18496 4365 1 12 . 1 1 15 15 VAL HA H 15 4.196 4.196 4.428 -0.232 18496 4366 1 12 . 1 1 15 15 VAL C C 15 175.180 175.180 175.091 0.089 18496 4367 1 12 . 1 1 15 15 VAL CA C 15 63.288 63.288 61.072 2.216 18496 4368 1 12 . 1 1 15 15 VAL CB C 15 32.117 32.117 32.685 -0.568 18496 4369 1 12 . 1 1 15 15 VAL H H 15 8.867 8.867 8.542 0.325 18496 4370 1 12 . 1 1 16 16 LEU N N 16 127.846 127.846 129.178 -1.332 18496 4371 1 12 . 1 1 16 16 LEU HA H 16 4.317 4.317 4.635 -0.318 18496 4372 1 12 . 1 1 16 16 LEU C C 16 176.070 176.070 177.309 -1.239 18496 4373 1 12 . 1 1 16 16 LEU CA C 16 57.252 57.252 56.373 0.879 18496 4374 1 12 . 1 1 16 16 LEU CB C 16 42.035 42.035 42.623 -0.588 18496 4375 1 12 . 1 1 16 16 LEU H H 16 9.555 9.555 8.616 0.940 18496 4376 1 12 . 1 1 17 17 SER N N 17 107.073 107.073 110.472 -3.399 18496 4377 1 12 . 1 1 17 17 SER HA H 17 4.540 4.540 4.627 -0.087 18496 4378 1 12 . 1 1 17 17 SER C C 17 172.277 172.277 172.258 0.019 18496 4379 1 12 . 1 1 17 17 SER CA C 17 57.882 57.882 57.990 -0.108 18496 4380 1 12 . 1 1 17 17 SER CB C 17 64.046 64.046 65.119 -1.073 18496 4381 1 12 . 1 1 17 17 SER H H 17 7.699 7.699 7.914 -0.215 18496 4382 1 12 . 1 1 18 18 GLU N N 18 119.235 119.235 120.128 -0.893 18496 4383 1 12 . 1 1 18 18 GLU HA H 18 5.143 5.143 4.866 0.277 18496 4384 1 12 . 1 1 18 18 GLU C C 18 175.469 175.469 176.223 -0.754 18496 4385 1 12 . 1 1 18 18 GLU CA C 18 55.248 55.248 55.173 0.075 18496 4386 1 12 . 1 1 18 18 GLU CB C 18 33.454 33.454 30.827 2.627 18496 4387 1 12 . 1 1 18 18 GLU H H 18 8.437 8.437 8.507 -0.070 18496 4388 1 12 . 1 1 19 19 ASN N N 19 123.988 123.988 122.177 1.811 18496 4389 1 12 . 1 1 19 19 ASN HA H 19 5.097 5.097 4.698 0.399 18496 4390 1 12 . 1 1 19 19 ASN CA C 19 50.916 50.916 53.464 -2.548 18496 4391 1 12 . 1 1 19 19 ASN CB C 19 39.482 39.482 39.686 -0.204 18496 4392 1 12 . 1 1 19 19 ASN H H 19 8.779 8.779 8.601 0.178 18496 4393 1 12 . 1 1 20 20 ALA N N 20 120.854 120.854 122.698 -1.844 18496 4394 1 12 . 1 1 20 20 ALA HA H 20 4.239 4.239 4.179 0.060 18496 4395 1 12 . 1 1 20 20 ALA C C 20 179.032 179.032 178.104 0.928 18496 4396 1 12 . 1 1 20 20 ALA CA C 20 54.924 54.924 54.252 0.672 18496 4397 1 12 . 1 1 20 20 ALA CB C 20 18.621 18.621 18.722 -0.101 18496 4398 1 12 . 1 1 20 20 ALA H H 20 8.616 8.616 8.661 -0.045 18496 4399 1 12 . 1 1 21 21 LYS N N 21 115.771 115.771 116.476 -0.705 18496 4400 1 12 . 1 1 21 21 LYS HA H 21 4.497 4.497 4.229 0.268 18496 4401 1 12 . 1 1 21 21 LYS C C 21 176.615 176.615 176.711 -0.096 18496 4402 1 12 . 1 1 21 21 LYS CA C 21 55.503 55.503 55.495 0.007 18496 4403 1 12 . 1 1 21 21 LYS CB C 21 32.742 32.742 32.160 0.582 18496 4404 1 12 . 1 1 21 21 LYS H H 21 7.767 7.767 7.694 0.073 18496 4405 1 12 . 1 1 22 22 GLY N N 22 107.695 107.695 106.838 0.857 18496 4406 1 12 . 1 1 22 22 GLY C C 22 174.843 174.843 174.456 0.387 18496 4407 1 12 . 1 1 22 22 GLY CA C 22 45.297 45.297 45.230 0.067 18496 4408 1 12 . 1 1 22 22 GLY H H 22 8.317 8.317 7.840 0.477 18496 4409 1 12 . 1 1 23 23 TRP N N 23 121.316 121.316 121.535 -0.219 18496 4410 1 12 . 1 1 23 23 TRP HA H 23 4.815 4.815 4.807 0.008 18496 4411 1 12 . 1 1 23 23 TRP C C 23 176.754 176.754 176.481 0.273 18496 4412 1 12 . 1 1 23 23 TRP CA C 23 58.291 58.291 55.119 3.172 18496 4413 1 12 . 1 1 23 23 TRP CB C 23 28.127 28.127 28.059 0.068 18496 4414 1 12 . 1 1 23 23 TRP H H 23 7.983 7.983 8.013 -0.030 18496 4415 1 12 . 1 1 24 24 ARG N N 24 120.789 120.789 126.964 -6.175 18496 4416 1 12 . 1 1 24 24 ARG HA H 24 5.496 5.496 5.023 0.473 18496 4417 1 12 . 1 1 24 24 ARG C C 24 175.831 175.831 176.098 -0.267 18496 4418 1 12 . 1 1 24 24 ARG CA C 24 54.755 54.755 54.482 0.273 18496 4419 1 12 . 1 1 24 24 ARG CB C 24 33.735 33.735 30.236 3.499 18496 4420 1 12 . 1 1 24 24 ARG H H 24 9.046 9.046 9.355 -0.309 18496 4421 1 12 . 1 1 25 25 LYS N N 25 126.507 126.507 129.173 -2.666 18496 4422 1 12 . 1 1 25 25 LYS HA H 25 5.081 5.081 4.781 0.300 18496 4423 1 12 . 1 1 25 25 LYS C C 25 175.648 175.648 175.656 -0.008 18496 4424 1 12 . 1 1 25 25 LYS CA C 25 56.071 56.071 57.060 -0.989 18496 4425 1 12 . 1 1 25 25 LYS CB C 25 32.214 32.214 32.904 -0.690 18496 4426 1 12 . 1 1 25 25 LYS H H 25 8.526 8.526 8.323 0.203 18496 4427 1 12 . 1 1 26 26 GLU N N 26 126.009 126.009 123.846 2.163 18496 4428 1 12 . 1 1 26 26 GLU HA H 26 5.275 5.275 5.102 0.173 18496 4429 1 12 . 1 1 26 26 GLU C C 26 174.894 174.894 174.191 0.703 18496 4430 1 12 . 1 1 26 26 GLU CA C 26 55.271 55.271 55.069 0.202 18496 4431 1 12 . 1 1 26 26 GLU CB C 26 33.781 33.781 34.699 -0.918 18496 4432 1 12 . 1 1 26 26 GLU H H 26 9.125 9.125 9.193 -0.068 18496 4433 1 12 . 1 1 27 27 LEU N N 27 121.930 121.930 124.646 -2.716 18496 4434 1 12 . 1 1 27 27 LEU HA H 27 5.788 5.788 4.848 0.940 18496 4435 1 12 . 1 1 27 27 LEU C C 27 173.941 173.941 174.383 -0.442 18496 4436 1 12 . 1 1 27 27 LEU CA C 27 53.859 53.859 53.909 -0.050 18496 4437 1 12 . 1 1 27 27 LEU CB C 27 44.020 44.020 44.088 -0.068 18496 4438 1 12 . 1 1 27 27 LEU H H 27 8.938 8.938 9.065 -0.127 18496 4439 1 12 . 1 1 28 28 ASN N N 28 124.630 124.630 125.131 -0.501 18496 4440 1 12 . 1 1 28 28 ASN HA H 28 5.411 5.411 5.234 0.177 18496 4441 1 12 . 1 1 28 28 ASN C C 28 174.366 174.366 173.159 1.207 18496 4442 1 12 . 1 1 28 28 ASN CA C 28 52.063 52.063 52.340 -0.277 18496 4443 1 12 . 1 1 28 28 ASN CB C 28 44.430 44.430 43.459 0.971 18496 4444 1 12 . 1 1 28 28 ASN H H 28 9.345 9.345 8.226 1.119 18496 4445 1 12 . 1 1 29 29 ARG N N 29 118.443 118.443 122.000 -3.557 18496 4446 1 12 . 1 1 29 29 ARG HA H 29 5.058 5.058 4.913 0.145 18496 4447 1 12 . 1 1 29 29 ARG C C 29 175.779 175.779 174.532 1.247 18496 4448 1 12 . 1 1 29 29 ARG CA C 29 56.091 56.091 55.560 0.531 18496 4449 1 12 . 1 1 29 29 ARG CB C 29 31.710 31.710 31.243 0.467 18496 4450 1 12 . 1 1 29 29 ARG H H 29 9.109 9.109 9.043 0.066 18496 4451 1 12 . 1 1 30 30 VAL N N 30 124.605 124.605 122.319 2.286 18496 4452 1 12 . 1 1 30 30 VAL HA H 30 4.535 4.535 5.350 -0.815 18496 4453 1 12 . 1 1 30 30 VAL C C 30 174.775 174.775 174.318 0.457 18496 4454 1 12 . 1 1 30 30 VAL CA C 30 60.921 60.921 59.194 1.727 18496 4455 1 12 . 1 1 30 30 VAL CB C 30 37.790 37.790 36.248 1.542 18496 4456 1 12 . 1 1 30 30 VAL H H 30 9.054 9.054 8.381 0.673 18496 4457 1 12 . 1 1 31 31 SER N N 31 120.794 120.794 114.772 6.022 18496 4458 1 12 . 1 1 31 31 SER HA H 31 4.652 4.652 5.123 -0.471 18496 4459 1 12 . 1 1 31 31 SER C C 31 174.214 174.214 175.436 -1.222 18496 4460 1 12 . 1 1 31 31 SER CA C 31 56.279 56.279 57.089 -0.810 18496 4461 1 12 . 1 1 31 31 SER CB C 31 64.128 64.128 64.063 0.065 18496 4462 1 12 . 1 1 31 31 SER H H 31 8.667 8.667 8.798 -0.131 18496 4463 1 12 . 1 1 32 32 TRP N N 32 132.303 132.303 128.158 4.145 18496 4464 1 12 . 1 1 32 32 TRP HA H 32 5.105 5.105 4.530 0.575 18496 4465 1 12 . 1 1 32 32 TRP C C 32 177.276 177.276 177.118 0.158 18496 4466 1 12 . 1 1 32 32 TRP CA C 32 56.198 56.198 58.474 -2.276 18496 4467 1 12 . 1 1 32 32 TRP CB C 32 29.968 29.968 28.108 1.860 18496 4468 1 12 . 1 1 32 32 TRP H H 32 9.282 9.282 9.347 -0.065 18496 4469 1 12 . 1 1 33 33 ASN N N 33 124.979 124.979 123.645 1.334 18496 4470 1 12 . 1 1 33 33 ASN HA H 33 4.257 4.257 4.398 -0.141 18496 4471 1 12 . 1 1 33 33 ASN C C 33 174.030 174.030 174.741 -0.711 18496 4472 1 12 . 1 1 33 33 ASN CA C 33 54.709 54.709 54.753 -0.044 18496 4473 1 12 . 1 1 33 33 ASN CB C 33 37.921 37.921 37.037 0.884 18496 4474 1 12 . 1 1 33 33 ASN H H 33 9.813 9.813 8.817 0.996 18496 4475 1 12 . 1 1 34 34 ASP N N 34 111.880 111.880 113.810 -1.930 18496 4476 1 12 . 1 1 34 34 ASP HA H 34 4.126 4.126 4.255 -0.130 18496 4477 1 12 . 1 1 34 34 ASP CA C 34 56.130 56.130 55.418 0.712 18496 4478 1 12 . 1 1 34 34 ASP CB C 34 39.760 39.760 40.155 -0.395 18496 4479 1 12 . 1 1 34 34 ASP H H 34 9.251 9.251 8.304 0.947 18496 4480 1 12 . 1 1 35 35 ALA N N 35 121.811 121.811 121.429 0.382 18496 4481 1 12 . 1 1 35 35 ALA HA H 35 4.477 4.477 4.502 -0.025 18496 4482 1 12 . 1 1 35 35 ALA C C 35 177.778 177.778 177.084 0.694 18496 4483 1 12 . 1 1 35 35 ALA CA C 35 51.528 51.528 52.633 -1.105 18496 4484 1 12 . 1 1 35 35 ALA CB C 35 20.445 20.445 20.485 -0.040 18496 4485 1 12 . 1 1 35 35 ALA H H 35 7.625 7.625 7.758 -0.133 18496 4486 1 12 . 1 1 36 36 GLU N N 36 121.068 121.068 122.386 -1.318 18496 4487 1 12 . 1 1 36 36 GLU HA H 36 4.390 4.390 4.750 -0.360 18496 4488 1 12 . 1 1 36 36 GLU CA C 36 55.276 55.276 52.361 2.915 18496 4489 1 12 . 1 1 36 36 GLU CB C 36 28.575 28.575 31.009 -2.434 18496 4490 1 12 . 1 1 36 36 GLU H H 36 8.658 8.658 7.986 0.672 18496 4491 1 12 . 1 1 37 37 PRO HA H 37 4.289 4.289 4.698 -0.409 18496 4492 1 12 . 1 1 37 37 PRO C C 37 175.799 175.799 176.059 -0.260 18496 4493 1 12 . 1 1 37 37 PRO CA C 37 63.105 63.105 62.281 0.824 18496 4494 1 12 . 1 1 37 37 PRO CB C 37 32.076 32.076 31.685 0.391 18496 4495 1 12 . 1 1 38 38 LYS N N 38 120.881 120.881 123.385 -2.504 18496 4496 1 12 . 1 1 38 38 LYS HA H 38 4.700 4.700 4.409 0.291 18496 4497 1 12 . 1 1 38 38 LYS C C 38 176.906 176.906 174.598 2.308 18496 4498 1 12 . 1 1 38 38 LYS CA C 38 54.399 54.399 54.920 -0.521 18496 4499 1 12 . 1 1 38 38 LYS CB C 38 37.217 37.217 36.443 0.774 18496 4500 1 12 . 1 1 38 38 LYS H H 38 8.316 8.316 8.820 -0.504 18496 4501 1 12 . 1 1 39 39 TYR N N 39 119.792 119.792 118.684 1.108 18496 4502 1 12 . 1 1 39 39 TYR HA H 39 4.636 4.636 4.561 0.075 18496 4503 1 12 . 1 1 39 39 TYR C C 39 175.834 175.834 174.922 0.912 18496 4504 1 12 . 1 1 39 39 TYR CA C 39 60.228 60.228 57.927 2.301 18496 4505 1 12 . 1 1 39 39 TYR CB C 39 38.683 38.683 38.995 -0.312 18496 4506 1 12 . 1 1 39 39 TYR H H 39 8.508 8.508 7.987 0.521 18496 4507 1 12 . 1 1 40 40 ASP N N 40 126.502 126.502 122.975 3.527 18496 4508 1 12 . 1 1 40 40 ASP HA H 40 5.597 5.597 5.309 0.288 18496 4509 1 12 . 1 1 40 40 ASP C C 40 175.283 175.283 174.008 1.275 18496 4510 1 12 . 1 1 40 40 ASP CA C 40 55.053 55.053 53.693 1.360 18496 4511 1 12 . 1 1 40 40 ASP CB C 40 48.656 48.656 45.459 3.197 18496 4512 1 12 . 1 1 40 40 ASP H H 40 9.219 9.219 8.474 0.745 18496 4513 1 12 . 1 1 41 41 ILE N N 41 125.910 125.910 124.803 1.107 18496 4514 1 12 . 1 1 41 41 ILE HA H 41 5.722 5.722 4.964 0.758 18496 4515 1 12 . 1 1 41 41 ILE C C 41 174.167 174.167 173.602 0.565 18496 4516 1 12 . 1 1 41 41 ILE CA C 41 60.734 60.734 59.817 0.917 18496 4517 1 12 . 1 1 41 41 ILE CB C 41 40.198 40.198 39.975 0.223 18496 4518 1 12 . 1 1 41 41 ILE H H 41 8.972 8.972 8.814 0.158 18496 4519 1 12 . 1 1 42 42 ARG N N 42 120.300 120.300 126.704 -6.404 18496 4520 1 12 . 1 1 42 42 ARG HA H 42 4.716 4.716 4.767 -0.051 18496 4521 1 12 . 1 1 42 42 ARG CA C 42 54.826 54.826 54.894 -0.068 18496 4522 1 12 . 1 1 42 42 ARG CB C 42 32.665 32.665 35.390 -2.725 18496 4523 1 12 . 1 1 42 42 ARG H H 42 8.320 8.320 8.603 -0.283 18496 4524 1 12 . 1 1 43 43 THR HA H 43 5.585 5.585 5.482 0.103 18496 4525 1 12 . 1 1 43 43 THR C C 43 173.294 173.294 173.182 0.112 18496 4526 1 12 . 1 1 43 43 THR CA C 43 60.847 60.847 59.745 1.102 18496 4527 1 12 . 1 1 43 43 THR CB C 43 69.961 69.961 71.106 -1.145 18496 4528 1 12 . 1 1 44 44 TRP N N 44 122.747 122.747 123.500 -0.753 18496 4529 1 12 . 1 1 44 44 TRP HA H 44 4.945 4.945 4.785 0.160 18496 4530 1 12 . 1 1 44 44 TRP C C 44 175.056 175.056 175.959 -0.903 18496 4531 1 12 . 1 1 44 44 TRP CA C 44 56.107 56.107 55.783 0.324 18496 4532 1 12 . 1 1 44 44 TRP CB C 44 34.506 34.506 32.524 1.982 18496 4533 1 12 . 1 1 44 44 TRP H H 44 9.180 9.180 8.851 0.329 18496 4534 1 12 . 1 1 45 45 SER N N 45 117.385 117.385 116.165 1.220 18496 4535 1 12 . 1 1 45 45 SER HA H 45 2.300 2.300 4.941 -2.641 18496 4536 1 12 . 1 1 45 45 SER CA C 45 56.481 56.481 56.696 -0.215 18496 4537 1 12 . 1 1 45 45 SER CB C 45 60.743 60.743 62.200 -1.458 18496 4538 1 12 . 1 1 45 45 SER H H 45 7.879 7.879 8.350 -0.471 18496 4539 1 12 . 1 1 46 46 PRO HA H 46 4.104 4.104 4.457 -0.353 18496 4540 1 12 . 1 1 46 46 PRO CA C 46 64.990 64.990 65.699 -0.709 18496 4541 1 12 . 1 1 46 46 PRO CB C 46 31.272 31.272 31.817 -0.545 18496 4542 1 12 . 1 1 47 47 ASP HA H 47 4.520 4.520 4.660 -0.140 18496 4543 1 12 . 1 1 47 47 ASP C C 47 175.629 175.629 175.471 0.158 18496 4544 1 12 . 1 1 47 47 ASP CA C 47 53.453 53.453 52.975 0.478 18496 4545 1 12 . 1 1 47 47 ASP CB C 47 40.239 40.239 41.124 -0.885 18496 4546 1 12 . 1 1 48 48 HIS N N 48 111.320 111.320 116.344 -5.024 18496 4547 1 12 . 1 1 48 48 HIS HA H 48 3.916 3.916 4.528 -0.612 18496 4548 1 12 . 1 1 48 48 HIS CA C 48 60.347 60.347 57.573 2.774 18496 4549 1 12 . 1 1 48 48 HIS CB C 48 25.499 25.499 27.795 -2.296 18496 4550 1 12 . 1 1 48 48 HIS H H 48 8.269 8.269 8.258 0.011 18496 4551 1 12 . 1 1 49 49 GLU N N 49 114.659 114.659 116.890 -2.231 18496 4552 1 12 . 1 1 49 49 GLU HA H 49 4.447 4.447 4.355 0.092 18496 4553 1 12 . 1 1 49 49 GLU C C 49 176.394 176.394 176.286 0.108 18496 4554 1 12 . 1 1 49 49 GLU CA C 49 57.940 57.940 57.941 -0.001 18496 4555 1 12 . 1 1 49 49 GLU CB C 49 30.641 30.641 30.973 -0.332 18496 4556 1 12 . 1 1 49 49 GLU H H 49 7.381 7.381 8.281 -0.900 18496 4557 1 12 . 1 1 50 50 LYS N N 50 118.126 118.126 117.920 0.206 18496 4558 1 12 . 1 1 50 50 LYS HA H 50 4.665 4.665 4.680 -0.015 18496 4559 1 12 . 1 1 50 50 LYS CA C 50 54.431 54.431 54.351 0.080 18496 4560 1 12 . 1 1 50 50 LYS CB C 50 36.543 36.543 36.566 -0.023 18496 4561 1 12 . 1 1 50 50 LYS H H 50 8.067 8.067 8.015 0.052 18496 4562 1 12 . 1 1 51 51 MET HA H 51 4.936 4.936 4.449 0.487 18496 4563 1 12 . 1 1 51 51 MET CA C 51 54.048 54.048 53.287 0.761 18496 4564 1 12 . 1 1 51 51 MET CB C 51 33.768 33.768 34.959 -1.192 18496 4565 1 12 . 1 1 52 52 GLY C C 52 173.534 173.534 172.356 1.178 18496 4566 1 12 . 1 1 52 52 GLY CA C 52 43.060 43.060 44.302 -1.242 18496 4567 1 12 . 1 1 53 53 LYS N N 53 118.012 118.012 119.527 -1.515 18496 4568 1 12 . 1 1 53 53 LYS HA H 53 4.155 4.155 4.444 -0.289 18496 4569 1 12 . 1 1 53 53 LYS C C 53 176.818 176.818 176.131 0.687 18496 4570 1 12 . 1 1 53 53 LYS CA C 53 56.478 56.478 56.144 0.334 18496 4571 1 12 . 1 1 53 53 LYS CB C 53 33.117 33.117 33.259 -0.142 18496 4572 1 12 . 1 1 53 53 LYS H H 53 8.132 8.132 8.065 0.067 18496 4573 1 12 . 1 1 54 54 GLY N N 54 109.836 109.836 108.392 1.444 18496 4574 1 12 . 1 1 54 54 GLY C C 54 170.848 170.848 172.917 -2.069 18496 4575 1 12 . 1 1 54 54 GLY CA C 54 46.701 46.701 44.963 1.738 18496 4576 1 12 . 1 1 54 54 GLY H H 54 8.079 8.079 8.260 -0.181 18496 4577 1 12 . 1 1 55 55 ILE N N 55 119.382 119.382 120.301 -0.919 18496 4578 1 12 . 1 1 55 55 ILE HA H 55 4.956 4.956 4.617 0.339 18496 4579 1 12 . 1 1 55 55 ILE C C 55 171.737 171.737 173.353 -1.616 18496 4580 1 12 . 1 1 55 55 ILE CA C 55 57.059 57.059 60.847 -3.788 18496 4581 1 12 . 1 1 55 55 ILE CB C 55 44.241 44.241 41.710 2.531 18496 4582 1 12 . 1 1 55 55 ILE H H 55 8.661 8.661 8.359 0.302 18496 4583 1 12 . 1 1 56 56 THR N N 56 113.795 113.795 122.952 -9.157 18496 4584 1 12 . 1 1 56 56 THR HA H 56 5.607 5.607 4.895 0.712 18496 4585 1 12 . 1 1 56 56 THR C C 56 174.417 174.417 173.552 0.865 18496 4586 1 12 . 1 1 56 56 THR CA C 56 59.098 59.098 61.421 -2.323 18496 4587 1 12 . 1 1 56 56 THR CB C 56 72.153 72.153 70.123 2.030 18496 4588 1 12 . 1 1 56 56 THR H H 56 7.916 7.916 8.293 -0.377 18496 4589 1 12 . 1 1 57 57 LEU N N 57 121.044 121.044 127.005 -5.961 18496 4590 1 12 . 1 1 57 57 LEU HA H 57 5.311 5.311 5.017 0.294 18496 4591 1 12 . 1 1 57 57 LEU C C 57 176.150 176.150 175.690 0.460 18496 4592 1 12 . 1 1 57 57 LEU CA C 57 53.264 53.264 53.598 -0.334 18496 4593 1 12 . 1 1 57 57 LEU CB C 57 45.901 45.901 45.604 0.297 18496 4594 1 12 . 1 1 57 57 LEU H H 57 9.421 9.421 9.079 0.342 18496 4595 1 12 . 1 1 58 58 SER N N 58 119.548 119.548 117.987 1.561 18496 4596 1 12 . 1 1 58 58 SER HA H 58 4.734 4.734 4.489 0.245 18496 4597 1 12 . 1 1 58 58 SER C C 58 174.786 174.786 175.619 -0.833 18496 4598 1 12 . 1 1 58 58 SER CA C 58 56.948 56.948 58.080 -1.132 18496 4599 1 12 . 1 1 58 58 SER CB C 58 65.726 65.726 64.291 1.435 18496 4600 1 12 . 1 1 58 58 SER H H 58 9.771 9.771 9.370 0.401 18496 4601 1 12 . 1 1 59 59 GLU N N 59 120.827 120.827 123.234 -2.407 18496 4602 1 12 . 1 1 59 59 GLU HA H 59 4.319 4.319 4.155 0.164 18496 4603 1 12 . 1 1 59 59 GLU C C 59 179.806 179.806 178.698 1.108 18496 4604 1 12 . 1 1 59 59 GLU CA C 59 60.913 60.913 61.259 -0.346 18496 4605 1 12 . 1 1 59 59 GLU CB C 59 29.538 29.538 29.417 0.121 18496 4606 1 12 . 1 1 59 59 GLU H H 59 9.394 9.394 9.183 0.211 18496 4607 1 12 . 1 1 60 60 GLU N N 60 119.587 119.587 119.320 0.267 18496 4608 1 12 . 1 1 60 60 GLU HA H 60 4.188 4.188 4.110 0.078 18496 4609 1 12 . 1 1 60 60 GLU C C 60 179.686 179.686 178.761 0.925 18496 4610 1 12 . 1 1 60 60 GLU CA C 60 60.279 60.279 59.530 0.749 18496 4611 1 12 . 1 1 60 60 GLU CB C 60 29.559 29.559 28.772 0.787 18496 4612 1 12 . 1 1 60 60 GLU H H 60 8.905 8.905 8.837 0.068 18496 4613 1 12 . 1 1 61 61 GLU N N 61 120.145 120.145 120.056 0.089 18496 4614 1 12 . 1 1 61 61 GLU HA H 61 4.037 4.037 4.082 -0.044 18496 4615 1 12 . 1 1 61 61 GLU C C 61 178.530 178.530 178.903 -0.373 18496 4616 1 12 . 1 1 61 61 GLU CA C 61 59.118 59.118 58.955 0.163 18496 4617 1 12 . 1 1 61 61 GLU CB C 61 30.976 30.976 29.302 1.674 18496 4618 1 12 . 1 1 61 61 GLU H H 61 8.013 8.013 8.352 -0.339 18496 4619 1 12 . 1 1 62 62 PHE N N 62 119.925 119.925 120.393 -0.468 18496 4620 1 12 . 1 1 62 62 PHE HA H 62 3.927 3.927 4.062 -0.135 18496 4621 1 12 . 1 1 62 62 PHE C C 62 176.783 176.783 177.583 -0.800 18496 4622 1 12 . 1 1 62 62 PHE CA C 62 61.827 61.827 61.429 0.398 18496 4623 1 12 . 1 1 62 62 PHE CB C 62 40.216 40.216 38.828 1.388 18496 4624 1 12 . 1 1 62 62 PHE H H 62 9.192 9.192 8.876 0.316 18496 4625 1 12 . 1 1 63 63 GLY N N 63 104.854 104.854 107.499 -2.645 18496 4626 1 12 . 1 1 63 63 GLY C C 63 176.854 176.854 175.993 0.861 18496 4627 1 12 . 1 1 63 63 GLY CA C 63 47.178 47.178 47.483 -0.305 18496 4628 1 12 . 1 1 63 63 GLY H H 63 8.316 8.316 8.531 -0.215 18496 4629 1 12 . 1 1 64 64 VAL N N 64 123.719 123.719 122.863 0.856 18496 4630 1 12 . 1 1 64 64 VAL HA H 64 3.663 3.663 3.718 -0.055 18496 4631 1 12 . 1 1 64 64 VAL C C 64 177.644 177.644 177.975 -0.331 18496 4632 1 12 . 1 1 64 64 VAL CA C 64 67.090 67.090 65.611 1.479 18496 4633 1 12 . 1 1 64 64 VAL CB C 64 31.367 31.367 30.966 0.401 18496 4634 1 12 . 1 1 64 64 VAL H H 64 7.759 7.759 7.751 0.008 18496 4635 1 12 . 1 1 65 65 LEU N N 65 120.099 120.099 121.297 -1.198 18496 4636 1 12 . 1 1 65 65 LEU HA H 65 3.672 3.672 3.911 -0.239 18496 4637 1 12 . 1 1 65 65 LEU C C 65 177.636 177.636 178.635 -0.999 18496 4638 1 12 . 1 1 65 65 LEU CA C 65 58.552 58.552 58.454 0.098 18496 4639 1 12 . 1 1 65 65 LEU CB C 65 41.358 41.358 41.725 -0.367 18496 4640 1 12 . 1 1 65 65 LEU H H 65 7.660 7.660 8.048 -0.388 18496 4641 1 12 . 1 1 66 66 LEU N N 66 115.733 115.733 118.237 -2.504 18496 4642 1 12 . 1 1 66 66 LEU HA H 66 3.556 3.556 3.616 -0.060 18496 4643 1 12 . 1 1 66 66 LEU C C 66 179.729 179.729 178.814 0.915 18496 4644 1 12 . 1 1 66 66 LEU CA C 66 58.069 58.069 58.105 -0.035 18496 4645 1 12 . 1 1 66 66 LEU CB C 66 41.625 41.625 40.956 0.669 18496 4646 1 12 . 1 1 66 66 LEU H H 66 8.083 8.083 8.244 -0.161 18496 4647 1 12 . 1 1 67 67 LYS N N 67 119.120 119.120 119.877 -0.757 18496 4648 1 12 . 1 1 67 67 LYS HA H 67 3.965 3.965 3.799 0.166 18496 4649 1 12 . 1 1 67 67 LYS C C 67 179.379 179.379 179.035 0.344 18496 4650 1 12 . 1 1 67 67 LYS CA C 67 59.227 59.227 59.850 -0.623 18496 4651 1 12 . 1 1 67 67 LYS CB C 67 32.737 32.737 32.231 0.506 18496 4652 1 12 . 1 1 67 67 LYS H H 67 7.861 7.861 8.259 -0.398 18496 4653 1 12 . 1 1 68 68 GLU N N 68 116.924 116.924 118.835 -1.911 18496 4654 1 12 . 1 1 68 68 GLU HA H 68 4.409 4.409 4.088 0.321 18496 4655 1 12 . 1 1 68 68 GLU CA C 68 57.712 57.712 58.688 -0.976 18496 4656 1 12 . 1 1 68 68 GLU CB C 68 29.586 29.586 29.443 0.143 18496 4657 1 12 . 1 1 68 68 GLU H H 68 8.319 8.319 7.826 0.493 18496 4658 1 12 . 1 1 69 69 LEU N N 69 120.032 120.032 120.070 -0.038 18496 4659 1 12 . 1 1 69 69 LEU HA H 69 4.107 4.107 3.929 0.178 18496 4660 1 12 . 1 1 69 69 LEU CA C 69 57.563 57.563 57.536 0.027 18496 4661 1 12 . 1 1 69 69 LEU CB C 69 41.373 41.373 41.519 -0.146 18496 4662 1 12 . 1 1 69 69 LEU H H 69 8.233 8.233 8.488 -0.255 18496 4663 1 12 . 1 1 70 70 GLY N N 70 105.472 105.472 105.328 0.144 18496 4664 1 12 . 1 1 70 70 GLY C C 70 174.986 174.986 176.333 -1.347 18496 4665 1 12 . 1 1 70 70 GLY CA C 70 46.704 46.704 46.758 -0.054 18496 4666 1 12 . 1 1 70 70 GLY H H 70 7.960 7.960 8.619 -0.659 18496 4667 1 12 . 1 1 71 71 ASN N N 71 118.596 118.596 119.994 -1.398 18496 4668 1 12 . 1 1 71 71 ASN HA H 71 4.681 4.681 4.840 -0.159 18496 4669 1 12 . 1 1 71 71 ASN C C 71 176.412 176.412 177.926 -1.514 18496 4670 1 12 . 1 1 71 71 ASN CA C 71 54.407 54.407 55.362 -0.955 18496 4671 1 12 . 1 1 71 71 ASN CB C 71 38.729 38.729 38.542 0.187 18496 4672 1 12 . 1 1 71 71 ASN H H 71 7.857 7.857 7.763 0.094 18496 4673 1 12 . 1 1 72 72 LYS N N 72 119.973 119.973 120.358 -0.385 18496 4674 1 12 . 1 1 72 72 LYS HA H 72 4.282 4.282 4.131 0.151 18496 4675 1 12 . 1 1 72 72 LYS CA C 72 57.338 57.338 58.045 -0.707 18496 4676 1 12 . 1 1 72 72 LYS CB C 72 32.755 32.755 31.958 0.797 18496 4677 1 12 . 1 1 72 72 LYS H H 72 8.100 8.100 8.000 0.100 18496 4678 1 12 . 1 1 73 73 LEU HA H 73 4.281 4.281 4.347 -0.066 18496 4679 1 12 . 1 1 73 73 LEU CA C 73 55.774 55.774 54.557 1.216 18496 4680 1 12 . 1 1 73 73 LEU CB C 73 41.983 41.983 42.157 -0.174 18496 4681 1 13 . 1 1 2 2 ALA HA H 2 4.074 4.074 4.537 -0.463 18496 4682 1 13 . 1 1 2 2 ALA CA C 2 51.966 51.966 51.469 0.497 18496 4683 1 13 . 1 1 2 2 ALA CB C 2 19.732 19.732 20.126 -0.394 18496 4684 1 13 . 1 1 3 3 ASP HA H 3 4.632 4.632 4.481 0.151 18496 4685 1 13 . 1 1 3 3 ASP C C 3 175.822 175.822 176.369 -0.547 18496 4686 1 13 . 1 1 3 3 ASP CA C 3 54.440 54.440 55.640 -1.200 18496 4687 1 13 . 1 1 3 3 ASP CB C 3 41.577 41.577 41.238 0.339 18496 4688 1 13 . 1 1 4 4 LYS N N 4 121.655 121.655 119.788 1.867 18496 4689 1 13 . 1 1 4 4 LYS HA H 4 4.379 4.379 4.517 -0.138 18496 4690 1 13 . 1 1 4 4 LYS C C 4 176.011 176.011 175.615 0.396 18496 4691 1 13 . 1 1 4 4 LYS CA C 4 56.213 56.213 55.261 0.952 18496 4692 1 13 . 1 1 4 4 LYS CB C 4 33.407 33.407 31.534 1.873 18496 4693 1 13 . 1 1 4 4 LYS H H 4 8.394 8.394 8.013 0.381 18496 4694 1 13 . 1 1 5 5 LEU N N 5 125.369 125.369 124.557 0.812 18496 4695 1 13 . 1 1 5 5 LEU HA H 5 4.351 4.351 4.277 0.074 18496 4696 1 13 . 1 1 5 5 LEU C C 5 175.682 175.682 176.866 -1.184 18496 4697 1 13 . 1 1 5 5 LEU CA C 5 55.117 55.117 55.032 0.085 18496 4698 1 13 . 1 1 5 5 LEU CB C 5 43.197 43.197 42.789 0.408 18496 4699 1 13 . 1 1 5 5 LEU H H 5 8.136 8.136 8.147 -0.011 18496 4700 1 13 . 1 1 6 6 LYS N N 6 126.844 126.844 125.780 1.064 18496 4701 1 13 . 1 1 6 6 LYS HA H 6 4.451 4.451 4.416 0.035 18496 4702 1 13 . 1 1 6 6 LYS C C 6 174.665 174.665 175.631 -0.966 18496 4703 1 13 . 1 1 6 6 LYS CA C 6 55.974 55.974 56.549 -0.575 18496 4704 1 13 . 1 1 6 6 LYS CB C 6 34.386 34.386 32.911 1.475 18496 4705 1 13 . 1 1 6 6 LYS H H 6 8.615 8.615 8.576 0.039 18496 4706 1 13 . 1 1 7 7 PHE N N 7 119.818 119.818 119.448 0.370 18496 4707 1 13 . 1 1 7 7 PHE HA H 7 5.343 5.343 5.527 -0.184 18496 4708 1 13 . 1 1 7 7 PHE C C 7 173.569 173.569 173.768 -0.199 18496 4709 1 13 . 1 1 7 7 PHE CA C 7 55.813 55.813 55.644 0.169 18496 4710 1 13 . 1 1 7 7 PHE CB C 7 42.975 42.975 42.525 0.450 18496 4711 1 13 . 1 1 7 7 PHE H H 7 7.734 7.734 8.253 -0.519 18496 4712 1 13 . 1 1 8 8 GLU N N 8 119.165 119.165 119.857 -0.692 18496 4713 1 13 . 1 1 8 8 GLU HA H 8 4.158 4.158 4.223 -0.065 18496 4714 1 13 . 1 1 8 8 GLU C C 8 175.026 175.026 174.284 0.742 18496 4715 1 13 . 1 1 8 8 GLU CA C 8 55.221 55.221 54.485 0.736 18496 4716 1 13 . 1 1 8 8 GLU CB C 8 33.699 33.699 32.650 1.049 18496 4717 1 13 . 1 1 8 8 GLU H H 8 8.295 8.295 8.796 -0.501 18496 4718 1 13 . 1 1 9 9 ILE N N 9 127.619 127.619 127.809 -0.190 18496 4719 1 13 . 1 1 9 9 ILE HA H 9 3.768 3.768 4.139 -0.371 18496 4720 1 13 . 1 1 9 9 ILE C C 9 174.902 174.902 175.910 -1.008 18496 4721 1 13 . 1 1 9 9 ILE CA C 9 62.505 62.505 62.658 -0.153 18496 4722 1 13 . 1 1 9 9 ILE CB C 9 36.094 36.094 37.676 -1.583 18496 4723 1 13 . 1 1 9 9 ILE H H 9 9.157 9.157 8.686 0.471 18496 4724 1 13 . 1 1 10 10 ILE N N 10 131.245 131.245 128.598 2.647 18496 4725 1 13 . 1 1 10 10 ILE HA H 10 3.861 3.861 4.111 -0.250 18496 4726 1 13 . 1 1 10 10 ILE C C 10 176.247 176.247 176.264 -0.017 18496 4727 1 13 . 1 1 10 10 ILE CA C 10 60.554 60.554 62.033 -1.479 18496 4728 1 13 . 1 1 10 10 ILE CB C 10 37.406 37.406 38.443 -1.037 18496 4729 1 13 . 1 1 10 10 ILE H H 10 8.428 8.428 8.995 -0.567 18496 4730 1 13 . 1 1 11 11 GLU N N 11 117.669 117.669 118.556 -0.887 18496 4731 1 13 . 1 1 11 11 GLU HA H 11 4.315 4.315 4.462 -0.147 18496 4732 1 13 . 1 1 11 11 GLU C C 11 174.155 174.155 174.569 -0.414 18496 4733 1 13 . 1 1 11 11 GLU CA C 11 55.755 55.755 55.668 0.087 18496 4734 1 13 . 1 1 11 11 GLU CB C 11 34.386 34.386 32.844 1.542 18496 4735 1 13 . 1 1 11 11 GLU H H 11 7.551 7.551 7.789 -0.238 18496 4736 1 13 . 1 1 12 12 GLU N N 12 128.587 128.587 125.240 3.347 18496 4737 1 13 . 1 1 12 12 GLU HA H 12 5.214 5.214 4.417 0.797 18496 4738 1 13 . 1 1 12 12 GLU C C 12 176.877 176.877 175.971 0.906 18496 4739 1 13 . 1 1 12 12 GLU CA C 12 54.801 54.801 57.381 -2.580 18496 4740 1 13 . 1 1 12 12 GLU CB C 12 30.137 30.137 30.081 0.056 18496 4741 1 13 . 1 1 12 12 GLU H H 12 8.762 8.762 8.802 -0.040 18496 4742 1 13 . 1 1 13 13 LEU N N 13 122.508 122.508 122.439 0.069 18496 4743 1 13 . 1 1 13 13 LEU HA H 13 4.872 4.872 4.513 0.359 18496 4744 1 13 . 1 1 13 13 LEU C C 13 176.060 176.060 176.914 -0.854 18496 4745 1 13 . 1 1 13 13 LEU CA C 13 57.372 57.372 55.402 1.970 18496 4746 1 13 . 1 1 13 13 LEU CB C 13 42.284 42.284 43.556 -1.272 18496 4747 1 13 . 1 1 13 13 LEU H H 13 8.058 8.058 8.718 -0.660 18496 4748 1 13 . 1 1 14 14 ILE N N 14 115.422 115.422 117.919 -2.497 18496 4749 1 13 . 1 1 14 14 ILE HA H 14 4.553 4.553 4.460 0.093 18496 4750 1 13 . 1 1 14 14 ILE C C 14 174.893 174.893 174.110 0.783 18496 4751 1 13 . 1 1 14 14 ILE CA C 14 60.586 60.586 59.582 1.004 18496 4752 1 13 . 1 1 14 14 ILE CB C 14 44.329 44.329 41.437 2.892 18496 4753 1 13 . 1 1 14 14 ILE H H 14 8.450 8.450 8.426 0.024 18496 4754 1 13 . 1 1 15 15 VAL N N 15 129.108 129.108 125.157 3.951 18496 4755 1 13 . 1 1 15 15 VAL HA H 15 4.196 4.196 4.430 -0.234 18496 4756 1 13 . 1 1 15 15 VAL C C 15 175.180 175.180 174.958 0.222 18496 4757 1 13 . 1 1 15 15 VAL CA C 15 63.288 63.288 60.961 2.327 18496 4758 1 13 . 1 1 15 15 VAL CB C 15 32.117 32.117 32.947 -0.830 18496 4759 1 13 . 1 1 15 15 VAL H H 15 8.867 8.867 8.490 0.377 18496 4760 1 13 . 1 1 16 16 LEU N N 16 127.846 127.846 129.025 -1.179 18496 4761 1 13 . 1 1 16 16 LEU HA H 16 4.317 4.317 4.647 -0.330 18496 4762 1 13 . 1 1 16 16 LEU C C 16 176.070 176.070 177.253 -1.183 18496 4763 1 13 . 1 1 16 16 LEU CA C 16 57.252 57.252 56.364 0.888 18496 4764 1 13 . 1 1 16 16 LEU CB C 16 42.035 42.035 42.676 -0.641 18496 4765 1 13 . 1 1 16 16 LEU H H 16 9.555 9.555 8.903 0.652 18496 4766 1 13 . 1 1 17 17 SER N N 17 107.073 107.073 110.352 -3.279 18496 4767 1 13 . 1 1 17 17 SER HA H 17 4.540 4.540 4.599 -0.059 18496 4768 1 13 . 1 1 17 17 SER C C 17 172.277 172.277 172.198 0.079 18496 4769 1 13 . 1 1 17 17 SER CA C 17 57.882 57.882 58.088 -0.206 18496 4770 1 13 . 1 1 17 17 SER CB C 17 64.046 64.046 65.247 -1.201 18496 4771 1 13 . 1 1 17 17 SER H H 17 7.699 7.699 7.850 -0.151 18496 4772 1 13 . 1 1 18 18 GLU N N 18 119.235 119.235 120.198 -0.963 18496 4773 1 13 . 1 1 18 18 GLU HA H 18 5.143 5.143 4.807 0.336 18496 4774 1 13 . 1 1 18 18 GLU C C 18 175.469 175.469 176.248 -0.779 18496 4775 1 13 . 1 1 18 18 GLU CA C 18 55.248 55.248 55.279 -0.031 18496 4776 1 13 . 1 1 18 18 GLU CB C 18 33.454 33.454 30.648 2.806 18496 4777 1 13 . 1 1 18 18 GLU H H 18 8.437 8.437 8.517 -0.080 18496 4778 1 13 . 1 1 19 19 ASN N N 19 123.988 123.988 122.686 1.302 18496 4779 1 13 . 1 1 19 19 ASN HA H 19 5.097 5.097 4.688 0.409 18496 4780 1 13 . 1 1 19 19 ASN CA C 19 50.916 50.916 53.517 -2.601 18496 4781 1 13 . 1 1 19 19 ASN CB C 19 39.482 39.482 39.666 -0.185 18496 4782 1 13 . 1 1 19 19 ASN H H 19 8.779 8.779 8.571 0.208 18496 4783 1 13 . 1 1 20 20 ALA N N 20 120.854 120.854 122.928 -2.074 18496 4784 1 13 . 1 1 20 20 ALA HA H 20 4.239 4.239 4.173 0.066 18496 4785 1 13 . 1 1 20 20 ALA C C 20 179.032 179.032 178.189 0.843 18496 4786 1 13 . 1 1 20 20 ALA CA C 20 54.924 54.924 54.297 0.627 18496 4787 1 13 . 1 1 20 20 ALA CB C 20 18.621 18.621 18.743 -0.122 18496 4788 1 13 . 1 1 20 20 ALA H H 20 8.616 8.616 8.664 -0.048 18496 4789 1 13 . 1 1 21 21 LYS N N 21 115.771 115.771 116.515 -0.744 18496 4790 1 13 . 1 1 21 21 LYS HA H 21 4.497 4.497 4.207 0.290 18496 4791 1 13 . 1 1 21 21 LYS C C 21 176.615 176.615 176.744 -0.129 18496 4792 1 13 . 1 1 21 21 LYS CA C 21 55.503 55.503 55.644 -0.141 18496 4793 1 13 . 1 1 21 21 LYS CB C 21 32.742 32.742 32.172 0.570 18496 4794 1 13 . 1 1 21 21 LYS H H 21 7.767 7.767 7.805 -0.038 18496 4795 1 13 . 1 1 22 22 GLY N N 22 107.695 107.695 106.689 1.006 18496 4796 1 13 . 1 1 22 22 GLY C C 22 174.843 174.843 174.464 0.379 18496 4797 1 13 . 1 1 22 22 GLY CA C 22 45.297 45.297 45.228 0.069 18496 4798 1 13 . 1 1 22 22 GLY H H 22 8.317 8.317 7.838 0.479 18496 4799 1 13 . 1 1 23 23 TRP N N 23 121.316 121.316 121.511 -0.195 18496 4800 1 13 . 1 1 23 23 TRP HA H 23 4.815 4.815 4.859 -0.044 18496 4801 1 13 . 1 1 23 23 TRP C C 23 176.754 176.754 176.528 0.226 18496 4802 1 13 . 1 1 23 23 TRP CA C 23 58.291 58.291 55.015 3.276 18496 4803 1 13 . 1 1 23 23 TRP CB C 23 28.127 28.127 28.073 0.054 18496 4804 1 13 . 1 1 23 23 TRP H H 23 7.983 7.983 8.021 -0.038 18496 4805 1 13 . 1 1 24 24 ARG N N 24 120.789 120.789 127.014 -6.225 18496 4806 1 13 . 1 1 24 24 ARG HA H 24 5.496 5.496 4.991 0.505 18496 4807 1 13 . 1 1 24 24 ARG C C 24 175.831 175.831 176.217 -0.386 18496 4808 1 13 . 1 1 24 24 ARG CA C 24 54.755 54.755 54.484 0.271 18496 4809 1 13 . 1 1 24 24 ARG CB C 24 33.735 33.735 30.119 3.616 18496 4810 1 13 . 1 1 24 24 ARG H H 24 9.046 9.046 9.414 -0.368 18496 4811 1 13 . 1 1 25 25 LYS N N 25 126.507 126.507 129.343 -2.836 18496 4812 1 13 . 1 1 25 25 LYS HA H 25 5.081 5.081 4.812 0.269 18496 4813 1 13 . 1 1 25 25 LYS C C 25 175.648 175.648 175.703 -0.055 18496 4814 1 13 . 1 1 25 25 LYS CA C 25 56.071 56.071 57.157 -1.085 18496 4815 1 13 . 1 1 25 25 LYS CB C 25 32.214 32.214 32.725 -0.511 18496 4816 1 13 . 1 1 25 25 LYS H H 25 8.526 8.526 8.473 0.053 18496 4817 1 13 . 1 1 26 26 GLU N N 26 126.009 126.009 123.912 2.097 18496 4818 1 13 . 1 1 26 26 GLU HA H 26 5.275 5.275 5.098 0.177 18496 4819 1 13 . 1 1 26 26 GLU C C 26 174.894 174.894 174.128 0.766 18496 4820 1 13 . 1 1 26 26 GLU CA C 26 55.271 55.271 55.011 0.259 18496 4821 1 13 . 1 1 26 26 GLU CB C 26 33.781 33.781 34.798 -1.017 18496 4822 1 13 . 1 1 26 26 GLU H H 26 9.125 9.125 9.167 -0.042 18496 4823 1 13 . 1 1 27 27 LEU N N 27 121.930 121.930 123.895 -1.965 18496 4824 1 13 . 1 1 27 27 LEU HA H 27 5.788 5.788 4.882 0.906 18496 4825 1 13 . 1 1 27 27 LEU C C 27 173.941 173.941 174.303 -0.362 18496 4826 1 13 . 1 1 27 27 LEU CA C 27 53.859 53.859 54.046 -0.187 18496 4827 1 13 . 1 1 27 27 LEU CB C 27 44.020 44.020 44.544 -0.523 18496 4828 1 13 . 1 1 27 27 LEU H H 27 8.938 8.938 9.063 -0.125 18496 4829 1 13 . 1 1 28 28 ASN N N 28 124.630 124.630 124.851 -0.221 18496 4830 1 13 . 1 1 28 28 ASN HA H 28 5.411 5.411 5.210 0.201 18496 4831 1 13 . 1 1 28 28 ASN C C 28 174.366 174.366 173.343 1.023 18496 4832 1 13 . 1 1 28 28 ASN CA C 28 52.063 52.063 52.253 -0.190 18496 4833 1 13 . 1 1 28 28 ASN CB C 28 44.430 44.430 43.284 1.146 18496 4834 1 13 . 1 1 28 28 ASN H H 28 9.345 9.345 8.187 1.158 18496 4835 1 13 . 1 1 29 29 ARG N N 29 118.443 118.443 122.463 -4.020 18496 4836 1 13 . 1 1 29 29 ARG HA H 29 5.058 5.058 4.791 0.267 18496 4837 1 13 . 1 1 29 29 ARG C C 29 175.779 175.779 174.676 1.103 18496 4838 1 13 . 1 1 29 29 ARG CA C 29 56.091 56.091 55.949 0.142 18496 4839 1 13 . 1 1 29 29 ARG CB C 29 31.710 31.710 30.933 0.777 18496 4840 1 13 . 1 1 29 29 ARG H H 29 9.109 9.109 8.970 0.139 18496 4841 1 13 . 1 1 30 30 VAL N N 30 124.605 124.605 122.525 2.080 18496 4842 1 13 . 1 1 30 30 VAL HA H 30 4.535 4.535 5.375 -0.840 18496 4843 1 13 . 1 1 30 30 VAL C C 30 174.775 174.775 174.386 0.389 18496 4844 1 13 . 1 1 30 30 VAL CA C 30 60.921 60.921 59.197 1.724 18496 4845 1 13 . 1 1 30 30 VAL CB C 30 37.790 37.790 36.156 1.634 18496 4846 1 13 . 1 1 30 30 VAL H H 30 9.054 9.054 8.658 0.396 18496 4847 1 13 . 1 1 31 31 SER N N 31 120.794 120.794 115.440 5.354 18496 4848 1 13 . 1 1 31 31 SER HA H 31 4.652 4.652 5.095 -0.443 18496 4849 1 13 . 1 1 31 31 SER C C 31 174.214 174.214 175.349 -1.135 18496 4850 1 13 . 1 1 31 31 SER CA C 31 56.279 56.279 57.108 -0.829 18496 4851 1 13 . 1 1 31 31 SER CB C 31 64.128 64.128 64.058 0.070 18496 4852 1 13 . 1 1 31 31 SER H H 31 8.667 8.667 8.826 -0.159 18496 4853 1 13 . 1 1 32 32 TRP N N 32 132.303 132.303 128.059 4.244 18496 4854 1 13 . 1 1 32 32 TRP HA H 32 5.105 5.105 4.532 0.573 18496 4855 1 13 . 1 1 32 32 TRP C C 32 177.276 177.276 177.156 0.120 18496 4856 1 13 . 1 1 32 32 TRP CA C 32 56.198 56.198 58.056 -1.858 18496 4857 1 13 . 1 1 32 32 TRP CB C 32 29.968 29.968 28.078 1.890 18496 4858 1 13 . 1 1 32 32 TRP H H 32 9.282 9.282 9.193 0.089 18496 4859 1 13 . 1 1 33 33 ASN N N 33 124.979 124.979 123.779 1.200 18496 4860 1 13 . 1 1 33 33 ASN HA H 33 4.257 4.257 4.361 -0.104 18496 4861 1 13 . 1 1 33 33 ASN C C 33 174.030 174.030 174.746 -0.716 18496 4862 1 13 . 1 1 33 33 ASN CA C 33 54.709 54.709 54.737 -0.028 18496 4863 1 13 . 1 1 33 33 ASN CB C 33 37.921 37.921 36.913 1.008 18496 4864 1 13 . 1 1 33 33 ASN H H 33 9.813 9.813 8.841 0.972 18496 4865 1 13 . 1 1 34 34 ASP N N 34 111.880 111.880 113.710 -1.830 18496 4866 1 13 . 1 1 34 34 ASP HA H 34 4.126 4.126 4.201 -0.075 18496 4867 1 13 . 1 1 34 34 ASP CA C 34 56.130 56.130 55.873 0.258 18496 4868 1 13 . 1 1 34 34 ASP CB C 34 39.760 39.760 40.312 -0.552 18496 4869 1 13 . 1 1 34 34 ASP H H 34 9.251 9.251 8.316 0.935 18496 4870 1 13 . 1 1 35 35 ALA N N 35 121.811 121.811 120.983 0.828 18496 4871 1 13 . 1 1 35 35 ALA HA H 35 4.477 4.477 4.499 -0.022 18496 4872 1 13 . 1 1 35 35 ALA C C 35 177.778 177.778 177.064 0.714 18496 4873 1 13 . 1 1 35 35 ALA CA C 35 51.528 51.528 52.371 -0.843 18496 4874 1 13 . 1 1 35 35 ALA CB C 35 20.445 20.445 20.142 0.303 18496 4875 1 13 . 1 1 35 35 ALA H H 35 7.625 7.625 7.724 -0.099 18496 4876 1 13 . 1 1 36 36 GLU N N 36 121.068 121.068 121.649 -0.581 18496 4877 1 13 . 1 1 36 36 GLU HA H 36 4.390 4.390 4.635 -0.245 18496 4878 1 13 . 1 1 36 36 GLU CA C 36 55.276 55.276 52.487 2.789 18496 4879 1 13 . 1 1 36 36 GLU CB C 36 28.575 28.575 30.587 -2.012 18496 4880 1 13 . 1 1 36 36 GLU H H 36 8.658 8.658 8.551 0.107 18496 4881 1 13 . 1 1 37 37 PRO HA H 37 4.289 4.289 4.650 -0.361 18496 4882 1 13 . 1 1 37 37 PRO C C 37 175.799 175.799 175.738 0.061 18496 4883 1 13 . 1 1 37 37 PRO CA C 37 63.105 63.105 62.297 0.808 18496 4884 1 13 . 1 1 37 37 PRO CB C 37 32.076 32.076 31.888 0.188 18496 4885 1 13 . 1 1 38 38 LYS N N 38 120.881 120.881 122.658 -1.777 18496 4886 1 13 . 1 1 38 38 LYS HA H 38 4.700 4.700 4.348 0.352 18496 4887 1 13 . 1 1 38 38 LYS C C 38 176.906 176.906 174.759 2.147 18496 4888 1 13 . 1 1 38 38 LYS CA C 38 54.399 54.399 54.259 0.140 18496 4889 1 13 . 1 1 38 38 LYS CB C 38 37.217 37.217 36.446 0.771 18496 4890 1 13 . 1 1 38 38 LYS H H 38 8.316 8.316 8.783 -0.467 18496 4891 1 13 . 1 1 39 39 TYR N N 39 119.792 119.792 118.510 1.282 18496 4892 1 13 . 1 1 39 39 TYR HA H 39 4.636 4.636 4.576 0.060 18496 4893 1 13 . 1 1 39 39 TYR C C 39 175.834 175.834 174.623 1.211 18496 4894 1 13 . 1 1 39 39 TYR CA C 39 60.228 60.228 57.368 2.860 18496 4895 1 13 . 1 1 39 39 TYR CB C 39 38.683 38.683 39.026 -0.343 18496 4896 1 13 . 1 1 39 39 TYR H H 39 8.508 8.508 7.798 0.710 18496 4897 1 13 . 1 1 40 40 ASP N N 40 126.502 126.502 123.126 3.376 18496 4898 1 13 . 1 1 40 40 ASP HA H 40 5.597 5.597 5.348 0.249 18496 4899 1 13 . 1 1 40 40 ASP C C 40 175.283 175.283 174.121 1.162 18496 4900 1 13 . 1 1 40 40 ASP CA C 40 55.053 55.053 53.552 1.501 18496 4901 1 13 . 1 1 40 40 ASP CB C 40 48.656 48.656 45.400 3.256 18496 4902 1 13 . 1 1 40 40 ASP H H 40 9.219 9.219 8.319 0.900 18496 4903 1 13 . 1 1 41 41 ILE N N 41 125.910 125.910 125.149 0.761 18496 4904 1 13 . 1 1 41 41 ILE HA H 41 5.722 5.722 4.994 0.728 18496 4905 1 13 . 1 1 41 41 ILE C C 41 174.167 174.167 173.667 0.500 18496 4906 1 13 . 1 1 41 41 ILE CA C 41 60.734 60.734 59.879 0.855 18496 4907 1 13 . 1 1 41 41 ILE CB C 41 40.198 40.198 39.821 0.377 18496 4908 1 13 . 1 1 41 41 ILE H H 41 8.972 8.972 8.718 0.254 18496 4909 1 13 . 1 1 42 42 ARG N N 42 120.300 120.300 127.073 -6.773 18496 4910 1 13 . 1 1 42 42 ARG HA H 42 4.716 4.716 4.820 -0.104 18496 4911 1 13 . 1 1 42 42 ARG CA C 42 54.826 54.826 54.969 -0.143 18496 4912 1 13 . 1 1 42 42 ARG CB C 42 32.665 32.665 35.296 -2.631 18496 4913 1 13 . 1 1 42 42 ARG H H 42 8.320 8.320 8.756 -0.436 18496 4914 1 13 . 1 1 43 43 THR HA H 43 5.585 5.585 5.505 0.080 18496 4915 1 13 . 1 1 43 43 THR C C 43 173.294 173.294 173.178 0.116 18496 4916 1 13 . 1 1 43 43 THR CA C 43 60.847 60.847 59.314 1.533 18496 4917 1 13 . 1 1 43 43 THR CB C 43 69.961 69.961 71.049 -1.088 18496 4918 1 13 . 1 1 44 44 TRP N N 44 122.747 122.747 123.531 -0.784 18496 4919 1 13 . 1 1 44 44 TRP HA H 44 4.945 4.945 4.778 0.167 18496 4920 1 13 . 1 1 44 44 TRP C C 44 175.056 175.056 176.215 -1.159 18496 4921 1 13 . 1 1 44 44 TRP CA C 44 56.107 56.107 55.615 0.492 18496 4922 1 13 . 1 1 44 44 TRP CB C 44 34.506 34.506 32.336 2.171 18496 4923 1 13 . 1 1 44 44 TRP H H 44 9.180 9.180 8.796 0.384 18496 4924 1 13 . 1 1 45 45 SER N N 45 117.385 117.385 116.266 1.119 18496 4925 1 13 . 1 1 45 45 SER HA H 45 2.300 2.300 4.937 -2.637 18496 4926 1 13 . 1 1 45 45 SER CA C 45 56.481 56.481 56.670 -0.189 18496 4927 1 13 . 1 1 45 45 SER CB C 45 60.743 60.743 62.235 -1.492 18496 4928 1 13 . 1 1 45 45 SER H H 45 7.879 7.879 8.273 -0.394 18496 4929 1 13 . 1 1 46 46 PRO HA H 46 4.104 4.104 4.463 -0.359 18496 4930 1 13 . 1 1 46 46 PRO CA C 46 64.990 64.990 65.646 -0.656 18496 4931 1 13 . 1 1 46 46 PRO CB C 46 31.272 31.272 31.837 -0.565 18496 4932 1 13 . 1 1 47 47 ASP HA H 47 4.520 4.520 4.609 -0.089 18496 4933 1 13 . 1 1 47 47 ASP C C 47 175.629 175.629 175.689 -0.060 18496 4934 1 13 . 1 1 47 47 ASP CA C 47 53.453 53.453 53.142 0.311 18496 4935 1 13 . 1 1 47 47 ASP CB C 47 40.239 40.239 41.014 -0.775 18496 4936 1 13 . 1 1 48 48 HIS N N 48 111.320 111.320 115.953 -4.633 18496 4937 1 13 . 1 1 48 48 HIS HA H 48 3.916 3.916 4.519 -0.603 18496 4938 1 13 . 1 1 48 48 HIS CA C 48 60.347 60.347 57.672 2.675 18496 4939 1 13 . 1 1 48 48 HIS CB C 48 25.499 25.499 28.086 -2.587 18496 4940 1 13 . 1 1 48 48 HIS H H 48 8.269 8.269 8.210 0.059 18496 4941 1 13 . 1 1 49 49 GLU N N 49 114.659 114.659 115.778 -1.119 18496 4942 1 13 . 1 1 49 49 GLU HA H 49 4.447 4.447 4.409 0.038 18496 4943 1 13 . 1 1 49 49 GLU C C 49 176.394 176.394 176.627 -0.233 18496 4944 1 13 . 1 1 49 49 GLU CA C 49 57.940 57.940 58.222 -0.282 18496 4945 1 13 . 1 1 49 49 GLU CB C 49 30.641 30.641 31.346 -0.705 18496 4946 1 13 . 1 1 49 49 GLU H H 49 7.381 7.381 8.274 -0.893 18496 4947 1 13 . 1 1 50 50 LYS N N 50 118.126 118.126 118.028 0.098 18496 4948 1 13 . 1 1 50 50 LYS HA H 50 4.665 4.665 4.565 0.100 18496 4949 1 13 . 1 1 50 50 LYS CA C 50 54.431 54.431 54.668 -0.237 18496 4950 1 13 . 1 1 50 50 LYS CB C 50 36.543 36.543 36.410 0.133 18496 4951 1 13 . 1 1 50 50 LYS H H 50 8.067 8.067 8.070 -0.003 18496 4952 1 13 . 1 1 51 51 MET HA H 51 4.936 4.936 4.481 0.455 18496 4953 1 13 . 1 1 51 51 MET CA C 51 54.048 54.048 53.236 0.812 18496 4954 1 13 . 1 1 51 51 MET CB C 51 33.768 33.768 34.942 -1.174 18496 4955 1 13 . 1 1 52 52 GLY C C 52 173.534 173.534 172.371 1.163 18496 4956 1 13 . 1 1 52 52 GLY CA C 52 43.060 43.060 44.314 -1.254 18496 4957 1 13 . 1 1 53 53 LYS N N 53 118.012 118.012 120.097 -2.085 18496 4958 1 13 . 1 1 53 53 LYS HA H 53 4.155 4.155 4.513 -0.358 18496 4959 1 13 . 1 1 53 53 LYS C C 53 176.818 176.818 175.990 0.828 18496 4960 1 13 . 1 1 53 53 LYS CA C 53 56.478 56.478 55.901 0.577 18496 4961 1 13 . 1 1 53 53 LYS CB C 53 33.117 33.117 33.626 -0.509 18496 4962 1 13 . 1 1 53 53 LYS H H 53 8.132 8.132 8.167 -0.035 18496 4963 1 13 . 1 1 54 54 GLY N N 54 109.836 109.836 107.983 1.853 18496 4964 1 13 . 1 1 54 54 GLY C C 54 170.848 170.848 172.851 -2.003 18496 4965 1 13 . 1 1 54 54 GLY CA C 54 46.701 46.701 44.790 1.911 18496 4966 1 13 . 1 1 54 54 GLY H H 54 8.079 8.079 8.193 -0.114 18496 4967 1 13 . 1 1 55 55 ILE N N 55 119.382 119.382 121.956 -2.574 18496 4968 1 13 . 1 1 55 55 ILE HA H 55 4.956 4.956 4.565 0.391 18496 4969 1 13 . 1 1 55 55 ILE C C 55 171.737 171.737 173.710 -1.973 18496 4970 1 13 . 1 1 55 55 ILE CA C 55 57.059 57.059 60.566 -3.507 18496 4971 1 13 . 1 1 55 55 ILE CB C 55 44.241 44.241 41.275 2.966 18496 4972 1 13 . 1 1 55 55 ILE H H 55 8.661 8.661 8.356 0.305 18496 4973 1 13 . 1 1 56 56 THR N N 56 113.795 113.795 122.312 -8.517 18496 4974 1 13 . 1 1 56 56 THR HA H 56 5.607 5.607 4.945 0.662 18496 4975 1 13 . 1 1 56 56 THR C C 56 174.417 174.417 173.653 0.764 18496 4976 1 13 . 1 1 56 56 THR CA C 56 59.098 59.098 61.395 -2.297 18496 4977 1 13 . 1 1 56 56 THR CB C 56 72.153 72.153 70.257 1.896 18496 4978 1 13 . 1 1 56 56 THR H H 56 7.916 7.916 8.427 -0.511 18496 4979 1 13 . 1 1 57 57 LEU N N 57 121.044 121.044 126.310 -5.266 18496 4980 1 13 . 1 1 57 57 LEU HA H 57 5.311 5.311 4.896 0.415 18496 4981 1 13 . 1 1 57 57 LEU C C 57 176.150 176.150 175.413 0.737 18496 4982 1 13 . 1 1 57 57 LEU CA C 57 53.264 53.264 54.016 -0.752 18496 4983 1 13 . 1 1 57 57 LEU CB C 57 45.901 45.901 45.178 0.723 18496 4984 1 13 . 1 1 57 57 LEU H H 57 9.421 9.421 9.201 0.220 18496 4985 1 13 . 1 1 58 58 SER N N 58 119.548 119.548 118.288 1.260 18496 4986 1 13 . 1 1 58 58 SER HA H 58 4.734 4.734 4.565 0.169 18496 4987 1 13 . 1 1 58 58 SER C C 58 174.786 174.786 175.857 -1.071 18496 4988 1 13 . 1 1 58 58 SER CA C 58 56.948 56.948 57.577 -0.629 18496 4989 1 13 . 1 1 58 58 SER CB C 58 65.726 65.726 65.017 0.709 18496 4990 1 13 . 1 1 58 58 SER H H 58 9.771 9.771 9.412 0.359 18496 4991 1 13 . 1 1 59 59 GLU N N 59 120.827 120.827 123.094 -2.267 18496 4992 1 13 . 1 1 59 59 GLU HA H 59 4.319 4.319 4.163 0.156 18496 4993 1 13 . 1 1 59 59 GLU C C 59 179.806 179.806 178.756 1.050 18496 4994 1 13 . 1 1 59 59 GLU CA C 59 60.913 60.913 61.127 -0.214 18496 4995 1 13 . 1 1 59 59 GLU CB C 59 29.538 29.538 29.233 0.305 18496 4996 1 13 . 1 1 59 59 GLU H H 59 9.394 9.394 9.150 0.244 18496 4997 1 13 . 1 1 60 60 GLU N N 60 119.587 119.587 119.351 0.236 18496 4998 1 13 . 1 1 60 60 GLU HA H 60 4.188 4.188 4.097 0.091 18496 4999 1 13 . 1 1 60 60 GLU C C 60 179.686 179.686 178.849 0.837 18496 5000 1 13 . 1 1 60 60 GLU CA C 60 60.279 60.279 59.566 0.713 18496 5001 1 13 . 1 1 60 60 GLU CB C 60 29.559 29.559 28.718 0.841 18496 5002 1 13 . 1 1 60 60 GLU H H 60 8.905 8.905 8.841 0.064 18496 5003 1 13 . 1 1 61 61 GLU N N 61 120.145 120.145 120.045 0.100 18496 5004 1 13 . 1 1 61 61 GLU HA H 61 4.037 4.037 4.082 -0.045 18496 5005 1 13 . 1 1 61 61 GLU C C 61 178.530 178.530 178.951 -0.421 18496 5006 1 13 . 1 1 61 61 GLU CA C 61 59.118 59.118 58.911 0.207 18496 5007 1 13 . 1 1 61 61 GLU CB C 61 30.976 30.976 29.306 1.670 18496 5008 1 13 . 1 1 61 61 GLU H H 61 8.013 8.013 8.390 -0.377 18496 5009 1 13 . 1 1 62 62 PHE N N 62 119.925 119.925 120.572 -0.647 18496 5010 1 13 . 1 1 62 62 PHE HA H 62 3.927 3.927 4.108 -0.181 18496 5011 1 13 . 1 1 62 62 PHE C C 62 176.783 176.783 177.523 -0.740 18496 5012 1 13 . 1 1 62 62 PHE CA C 62 61.827 61.827 61.151 0.676 18496 5013 1 13 . 1 1 62 62 PHE CB C 62 40.216 40.216 38.909 1.307 18496 5014 1 13 . 1 1 62 62 PHE H H 62 9.192 9.192 8.890 0.302 18496 5015 1 13 . 1 1 63 63 GLY N N 63 104.854 104.854 107.721 -2.867 18496 5016 1 13 . 1 1 63 63 GLY C C 63 176.854 176.854 175.885 0.969 18496 5017 1 13 . 1 1 63 63 GLY CA C 63 47.178 47.178 47.413 -0.235 18496 5018 1 13 . 1 1 63 63 GLY H H 63 8.316 8.316 8.707 -0.391 18496 5019 1 13 . 1 1 64 64 VAL N N 64 123.719 123.719 123.129 0.590 18496 5020 1 13 . 1 1 64 64 VAL HA H 64 3.663 3.663 3.587 0.076 18496 5021 1 13 . 1 1 64 64 VAL C C 64 177.644 177.644 177.541 0.103 18496 5022 1 13 . 1 1 64 64 VAL CA C 64 67.090 67.090 66.204 0.886 18496 5023 1 13 . 1 1 64 64 VAL CB C 64 31.367 31.367 31.691 -0.324 18496 5024 1 13 . 1 1 64 64 VAL H H 64 7.759 7.759 7.829 -0.070 18496 5025 1 13 . 1 1 65 65 LEU N N 65 120.099 120.099 120.993 -0.894 18496 5026 1 13 . 1 1 65 65 LEU HA H 65 3.672 3.672 3.899 -0.227 18496 5027 1 13 . 1 1 65 65 LEU C C 65 177.636 177.636 178.317 -0.681 18496 5028 1 13 . 1 1 65 65 LEU CA C 65 58.552 58.552 58.362 0.190 18496 5029 1 13 . 1 1 65 65 LEU CB C 65 41.358 41.358 41.704 -0.346 18496 5030 1 13 . 1 1 65 65 LEU H H 65 7.660 7.660 7.758 -0.098 18496 5031 1 13 . 1 1 66 66 LEU N N 66 115.733 115.733 118.340 -2.607 18496 5032 1 13 . 1 1 66 66 LEU HA H 66 3.556 3.556 3.603 -0.047 18496 5033 1 13 . 1 1 66 66 LEU C C 66 179.729 179.729 178.824 0.905 18496 5034 1 13 . 1 1 66 66 LEU CA C 66 58.069 58.069 58.083 -0.014 18496 5035 1 13 . 1 1 66 66 LEU CB C 66 41.625 41.625 40.985 0.640 18496 5036 1 13 . 1 1 66 66 LEU H H 66 8.083 8.083 8.208 -0.125 18496 5037 1 13 . 1 1 67 67 LYS N N 67 119.120 119.120 119.897 -0.777 18496 5038 1 13 . 1 1 67 67 LYS HA H 67 3.965 3.965 3.804 0.161 18496 5039 1 13 . 1 1 67 67 LYS C C 67 179.379 179.379 179.062 0.317 18496 5040 1 13 . 1 1 67 67 LYS CA C 67 59.227 59.227 59.855 -0.628 18496 5041 1 13 . 1 1 67 67 LYS CB C 67 32.737 32.737 32.254 0.483 18496 5042 1 13 . 1 1 67 67 LYS H H 67 7.861 7.861 8.209 -0.348 18496 5043 1 13 . 1 1 68 68 GLU N N 68 116.924 116.924 118.731 -1.807 18496 5044 1 13 . 1 1 68 68 GLU HA H 68 4.409 4.409 4.087 0.322 18496 5045 1 13 . 1 1 68 68 GLU CA C 68 57.712 57.712 58.528 -0.816 18496 5046 1 13 . 1 1 68 68 GLU CB C 68 29.586 29.586 29.479 0.107 18496 5047 1 13 . 1 1 68 68 GLU H H 68 8.319 8.319 7.843 0.476 18496 5048 1 13 . 1 1 69 69 LEU N N 69 120.032 120.032 120.103 -0.071 18496 5049 1 13 . 1 1 69 69 LEU HA H 69 4.107 4.107 3.937 0.170 18496 5050 1 13 . 1 1 69 69 LEU CA C 69 57.563 57.563 57.544 0.019 18496 5051 1 13 . 1 1 69 69 LEU CB C 69 41.373 41.373 41.502 -0.129 18496 5052 1 13 . 1 1 69 69 LEU H H 69 8.233 8.233 8.560 -0.327 18496 5053 1 13 . 1 1 70 70 GLY N N 70 105.472 105.472 105.387 0.085 18496 5054 1 13 . 1 1 70 70 GLY C C 70 174.986 174.986 176.355 -1.369 18496 5055 1 13 . 1 1 70 70 GLY CA C 70 46.704 46.704 46.751 -0.047 18496 5056 1 13 . 1 1 70 70 GLY H H 70 7.960 7.960 8.577 -0.617 18496 5057 1 13 . 1 1 71 71 ASN N N 71 118.596 118.596 120.069 -1.473 18496 5058 1 13 . 1 1 71 71 ASN HA H 71 4.681 4.681 4.808 -0.127 18496 5059 1 13 . 1 1 71 71 ASN C C 71 176.412 176.412 177.915 -1.503 18496 5060 1 13 . 1 1 71 71 ASN CA C 71 54.407 54.407 55.473 -1.066 18496 5061 1 13 . 1 1 71 71 ASN CB C 71 38.729 38.729 38.545 0.184 18496 5062 1 13 . 1 1 71 71 ASN H H 71 7.857 7.857 7.790 0.067 18496 5063 1 13 . 1 1 72 72 LYS N N 72 119.973 119.973 120.288 -0.315 18496 5064 1 13 . 1 1 72 72 LYS HA H 72 4.282 4.282 4.136 0.146 18496 5065 1 13 . 1 1 72 72 LYS CA C 72 57.338 57.338 57.953 -0.615 18496 5066 1 13 . 1 1 72 72 LYS CB C 72 32.755 32.755 31.939 0.816 18496 5067 1 13 . 1 1 72 72 LYS H H 72 8.100 8.100 8.031 0.069 18496 5068 1 13 . 1 1 73 73 LEU HA H 73 4.281 4.281 4.328 -0.047 18496 5069 1 13 . 1 1 73 73 LEU CA C 73 55.774 55.774 54.643 1.131 18496 5070 1 13 . 1 1 73 73 LEU CB C 73 41.983 41.983 42.347 -0.364 18496 5071 1 14 . 1 1 2 2 ALA HA H 2 4.074 4.074 4.490 -0.416 18496 5072 1 14 . 1 1 2 2 ALA CA C 2 51.966 51.966 51.544 0.422 18496 5073 1 14 . 1 1 2 2 ALA CB C 2 19.732 19.732 19.737 -0.005 18496 5074 1 14 . 1 1 3 3 ASP HA H 3 4.632 4.632 4.519 0.113 18496 5075 1 14 . 1 1 3 3 ASP C C 3 175.822 175.822 176.367 -0.545 18496 5076 1 14 . 1 1 3 3 ASP CA C 3 54.440 54.440 55.520 -1.080 18496 5077 1 14 . 1 1 3 3 ASP CB C 3 41.577 41.577 41.269 0.308 18496 5078 1 14 . 1 1 4 4 LYS N N 4 121.655 121.655 119.822 1.833 18496 5079 1 14 . 1 1 4 4 LYS HA H 4 4.379 4.379 4.535 -0.155 18496 5080 1 14 . 1 1 4 4 LYS C C 4 176.011 176.011 175.942 0.069 18496 5081 1 14 . 1 1 4 4 LYS CA C 4 56.213 56.213 54.745 1.468 18496 5082 1 14 . 1 1 4 4 LYS CB C 4 33.407 33.407 31.891 1.516 18496 5083 1 14 . 1 1 4 4 LYS H H 4 8.394 8.394 8.076 0.318 18496 5084 1 14 . 1 1 5 5 LEU N N 5 125.369 125.369 125.298 0.071 18496 5085 1 14 . 1 1 5 5 LEU HA H 5 4.351 4.351 4.316 0.035 18496 5086 1 14 . 1 1 5 5 LEU C C 5 175.682 175.682 176.296 -0.614 18496 5087 1 14 . 1 1 5 5 LEU CA C 5 55.117 55.117 54.923 0.194 18496 5088 1 14 . 1 1 5 5 LEU CB C 5 43.197 43.197 42.936 0.261 18496 5089 1 14 . 1 1 5 5 LEU H H 5 8.136 8.136 8.175 -0.039 18496 5090 1 14 . 1 1 6 6 LYS N N 6 126.844 126.844 125.469 1.375 18496 5091 1 14 . 1 1 6 6 LYS HA H 6 4.451 4.451 4.544 -0.093 18496 5092 1 14 . 1 1 6 6 LYS C C 6 174.665 174.665 175.420 -0.755 18496 5093 1 14 . 1 1 6 6 LYS CA C 6 55.974 55.974 56.196 -0.222 18496 5094 1 14 . 1 1 6 6 LYS CB C 6 34.386 34.386 33.250 1.136 18496 5095 1 14 . 1 1 6 6 LYS H H 6 8.615 8.615 8.584 0.031 18496 5096 1 14 . 1 1 7 7 PHE N N 7 119.818 119.818 119.548 0.270 18496 5097 1 14 . 1 1 7 7 PHE HA H 7 5.343 5.343 5.486 -0.143 18496 5098 1 14 . 1 1 7 7 PHE C C 7 173.569 173.569 173.632 -0.063 18496 5099 1 14 . 1 1 7 7 PHE CA C 7 55.813 55.813 55.791 0.022 18496 5100 1 14 . 1 1 7 7 PHE CB C 7 42.975 42.975 42.364 0.611 18496 5101 1 14 . 1 1 7 7 PHE H H 7 7.734 7.734 8.312 -0.578 18496 5102 1 14 . 1 1 8 8 GLU N N 8 119.165 119.165 119.182 -0.017 18496 5103 1 14 . 1 1 8 8 GLU HA H 8 4.158 4.158 4.191 -0.033 18496 5104 1 14 . 1 1 8 8 GLU C C 8 175.026 175.026 174.170 0.856 18496 5105 1 14 . 1 1 8 8 GLU CA C 8 55.221 55.221 54.610 0.611 18496 5106 1 14 . 1 1 8 8 GLU CB C 8 33.699 33.699 32.964 0.735 18496 5107 1 14 . 1 1 8 8 GLU H H 8 8.295 8.295 8.711 -0.416 18496 5108 1 14 . 1 1 9 9 ILE N N 9 127.619 127.619 127.097 0.522 18496 5109 1 14 . 1 1 9 9 ILE HA H 9 3.768 3.768 4.200 -0.432 18496 5110 1 14 . 1 1 9 9 ILE C C 9 174.902 174.902 175.593 -0.691 18496 5111 1 14 . 1 1 9 9 ILE CA C 9 62.505 62.505 61.756 0.749 18496 5112 1 14 . 1 1 9 9 ILE CB C 9 36.094 36.094 37.638 -1.544 18496 5113 1 14 . 1 1 9 9 ILE H H 9 9.157 9.157 8.607 0.550 18496 5114 1 14 . 1 1 10 10 ILE N N 10 131.245 131.245 128.509 2.736 18496 5115 1 14 . 1 1 10 10 ILE HA H 10 3.861 3.861 4.019 -0.158 18496 5116 1 14 . 1 1 10 10 ILE C C 10 176.247 176.247 176.656 -0.409 18496 5117 1 14 . 1 1 10 10 ILE CA C 10 60.554 60.554 62.090 -1.536 18496 5118 1 14 . 1 1 10 10 ILE CB C 10 37.406 37.406 38.298 -0.892 18496 5119 1 14 . 1 1 10 10 ILE H H 10 8.428 8.428 8.757 -0.329 18496 5120 1 14 . 1 1 11 11 GLU N N 11 117.669 117.669 117.697 -0.028 18496 5121 1 14 . 1 1 11 11 GLU HA H 11 4.315 4.315 4.537 -0.222 18496 5122 1 14 . 1 1 11 11 GLU C C 11 174.155 174.155 174.319 -0.164 18496 5123 1 14 . 1 1 11 11 GLU CA C 11 55.755 55.755 55.479 0.276 18496 5124 1 14 . 1 1 11 11 GLU CB C 11 34.386 34.386 32.601 1.785 18496 5125 1 14 . 1 1 11 11 GLU H H 11 7.551 7.551 8.109 -0.558 18496 5126 1 14 . 1 1 12 12 GLU N N 12 128.587 128.587 124.708 3.879 18496 5127 1 14 . 1 1 12 12 GLU HA H 12 5.214 5.214 4.484 0.730 18496 5128 1 14 . 1 1 12 12 GLU C C 12 176.877 176.877 175.751 1.126 18496 5129 1 14 . 1 1 12 12 GLU CA C 12 54.801 54.801 57.183 -2.382 18496 5130 1 14 . 1 1 12 12 GLU CB C 12 30.137 30.137 30.024 0.113 18496 5131 1 14 . 1 1 12 12 GLU H H 12 8.762 8.762 8.874 -0.112 18496 5132 1 14 . 1 1 13 13 LEU N N 13 122.508 122.508 121.813 0.695 18496 5133 1 14 . 1 1 13 13 LEU HA H 13 4.872 4.872 4.719 0.153 18496 5134 1 14 . 1 1 13 13 LEU C C 13 176.060 176.060 177.312 -1.252 18496 5135 1 14 . 1 1 13 13 LEU CA C 13 57.372 57.372 55.274 2.098 18496 5136 1 14 . 1 1 13 13 LEU CB C 13 42.284 42.284 43.691 -1.407 18496 5137 1 14 . 1 1 13 13 LEU H H 13 8.058 8.058 8.840 -0.782 18496 5138 1 14 . 1 1 14 14 ILE N N 14 115.422 115.422 118.146 -2.724 18496 5139 1 14 . 1 1 14 14 ILE HA H 14 4.553 4.553 4.450 0.103 18496 5140 1 14 . 1 1 14 14 ILE C C 14 174.893 174.893 174.033 0.860 18496 5141 1 14 . 1 1 14 14 ILE CA C 14 60.586 60.586 59.749 0.837 18496 5142 1 14 . 1 1 14 14 ILE CB C 14 44.329 44.329 41.395 2.934 18496 5143 1 14 . 1 1 14 14 ILE H H 14 8.450 8.450 8.389 0.061 18496 5144 1 14 . 1 1 15 15 VAL N N 15 129.108 129.108 125.782 3.326 18496 5145 1 14 . 1 1 15 15 VAL HA H 15 4.196 4.196 4.426 -0.230 18496 5146 1 14 . 1 1 15 15 VAL C C 15 175.180 175.180 175.067 0.113 18496 5147 1 14 . 1 1 15 15 VAL CA C 15 63.288 63.288 60.938 2.350 18496 5148 1 14 . 1 1 15 15 VAL CB C 15 32.117 32.117 32.720 -0.603 18496 5149 1 14 . 1 1 15 15 VAL H H 15 8.867 8.867 8.535 0.332 18496 5150 1 14 . 1 1 16 16 LEU N N 16 127.846 127.846 129.129 -1.283 18496 5151 1 14 . 1 1 16 16 LEU HA H 16 4.317 4.317 4.624 -0.307 18496 5152 1 14 . 1 1 16 16 LEU C C 16 176.070 176.070 177.337 -1.267 18496 5153 1 14 . 1 1 16 16 LEU CA C 16 57.252 57.252 56.441 0.810 18496 5154 1 14 . 1 1 16 16 LEU CB C 16 42.035 42.035 42.611 -0.576 18496 5155 1 14 . 1 1 16 16 LEU H H 16 9.555 9.555 8.792 0.763 18496 5156 1 14 . 1 1 17 17 SER N N 17 107.073 107.073 110.285 -3.212 18496 5157 1 14 . 1 1 17 17 SER HA H 17 4.540 4.540 4.594 -0.054 18496 5158 1 14 . 1 1 17 17 SER C C 17 172.277 172.277 172.240 0.037 18496 5159 1 14 . 1 1 17 17 SER CA C 17 57.882 57.882 58.110 -0.228 18496 5160 1 14 . 1 1 17 17 SER CB C 17 64.046 64.046 64.962 -0.916 18496 5161 1 14 . 1 1 17 17 SER H H 17 7.699 7.699 7.827 -0.128 18496 5162 1 14 . 1 1 18 18 GLU N N 18 119.235 119.235 120.059 -0.824 18496 5163 1 14 . 1 1 18 18 GLU HA H 18 5.143 5.143 5.028 0.115 18496 5164 1 14 . 1 1 18 18 GLU C C 18 175.469 175.469 176.231 -0.762 18496 5165 1 14 . 1 1 18 18 GLU CA C 18 55.248 55.248 54.872 0.376 18496 5166 1 14 . 1 1 18 18 GLU CB C 18 33.454 33.454 30.969 2.485 18496 5167 1 14 . 1 1 18 18 GLU H H 18 8.437 8.437 8.501 -0.064 18496 5168 1 14 . 1 1 19 19 ASN N N 19 123.988 123.988 120.887 3.101 18496 5169 1 14 . 1 1 19 19 ASN HA H 19 5.097 5.097 4.761 0.336 18496 5170 1 14 . 1 1 19 19 ASN CA C 19 50.916 50.916 52.918 -2.002 18496 5171 1 14 . 1 1 19 19 ASN CB C 19 39.482 39.482 39.729 -0.247 18496 5172 1 14 . 1 1 19 19 ASN H H 19 8.779 8.779 8.289 0.490 18496 5173 1 14 . 1 1 20 20 ALA N N 20 120.854 120.854 122.555 -1.701 18496 5174 1 14 . 1 1 20 20 ALA HA H 20 4.239 4.239 4.189 0.050 18496 5175 1 14 . 1 1 20 20 ALA C C 20 179.032 179.032 178.021 1.011 18496 5176 1 14 . 1 1 20 20 ALA CA C 20 54.924 54.924 54.225 0.699 18496 5177 1 14 . 1 1 20 20 ALA CB C 20 18.621 18.621 18.677 -0.056 18496 5178 1 14 . 1 1 20 20 ALA H H 20 8.616 8.616 8.637 -0.021 18496 5179 1 14 . 1 1 21 21 LYS N N 21 115.771 115.771 116.487 -0.716 18496 5180 1 14 . 1 1 21 21 LYS HA H 21 4.497 4.497 4.327 0.170 18496 5181 1 14 . 1 1 21 21 LYS C C 21 176.615 176.615 176.798 -0.183 18496 5182 1 14 . 1 1 21 21 LYS CA C 21 55.503 55.503 55.234 0.269 18496 5183 1 14 . 1 1 21 21 LYS CB C 21 32.742 32.742 32.147 0.595 18496 5184 1 14 . 1 1 21 21 LYS H H 21 7.767 7.767 7.670 0.097 18496 5185 1 14 . 1 1 22 22 GLY N N 22 107.695 107.695 106.626 1.069 18496 5186 1 14 . 1 1 22 22 GLY C C 22 174.843 174.843 174.418 0.425 18496 5187 1 14 . 1 1 22 22 GLY CA C 22 45.297 45.297 45.201 0.096 18496 5188 1 14 . 1 1 22 22 GLY H H 22 8.317 8.317 7.787 0.530 18496 5189 1 14 . 1 1 23 23 TRP N N 23 121.316 121.316 121.142 0.174 18496 5190 1 14 . 1 1 23 23 TRP HA H 23 4.815 4.815 4.782 0.033 18496 5191 1 14 . 1 1 23 23 TRP C C 23 176.754 176.754 176.538 0.216 18496 5192 1 14 . 1 1 23 23 TRP CA C 23 58.291 58.291 55.018 3.273 18496 5193 1 14 . 1 1 23 23 TRP CB C 23 28.127 28.127 28.052 0.075 18496 5194 1 14 . 1 1 23 23 TRP H H 23 7.983 7.983 8.027 -0.044 18496 5195 1 14 . 1 1 24 24 ARG N N 24 120.789 120.789 127.079 -6.290 18496 5196 1 14 . 1 1 24 24 ARG HA H 24 5.496 5.496 4.875 0.621 18496 5197 1 14 . 1 1 24 24 ARG C C 24 175.831 175.831 176.092 -0.261 18496 5198 1 14 . 1 1 24 24 ARG CA C 24 54.755 54.755 54.776 -0.021 18496 5199 1 14 . 1 1 24 24 ARG CB C 24 33.735 33.735 30.050 3.685 18496 5200 1 14 . 1 1 24 24 ARG H H 24 9.046 9.046 9.304 -0.258 18496 5201 1 14 . 1 1 25 25 LYS N N 25 126.507 126.507 129.218 -2.711 18496 5202 1 14 . 1 1 25 25 LYS HA H 25 5.081 5.081 4.857 0.224 18496 5203 1 14 . 1 1 25 25 LYS C C 25 175.648 175.648 175.661 -0.013 18496 5204 1 14 . 1 1 25 25 LYS CA C 25 56.071 56.071 56.968 -0.897 18496 5205 1 14 . 1 1 25 25 LYS CB C 25 32.214 32.214 33.051 -0.837 18496 5206 1 14 . 1 1 25 25 LYS H H 25 8.526 8.526 8.521 0.005 18496 5207 1 14 . 1 1 26 26 GLU N N 26 126.009 126.009 123.849 2.160 18496 5208 1 14 . 1 1 26 26 GLU HA H 26 5.275 5.275 5.128 0.147 18496 5209 1 14 . 1 1 26 26 GLU C C 26 174.894 174.894 174.122 0.772 18496 5210 1 14 . 1 1 26 26 GLU CA C 26 55.271 55.271 55.072 0.199 18496 5211 1 14 . 1 1 26 26 GLU CB C 26 33.781 33.781 34.864 -1.083 18496 5212 1 14 . 1 1 26 26 GLU H H 26 9.125 9.125 9.089 0.036 18496 5213 1 14 . 1 1 27 27 LEU N N 27 121.930 121.930 124.008 -2.078 18496 5214 1 14 . 1 1 27 27 LEU HA H 27 5.788 5.788 4.872 0.916 18496 5215 1 14 . 1 1 27 27 LEU C C 27 173.941 173.941 174.328 -0.387 18496 5216 1 14 . 1 1 27 27 LEU CA C 27 53.859 53.859 53.963 -0.104 18496 5217 1 14 . 1 1 27 27 LEU CB C 27 44.020 44.020 44.334 -0.313 18496 5218 1 14 . 1 1 27 27 LEU H H 27 8.938 8.938 9.173 -0.235 18496 5219 1 14 . 1 1 28 28 ASN N N 28 124.630 124.630 124.917 -0.287 18496 5220 1 14 . 1 1 28 28 ASN HA H 28 5.411 5.411 5.219 0.192 18496 5221 1 14 . 1 1 28 28 ASN C C 28 174.366 174.366 173.315 1.051 18496 5222 1 14 . 1 1 28 28 ASN CA C 28 52.063 52.063 52.326 -0.263 18496 5223 1 14 . 1 1 28 28 ASN CB C 28 44.430 44.430 43.381 1.049 18496 5224 1 14 . 1 1 28 28 ASN H H 28 9.345 9.345 8.160 1.185 18496 5225 1 14 . 1 1 29 29 ARG N N 29 118.443 118.443 123.011 -4.568 18496 5226 1 14 . 1 1 29 29 ARG HA H 29 5.058 5.058 4.860 0.198 18496 5227 1 14 . 1 1 29 29 ARG C C 29 175.779 175.779 174.903 0.876 18496 5228 1 14 . 1 1 29 29 ARG CA C 29 56.091 56.091 55.810 0.281 18496 5229 1 14 . 1 1 29 29 ARG CB C 29 31.710 31.710 31.046 0.664 18496 5230 1 14 . 1 1 29 29 ARG H H 29 9.109 9.109 9.161 -0.052 18496 5231 1 14 . 1 1 30 30 VAL N N 30 124.605 124.605 121.636 2.969 18496 5232 1 14 . 1 1 30 30 VAL HA H 30 4.535 4.535 5.456 -0.921 18496 5233 1 14 . 1 1 30 30 VAL C C 30 174.775 174.775 174.518 0.257 18496 5234 1 14 . 1 1 30 30 VAL CA C 30 60.921 60.921 58.792 2.129 18496 5235 1 14 . 1 1 30 30 VAL CB C 30 37.790 37.790 36.163 1.627 18496 5236 1 14 . 1 1 30 30 VAL H H 30 9.054 9.054 8.547 0.507 18496 5237 1 14 . 1 1 31 31 SER N N 31 120.794 120.794 115.477 5.317 18496 5238 1 14 . 1 1 31 31 SER HA H 31 4.652 4.652 5.112 -0.460 18496 5239 1 14 . 1 1 31 31 SER C C 31 174.214 174.214 175.404 -1.190 18496 5240 1 14 . 1 1 31 31 SER CA C 31 56.279 56.279 56.938 -0.659 18496 5241 1 14 . 1 1 31 31 SER CB C 31 64.128 64.128 64.153 -0.025 18496 5242 1 14 . 1 1 31 31 SER H H 31 8.667 8.667 8.973 -0.306 18496 5243 1 14 . 1 1 32 32 TRP N N 32 132.303 132.303 127.991 4.312 18496 5244 1 14 . 1 1 32 32 TRP HA H 32 5.105 5.105 4.524 0.581 18496 5245 1 14 . 1 1 32 32 TRP C C 32 177.276 177.276 177.147 0.129 18496 5246 1 14 . 1 1 32 32 TRP CA C 32 56.198 56.198 58.286 -2.088 18496 5247 1 14 . 1 1 32 32 TRP CB C 32 29.968 29.968 28.196 1.772 18496 5248 1 14 . 1 1 32 32 TRP H H 32 9.282 9.282 9.332 -0.050 18496 5249 1 14 . 1 1 33 33 ASN N N 33 124.979 124.979 123.405 1.574 18496 5250 1 14 . 1 1 33 33 ASN HA H 33 4.257 4.257 4.397 -0.140 18496 5251 1 14 . 1 1 33 33 ASN C C 33 174.030 174.030 174.769 -0.739 18496 5252 1 14 . 1 1 33 33 ASN CA C 33 54.709 54.709 54.742 -0.034 18496 5253 1 14 . 1 1 33 33 ASN CB C 33 37.921 37.921 36.968 0.953 18496 5254 1 14 . 1 1 33 33 ASN H H 33 9.813 9.813 8.825 0.988 18496 5255 1 14 . 1 1 34 34 ASP N N 34 111.880 111.880 113.553 -1.673 18496 5256 1 14 . 1 1 34 34 ASP HA H 34 4.126 4.126 4.240 -0.114 18496 5257 1 14 . 1 1 34 34 ASP CA C 34 56.130 56.130 55.431 0.699 18496 5258 1 14 . 1 1 34 34 ASP CB C 34 39.760 39.760 40.364 -0.604 18496 5259 1 14 . 1 1 34 34 ASP H H 34 9.251 9.251 8.243 1.008 18496 5260 1 14 . 1 1 35 35 ALA N N 35 121.811 121.811 121.138 0.673 18496 5261 1 14 . 1 1 35 35 ALA HA H 35 4.477 4.477 4.520 -0.043 18496 5262 1 14 . 1 1 35 35 ALA C C 35 177.778 177.778 176.971 0.807 18496 5263 1 14 . 1 1 35 35 ALA CA C 35 51.528 51.528 52.572 -1.044 18496 5264 1 14 . 1 1 35 35 ALA CB C 35 20.445 20.445 20.511 -0.066 18496 5265 1 14 . 1 1 35 35 ALA H H 35 7.625 7.625 7.764 -0.139 18496 5266 1 14 . 1 1 36 36 GLU N N 36 121.068 121.068 122.556 -1.488 18496 5267 1 14 . 1 1 36 36 GLU HA H 36 4.390 4.390 4.703 -0.313 18496 5268 1 14 . 1 1 36 36 GLU CA C 36 55.276 55.276 52.482 2.794 18496 5269 1 14 . 1 1 36 36 GLU CB C 36 28.575 28.575 30.835 -2.260 18496 5270 1 14 . 1 1 36 36 GLU H H 36 8.658 8.658 8.033 0.625 18496 5271 1 14 . 1 1 37 37 PRO HA H 37 4.289 4.289 4.746 -0.457 18496 5272 1 14 . 1 1 37 37 PRO C C 37 175.799 175.799 175.892 -0.093 18496 5273 1 14 . 1 1 37 37 PRO CA C 37 63.105 63.105 62.384 0.721 18496 5274 1 14 . 1 1 37 37 PRO CB C 37 32.076 32.076 31.992 0.084 18496 5275 1 14 . 1 1 38 38 LYS N N 38 120.881 120.881 123.348 -2.467 18496 5276 1 14 . 1 1 38 38 LYS HA H 38 4.700 4.700 4.346 0.354 18496 5277 1 14 . 1 1 38 38 LYS C C 38 176.906 176.906 174.444 2.462 18496 5278 1 14 . 1 1 38 38 LYS CA C 38 54.399 54.399 55.103 -0.704 18496 5279 1 14 . 1 1 38 38 LYS CB C 38 37.217 37.217 36.391 0.826 18496 5280 1 14 . 1 1 38 38 LYS H H 38 8.316 8.316 8.746 -0.430 18496 5281 1 14 . 1 1 39 39 TYR N N 39 119.792 119.792 117.769 2.023 18496 5282 1 14 . 1 1 39 39 TYR HA H 39 4.636 4.636 4.574 0.062 18496 5283 1 14 . 1 1 39 39 TYR C C 39 175.834 175.834 174.846 0.988 18496 5284 1 14 . 1 1 39 39 TYR CA C 39 60.228 60.228 57.407 2.821 18496 5285 1 14 . 1 1 39 39 TYR CB C 39 38.683 38.683 39.179 -0.497 18496 5286 1 14 . 1 1 39 39 TYR H H 39 8.508 8.508 7.832 0.676 18496 5287 1 14 . 1 1 40 40 ASP N N 40 126.502 126.502 122.665 3.837 18496 5288 1 14 . 1 1 40 40 ASP HA H 40 5.597 5.597 5.274 0.323 18496 5289 1 14 . 1 1 40 40 ASP C C 40 175.283 175.283 174.035 1.248 18496 5290 1 14 . 1 1 40 40 ASP CA C 40 55.053 55.053 53.798 1.255 18496 5291 1 14 . 1 1 40 40 ASP CB C 40 48.656 48.656 45.333 3.323 18496 5292 1 14 . 1 1 40 40 ASP H H 40 9.219 9.219 8.328 0.891 18496 5293 1 14 . 1 1 41 41 ILE N N 41 125.910 125.910 125.004 0.906 18496 5294 1 14 . 1 1 41 41 ILE HA H 41 5.722 5.722 4.949 0.773 18496 5295 1 14 . 1 1 41 41 ILE C C 41 174.167 174.167 173.599 0.568 18496 5296 1 14 . 1 1 41 41 ILE CA C 41 60.734 60.734 59.889 0.845 18496 5297 1 14 . 1 1 41 41 ILE CB C 41 40.198 40.198 39.934 0.264 18496 5298 1 14 . 1 1 41 41 ILE H H 41 8.972 8.972 8.716 0.256 18496 5299 1 14 . 1 1 42 42 ARG N N 42 120.300 120.300 126.595 -6.295 18496 5300 1 14 . 1 1 42 42 ARG HA H 42 4.716 4.716 4.749 -0.033 18496 5301 1 14 . 1 1 42 42 ARG CA C 42 54.826 54.826 54.946 -0.120 18496 5302 1 14 . 1 1 42 42 ARG CB C 42 32.665 32.665 35.334 -2.669 18496 5303 1 14 . 1 1 42 42 ARG H H 42 8.320 8.320 8.565 -0.245 18496 5304 1 14 . 1 1 43 43 THR HA H 43 5.585 5.585 5.497 0.088 18496 5305 1 14 . 1 1 43 43 THR C C 43 173.294 173.294 173.139 0.155 18496 5306 1 14 . 1 1 43 43 THR CA C 43 60.847 60.847 59.697 1.151 18496 5307 1 14 . 1 1 43 43 THR CB C 43 69.961 69.961 71.087 -1.126 18496 5308 1 14 . 1 1 44 44 TRP N N 44 122.747 122.747 123.597 -0.850 18496 5309 1 14 . 1 1 44 44 TRP HA H 44 4.945 4.945 4.774 0.171 18496 5310 1 14 . 1 1 44 44 TRP C C 44 175.056 175.056 176.064 -1.008 18496 5311 1 14 . 1 1 44 44 TRP CA C 44 56.107 56.107 55.678 0.429 18496 5312 1 14 . 1 1 44 44 TRP CB C 44 34.506 34.506 32.430 2.076 18496 5313 1 14 . 1 1 44 44 TRP H H 44 9.180 9.180 8.870 0.310 18496 5314 1 14 . 1 1 45 45 SER N N 45 117.385 117.385 116.267 1.118 18496 5315 1 14 . 1 1 45 45 SER HA H 45 2.300 2.300 4.898 -2.598 18496 5316 1 14 . 1 1 45 45 SER CA C 45 56.481 56.481 56.804 -0.323 18496 5317 1 14 . 1 1 45 45 SER CB C 45 60.743 60.743 62.270 -1.527 18496 5318 1 14 . 1 1 45 45 SER H H 45 7.879 7.879 8.234 -0.355 18496 5319 1 14 . 1 1 46 46 PRO HA H 46 4.104 4.104 4.435 -0.331 18496 5320 1 14 . 1 1 46 46 PRO CA C 46 64.990 64.990 65.707 -0.717 18496 5321 1 14 . 1 1 46 46 PRO CB C 46 31.272 31.272 31.834 -0.562 18496 5322 1 14 . 1 1 47 47 ASP HA H 47 4.520 4.520 4.642 -0.122 18496 5323 1 14 . 1 1 47 47 ASP C C 47 175.629 175.629 175.463 0.166 18496 5324 1 14 . 1 1 47 47 ASP CA C 47 53.453 53.453 53.003 0.450 18496 5325 1 14 . 1 1 47 47 ASP CB C 47 40.239 40.239 40.894 -0.655 18496 5326 1 14 . 1 1 48 48 HIS N N 48 111.320 111.320 116.858 -5.538 18496 5327 1 14 . 1 1 48 48 HIS HA H 48 3.916 3.916 4.468 -0.552 18496 5328 1 14 . 1 1 48 48 HIS CA C 48 60.347 60.347 57.521 2.826 18496 5329 1 14 . 1 1 48 48 HIS CB C 48 25.499 25.499 27.653 -2.154 18496 5330 1 14 . 1 1 48 48 HIS H H 48 8.269 8.269 8.216 0.053 18496 5331 1 14 . 1 1 49 49 GLU N N 49 114.659 114.659 116.962 -2.303 18496 5332 1 14 . 1 1 49 49 GLU HA H 49 4.447 4.447 4.378 0.069 18496 5333 1 14 . 1 1 49 49 GLU C C 49 176.394 176.394 176.208 0.186 18496 5334 1 14 . 1 1 49 49 GLU CA C 49 57.940 57.940 57.736 0.204 18496 5335 1 14 . 1 1 49 49 GLU CB C 49 30.641 30.641 31.180 -0.539 18496 5336 1 14 . 1 1 49 49 GLU H H 49 7.381 7.381 8.306 -0.925 18496 5337 1 14 . 1 1 50 50 LYS N N 50 118.126 118.126 118.029 0.097 18496 5338 1 14 . 1 1 50 50 LYS HA H 50 4.665 4.665 4.736 -0.071 18496 5339 1 14 . 1 1 50 50 LYS CA C 50 54.431 54.431 54.384 0.047 18496 5340 1 14 . 1 1 50 50 LYS CB C 50 36.543 36.543 36.526 0.016 18496 5341 1 14 . 1 1 50 50 LYS H H 50 8.067 8.067 7.988 0.079 18496 5342 1 14 . 1 1 51 51 MET HA H 51 4.936 4.936 4.489 0.447 18496 5343 1 14 . 1 1 51 51 MET CA C 51 54.048 54.048 52.924 1.124 18496 5344 1 14 . 1 1 51 51 MET CB C 51 33.768 33.768 34.917 -1.149 18496 5345 1 14 . 1 1 52 52 GLY C C 52 173.534 173.534 172.326 1.208 18496 5346 1 14 . 1 1 52 52 GLY CA C 52 43.060 43.060 44.398 -1.338 18496 5347 1 14 . 1 1 53 53 LYS N N 53 118.012 118.012 119.552 -1.540 18496 5348 1 14 . 1 1 53 53 LYS HA H 53 4.155 4.155 4.454 -0.299 18496 5349 1 14 . 1 1 53 53 LYS C C 53 176.818 176.818 176.191 0.627 18496 5350 1 14 . 1 1 53 53 LYS CA C 53 56.478 56.478 56.116 0.362 18496 5351 1 14 . 1 1 53 53 LYS CB C 53 33.117 33.117 33.364 -0.247 18496 5352 1 14 . 1 1 53 53 LYS H H 53 8.132 8.132 8.173 -0.041 18496 5353 1 14 . 1 1 54 54 GLY N N 54 109.836 109.836 108.019 1.817 18496 5354 1 14 . 1 1 54 54 GLY C C 54 170.848 170.848 172.671 -1.823 18496 5355 1 14 . 1 1 54 54 GLY CA C 54 46.701 46.701 44.791 1.910 18496 5356 1 14 . 1 1 54 54 GLY H H 54 8.079 8.079 8.132 -0.053 18496 5357 1 14 . 1 1 55 55 ILE N N 55 119.382 119.382 121.696 -2.314 18496 5358 1 14 . 1 1 55 55 ILE HA H 55 4.956 4.956 4.642 0.314 18496 5359 1 14 . 1 1 55 55 ILE C C 55 171.737 171.737 173.786 -2.049 18496 5360 1 14 . 1 1 55 55 ILE CA C 55 57.059 57.059 60.380 -3.321 18496 5361 1 14 . 1 1 55 55 ILE CB C 55 44.241 44.241 41.461 2.780 18496 5362 1 14 . 1 1 55 55 ILE H H 55 8.661 8.661 8.278 0.383 18496 5363 1 14 . 1 1 56 56 THR N N 56 113.795 113.795 122.504 -8.709 18496 5364 1 14 . 1 1 56 56 THR HA H 56 5.607 5.607 4.766 0.841 18496 5365 1 14 . 1 1 56 56 THR C C 56 174.417 174.417 173.611 0.806 18496 5366 1 14 . 1 1 56 56 THR CA C 56 59.098 59.098 61.607 -2.509 18496 5367 1 14 . 1 1 56 56 THR CB C 56 72.153 72.153 70.233 1.920 18496 5368 1 14 . 1 1 56 56 THR H H 56 7.916 7.916 8.404 -0.488 18496 5369 1 14 . 1 1 57 57 LEU N N 57 121.044 121.044 127.214 -6.170 18496 5370 1 14 . 1 1 57 57 LEU HA H 57 5.311 5.311 4.922 0.389 18496 5371 1 14 . 1 1 57 57 LEU C C 57 176.150 176.150 175.564 0.586 18496 5372 1 14 . 1 1 57 57 LEU CA C 57 53.264 53.264 53.768 -0.504 18496 5373 1 14 . 1 1 57 57 LEU CB C 57 45.901 45.901 45.335 0.566 18496 5374 1 14 . 1 1 57 57 LEU H H 57 9.421 9.421 9.040 0.381 18496 5375 1 14 . 1 1 58 58 SER N N 58 119.548 119.548 119.040 0.508 18496 5376 1 14 . 1 1 58 58 SER HA H 58 4.734 4.734 4.461 0.273 18496 5377 1 14 . 1 1 58 58 SER C C 58 174.786 174.786 175.279 -0.493 18496 5378 1 14 . 1 1 58 58 SER CA C 58 56.948 56.948 57.901 -0.953 18496 5379 1 14 . 1 1 58 58 SER CB C 58 65.726 65.726 63.943 1.783 18496 5380 1 14 . 1 1 58 58 SER H H 58 9.771 9.771 9.521 0.250 18496 5381 1 14 . 1 1 59 59 GLU N N 59 120.827 120.827 123.541 -2.714 18496 5382 1 14 . 1 1 59 59 GLU HA H 59 4.319 4.319 4.202 0.117 18496 5383 1 14 . 1 1 59 59 GLU C C 59 179.806 179.806 178.950 0.856 18496 5384 1 14 . 1 1 59 59 GLU CA C 59 60.913 60.913 60.777 0.136 18496 5385 1 14 . 1 1 59 59 GLU CB C 59 29.538 29.538 29.306 0.232 18496 5386 1 14 . 1 1 59 59 GLU H H 59 9.394 9.394 8.993 0.401 18496 5387 1 14 . 1 1 60 60 GLU N N 60 119.587 119.587 119.404 0.183 18496 5388 1 14 . 1 1 60 60 GLU HA H 60 4.188 4.188 4.121 0.067 18496 5389 1 14 . 1 1 60 60 GLU C C 60 179.686 179.686 178.829 0.857 18496 5390 1 14 . 1 1 60 60 GLU CA C 60 60.279 60.279 59.554 0.724 18496 5391 1 14 . 1 1 60 60 GLU CB C 60 29.559 29.559 28.753 0.806 18496 5392 1 14 . 1 1 60 60 GLU H H 60 8.905 8.905 8.855 0.050 18496 5393 1 14 . 1 1 61 61 GLU N N 61 120.145 120.145 119.936 0.209 18496 5394 1 14 . 1 1 61 61 GLU HA H 61 4.037 4.037 4.104 -0.067 18496 5395 1 14 . 1 1 61 61 GLU C C 61 178.530 178.530 178.932 -0.402 18496 5396 1 14 . 1 1 61 61 GLU CA C 61 59.118 59.118 58.926 0.192 18496 5397 1 14 . 1 1 61 61 GLU CB C 61 30.976 30.976 29.311 1.665 18496 5398 1 14 . 1 1 61 61 GLU H H 61 8.013 8.013 8.422 -0.409 18496 5399 1 14 . 1 1 62 62 PHE N N 62 119.925 119.925 120.648 -0.723 18496 5400 1 14 . 1 1 62 62 PHE HA H 62 3.927 3.927 4.119 -0.192 18496 5401 1 14 . 1 1 62 62 PHE C C 62 176.783 176.783 177.527 -0.744 18496 5402 1 14 . 1 1 62 62 PHE CA C 62 61.827 61.827 61.358 0.469 18496 5403 1 14 . 1 1 62 62 PHE CB C 62 40.216 40.216 38.993 1.223 18496 5404 1 14 . 1 1 62 62 PHE H H 62 9.192 9.192 8.915 0.277 18496 5405 1 14 . 1 1 63 63 GLY N N 63 104.854 104.854 107.687 -2.833 18496 5406 1 14 . 1 1 63 63 GLY C C 63 176.854 176.854 175.967 0.887 18496 5407 1 14 . 1 1 63 63 GLY CA C 63 47.178 47.178 47.510 -0.332 18496 5408 1 14 . 1 1 63 63 GLY H H 63 8.316 8.316 8.724 -0.408 18496 5409 1 14 . 1 1 64 64 VAL N N 64 123.719 123.719 122.800 0.919 18496 5410 1 14 . 1 1 64 64 VAL HA H 64 3.663 3.663 3.718 -0.055 18496 5411 1 14 . 1 1 64 64 VAL C C 64 177.644 177.644 177.807 -0.163 18496 5412 1 14 . 1 1 64 64 VAL CA C 64 67.090 67.090 65.893 1.197 18496 5413 1 14 . 1 1 64 64 VAL CB C 64 31.367 31.367 31.044 0.323 18496 5414 1 14 . 1 1 64 64 VAL H H 64 7.759 7.759 7.816 -0.057 18496 5415 1 14 . 1 1 65 65 LEU N N 65 120.099 120.099 121.206 -1.107 18496 5416 1 14 . 1 1 65 65 LEU HA H 65 3.672 3.672 3.924 -0.252 18496 5417 1 14 . 1 1 65 65 LEU C C 65 177.636 177.636 178.640 -1.004 18496 5418 1 14 . 1 1 65 65 LEU CA C 65 58.552 58.552 58.366 0.186 18496 5419 1 14 . 1 1 65 65 LEU CB C 65 41.358 41.358 41.732 -0.374 18496 5420 1 14 . 1 1 65 65 LEU H H 65 7.660 7.660 7.851 -0.191 18496 5421 1 14 . 1 1 66 66 LEU N N 66 115.733 115.733 118.460 -2.727 18496 5422 1 14 . 1 1 66 66 LEU HA H 66 3.556 3.556 3.601 -0.045 18496 5423 1 14 . 1 1 66 66 LEU C C 66 179.729 179.729 178.802 0.927 18496 5424 1 14 . 1 1 66 66 LEU CA C 66 58.069 58.069 58.142 -0.073 18496 5425 1 14 . 1 1 66 66 LEU CB C 66 41.625 41.625 41.002 0.624 18496 5426 1 14 . 1 1 66 66 LEU H H 66 8.083 8.083 8.263 -0.180 18496 5427 1 14 . 1 1 67 67 LYS N N 67 119.120 119.120 119.888 -0.768 18496 5428 1 14 . 1 1 67 67 LYS HA H 67 3.965 3.965 3.792 0.173 18496 5429 1 14 . 1 1 67 67 LYS C C 67 179.379 179.379 178.974 0.405 18496 5430 1 14 . 1 1 67 67 LYS CA C 67 59.227 59.227 59.864 -0.637 18496 5431 1 14 . 1 1 67 67 LYS CB C 67 32.737 32.737 32.219 0.517 18496 5432 1 14 . 1 1 67 67 LYS H H 67 7.861 7.861 8.351 -0.490 18496 5433 1 14 . 1 1 68 68 GLU N N 68 116.924 116.924 118.781 -1.857 18496 5434 1 14 . 1 1 68 68 GLU HA H 68 4.409 4.409 4.070 0.339 18496 5435 1 14 . 1 1 68 68 GLU CA C 68 57.712 57.712 58.880 -1.168 18496 5436 1 14 . 1 1 68 68 GLU CB C 68 29.586 29.586 29.475 0.111 18496 5437 1 14 . 1 1 68 68 GLU H H 68 8.319 8.319 7.760 0.559 18496 5438 1 14 . 1 1 69 69 LEU N N 69 120.032 120.032 120.085 -0.053 18496 5439 1 14 . 1 1 69 69 LEU HA H 69 4.107 4.107 3.944 0.163 18496 5440 1 14 . 1 1 69 69 LEU CA C 69 57.563 57.563 57.528 0.035 18496 5441 1 14 . 1 1 69 69 LEU CB C 69 41.373 41.373 41.538 -0.165 18496 5442 1 14 . 1 1 69 69 LEU H H 69 8.233 8.233 8.501 -0.268 18496 5443 1 14 . 1 1 70 70 GLY N N 70 105.472 105.472 105.484 -0.012 18496 5444 1 14 . 1 1 70 70 GLY C C 70 174.986 174.986 175.611 -0.625 18496 5445 1 14 . 1 1 70 70 GLY CA C 70 46.704 46.704 46.774 -0.070 18496 5446 1 14 . 1 1 70 70 GLY H H 70 7.960 7.960 8.539 -0.579 18496 5447 1 14 . 1 1 71 71 ASN N N 71 118.596 118.596 119.219 -0.623 18496 5448 1 14 . 1 1 71 71 ASN HA H 71 4.681 4.681 4.944 -0.263 18496 5449 1 14 . 1 1 71 71 ASN C C 71 176.412 176.412 177.812 -1.400 18496 5450 1 14 . 1 1 71 71 ASN CA C 71 54.407 54.407 54.955 -0.547 18496 5451 1 14 . 1 1 71 71 ASN CB C 71 38.729 38.729 38.828 -0.099 18496 5452 1 14 . 1 1 71 71 ASN H H 71 7.857 7.857 7.724 0.133 18496 5453 1 14 . 1 1 72 72 LYS N N 72 119.973 119.973 120.863 -0.890 18496 5454 1 14 . 1 1 72 72 LYS HA H 72 4.282 4.282 4.108 0.174 18496 5455 1 14 . 1 1 72 72 LYS CA C 72 57.338 57.338 58.340 -1.002 18496 5456 1 14 . 1 1 72 72 LYS CB C 72 32.755 32.755 32.062 0.693 18496 5457 1 14 . 1 1 72 72 LYS H H 72 8.100 8.100 8.012 0.088 18496 5458 1 14 . 1 1 73 73 LEU HA H 73 4.281 4.281 4.312 -0.031 18496 5459 1 14 . 1 1 73 73 LEU CA C 73 55.774 55.774 54.938 0.836 18496 5460 1 14 . 1 1 73 73 LEU CB C 73 41.983 41.983 42.065 -0.082 18496 5461 1 15 . 1 1 2 2 ALA HA H 2 4.074 4.074 4.541 -0.467 18496 5462 1 15 . 1 1 2 2 ALA CA C 2 51.966 51.966 51.295 0.671 18496 5463 1 15 . 1 1 2 2 ALA CB C 2 19.732 19.732 20.172 -0.440 18496 5464 1 15 . 1 1 3 3 ASP HA H 3 4.632 4.632 4.501 0.131 18496 5465 1 15 . 1 1 3 3 ASP C C 3 175.822 175.822 176.146 -0.324 18496 5466 1 15 . 1 1 3 3 ASP CA C 3 54.440 54.440 55.387 -0.947 18496 5467 1 15 . 1 1 3 3 ASP CB C 3 41.577 41.577 41.286 0.291 18496 5468 1 15 . 1 1 4 4 LYS N N 4 121.655 121.655 119.708 1.947 18496 5469 1 15 . 1 1 4 4 LYS HA H 4 4.379 4.379 4.529 -0.150 18496 5470 1 15 . 1 1 4 4 LYS C C 4 176.011 176.011 175.333 0.678 18496 5471 1 15 . 1 1 4 4 LYS CA C 4 56.213 56.213 55.168 1.045 18496 5472 1 15 . 1 1 4 4 LYS CB C 4 33.407 33.407 32.126 1.281 18496 5473 1 15 . 1 1 4 4 LYS H H 4 8.394 8.394 7.947 0.447 18496 5474 1 15 . 1 1 5 5 LEU N N 5 125.369 125.369 125.188 0.181 18496 5475 1 15 . 1 1 5 5 LEU HA H 5 4.351 4.351 4.369 -0.018 18496 5476 1 15 . 1 1 5 5 LEU C C 5 175.682 175.682 176.651 -0.969 18496 5477 1 15 . 1 1 5 5 LEU CA C 5 55.117 55.117 54.703 0.415 18496 5478 1 15 . 1 1 5 5 LEU CB C 5 43.197 43.197 42.835 0.362 18496 5479 1 15 . 1 1 5 5 LEU H H 5 8.136 8.136 8.282 -0.146 18496 5480 1 15 . 1 1 6 6 LYS N N 6 126.844 126.844 127.081 -0.237 18496 5481 1 15 . 1 1 6 6 LYS HA H 6 4.451 4.451 4.403 0.048 18496 5482 1 15 . 1 1 6 6 LYS C C 6 174.665 174.665 175.396 -0.731 18496 5483 1 15 . 1 1 6 6 LYS CA C 6 55.974 55.974 56.653 -0.679 18496 5484 1 15 . 1 1 6 6 LYS CB C 6 34.386 34.386 33.141 1.245 18496 5485 1 15 . 1 1 6 6 LYS H H 6 8.615 8.615 8.623 -0.008 18496 5486 1 15 . 1 1 7 7 PHE N N 7 119.818 119.818 120.079 -0.261 18496 5487 1 15 . 1 1 7 7 PHE HA H 7 5.343 5.343 5.493 -0.150 18496 5488 1 15 . 1 1 7 7 PHE C C 7 173.569 173.569 173.849 -0.280 18496 5489 1 15 . 1 1 7 7 PHE CA C 7 55.813 55.813 55.814 -0.001 18496 5490 1 15 . 1 1 7 7 PHE CB C 7 42.975 42.975 42.865 0.110 18496 5491 1 15 . 1 1 7 7 PHE H H 7 7.734 7.734 8.021 -0.287 18496 5492 1 15 . 1 1 8 8 GLU N N 8 119.165 119.165 120.415 -1.250 18496 5493 1 15 . 1 1 8 8 GLU HA H 8 4.158 4.158 4.421 -0.263 18496 5494 1 15 . 1 1 8 8 GLU C C 8 175.026 175.026 175.030 -0.004 18496 5495 1 15 . 1 1 8 8 GLU CA C 8 55.221 55.221 54.634 0.587 18496 5496 1 15 . 1 1 8 8 GLU CB C 8 33.699 33.699 33.273 0.426 18496 5497 1 15 . 1 1 8 8 GLU H H 8 8.295 8.295 8.496 -0.201 18496 5498 1 15 . 1 1 9 9 ILE N N 9 127.619 127.619 127.744 -0.125 18496 5499 1 15 . 1 1 9 9 ILE HA H 9 3.768 3.768 4.162 -0.394 18496 5500 1 15 . 1 1 9 9 ILE C C 9 174.902 174.902 175.964 -1.062 18496 5501 1 15 . 1 1 9 9 ILE CA C 9 62.505 62.505 61.995 0.510 18496 5502 1 15 . 1 1 9 9 ILE CB C 9 36.094 36.094 37.309 -1.215 18496 5503 1 15 . 1 1 9 9 ILE H H 9 9.157 9.157 8.643 0.514 18496 5504 1 15 . 1 1 10 10 ILE N N 10 131.245 131.245 128.550 2.695 18496 5505 1 15 . 1 1 10 10 ILE HA H 10 3.861 3.861 3.999 -0.138 18496 5506 1 15 . 1 1 10 10 ILE C C 10 176.247 176.247 176.723 -0.476 18496 5507 1 15 . 1 1 10 10 ILE CA C 10 60.554 60.554 62.217 -1.663 18496 5508 1 15 . 1 1 10 10 ILE CB C 10 37.406 37.406 38.152 -0.746 18496 5509 1 15 . 1 1 10 10 ILE H H 10 8.428 8.428 8.793 -0.365 18496 5510 1 15 . 1 1 11 11 GLU N N 11 117.669 117.669 117.422 0.247 18496 5511 1 15 . 1 1 11 11 GLU HA H 11 4.315 4.315 4.511 -0.196 18496 5512 1 15 . 1 1 11 11 GLU C C 11 174.155 174.155 174.342 -0.187 18496 5513 1 15 . 1 1 11 11 GLU CA C 11 55.755 55.755 55.627 0.128 18496 5514 1 15 . 1 1 11 11 GLU CB C 11 34.386 34.386 32.395 1.991 18496 5515 1 15 . 1 1 11 11 GLU H H 11 7.551 7.551 7.931 -0.380 18496 5516 1 15 . 1 1 12 12 GLU N N 12 128.587 128.587 124.684 3.903 18496 5517 1 15 . 1 1 12 12 GLU HA H 12 5.214 5.214 4.447 0.767 18496 5518 1 15 . 1 1 12 12 GLU C C 12 176.877 176.877 175.580 1.297 18496 5519 1 15 . 1 1 12 12 GLU CA C 12 54.801 54.801 57.567 -2.766 18496 5520 1 15 . 1 1 12 12 GLU CB C 12 30.137 30.137 30.049 0.087 18496 5521 1 15 . 1 1 12 12 GLU H H 12 8.762 8.762 8.854 -0.092 18496 5522 1 15 . 1 1 13 13 LEU N N 13 122.508 122.508 121.689 0.819 18496 5523 1 15 . 1 1 13 13 LEU HA H 13 4.872 4.872 4.642 0.230 18496 5524 1 15 . 1 1 13 13 LEU C C 13 176.060 176.060 177.258 -1.198 18496 5525 1 15 . 1 1 13 13 LEU CA C 13 57.372 57.372 55.352 2.020 18496 5526 1 15 . 1 1 13 13 LEU CB C 13 42.284 42.284 43.680 -1.396 18496 5527 1 15 . 1 1 13 13 LEU H H 13 8.058 8.058 8.729 -0.671 18496 5528 1 15 . 1 1 14 14 ILE N N 14 115.422 115.422 118.063 -2.641 18496 5529 1 15 . 1 1 14 14 ILE HA H 14 4.553 4.553 4.464 0.089 18496 5530 1 15 . 1 1 14 14 ILE C C 14 174.893 174.893 174.147 0.746 18496 5531 1 15 . 1 1 14 14 ILE CA C 14 60.586 60.586 59.642 0.945 18496 5532 1 15 . 1 1 14 14 ILE CB C 14 44.329 44.329 41.349 2.980 18496 5533 1 15 . 1 1 14 14 ILE H H 14 8.450 8.450 8.400 0.050 18496 5534 1 15 . 1 1 15 15 VAL N N 15 129.108 129.108 126.655 2.453 18496 5535 1 15 . 1 1 15 15 VAL HA H 15 4.196 4.196 4.416 -0.220 18496 5536 1 15 . 1 1 15 15 VAL C C 15 175.180 175.180 175.137 0.043 18496 5537 1 15 . 1 1 15 15 VAL CA C 15 63.288 63.288 60.632 2.656 18496 5538 1 15 . 1 1 15 15 VAL CB C 15 32.117 32.117 33.312 -1.195 18496 5539 1 15 . 1 1 15 15 VAL H H 15 8.867 8.867 8.463 0.404 18496 5540 1 15 . 1 1 16 16 LEU N N 16 127.846 127.846 129.690 -1.844 18496 5541 1 15 . 1 1 16 16 LEU HA H 16 4.317 4.317 4.639 -0.322 18496 5542 1 15 . 1 1 16 16 LEU C C 16 176.070 176.070 176.880 -0.810 18496 5543 1 15 . 1 1 16 16 LEU CA C 16 57.252 57.252 55.753 1.499 18496 5544 1 15 . 1 1 16 16 LEU CB C 16 42.035 42.035 42.667 -0.632 18496 5545 1 15 . 1 1 16 16 LEU H H 16 9.555 9.555 8.961 0.594 18496 5546 1 15 . 1 1 17 17 SER N N 17 107.073 107.073 110.649 -3.576 18496 5547 1 15 . 1 1 17 17 SER HA H 17 4.540 4.540 4.639 -0.099 18496 5548 1 15 . 1 1 17 17 SER C C 17 172.277 172.277 172.251 0.026 18496 5549 1 15 . 1 1 17 17 SER CA C 17 57.882 57.882 57.989 -0.107 18496 5550 1 15 . 1 1 17 17 SER CB C 17 64.046 64.046 65.203 -1.157 18496 5551 1 15 . 1 1 17 17 SER H H 17 7.699 7.699 7.919 -0.220 18496 5552 1 15 . 1 1 18 18 GLU N N 18 119.235 119.235 119.905 -0.670 18496 5553 1 15 . 1 1 18 18 GLU HA H 18 5.143 5.143 5.071 0.072 18496 5554 1 15 . 1 1 18 18 GLU C C 18 175.469 175.469 176.372 -0.903 18496 5555 1 15 . 1 1 18 18 GLU CA C 18 55.248 55.248 55.231 0.017 18496 5556 1 15 . 1 1 18 18 GLU CB C 18 33.454 33.454 31.102 2.352 18496 5557 1 15 . 1 1 18 18 GLU H H 18 8.437 8.437 8.484 -0.047 18496 5558 1 15 . 1 1 19 19 ASN N N 19 123.988 123.988 122.565 1.423 18496 5559 1 15 . 1 1 19 19 ASN HA H 19 5.097 5.097 4.720 0.377 18496 5560 1 15 . 1 1 19 19 ASN CA C 19 50.916 50.916 53.215 -2.300 18496 5561 1 15 . 1 1 19 19 ASN CB C 19 39.482 39.482 39.015 0.467 18496 5562 1 15 . 1 1 19 19 ASN H H 19 8.779 8.779 8.504 0.275 18496 5563 1 15 . 1 1 20 20 ALA N N 20 120.854 120.854 122.174 -1.320 18496 5564 1 15 . 1 1 20 20 ALA HA H 20 4.239 4.239 4.129 0.110 18496 5565 1 15 . 1 1 20 20 ALA C C 20 179.032 179.032 177.957 1.075 18496 5566 1 15 . 1 1 20 20 ALA CA C 20 54.924 54.924 54.391 0.533 18496 5567 1 15 . 1 1 20 20 ALA CB C 20 18.621 18.621 18.541 0.080 18496 5568 1 15 . 1 1 20 20 ALA H H 20 8.616 8.616 8.586 0.030 18496 5569 1 15 . 1 1 21 21 LYS N N 21 115.771 115.771 116.427 -0.656 18496 5570 1 15 . 1 1 21 21 LYS HA H 21 4.497 4.497 4.229 0.268 18496 5571 1 15 . 1 1 21 21 LYS C C 21 176.615 176.615 176.824 -0.209 18496 5572 1 15 . 1 1 21 21 LYS CA C 21 55.503 55.503 55.220 0.283 18496 5573 1 15 . 1 1 21 21 LYS CB C 21 32.742 32.742 31.652 1.090 18496 5574 1 15 . 1 1 21 21 LYS H H 21 7.767 7.767 7.706 0.061 18496 5575 1 15 . 1 1 22 22 GLY N N 22 107.695 107.695 106.877 0.818 18496 5576 1 15 . 1 1 22 22 GLY C C 22 174.843 174.843 173.886 0.957 18496 5577 1 15 . 1 1 22 22 GLY CA C 22 45.297 45.297 45.278 0.019 18496 5578 1 15 . 1 1 22 22 GLY H H 22 8.317 8.317 7.917 0.400 18496 5579 1 15 . 1 1 23 23 TRP N N 23 121.316 121.316 120.948 0.368 18496 5580 1 15 . 1 1 23 23 TRP HA H 23 4.815 4.815 4.824 -0.009 18496 5581 1 15 . 1 1 23 23 TRP C C 23 176.754 176.754 176.341 0.413 18496 5582 1 15 . 1 1 23 23 TRP CA C 23 58.291 58.291 55.073 3.218 18496 5583 1 15 . 1 1 23 23 TRP CB C 23 28.127 28.127 28.096 0.031 18496 5584 1 15 . 1 1 23 23 TRP H H 23 7.983 7.983 7.997 -0.014 18496 5585 1 15 . 1 1 24 24 ARG N N 24 120.789 120.789 126.861 -6.072 18496 5586 1 15 . 1 1 24 24 ARG HA H 24 5.496 5.496 5.070 0.426 18496 5587 1 15 . 1 1 24 24 ARG C C 24 175.831 175.831 176.102 -0.271 18496 5588 1 15 . 1 1 24 24 ARG CA C 24 54.755 54.755 54.270 0.485 18496 5589 1 15 . 1 1 24 24 ARG CB C 24 33.735 33.735 30.251 3.484 18496 5590 1 15 . 1 1 24 24 ARG H H 24 9.046 9.046 9.445 -0.399 18496 5591 1 15 . 1 1 25 25 LYS N N 25 126.507 126.507 129.198 -2.691 18496 5592 1 15 . 1 1 25 25 LYS HA H 25 5.081 5.081 4.911 0.170 18496 5593 1 15 . 1 1 25 25 LYS C C 25 175.648 175.648 175.696 -0.048 18496 5594 1 15 . 1 1 25 25 LYS CA C 25 56.071 56.071 56.952 -0.881 18496 5595 1 15 . 1 1 25 25 LYS CB C 25 32.214 32.214 32.951 -0.737 18496 5596 1 15 . 1 1 25 25 LYS H H 25 8.526 8.526 8.418 0.108 18496 5597 1 15 . 1 1 26 26 GLU N N 26 126.009 126.009 123.987 2.022 18496 5598 1 15 . 1 1 26 26 GLU HA H 26 5.275 5.275 5.139 0.136 18496 5599 1 15 . 1 1 26 26 GLU C C 26 174.894 174.894 174.247 0.647 18496 5600 1 15 . 1 1 26 26 GLU CA C 26 55.271 55.271 55.100 0.171 18496 5601 1 15 . 1 1 26 26 GLU CB C 26 33.781 33.781 34.604 -0.823 18496 5602 1 15 . 1 1 26 26 GLU H H 26 9.125 9.125 9.251 -0.126 18496 5603 1 15 . 1 1 27 27 LEU N N 27 121.930 121.930 125.401 -3.471 18496 5604 1 15 . 1 1 27 27 LEU HA H 27 5.788 5.788 4.870 0.918 18496 5605 1 15 . 1 1 27 27 LEU C C 27 173.941 173.941 174.396 -0.455 18496 5606 1 15 . 1 1 27 27 LEU CA C 27 53.859 53.859 53.831 0.028 18496 5607 1 15 . 1 1 27 27 LEU CB C 27 44.020 44.020 44.045 -0.025 18496 5608 1 15 . 1 1 27 27 LEU H H 27 8.938 8.938 9.111 -0.173 18496 5609 1 15 . 1 1 28 28 ASN N N 28 124.630 124.630 125.082 -0.452 18496 5610 1 15 . 1 1 28 28 ASN HA H 28 5.411 5.411 5.216 0.195 18496 5611 1 15 . 1 1 28 28 ASN C C 28 174.366 174.366 173.315 1.051 18496 5612 1 15 . 1 1 28 28 ASN CA C 28 52.063 52.063 52.236 -0.173 18496 5613 1 15 . 1 1 28 28 ASN CB C 28 44.430 44.430 43.274 1.156 18496 5614 1 15 . 1 1 28 28 ASN H H 28 9.345 9.345 8.217 1.128 18496 5615 1 15 . 1 1 29 29 ARG N N 29 118.443 118.443 122.659 -4.216 18496 5616 1 15 . 1 1 29 29 ARG HA H 29 5.058 5.058 4.832 0.226 18496 5617 1 15 . 1 1 29 29 ARG C C 29 175.779 175.779 174.785 0.994 18496 5618 1 15 . 1 1 29 29 ARG CA C 29 56.091 56.091 55.688 0.403 18496 5619 1 15 . 1 1 29 29 ARG CB C 29 31.710 31.710 31.116 0.594 18496 5620 1 15 . 1 1 29 29 ARG H H 29 9.109 9.109 9.004 0.105 18496 5621 1 15 . 1 1 30 30 VAL N N 30 124.605 124.605 121.431 3.174 18496 5622 1 15 . 1 1 30 30 VAL HA H 30 4.535 4.535 5.366 -0.831 18496 5623 1 15 . 1 1 30 30 VAL C C 30 174.775 174.775 174.449 0.326 18496 5624 1 15 . 1 1 30 30 VAL CA C 30 60.921 60.921 58.918 2.003 18496 5625 1 15 . 1 1 30 30 VAL CB C 30 37.790 37.790 36.143 1.647 18496 5626 1 15 . 1 1 30 30 VAL H H 30 9.054 9.054 8.607 0.447 18496 5627 1 15 . 1 1 31 31 SER N N 31 120.794 120.794 115.422 5.372 18496 5628 1 15 . 1 1 31 31 SER HA H 31 4.652 4.652 5.134 -0.482 18496 5629 1 15 . 1 1 31 31 SER C C 31 174.214 174.214 175.550 -1.336 18496 5630 1 15 . 1 1 31 31 SER CA C 31 56.279 56.279 56.878 -0.599 18496 5631 1 15 . 1 1 31 31 SER CB C 31 64.128 64.128 64.324 -0.196 18496 5632 1 15 . 1 1 31 31 SER H H 31 8.667 8.667 8.838 -0.171 18496 5633 1 15 . 1 1 32 32 TRP N N 32 132.303 132.303 127.906 4.397 18496 5634 1 15 . 1 1 32 32 TRP HA H 32 5.105 5.105 4.547 0.558 18496 5635 1 15 . 1 1 32 32 TRP C C 32 177.276 177.276 177.166 0.110 18496 5636 1 15 . 1 1 32 32 TRP CA C 32 56.198 56.198 58.048 -1.850 18496 5637 1 15 . 1 1 32 32 TRP CB C 32 29.968 29.968 27.931 2.037 18496 5638 1 15 . 1 1 32 32 TRP H H 32 9.282 9.282 9.185 0.097 18496 5639 1 15 . 1 1 33 33 ASN N N 33 124.979 124.979 123.398 1.581 18496 5640 1 15 . 1 1 33 33 ASN HA H 33 4.257 4.257 4.391 -0.134 18496 5641 1 15 . 1 1 33 33 ASN C C 33 174.030 174.030 174.785 -0.755 18496 5642 1 15 . 1 1 33 33 ASN CA C 33 54.709 54.709 54.805 -0.096 18496 5643 1 15 . 1 1 33 33 ASN CB C 33 37.921 37.921 36.998 0.923 18496 5644 1 15 . 1 1 33 33 ASN H H 33 9.813 9.813 8.833 0.980 18496 5645 1 15 . 1 1 34 34 ASP N N 34 111.880 111.880 113.594 -1.714 18496 5646 1 15 . 1 1 34 34 ASP HA H 34 4.126 4.126 4.248 -0.122 18496 5647 1 15 . 1 1 34 34 ASP CA C 34 56.130 56.130 55.410 0.720 18496 5648 1 15 . 1 1 34 34 ASP CB C 34 39.760 39.760 40.373 -0.613 18496 5649 1 15 . 1 1 34 34 ASP H H 34 9.251 9.251 8.247 1.004 18496 5650 1 15 . 1 1 35 35 ALA N N 35 121.811 121.811 121.594 0.217 18496 5651 1 15 . 1 1 35 35 ALA HA H 35 4.477 4.477 4.448 0.029 18496 5652 1 15 . 1 1 35 35 ALA C C 35 177.778 177.778 177.183 0.595 18496 5653 1 15 . 1 1 35 35 ALA CA C 35 51.528 51.528 52.805 -1.277 18496 5654 1 15 . 1 1 35 35 ALA CB C 35 20.445 20.445 20.331 0.114 18496 5655 1 15 . 1 1 35 35 ALA H H 35 7.625 7.625 7.802 -0.177 18496 5656 1 15 . 1 1 36 36 GLU N N 36 121.068 121.068 121.635 -0.567 18496 5657 1 15 . 1 1 36 36 GLU HA H 36 4.390 4.390 4.759 -0.369 18496 5658 1 15 . 1 1 36 36 GLU CA C 36 55.276 55.276 52.106 3.170 18496 5659 1 15 . 1 1 36 36 GLU CB C 36 28.575 28.575 31.202 -2.627 18496 5660 1 15 . 1 1 36 36 GLU H H 36 8.658 8.658 8.085 0.573 18496 5661 1 15 . 1 1 37 37 PRO HA H 37 4.289 4.289 4.677 -0.388 18496 5662 1 15 . 1 1 37 37 PRO C C 37 175.799 175.799 175.766 0.033 18496 5663 1 15 . 1 1 37 37 PRO CA C 37 63.105 63.105 62.316 0.789 18496 5664 1 15 . 1 1 37 37 PRO CB C 37 32.076 32.076 31.749 0.327 18496 5665 1 15 . 1 1 38 38 LYS N N 38 120.881 120.881 122.871 -1.990 18496 5666 1 15 . 1 1 38 38 LYS HA H 38 4.700 4.700 4.333 0.367 18496 5667 1 15 . 1 1 38 38 LYS C C 38 176.906 176.906 174.723 2.183 18496 5668 1 15 . 1 1 38 38 LYS CA C 38 54.399 54.399 54.299 0.100 18496 5669 1 15 . 1 1 38 38 LYS CB C 38 37.217 37.217 36.393 0.824 18496 5670 1 15 . 1 1 38 38 LYS H H 38 8.316 8.316 8.799 -0.483 18496 5671 1 15 . 1 1 39 39 TYR N N 39 119.792 119.792 118.438 1.354 18496 5672 1 15 . 1 1 39 39 TYR HA H 39 4.636 4.636 4.629 0.007 18496 5673 1 15 . 1 1 39 39 TYR C C 39 175.834 175.834 174.779 1.055 18496 5674 1 15 . 1 1 39 39 TYR CA C 39 60.228 60.228 57.419 2.809 18496 5675 1 15 . 1 1 39 39 TYR CB C 39 38.683 38.683 39.050 -0.367 18496 5676 1 15 . 1 1 39 39 TYR H H 39 8.508 8.508 7.809 0.699 18496 5677 1 15 . 1 1 40 40 ASP N N 40 126.502 126.502 123.023 3.479 18496 5678 1 15 . 1 1 40 40 ASP HA H 40 5.597 5.597 5.354 0.243 18496 5679 1 15 . 1 1 40 40 ASP C C 40 175.283 175.283 174.054 1.229 18496 5680 1 15 . 1 1 40 40 ASP CA C 40 55.053 55.053 53.583 1.470 18496 5681 1 15 . 1 1 40 40 ASP CB C 40 48.656 48.656 45.468 3.188 18496 5682 1 15 . 1 1 40 40 ASP H H 40 9.219 9.219 8.383 0.836 18496 5683 1 15 . 1 1 41 41 ILE N N 41 125.910 125.910 124.916 0.994 18496 5684 1 15 . 1 1 41 41 ILE HA H 41 5.722 5.722 5.031 0.691 18496 5685 1 15 . 1 1 41 41 ILE C C 41 174.167 174.167 173.603 0.564 18496 5686 1 15 . 1 1 41 41 ILE CA C 41 60.734 60.734 59.734 1.000 18496 5687 1 15 . 1 1 41 41 ILE CB C 41 40.198 40.198 39.942 0.256 18496 5688 1 15 . 1 1 41 41 ILE H H 41 8.972 8.972 8.665 0.307 18496 5689 1 15 . 1 1 42 42 ARG N N 42 120.300 120.300 127.154 -6.854 18496 5690 1 15 . 1 1 42 42 ARG HA H 42 4.716 4.716 4.817 -0.101 18496 5691 1 15 . 1 1 42 42 ARG CA C 42 54.826 54.826 54.881 -0.055 18496 5692 1 15 . 1 1 42 42 ARG CB C 42 32.665 32.665 35.266 -2.601 18496 5693 1 15 . 1 1 42 42 ARG H H 42 8.320 8.320 8.689 -0.369 18496 5694 1 15 . 1 1 43 43 THR HA H 43 5.585 5.585 5.486 0.099 18496 5695 1 15 . 1 1 43 43 THR C C 43 173.294 173.294 173.066 0.228 18496 5696 1 15 . 1 1 43 43 THR CA C 43 60.847 60.847 59.295 1.552 18496 5697 1 15 . 1 1 43 43 THR CB C 43 69.961 69.961 70.942 -0.981 18496 5698 1 15 . 1 1 44 44 TRP N N 44 122.747 122.747 124.026 -1.279 18496 5699 1 15 . 1 1 44 44 TRP HA H 44 4.945 4.945 4.829 0.116 18496 5700 1 15 . 1 1 44 44 TRP C C 44 175.056 175.056 176.204 -1.148 18496 5701 1 15 . 1 1 44 44 TRP CA C 44 56.107 56.107 55.583 0.524 18496 5702 1 15 . 1 1 44 44 TRP CB C 44 34.506 34.506 32.324 2.182 18496 5703 1 15 . 1 1 44 44 TRP H H 44 9.180 9.180 8.934 0.246 18496 5704 1 15 . 1 1 45 45 SER N N 45 117.385 117.385 117.178 0.207 18496 5705 1 15 . 1 1 45 45 SER HA H 45 2.300 2.300 4.753 -2.453 18496 5706 1 15 . 1 1 45 45 SER CA C 45 56.481 56.481 58.241 -1.760 18496 5707 1 15 . 1 1 45 45 SER CB C 45 60.743 60.743 62.470 -1.727 18496 5708 1 15 . 1 1 45 45 SER H H 45 7.879 7.879 8.451 -0.572 18496 5709 1 15 . 1 1 46 46 PRO HA H 46 4.104 4.104 4.467 -0.363 18496 5710 1 15 . 1 1 46 46 PRO CA C 46 64.990 64.990 65.541 -0.551 18496 5711 1 15 . 1 1 46 46 PRO CB C 46 31.272 31.272 31.918 -0.646 18496 5712 1 15 . 1 1 47 47 ASP HA H 47 4.520 4.520 4.630 -0.110 18496 5713 1 15 . 1 1 47 47 ASP C C 47 175.629 175.629 175.646 -0.017 18496 5714 1 15 . 1 1 47 47 ASP CA C 47 53.453 53.453 53.038 0.415 18496 5715 1 15 . 1 1 47 47 ASP CB C 47 40.239 40.239 40.926 -0.687 18496 5716 1 15 . 1 1 48 48 HIS N N 48 111.320 111.320 115.442 -4.122 18496 5717 1 15 . 1 1 48 48 HIS HA H 48 3.916 3.916 4.494 -0.578 18496 5718 1 15 . 1 1 48 48 HIS CA C 48 60.347 60.347 57.485 2.862 18496 5719 1 15 . 1 1 48 48 HIS CB C 48 25.499 25.499 28.621 -3.122 18496 5720 1 15 . 1 1 48 48 HIS H H 48 8.269 8.269 8.265 0.004 18496 5721 1 15 . 1 1 49 49 GLU N N 49 114.659 114.659 114.555 0.104 18496 5722 1 15 . 1 1 49 49 GLU HA H 49 4.447 4.447 4.376 0.071 18496 5723 1 15 . 1 1 49 49 GLU C C 49 176.394 176.394 176.518 -0.124 18496 5724 1 15 . 1 1 49 49 GLU CA C 49 57.940 57.940 57.798 0.142 18496 5725 1 15 . 1 1 49 49 GLU CB C 49 30.641 30.641 30.599 0.042 18496 5726 1 15 . 1 1 49 49 GLU H H 49 7.381 7.381 8.720 -1.339 18496 5727 1 15 . 1 1 50 50 LYS N N 50 118.126 118.126 118.343 -0.217 18496 5728 1 15 . 1 1 50 50 LYS HA H 50 4.665 4.665 4.610 0.055 18496 5729 1 15 . 1 1 50 50 LYS CA C 50 54.431 54.431 54.590 -0.159 18496 5730 1 15 . 1 1 50 50 LYS CB C 50 36.543 36.543 36.341 0.202 18496 5731 1 15 . 1 1 50 50 LYS H H 50 8.067 8.067 7.744 0.323 18496 5732 1 15 . 1 1 51 51 MET HA H 51 4.936 4.936 4.405 0.531 18496 5733 1 15 . 1 1 51 51 MET CA C 51 54.048 54.048 52.622 1.426 18496 5734 1 15 . 1 1 51 51 MET CB C 51 33.768 33.768 34.946 -1.178 18496 5735 1 15 . 1 1 52 52 GLY C C 52 173.534 173.534 172.146 1.388 18496 5736 1 15 . 1 1 52 52 GLY CA C 52 43.060 43.060 44.379 -1.319 18496 5737 1 15 . 1 1 53 53 LYS N N 53 118.012 118.012 119.697 -1.685 18496 5738 1 15 . 1 1 53 53 LYS HA H 53 4.155 4.155 4.493 -0.338 18496 5739 1 15 . 1 1 53 53 LYS C C 53 176.818 176.818 176.111 0.707 18496 5740 1 15 . 1 1 53 53 LYS CA C 53 56.478 56.478 56.074 0.404 18496 5741 1 15 . 1 1 53 53 LYS CB C 53 33.117 33.117 33.399 -0.282 18496 5742 1 15 . 1 1 53 53 LYS H H 53 8.132 8.132 8.187 -0.055 18496 5743 1 15 . 1 1 54 54 GLY N N 54 109.836 109.836 108.496 1.340 18496 5744 1 15 . 1 1 54 54 GLY C C 54 170.848 170.848 172.734 -1.886 18496 5745 1 15 . 1 1 54 54 GLY CA C 54 46.701 46.701 44.834 1.867 18496 5746 1 15 . 1 1 54 54 GLY H H 54 8.079 8.079 8.186 -0.107 18496 5747 1 15 . 1 1 55 55 ILE N N 55 119.382 119.382 121.821 -2.439 18496 5748 1 15 . 1 1 55 55 ILE HA H 55 4.956 4.956 4.636 0.320 18496 5749 1 15 . 1 1 55 55 ILE C C 55 171.737 171.737 173.777 -2.040 18496 5750 1 15 . 1 1 55 55 ILE CA C 55 57.059 57.059 60.333 -3.274 18496 5751 1 15 . 1 1 55 55 ILE CB C 55 44.241 44.241 41.454 2.787 18496 5752 1 15 . 1 1 55 55 ILE H H 55 8.661 8.661 8.285 0.376 18496 5753 1 15 . 1 1 56 56 THR N N 56 113.795 113.795 122.430 -8.635 18496 5754 1 15 . 1 1 56 56 THR HA H 56 5.607 5.607 4.906 0.701 18496 5755 1 15 . 1 1 56 56 THR C C 56 174.417 174.417 173.605 0.812 18496 5756 1 15 . 1 1 56 56 THR CA C 56 59.098 59.098 61.528 -2.430 18496 5757 1 15 . 1 1 56 56 THR CB C 56 72.153 72.153 70.344 1.809 18496 5758 1 15 . 1 1 56 56 THR H H 56 7.916 7.916 8.404 -0.488 18496 5759 1 15 . 1 1 57 57 LEU N N 57 121.044 121.044 127.592 -6.548 18496 5760 1 15 . 1 1 57 57 LEU HA H 57 5.311 5.311 4.949 0.362 18496 5761 1 15 . 1 1 57 57 LEU C C 57 176.150 176.150 175.639 0.511 18496 5762 1 15 . 1 1 57 57 LEU CA C 57 53.264 53.264 53.775 -0.511 18496 5763 1 15 . 1 1 57 57 LEU CB C 57 45.901 45.901 45.130 0.771 18496 5764 1 15 . 1 1 57 57 LEU H H 57 9.421 9.421 9.255 0.166 18496 5765 1 15 . 1 1 58 58 SER N N 58 119.548 119.548 117.926 1.622 18496 5766 1 15 . 1 1 58 58 SER HA H 58 4.734 4.734 4.560 0.174 18496 5767 1 15 . 1 1 58 58 SER C C 58 174.786 174.786 175.942 -1.156 18496 5768 1 15 . 1 1 58 58 SER CA C 58 56.948 56.948 57.817 -0.869 18496 5769 1 15 . 1 1 58 58 SER CB C 58 65.726 65.726 64.502 1.224 18496 5770 1 15 . 1 1 58 58 SER H H 58 9.771 9.771 9.479 0.292 18496 5771 1 15 . 1 1 59 59 GLU N N 59 120.827 120.827 122.842 -2.015 18496 5772 1 15 . 1 1 59 59 GLU HA H 59 4.319 4.319 4.217 0.102 18496 5773 1 15 . 1 1 59 59 GLU C C 59 179.806 179.806 178.715 1.091 18496 5774 1 15 . 1 1 59 59 GLU CA C 59 60.913 60.913 61.149 -0.236 18496 5775 1 15 . 1 1 59 59 GLU CB C 59 29.538 29.538 29.347 0.191 18496 5776 1 15 . 1 1 59 59 GLU H H 59 9.394 9.394 9.174 0.220 18496 5777 1 15 . 1 1 60 60 GLU N N 60 119.587 119.587 119.711 -0.124 18496 5778 1 15 . 1 1 60 60 GLU HA H 60 4.188 4.188 4.112 0.076 18496 5779 1 15 . 1 1 60 60 GLU C C 60 179.686 179.686 178.829 0.857 18496 5780 1 15 . 1 1 60 60 GLU CA C 60 60.279 60.279 59.534 0.745 18496 5781 1 15 . 1 1 60 60 GLU CB C 60 29.559 29.559 28.723 0.837 18496 5782 1 15 . 1 1 60 60 GLU H H 60 8.905 8.905 8.886 0.019 18496 5783 1 15 . 1 1 61 61 GLU N N 61 120.145 120.145 119.856 0.289 18496 5784 1 15 . 1 1 61 61 GLU HA H 61 4.037 4.037 4.108 -0.071 18496 5785 1 15 . 1 1 61 61 GLU C C 61 178.530 178.530 178.887 -0.357 18496 5786 1 15 . 1 1 61 61 GLU CA C 61 59.118 59.118 58.805 0.313 18496 5787 1 15 . 1 1 61 61 GLU CB C 61 30.976 30.976 29.314 1.662 18496 5788 1 15 . 1 1 61 61 GLU H H 61 8.013 8.013 8.402 -0.389 18496 5789 1 15 . 1 1 62 62 PHE N N 62 119.925 119.925 120.764 -0.839 18496 5790 1 15 . 1 1 62 62 PHE HA H 62 3.927 3.927 4.073 -0.146 18496 5791 1 15 . 1 1 62 62 PHE C C 62 176.783 176.783 177.567 -0.784 18496 5792 1 15 . 1 1 62 62 PHE CA C 62 61.827 61.827 61.491 0.336 18496 5793 1 15 . 1 1 62 62 PHE CB C 62 40.216 40.216 38.906 1.310 18496 5794 1 15 . 1 1 62 62 PHE H H 62 9.192 9.192 8.874 0.318 18496 5795 1 15 . 1 1 63 63 GLY N N 63 104.854 104.854 107.306 -2.452 18496 5796 1 15 . 1 1 63 63 GLY C C 63 176.854 176.854 176.057 0.797 18496 5797 1 15 . 1 1 63 63 GLY CA C 63 47.178 47.178 47.458 -0.280 18496 5798 1 15 . 1 1 63 63 GLY H H 63 8.316 8.316 8.645 -0.329 18496 5799 1 15 . 1 1 64 64 VAL N N 64 123.719 123.719 122.887 0.832 18496 5800 1 15 . 1 1 64 64 VAL HA H 64 3.663 3.663 3.711 -0.048 18496 5801 1 15 . 1 1 64 64 VAL C C 64 177.644 177.644 177.818 -0.174 18496 5802 1 15 . 1 1 64 64 VAL CA C 64 67.090 67.090 65.966 1.124 18496 5803 1 15 . 1 1 64 64 VAL CB C 64 31.367 31.367 31.129 0.238 18496 5804 1 15 . 1 1 64 64 VAL H H 64 7.759 7.759 7.665 0.094 18496 5805 1 15 . 1 1 65 65 LEU N N 65 120.099 120.099 121.361 -1.262 18496 5806 1 15 . 1 1 65 65 LEU HA H 65 3.672 3.672 3.916 -0.244 18496 5807 1 15 . 1 1 65 65 LEU C C 65 177.636 177.636 178.682 -1.046 18496 5808 1 15 . 1 1 65 65 LEU CA C 65 58.552 58.552 58.440 0.112 18496 5809 1 15 . 1 1 65 65 LEU CB C 65 41.358 41.358 41.707 -0.349 18496 5810 1 15 . 1 1 65 65 LEU H H 65 7.660 7.660 8.135 -0.475 18496 5811 1 15 . 1 1 66 66 LEU N N 66 115.733 115.733 117.973 -2.240 18496 5812 1 15 . 1 1 66 66 LEU HA H 66 3.556 3.556 3.644 -0.088 18496 5813 1 15 . 1 1 66 66 LEU C C 66 179.729 179.729 178.825 0.904 18496 5814 1 15 . 1 1 66 66 LEU CA C 66 58.069 58.069 58.023 0.046 18496 5815 1 15 . 1 1 66 66 LEU CB C 66 41.625 41.625 40.954 0.671 18496 5816 1 15 . 1 1 66 66 LEU H H 66 8.083 8.083 8.211 -0.128 18496 5817 1 15 . 1 1 67 67 LYS N N 67 119.120 119.120 120.081 -0.961 18496 5818 1 15 . 1 1 67 67 LYS HA H 67 3.965 3.965 3.811 0.154 18496 5819 1 15 . 1 1 67 67 LYS C C 67 179.379 179.379 179.052 0.327 18496 5820 1 15 . 1 1 67 67 LYS CA C 67 59.227 59.227 59.857 -0.630 18496 5821 1 15 . 1 1 67 67 LYS CB C 67 32.737 32.737 32.225 0.512 18496 5822 1 15 . 1 1 67 67 LYS H H 67 7.861 7.861 8.264 -0.403 18496 5823 1 15 . 1 1 68 68 GLU N N 68 116.924 116.924 118.446 -1.522 18496 5824 1 15 . 1 1 68 68 GLU HA H 68 4.409 4.409 4.140 0.269 18496 5825 1 15 . 1 1 68 68 GLU CA C 68 57.712 57.712 58.625 -0.913 18496 5826 1 15 . 1 1 68 68 GLU CB C 68 29.586 29.586 29.537 0.049 18496 5827 1 15 . 1 1 68 68 GLU H H 68 8.319 8.319 7.793 0.526 18496 5828 1 15 . 1 1 69 69 LEU N N 69 120.032 120.032 120.162 -0.130 18496 5829 1 15 . 1 1 69 69 LEU HA H 69 4.107 4.107 3.940 0.167 18496 5830 1 15 . 1 1 69 69 LEU CA C 69 57.563 57.563 57.550 0.013 18496 5831 1 15 . 1 1 69 69 LEU CB C 69 41.373 41.373 41.541 -0.168 18496 5832 1 15 . 1 1 69 69 LEU H H 69 8.233 8.233 8.481 -0.248 18496 5833 1 15 . 1 1 70 70 GLY N N 70 105.472 105.472 105.254 0.218 18496 5834 1 15 . 1 1 70 70 GLY C C 70 174.986 174.986 176.158 -1.172 18496 5835 1 15 . 1 1 70 70 GLY CA C 70 46.704 46.704 46.747 -0.043 18496 5836 1 15 . 1 1 70 70 GLY H H 70 7.960 7.960 8.581 -0.621 18496 5837 1 15 . 1 1 71 71 ASN N N 71 118.596 118.596 119.838 -1.242 18496 5838 1 15 . 1 1 71 71 ASN HA H 71 4.681 4.681 4.769 -0.088 18496 5839 1 15 . 1 1 71 71 ASN C C 71 176.412 176.412 177.737 -1.325 18496 5840 1 15 . 1 1 71 71 ASN CA C 71 54.407 54.407 55.343 -0.936 18496 5841 1 15 . 1 1 71 71 ASN CB C 71 38.729 38.729 38.593 0.136 18496 5842 1 15 . 1 1 71 71 ASN H H 71 7.857 7.857 7.741 0.116 18496 5843 1 15 . 1 1 72 72 LYS N N 72 119.973 119.973 120.437 -0.464 18496 5844 1 15 . 1 1 72 72 LYS HA H 72 4.282 4.282 4.141 0.141 18496 5845 1 15 . 1 1 72 72 LYS CA C 72 57.338 57.338 57.963 -0.625 18496 5846 1 15 . 1 1 72 72 LYS CB C 72 32.755 32.755 32.005 0.750 18496 5847 1 15 . 1 1 72 72 LYS H H 72 8.100 8.100 8.098 0.002 18496 5848 1 15 . 1 1 73 73 LEU HA H 73 4.281 4.281 4.335 -0.054 18496 5849 1 15 . 1 1 73 73 LEU CA C 73 55.774 55.774 54.633 1.141 18496 5850 1 15 . 1 1 73 73 LEU CB C 73 41.983 41.983 42.107 -0.124 18496 5851 1 16 . 1 1 2 2 ALA HA H 2 4.074 4.074 4.590 -0.516 18496 5852 1 16 . 1 1 2 2 ALA CA C 2 51.966 51.966 51.629 0.337 18496 5853 1 16 . 1 1 2 2 ALA CB C 2 19.732 19.732 19.784 -0.052 18496 5854 1 16 . 1 1 3 3 ASP HA H 3 4.632 4.632 4.426 0.206 18496 5855 1 16 . 1 1 3 3 ASP C C 3 175.822 175.822 176.343 -0.521 18496 5856 1 16 . 1 1 3 3 ASP CA C 3 54.440 54.440 55.653 -1.213 18496 5857 1 16 . 1 1 3 3 ASP CB C 3 41.577 41.577 41.326 0.251 18496 5858 1 16 . 1 1 4 4 LYS N N 4 121.655 121.655 119.589 2.066 18496 5859 1 16 . 1 1 4 4 LYS HA H 4 4.379 4.379 4.486 -0.107 18496 5860 1 16 . 1 1 4 4 LYS C C 4 176.011 176.011 175.520 0.491 18496 5861 1 16 . 1 1 4 4 LYS CA C 4 56.213 56.213 55.162 1.051 18496 5862 1 16 . 1 1 4 4 LYS CB C 4 33.407 33.407 31.658 1.749 18496 5863 1 16 . 1 1 4 4 LYS H H 4 8.394 8.394 7.965 0.429 18496 5864 1 16 . 1 1 5 5 LEU N N 5 125.369 125.369 124.526 0.843 18496 5865 1 16 . 1 1 5 5 LEU HA H 5 4.351 4.351 4.263 0.088 18496 5866 1 16 . 1 1 5 5 LEU C C 5 175.682 175.682 176.911 -1.229 18496 5867 1 16 . 1 1 5 5 LEU CA C 5 55.117 55.117 55.043 0.074 18496 5868 1 16 . 1 1 5 5 LEU CB C 5 43.197 43.197 42.719 0.478 18496 5869 1 16 . 1 1 5 5 LEU H H 5 8.136 8.136 8.123 0.013 18496 5870 1 16 . 1 1 6 6 LYS N N 6 126.844 126.844 126.237 0.607 18496 5871 1 16 . 1 1 6 6 LYS HA H 6 4.451 4.451 4.370 0.081 18496 5872 1 16 . 1 1 6 6 LYS C C 6 174.665 174.665 175.668 -1.003 18496 5873 1 16 . 1 1 6 6 LYS CA C 6 55.974 55.974 56.511 -0.537 18496 5874 1 16 . 1 1 6 6 LYS CB C 6 34.386 34.386 32.902 1.484 18496 5875 1 16 . 1 1 6 6 LYS H H 6 8.615 8.615 8.598 0.017 18496 5876 1 16 . 1 1 7 7 PHE N N 7 119.818 119.818 118.936 0.882 18496 5877 1 16 . 1 1 7 7 PHE HA H 7 5.343 5.343 5.542 -0.199 18496 5878 1 16 . 1 1 7 7 PHE C C 7 173.569 173.569 173.701 -0.132 18496 5879 1 16 . 1 1 7 7 PHE CA C 7 55.813 55.813 55.744 0.069 18496 5880 1 16 . 1 1 7 7 PHE CB C 7 42.975 42.975 42.562 0.413 18496 5881 1 16 . 1 1 7 7 PHE H H 7 7.734 7.734 8.144 -0.410 18496 5882 1 16 . 1 1 8 8 GLU N N 8 119.165 119.165 119.392 -0.227 18496 5883 1 16 . 1 1 8 8 GLU HA H 8 4.158 4.158 4.232 -0.074 18496 5884 1 16 . 1 1 8 8 GLU C C 8 175.026 175.026 174.281 0.745 18496 5885 1 16 . 1 1 8 8 GLU CA C 8 55.221 55.221 54.536 0.685 18496 5886 1 16 . 1 1 8 8 GLU CB C 8 33.699 33.699 32.923 0.776 18496 5887 1 16 . 1 1 8 8 GLU H H 8 8.295 8.295 8.788 -0.493 18496 5888 1 16 . 1 1 9 9 ILE N N 9 127.619 127.619 127.772 -0.153 18496 5889 1 16 . 1 1 9 9 ILE HA H 9 3.768 3.768 4.282 -0.514 18496 5890 1 16 . 1 1 9 9 ILE C C 9 174.902 174.902 175.895 -0.993 18496 5891 1 16 . 1 1 9 9 ILE CA C 9 62.505 62.505 62.498 0.007 18496 5892 1 16 . 1 1 9 9 ILE CB C 9 36.094 36.094 37.593 -1.499 18496 5893 1 16 . 1 1 9 9 ILE H H 9 9.157 9.157 8.703 0.454 18496 5894 1 16 . 1 1 10 10 ILE N N 10 131.245 131.245 128.547 2.698 18496 5895 1 16 . 1 1 10 10 ILE HA H 10 3.861 3.861 4.095 -0.234 18496 5896 1 16 . 1 1 10 10 ILE C C 10 176.247 176.247 176.250 -0.003 18496 5897 1 16 . 1 1 10 10 ILE CA C 10 60.554 60.554 62.090 -1.536 18496 5898 1 16 . 1 1 10 10 ILE CB C 10 37.406 37.406 38.321 -0.915 18496 5899 1 16 . 1 1 10 10 ILE H H 10 8.428 8.428 8.960 -0.532 18496 5900 1 16 . 1 1 11 11 GLU N N 11 117.669 117.669 118.432 -0.763 18496 5901 1 16 . 1 1 11 11 GLU HA H 11 4.315 4.315 4.474 -0.159 18496 5902 1 16 . 1 1 11 11 GLU C C 11 174.155 174.155 174.403 -0.248 18496 5903 1 16 . 1 1 11 11 GLU CA C 11 55.755 55.755 55.611 0.144 18496 5904 1 16 . 1 1 11 11 GLU CB C 11 34.386 34.386 32.903 1.483 18496 5905 1 16 . 1 1 11 11 GLU H H 11 7.551 7.551 7.848 -0.297 18496 5906 1 16 . 1 1 12 12 GLU N N 12 128.587 128.587 124.236 4.351 18496 5907 1 16 . 1 1 12 12 GLU HA H 12 5.214 5.214 4.562 0.652 18496 5908 1 16 . 1 1 12 12 GLU C C 12 176.877 176.877 176.126 0.751 18496 5909 1 16 . 1 1 12 12 GLU CA C 12 54.801 54.801 56.870 -2.069 18496 5910 1 16 . 1 1 12 12 GLU CB C 12 30.137 30.137 30.473 -0.336 18496 5911 1 16 . 1 1 12 12 GLU H H 12 8.762 8.762 8.771 -0.009 18496 5912 1 16 . 1 1 13 13 LEU N N 13 122.508 122.508 123.910 -1.402 18496 5913 1 16 . 1 1 13 13 LEU HA H 13 4.872 4.872 4.547 0.325 18496 5914 1 16 . 1 1 13 13 LEU C C 13 176.060 176.060 177.137 -1.077 18496 5915 1 16 . 1 1 13 13 LEU CA C 13 57.372 57.372 55.682 1.690 18496 5916 1 16 . 1 1 13 13 LEU CB C 13 42.284 42.284 43.518 -1.234 18496 5917 1 16 . 1 1 13 13 LEU H H 13 8.058 8.058 8.622 -0.564 18496 5918 1 16 . 1 1 14 14 ILE N N 14 115.422 115.422 117.970 -2.548 18496 5919 1 16 . 1 1 14 14 ILE HA H 14 4.553 4.553 4.433 0.120 18496 5920 1 16 . 1 1 14 14 ILE C C 14 174.893 174.893 174.060 0.833 18496 5921 1 16 . 1 1 14 14 ILE CA C 14 60.586 60.586 59.696 0.890 18496 5922 1 16 . 1 1 14 14 ILE CB C 14 44.329 44.329 41.261 3.068 18496 5923 1 16 . 1 1 14 14 ILE H H 14 8.450 8.450 8.428 0.022 18496 5924 1 16 . 1 1 15 15 VAL N N 15 129.108 129.108 126.446 2.662 18496 5925 1 16 . 1 1 15 15 VAL HA H 15 4.196 4.196 4.357 -0.161 18496 5926 1 16 . 1 1 15 15 VAL C C 15 175.180 175.180 175.117 0.063 18496 5927 1 16 . 1 1 15 15 VAL CA C 15 63.288 63.288 61.062 2.225 18496 5928 1 16 . 1 1 15 15 VAL CB C 15 32.117 32.117 32.788 -0.671 18496 5929 1 16 . 1 1 15 15 VAL H H 15 8.867 8.867 8.509 0.358 18496 5930 1 16 . 1 1 16 16 LEU N N 16 127.846 127.846 129.657 -1.811 18496 5931 1 16 . 1 1 16 16 LEU HA H 16 4.317 4.317 4.606 -0.289 18496 5932 1 16 . 1 1 16 16 LEU C C 16 176.070 176.070 177.249 -1.179 18496 5933 1 16 . 1 1 16 16 LEU CA C 16 57.252 57.252 56.337 0.915 18496 5934 1 16 . 1 1 16 16 LEU CB C 16 42.035 42.035 42.693 -0.658 18496 5935 1 16 . 1 1 16 16 LEU H H 16 9.555 9.555 8.943 0.612 18496 5936 1 16 . 1 1 17 17 SER N N 17 107.073 107.073 110.338 -3.265 18496 5937 1 16 . 1 1 17 17 SER HA H 17 4.540 4.540 4.584 -0.044 18496 5938 1 16 . 1 1 17 17 SER C C 17 172.277 172.277 172.231 0.046 18496 5939 1 16 . 1 1 17 17 SER CA C 17 57.882 57.882 58.132 -0.250 18496 5940 1 16 . 1 1 17 17 SER CB C 17 64.046 64.046 65.038 -0.992 18496 5941 1 16 . 1 1 17 17 SER H H 17 7.699 7.699 7.711 -0.012 18496 5942 1 16 . 1 1 18 18 GLU N N 18 119.235 119.235 120.173 -0.938 18496 5943 1 16 . 1 1 18 18 GLU HA H 18 5.143 5.143 5.254 -0.111 18496 5944 1 16 . 1 1 18 18 GLU C C 18 175.469 175.469 176.212 -0.743 18496 5945 1 16 . 1 1 18 18 GLU CA C 18 55.248 55.248 54.778 0.470 18496 5946 1 16 . 1 1 18 18 GLU CB C 18 33.454 33.454 31.198 2.256 18496 5947 1 16 . 1 1 18 18 GLU H H 18 8.437 8.437 8.498 -0.061 18496 5948 1 16 . 1 1 19 19 ASN N N 19 123.988 123.988 121.031 2.957 18496 5949 1 16 . 1 1 19 19 ASN HA H 19 5.097 5.097 4.783 0.314 18496 5950 1 16 . 1 1 19 19 ASN CA C 19 50.916 50.916 52.825 -1.909 18496 5951 1 16 . 1 1 19 19 ASN CB C 19 39.482 39.482 39.850 -0.368 18496 5952 1 16 . 1 1 19 19 ASN H H 19 8.779 8.779 8.337 0.442 18496 5953 1 16 . 1 1 20 20 ALA N N 20 120.854 120.854 122.528 -1.674 18496 5954 1 16 . 1 1 20 20 ALA HA H 20 4.239 4.239 4.186 0.053 18496 5955 1 16 . 1 1 20 20 ALA C C 20 179.032 179.032 178.198 0.834 18496 5956 1 16 . 1 1 20 20 ALA CA C 20 54.924 54.924 54.203 0.721 18496 5957 1 16 . 1 1 20 20 ALA CB C 20 18.621 18.621 18.672 -0.051 18496 5958 1 16 . 1 1 20 20 ALA H H 20 8.616 8.616 8.651 -0.035 18496 5959 1 16 . 1 1 21 21 LYS N N 21 115.771 115.771 116.734 -0.963 18496 5960 1 16 . 1 1 21 21 LYS HA H 21 4.497 4.497 4.225 0.272 18496 5961 1 16 . 1 1 21 21 LYS C C 21 176.615 176.615 176.783 -0.168 18496 5962 1 16 . 1 1 21 21 LYS CA C 21 55.503 55.503 55.534 -0.031 18496 5963 1 16 . 1 1 21 21 LYS CB C 21 32.742 32.742 32.126 0.616 18496 5964 1 16 . 1 1 21 21 LYS H H 21 7.767 7.767 7.692 0.075 18496 5965 1 16 . 1 1 22 22 GLY N N 22 107.695 107.695 106.846 0.849 18496 5966 1 16 . 1 1 22 22 GLY C C 22 174.843 174.843 173.939 0.904 18496 5967 1 16 . 1 1 22 22 GLY CA C 22 45.297 45.297 45.275 0.022 18496 5968 1 16 . 1 1 22 22 GLY H H 22 8.317 8.317 7.891 0.426 18496 5969 1 16 . 1 1 23 23 TRP N N 23 121.316 121.316 121.001 0.315 18496 5970 1 16 . 1 1 23 23 TRP HA H 23 4.815 4.815 4.956 -0.141 18496 5971 1 16 . 1 1 23 23 TRP C C 23 176.754 176.754 176.502 0.252 18496 5972 1 16 . 1 1 23 23 TRP CA C 23 58.291 58.291 55.068 3.224 18496 5973 1 16 . 1 1 23 23 TRP CB C 23 28.127 28.127 28.159 -0.032 18496 5974 1 16 . 1 1 23 23 TRP H H 23 7.983 7.983 7.993 -0.010 18496 5975 1 16 . 1 1 24 24 ARG N N 24 120.789 120.789 127.012 -6.223 18496 5976 1 16 . 1 1 24 24 ARG HA H 24 5.496 5.496 4.757 0.739 18496 5977 1 16 . 1 1 24 24 ARG C C 24 175.831 175.831 176.003 -0.172 18496 5978 1 16 . 1 1 24 24 ARG CA C 24 54.755 54.755 54.861 -0.106 18496 5979 1 16 . 1 1 24 24 ARG CB C 24 33.735 33.735 30.175 3.560 18496 5980 1 16 . 1 1 24 24 ARG H H 24 9.046 9.046 9.333 -0.287 18496 5981 1 16 . 1 1 25 25 LYS N N 25 126.507 126.507 129.352 -2.845 18496 5982 1 16 . 1 1 25 25 LYS HA H 25 5.081 5.081 4.782 0.299 18496 5983 1 16 . 1 1 25 25 LYS C C 25 175.648 175.648 175.521 0.127 18496 5984 1 16 . 1 1 25 25 LYS CA C 25 56.071 56.071 56.595 -0.524 18496 5985 1 16 . 1 1 25 25 LYS CB C 25 32.214 32.214 32.504 -0.290 18496 5986 1 16 . 1 1 25 25 LYS H H 25 8.526 8.526 9.177 -0.651 18496 5987 1 16 . 1 1 26 26 GLU N N 26 126.009 126.009 124.168 1.841 18496 5988 1 16 . 1 1 26 26 GLU HA H 26 5.275 5.275 5.096 0.179 18496 5989 1 16 . 1 1 26 26 GLU C C 26 174.894 174.894 173.977 0.917 18496 5990 1 16 . 1 1 26 26 GLU CA C 26 55.271 55.271 54.991 0.280 18496 5991 1 16 . 1 1 26 26 GLU CB C 26 33.781 33.781 34.629 -0.848 18496 5992 1 16 . 1 1 26 26 GLU H H 26 9.125 9.125 8.746 0.379 18496 5993 1 16 . 1 1 27 27 LEU N N 27 121.930 121.930 124.559 -2.629 18496 5994 1 16 . 1 1 27 27 LEU HA H 27 5.788 5.788 5.019 0.769 18496 5995 1 16 . 1 1 27 27 LEU C C 27 173.941 173.941 174.260 -0.319 18496 5996 1 16 . 1 1 27 27 LEU CA C 27 53.859 53.859 53.873 -0.014 18496 5997 1 16 . 1 1 27 27 LEU CB C 27 44.020 44.020 44.332 -0.312 18496 5998 1 16 . 1 1 27 27 LEU H H 27 8.938 8.938 9.112 -0.174 18496 5999 1 16 . 1 1 28 28 ASN N N 28 124.630 124.630 124.650 -0.020 18496 6000 1 16 . 1 1 28 28 ASN HA H 28 5.411 5.411 5.201 0.210 18496 6001 1 16 . 1 1 28 28 ASN C C 28 174.366 174.366 173.136 1.230 18496 6002 1 16 . 1 1 28 28 ASN CA C 28 52.063 52.063 52.186 -0.123 18496 6003 1 16 . 1 1 28 28 ASN CB C 28 44.430 44.430 43.285 1.145 18496 6004 1 16 . 1 1 28 28 ASN H H 28 9.345 9.345 8.569 0.776 18496 6005 1 16 . 1 1 29 29 ARG N N 29 118.443 118.443 121.885 -3.442 18496 6006 1 16 . 1 1 29 29 ARG HA H 29 5.058 5.058 4.974 0.084 18496 6007 1 16 . 1 1 29 29 ARG C C 29 175.779 175.779 174.563 1.216 18496 6008 1 16 . 1 1 29 29 ARG CA C 29 56.091 56.091 55.588 0.503 18496 6009 1 16 . 1 1 29 29 ARG CB C 29 31.710 31.710 31.160 0.550 18496 6010 1 16 . 1 1 29 29 ARG H H 29 9.109 9.109 9.036 0.073 18496 6011 1 16 . 1 1 30 30 VAL N N 30 124.605 124.605 122.290 2.315 18496 6012 1 16 . 1 1 30 30 VAL HA H 30 4.535 4.535 5.384 -0.849 18496 6013 1 16 . 1 1 30 30 VAL C C 30 174.775 174.775 174.412 0.363 18496 6014 1 16 . 1 1 30 30 VAL CA C 30 60.921 60.921 59.273 1.648 18496 6015 1 16 . 1 1 30 30 VAL CB C 30 37.790 37.790 36.265 1.525 18496 6016 1 16 . 1 1 30 30 VAL H H 30 9.054 9.054 8.916 0.138 18496 6017 1 16 . 1 1 31 31 SER N N 31 120.794 120.794 115.598 5.196 18496 6018 1 16 . 1 1 31 31 SER HA H 31 4.652 4.652 5.129 -0.477 18496 6019 1 16 . 1 1 31 31 SER C C 31 174.214 174.214 175.374 -1.160 18496 6020 1 16 . 1 1 31 31 SER CA C 31 56.279 56.279 57.164 -0.885 18496 6021 1 16 . 1 1 31 31 SER CB C 31 64.128 64.128 64.020 0.107 18496 6022 1 16 . 1 1 31 31 SER H H 31 8.667 8.667 8.881 -0.214 18496 6023 1 16 . 1 1 32 32 TRP N N 32 132.303 132.303 127.886 4.417 18496 6024 1 16 . 1 1 32 32 TRP HA H 32 5.105 5.105 4.531 0.574 18496 6025 1 16 . 1 1 32 32 TRP C C 32 177.276 177.276 177.129 0.147 18496 6026 1 16 . 1 1 32 32 TRP CA C 32 56.198 56.198 57.972 -1.774 18496 6027 1 16 . 1 1 32 32 TRP CB C 32 29.968 29.968 27.983 1.985 18496 6028 1 16 . 1 1 32 32 TRP H H 32 9.282 9.282 9.148 0.134 18496 6029 1 16 . 1 1 33 33 ASN N N 33 124.979 124.979 123.783 1.196 18496 6030 1 16 . 1 1 33 33 ASN HA H 33 4.257 4.257 4.374 -0.117 18496 6031 1 16 . 1 1 33 33 ASN C C 33 174.030 174.030 174.733 -0.703 18496 6032 1 16 . 1 1 33 33 ASN CA C 33 54.709 54.709 54.756 -0.047 18496 6033 1 16 . 1 1 33 33 ASN CB C 33 37.921 37.921 36.978 0.943 18496 6034 1 16 . 1 1 33 33 ASN H H 33 9.813 9.813 8.839 0.974 18496 6035 1 16 . 1 1 34 34 ASP N N 34 111.880 111.880 113.384 -1.504 18496 6036 1 16 . 1 1 34 34 ASP HA H 34 4.126 4.126 4.236 -0.110 18496 6037 1 16 . 1 1 34 34 ASP CA C 34 56.130 56.130 55.487 0.643 18496 6038 1 16 . 1 1 34 34 ASP CB C 34 39.760 39.760 40.274 -0.514 18496 6039 1 16 . 1 1 34 34 ASP H H 34 9.251 9.251 8.253 0.998 18496 6040 1 16 . 1 1 35 35 ALA N N 35 121.811 121.811 121.522 0.289 18496 6041 1 16 . 1 1 35 35 ALA HA H 35 4.477 4.477 4.439 0.038 18496 6042 1 16 . 1 1 35 35 ALA C C 35 177.778 177.778 177.031 0.747 18496 6043 1 16 . 1 1 35 35 ALA CA C 35 51.528 51.528 52.599 -1.071 18496 6044 1 16 . 1 1 35 35 ALA CB C 35 20.445 20.445 20.195 0.250 18496 6045 1 16 . 1 1 35 35 ALA H H 35 7.625 7.625 7.689 -0.064 18496 6046 1 16 . 1 1 36 36 GLU N N 36 121.068 121.068 121.378 -0.310 18496 6047 1 16 . 1 1 36 36 GLU HA H 36 4.390 4.390 4.660 -0.270 18496 6048 1 16 . 1 1 36 36 GLU CA C 36 55.276 55.276 52.247 3.029 18496 6049 1 16 . 1 1 36 36 GLU CB C 36 28.575 28.575 30.777 -2.202 18496 6050 1 16 . 1 1 36 36 GLU H H 36 8.658 8.658 8.477 0.181 18496 6051 1 16 . 1 1 37 37 PRO HA H 37 4.289 4.289 4.615 -0.326 18496 6052 1 16 . 1 1 37 37 PRO C C 37 175.799 175.799 175.884 -0.085 18496 6053 1 16 . 1 1 37 37 PRO CA C 37 63.105 63.105 62.263 0.842 18496 6054 1 16 . 1 1 37 37 PRO CB C 37 32.076 32.076 31.889 0.188 18496 6055 1 16 . 1 1 38 38 LYS N N 38 120.881 120.881 123.186 -2.305 18496 6056 1 16 . 1 1 38 38 LYS HA H 38 4.700 4.700 4.283 0.417 18496 6057 1 16 . 1 1 38 38 LYS C C 38 176.906 176.906 174.646 2.260 18496 6058 1 16 . 1 1 38 38 LYS CA C 38 54.399 54.399 54.263 0.136 18496 6059 1 16 . 1 1 38 38 LYS CB C 38 37.217 37.217 36.582 0.635 18496 6060 1 16 . 1 1 38 38 LYS H H 38 8.316 8.316 8.798 -0.482 18496 6061 1 16 . 1 1 39 39 TYR N N 39 119.792 119.792 118.563 1.229 18496 6062 1 16 . 1 1 39 39 TYR HA H 39 4.636 4.636 4.913 -0.277 18496 6063 1 16 . 1 1 39 39 TYR C C 39 175.834 175.834 174.927 0.907 18496 6064 1 16 . 1 1 39 39 TYR CA C 39 60.228 60.228 56.928 3.300 18496 6065 1 16 . 1 1 39 39 TYR CB C 39 38.683 38.683 39.066 -0.383 18496 6066 1 16 . 1 1 39 39 TYR H H 39 8.508 8.508 7.617 0.891 18496 6067 1 16 . 1 1 40 40 ASP N N 40 126.502 126.502 122.764 3.738 18496 6068 1 16 . 1 1 40 40 ASP HA H 40 5.597 5.597 5.348 0.249 18496 6069 1 16 . 1 1 40 40 ASP C C 40 175.283 175.283 174.109 1.174 18496 6070 1 16 . 1 1 40 40 ASP CA C 40 55.053 55.053 53.473 1.580 18496 6071 1 16 . 1 1 40 40 ASP CB C 40 48.656 48.656 45.544 3.112 18496 6072 1 16 . 1 1 40 40 ASP H H 40 9.219 9.219 9.083 0.136 18496 6073 1 16 . 1 1 41 41 ILE N N 41 125.910 125.910 124.922 0.988 18496 6074 1 16 . 1 1 41 41 ILE HA H 41 5.722 5.722 5.042 0.680 18496 6075 1 16 . 1 1 41 41 ILE C C 41 174.167 174.167 173.583 0.584 18496 6076 1 16 . 1 1 41 41 ILE CA C 41 60.734 60.734 59.743 0.991 18496 6077 1 16 . 1 1 41 41 ILE CB C 41 40.198 40.198 40.006 0.192 18496 6078 1 16 . 1 1 41 41 ILE H H 41 8.972 8.972 8.662 0.310 18496 6079 1 16 . 1 1 42 42 ARG N N 42 120.300 120.300 127.393 -7.093 18496 6080 1 16 . 1 1 42 42 ARG HA H 42 4.716 4.716 4.843 -0.127 18496 6081 1 16 . 1 1 42 42 ARG CA C 42 54.826 54.826 54.903 -0.077 18496 6082 1 16 . 1 1 42 42 ARG CB C 42 32.665 32.665 35.644 -2.978 18496 6083 1 16 . 1 1 42 42 ARG H H 42 8.320 8.320 8.825 -0.505 18496 6084 1 16 . 1 1 43 43 THR HA H 43 5.585 5.585 5.520 0.065 18496 6085 1 16 . 1 1 43 43 THR C C 43 173.294 173.294 173.838 -0.544 18496 6086 1 16 . 1 1 43 43 THR CA C 43 60.847 60.847 61.283 -0.437 18496 6087 1 16 . 1 1 43 43 THR CB C 43 69.961 69.961 70.002 -0.041 18496 6088 1 16 . 1 1 44 44 TRP N N 44 122.747 122.747 124.719 -1.972 18496 6089 1 16 . 1 1 44 44 TRP HA H 44 4.945 4.945 4.780 0.165 18496 6090 1 16 . 1 1 44 44 TRP C C 44 175.056 175.056 176.003 -0.947 18496 6091 1 16 . 1 1 44 44 TRP CA C 44 56.107 56.107 55.676 0.431 18496 6092 1 16 . 1 1 44 44 TRP CB C 44 34.506 34.506 32.034 2.472 18496 6093 1 16 . 1 1 44 44 TRP H H 44 9.180 9.180 9.092 0.088 18496 6094 1 16 . 1 1 45 45 SER N N 45 117.385 117.385 116.625 0.760 18496 6095 1 16 . 1 1 45 45 SER HA H 45 2.300 2.300 4.872 -2.572 18496 6096 1 16 . 1 1 45 45 SER CA C 45 56.481 56.481 56.802 -0.321 18496 6097 1 16 . 1 1 45 45 SER CB C 45 60.743 60.743 61.953 -1.210 18496 6098 1 16 . 1 1 45 45 SER H H 45 7.879 7.879 8.369 -0.490 18496 6099 1 16 . 1 1 46 46 PRO HA H 46 4.104 4.104 4.352 -0.248 18496 6100 1 16 . 1 1 46 46 PRO CA C 46 64.990 64.990 65.619 -0.629 18496 6101 1 16 . 1 1 46 46 PRO CB C 46 31.272 31.272 31.861 -0.589 18496 6102 1 16 . 1 1 47 47 ASP HA H 47 4.520 4.520 4.556 -0.036 18496 6103 1 16 . 1 1 47 47 ASP C C 47 175.629 175.629 175.331 0.298 18496 6104 1 16 . 1 1 47 47 ASP CA C 47 53.453 53.453 52.888 0.565 18496 6105 1 16 . 1 1 47 47 ASP CB C 47 40.239 40.239 40.877 -0.638 18496 6106 1 16 . 1 1 48 48 HIS N N 48 111.320 111.320 115.289 -3.969 18496 6107 1 16 . 1 1 48 48 HIS HA H 48 3.916 3.916 4.477 -0.561 18496 6108 1 16 . 1 1 48 48 HIS CA C 48 60.347 60.347 56.874 3.473 18496 6109 1 16 . 1 1 48 48 HIS CB C 48 25.499 25.499 28.555 -3.056 18496 6110 1 16 . 1 1 48 48 HIS H H 48 8.269 8.269 8.068 0.201 18496 6111 1 16 . 1 1 49 49 GLU N N 49 114.659 114.659 115.172 -0.513 18496 6112 1 16 . 1 1 49 49 GLU HA H 49 4.447 4.447 4.207 0.240 18496 6113 1 16 . 1 1 49 49 GLU C C 49 176.394 176.394 176.872 -0.478 18496 6114 1 16 . 1 1 49 49 GLU CA C 49 57.940 57.940 58.016 -0.076 18496 6115 1 16 . 1 1 49 49 GLU CB C 49 30.641 30.641 30.212 0.429 18496 6116 1 16 . 1 1 49 49 GLU H H 49 7.381 7.381 8.696 -1.315 18496 6117 1 16 . 1 1 50 50 LYS N N 50 118.126 118.126 116.559 1.567 18496 6118 1 16 . 1 1 50 50 LYS HA H 50 4.665 4.665 4.414 0.251 18496 6119 1 16 . 1 1 50 50 LYS CA C 50 54.431 54.431 54.653 -0.222 18496 6120 1 16 . 1 1 50 50 LYS CB C 50 36.543 36.543 36.615 -0.072 18496 6121 1 16 . 1 1 50 50 LYS H H 50 8.067 8.067 7.667 0.400 18496 6122 1 16 . 1 1 51 51 MET HA H 51 4.936 4.936 4.178 0.758 18496 6123 1 16 . 1 1 51 51 MET CA C 51 54.048 54.048 52.707 1.341 18496 6124 1 16 . 1 1 51 51 MET CB C 51 33.768 33.768 34.760 -0.992 18496 6125 1 16 . 1 1 52 52 GLY C C 52 173.534 173.534 172.125 1.409 18496 6126 1 16 . 1 1 52 52 GLY CA C 52 43.060 43.060 44.399 -1.339 18496 6127 1 16 . 1 1 53 53 LYS N N 53 118.012 118.012 119.977 -1.965 18496 6128 1 16 . 1 1 53 53 LYS HA H 53 4.155 4.155 4.511 -0.356 18496 6129 1 16 . 1 1 53 53 LYS C C 53 176.818 176.818 175.933 0.885 18496 6130 1 16 . 1 1 53 53 LYS CA C 53 56.478 56.478 56.135 0.343 18496 6131 1 16 . 1 1 53 53 LYS CB C 53 33.117 33.117 33.478 -0.361 18496 6132 1 16 . 1 1 53 53 LYS H H 53 8.132 8.132 8.277 -0.145 18496 6133 1 16 . 1 1 54 54 GLY N N 54 109.836 109.836 109.520 0.316 18496 6134 1 16 . 1 1 54 54 GLY C C 54 170.848 170.848 172.988 -2.140 18496 6135 1 16 . 1 1 54 54 GLY CA C 54 46.701 46.701 44.650 2.051 18496 6136 1 16 . 1 1 54 54 GLY H H 54 8.079 8.079 8.255 -0.176 18496 6137 1 16 . 1 1 55 55 ILE N N 55 119.382 119.382 119.992 -0.610 18496 6138 1 16 . 1 1 55 55 ILE HA H 55 4.956 4.956 4.600 0.356 18496 6139 1 16 . 1 1 55 55 ILE C C 55 171.737 171.737 173.448 -1.711 18496 6140 1 16 . 1 1 55 55 ILE CA C 55 57.059 57.059 60.664 -3.606 18496 6141 1 16 . 1 1 55 55 ILE CB C 55 44.241 44.241 41.802 2.439 18496 6142 1 16 . 1 1 55 55 ILE H H 55 8.661 8.661 8.407 0.254 18496 6143 1 16 . 1 1 56 56 THR N N 56 113.795 113.795 122.462 -8.667 18496 6144 1 16 . 1 1 56 56 THR HA H 56 5.607 5.607 4.972 0.635 18496 6145 1 16 . 1 1 56 56 THR C C 56 174.417 174.417 173.812 0.605 18496 6146 1 16 . 1 1 56 56 THR CA C 56 59.098 59.098 61.867 -2.769 18496 6147 1 16 . 1 1 56 56 THR CB C 56 72.153 72.153 69.873 2.280 18496 6148 1 16 . 1 1 56 56 THR H H 56 7.916 7.916 8.330 -0.414 18496 6149 1 16 . 1 1 57 57 LEU N N 57 121.044 121.044 127.305 -6.261 18496 6150 1 16 . 1 1 57 57 LEU HA H 57 5.311 5.311 4.794 0.517 18496 6151 1 16 . 1 1 57 57 LEU C C 57 176.150 176.150 175.541 0.609 18496 6152 1 16 . 1 1 57 57 LEU CA C 57 53.264 53.264 53.855 -0.591 18496 6153 1 16 . 1 1 57 57 LEU CB C 57 45.901 45.901 43.512 2.389 18496 6154 1 16 . 1 1 57 57 LEU H H 57 9.421 9.421 9.187 0.234 18496 6155 1 16 . 1 1 58 58 SER N N 58 119.548 119.548 118.670 0.878 18496 6156 1 16 . 1 1 58 58 SER HA H 58 4.734 4.734 4.491 0.243 18496 6157 1 16 . 1 1 58 58 SER C C 58 174.786 174.786 175.722 -0.936 18496 6158 1 16 . 1 1 58 58 SER CA C 58 56.948 56.948 57.347 -0.399 18496 6159 1 16 . 1 1 58 58 SER CB C 58 65.726 65.726 64.875 0.851 18496 6160 1 16 . 1 1 58 58 SER H H 58 9.771 9.771 9.434 0.337 18496 6161 1 16 . 1 1 59 59 GLU N N 59 120.827 120.827 122.232 -1.405 18496 6162 1 16 . 1 1 59 59 GLU HA H 59 4.319 4.319 4.244 0.075 18496 6163 1 16 . 1 1 59 59 GLU C C 59 179.806 179.806 178.780 1.026 18496 6164 1 16 . 1 1 59 59 GLU CA C 59 60.913 60.913 60.644 0.269 18496 6165 1 16 . 1 1 59 59 GLU CB C 59 29.538 29.538 29.462 0.076 18496 6166 1 16 . 1 1 59 59 GLU H H 59 9.394 9.394 9.029 0.365 18496 6167 1 16 . 1 1 60 60 GLU N N 60 119.587 119.587 119.627 -0.040 18496 6168 1 16 . 1 1 60 60 GLU HA H 60 4.188 4.188 4.081 0.107 18496 6169 1 16 . 1 1 60 60 GLU C C 60 179.686 179.686 178.850 0.836 18496 6170 1 16 . 1 1 60 60 GLU CA C 60 60.279 60.279 59.495 0.784 18496 6171 1 16 . 1 1 60 60 GLU CB C 60 29.559 29.559 28.776 0.783 18496 6172 1 16 . 1 1 60 60 GLU H H 60 8.905 8.905 8.876 0.029 18496 6173 1 16 . 1 1 61 61 GLU N N 61 120.145 120.145 119.983 0.162 18496 6174 1 16 . 1 1 61 61 GLU HA H 61 4.037 4.037 4.119 -0.082 18496 6175 1 16 . 1 1 61 61 GLU C C 61 178.530 178.530 178.782 -0.252 18496 6176 1 16 . 1 1 61 61 GLU CA C 61 59.118 59.118 58.818 0.300 18496 6177 1 16 . 1 1 61 61 GLU CB C 61 30.976 30.976 29.429 1.547 18496 6178 1 16 . 1 1 61 61 GLU H H 61 8.013 8.013 8.197 -0.184 18496 6179 1 16 . 1 1 62 62 PHE N N 62 119.925 119.925 120.363 -0.438 18496 6180 1 16 . 1 1 62 62 PHE HA H 62 3.927 3.927 3.988 -0.061 18496 6181 1 16 . 1 1 62 62 PHE C C 62 176.783 176.783 177.881 -1.098 18496 6182 1 16 . 1 1 62 62 PHE CA C 62 61.827 61.827 61.495 0.332 18496 6183 1 16 . 1 1 62 62 PHE CB C 62 40.216 40.216 38.711 1.505 18496 6184 1 16 . 1 1 62 62 PHE H H 62 9.192 9.192 8.847 0.345 18496 6185 1 16 . 1 1 63 63 GLY N N 63 104.854 104.854 106.652 -1.798 18496 6186 1 16 . 1 1 63 63 GLY C C 63 176.854 176.854 175.959 0.895 18496 6187 1 16 . 1 1 63 63 GLY CA C 63 47.178 47.178 47.294 -0.116 18496 6188 1 16 . 1 1 63 63 GLY H H 63 8.316 8.316 8.369 -0.053 18496 6189 1 16 . 1 1 64 64 VAL N N 64 123.719 123.719 123.077 0.642 18496 6190 1 16 . 1 1 64 64 VAL HA H 64 3.663 3.663 3.623 0.040 18496 6191 1 16 . 1 1 64 64 VAL C C 64 177.644 177.644 177.657 -0.013 18496 6192 1 16 . 1 1 64 64 VAL CA C 64 67.090 67.090 66.182 0.908 18496 6193 1 16 . 1 1 64 64 VAL CB C 64 31.367 31.367 31.848 -0.481 18496 6194 1 16 . 1 1 64 64 VAL H H 64 7.759 7.759 7.369 0.390 18496 6195 1 16 . 1 1 65 65 LEU N N 65 120.099 120.099 121.004 -0.905 18496 6196 1 16 . 1 1 65 65 LEU HA H 65 3.672 3.672 3.935 -0.263 18496 6197 1 16 . 1 1 65 65 LEU C C 65 177.636 177.636 178.298 -0.662 18496 6198 1 16 . 1 1 65 65 LEU CA C 65 58.552 58.552 58.525 0.027 18496 6199 1 16 . 1 1 65 65 LEU CB C 65 41.358 41.358 41.729 -0.371 18496 6200 1 16 . 1 1 65 65 LEU H H 65 7.660 7.660 8.453 -0.793 18496 6201 1 16 . 1 1 66 66 LEU N N 66 115.733 115.733 117.998 -2.265 18496 6202 1 16 . 1 1 66 66 LEU HA H 66 3.556 3.556 3.636 -0.080 18496 6203 1 16 . 1 1 66 66 LEU C C 66 179.729 179.729 178.772 0.957 18496 6204 1 16 . 1 1 66 66 LEU CA C 66 58.069 58.069 58.069 -0.000 18496 6205 1 16 . 1 1 66 66 LEU CB C 66 41.625 41.625 40.969 0.656 18496 6206 1 16 . 1 1 66 66 LEU H H 66 8.083 8.083 8.013 0.070 18496 6207 1 16 . 1 1 67 67 LYS N N 67 119.120 119.120 119.868 -0.748 18496 6208 1 16 . 1 1 67 67 LYS HA H 67 3.965 3.965 3.806 0.159 18496 6209 1 16 . 1 1 67 67 LYS C C 67 179.379 179.379 179.068 0.311 18496 6210 1 16 . 1 1 67 67 LYS CA C 67 59.227 59.227 59.754 -0.527 18496 6211 1 16 . 1 1 67 67 LYS CB C 67 32.737 32.737 32.196 0.541 18496 6212 1 16 . 1 1 67 67 LYS H H 67 7.861 7.861 7.644 0.217 18496 6213 1 16 . 1 1 68 68 GLU N N 68 116.924 116.924 118.766 -1.842 18496 6214 1 16 . 1 1 68 68 GLU HA H 68 4.409 4.409 4.124 0.285 18496 6215 1 16 . 1 1 68 68 GLU CA C 68 57.712 57.712 58.659 -0.947 18496 6216 1 16 . 1 1 68 68 GLU CB C 68 29.586 29.586 29.494 0.092 18496 6217 1 16 . 1 1 68 68 GLU H H 68 8.319 8.319 7.898 0.421 18496 6218 1 16 . 1 1 69 69 LEU N N 69 120.032 120.032 120.104 -0.072 18496 6219 1 16 . 1 1 69 69 LEU HA H 69 4.107 4.107 3.929 0.178 18496 6220 1 16 . 1 1 69 69 LEU CA C 69 57.563 57.563 57.646 -0.083 18496 6221 1 16 . 1 1 69 69 LEU CB C 69 41.373 41.373 41.544 -0.171 18496 6222 1 16 . 1 1 69 69 LEU H H 69 8.233 8.233 8.653 -0.420 18496 6223 1 16 . 1 1 70 70 GLY N N 70 105.472 105.472 105.233 0.239 18496 6224 1 16 . 1 1 70 70 GLY C C 70 174.986 174.986 174.785 0.201 18496 6225 1 16 . 1 1 70 70 GLY CA C 70 46.704 46.704 46.737 -0.033 18496 6226 1 16 . 1 1 70 70 GLY H H 70 7.960 7.960 8.453 -0.493 18496 6227 1 16 . 1 1 71 71 ASN N N 71 118.596 118.596 119.093 -0.497 18496 6228 1 16 . 1 1 71 71 ASN HA H 71 4.681 4.681 4.786 -0.105 18496 6229 1 16 . 1 1 71 71 ASN C C 71 176.412 176.412 177.996 -1.584 18496 6230 1 16 . 1 1 71 71 ASN CA C 71 54.407 54.407 55.212 -0.804 18496 6231 1 16 . 1 1 71 71 ASN CB C 71 38.729 38.729 38.954 -0.225 18496 6232 1 16 . 1 1 71 71 ASN H H 71 7.857 7.857 7.647 0.210 18496 6233 1 16 . 1 1 72 72 LYS N N 72 119.973 119.973 120.772 -0.799 18496 6234 1 16 . 1 1 72 72 LYS HA H 72 4.282 4.282 4.135 0.147 18496 6235 1 16 . 1 1 72 72 LYS CA C 72 57.338 57.338 57.926 -0.588 18496 6236 1 16 . 1 1 72 72 LYS CB C 72 32.755 32.755 31.823 0.932 18496 6237 1 16 . 1 1 72 72 LYS H H 72 8.100 8.100 8.215 -0.115 18496 6238 1 16 . 1 1 73 73 LEU HA H 73 4.281 4.281 4.303 -0.022 18496 6239 1 16 . 1 1 73 73 LEU CA C 73 55.774 55.774 54.878 0.896 18496 6240 1 16 . 1 1 73 73 LEU CB C 73 41.983 41.983 42.121 -0.138 18496 6241 1 17 . 1 1 2 2 ALA HA H 2 4.074 4.074 4.469 -0.395 18496 6242 1 17 . 1 1 2 2 ALA CA C 2 51.966 51.966 51.536 0.430 18496 6243 1 17 . 1 1 2 2 ALA CB C 2 19.732 19.732 19.656 0.076 18496 6244 1 17 . 1 1 3 3 ASP HA H 3 4.632 4.632 4.505 0.127 18496 6245 1 17 . 1 1 3 3 ASP C C 3 175.822 175.822 176.360 -0.538 18496 6246 1 17 . 1 1 3 3 ASP CA C 3 54.440 54.440 55.604 -1.164 18496 6247 1 17 . 1 1 3 3 ASP CB C 3 41.577 41.577 41.253 0.324 18496 6248 1 17 . 1 1 4 4 LYS N N 4 121.655 121.655 119.824 1.831 18496 6249 1 17 . 1 1 4 4 LYS HA H 4 4.379 4.379 4.578 -0.199 18496 6250 1 17 . 1 1 4 4 LYS C C 4 176.011 176.011 175.636 0.375 18496 6251 1 17 . 1 1 4 4 LYS CA C 4 56.213 56.213 54.903 1.310 18496 6252 1 17 . 1 1 4 4 LYS CB C 4 33.407 33.407 31.809 1.598 18496 6253 1 17 . 1 1 4 4 LYS H H 4 8.394 8.394 7.991 0.403 18496 6254 1 17 . 1 1 5 5 LEU N N 5 125.369 125.369 124.645 0.724 18496 6255 1 17 . 1 1 5 5 LEU HA H 5 4.351 4.351 4.308 0.043 18496 6256 1 17 . 1 1 5 5 LEU C C 5 175.682 175.682 176.776 -1.094 18496 6257 1 17 . 1 1 5 5 LEU CA C 5 55.117 55.117 54.931 0.186 18496 6258 1 17 . 1 1 5 5 LEU CB C 5 43.197 43.197 42.847 0.350 18496 6259 1 17 . 1 1 5 5 LEU H H 5 8.136 8.136 8.160 -0.024 18496 6260 1 17 . 1 1 6 6 LYS N N 6 126.844 126.844 126.242 0.602 18496 6261 1 17 . 1 1 6 6 LYS HA H 6 4.451 4.451 4.501 -0.050 18496 6262 1 17 . 1 1 6 6 LYS C C 6 174.665 174.665 175.366 -0.701 18496 6263 1 17 . 1 1 6 6 LYS CA C 6 55.974 55.974 56.329 -0.355 18496 6264 1 17 . 1 1 6 6 LYS CB C 6 34.386 34.386 33.123 1.262 18496 6265 1 17 . 1 1 6 6 LYS H H 6 8.615 8.615 8.600 0.015 18496 6266 1 17 . 1 1 7 7 PHE N N 7 119.818 119.818 119.407 0.411 18496 6267 1 17 . 1 1 7 7 PHE HA H 7 5.343 5.343 5.500 -0.157 18496 6268 1 17 . 1 1 7 7 PHE C C 7 173.569 173.569 173.713 -0.144 18496 6269 1 17 . 1 1 7 7 PHE CA C 7 55.813 55.813 55.639 0.174 18496 6270 1 17 . 1 1 7 7 PHE CB C 7 42.975 42.975 42.483 0.492 18496 6271 1 17 . 1 1 7 7 PHE H H 7 7.734 7.734 8.238 -0.504 18496 6272 1 17 . 1 1 8 8 GLU N N 8 119.165 119.165 119.267 -0.102 18496 6273 1 17 . 1 1 8 8 GLU HA H 8 4.158 4.158 4.257 -0.099 18496 6274 1 17 . 1 1 8 8 GLU C C 8 175.026 175.026 174.132 0.894 18496 6275 1 17 . 1 1 8 8 GLU CA C 8 55.221 55.221 54.682 0.539 18496 6276 1 17 . 1 1 8 8 GLU CB C 8 33.699 33.699 33.026 0.673 18496 6277 1 17 . 1 1 8 8 GLU H H 8 8.295 8.295 8.772 -0.477 18496 6278 1 17 . 1 1 9 9 ILE N N 9 127.619 127.619 127.506 0.113 18496 6279 1 17 . 1 1 9 9 ILE HA H 9 3.768 3.768 4.188 -0.420 18496 6280 1 17 . 1 1 9 9 ILE C C 9 174.902 174.902 175.789 -0.887 18496 6281 1 17 . 1 1 9 9 ILE CA C 9 62.505 62.505 62.369 0.136 18496 6282 1 17 . 1 1 9 9 ILE CB C 9 36.094 36.094 37.935 -1.841 18496 6283 1 17 . 1 1 9 9 ILE H H 9 9.157 9.157 8.670 0.487 18496 6284 1 17 . 1 1 10 10 ILE N N 10 131.245 131.245 128.590 2.655 18496 6285 1 17 . 1 1 10 10 ILE HA H 10 3.861 3.861 4.121 -0.260 18496 6286 1 17 . 1 1 10 10 ILE C C 10 176.247 176.247 176.309 -0.062 18496 6287 1 17 . 1 1 10 10 ILE CA C 10 60.554 60.554 62.091 -1.537 18496 6288 1 17 . 1 1 10 10 ILE CB C 10 37.406 37.406 38.470 -1.064 18496 6289 1 17 . 1 1 10 10 ILE H H 10 8.428 8.428 8.965 -0.537 18496 6290 1 17 . 1 1 11 11 GLU N N 11 117.669 117.669 118.402 -0.733 18496 6291 1 17 . 1 1 11 11 GLU HA H 11 4.315 4.315 4.485 -0.170 18496 6292 1 17 . 1 1 11 11 GLU C C 11 174.155 174.155 174.532 -0.377 18496 6293 1 17 . 1 1 11 11 GLU CA C 11 55.755 55.755 55.520 0.235 18496 6294 1 17 . 1 1 11 11 GLU CB C 11 34.386 34.386 32.946 1.440 18496 6295 1 17 . 1 1 11 11 GLU H H 11 7.551 7.551 7.843 -0.292 18496 6296 1 17 . 1 1 12 12 GLU N N 12 128.587 128.587 125.077 3.510 18496 6297 1 17 . 1 1 12 12 GLU HA H 12 5.214 5.214 4.462 0.752 18496 6298 1 17 . 1 1 12 12 GLU C C 12 176.877 176.877 175.931 0.946 18496 6299 1 17 . 1 1 12 12 GLU CA C 12 54.801 54.801 57.035 -2.234 18496 6300 1 17 . 1 1 12 12 GLU CB C 12 30.137 30.137 30.001 0.136 18496 6301 1 17 . 1 1 12 12 GLU H H 12 8.762 8.762 8.807 -0.045 18496 6302 1 17 . 1 1 13 13 LEU N N 13 122.508 122.508 123.155 -0.647 18496 6303 1 17 . 1 1 13 13 LEU HA H 13 4.872 4.872 4.471 0.401 18496 6304 1 17 . 1 1 13 13 LEU C C 13 176.060 176.060 177.054 -0.994 18496 6305 1 17 . 1 1 13 13 LEU CA C 13 57.372 57.372 55.592 1.780 18496 6306 1 17 . 1 1 13 13 LEU CB C 13 42.284 42.284 43.483 -1.198 18496 6307 1 17 . 1 1 13 13 LEU H H 13 8.058 8.058 8.662 -0.604 18496 6308 1 17 . 1 1 14 14 ILE N N 14 115.422 115.422 117.734 -2.312 18496 6309 1 17 . 1 1 14 14 ILE HA H 14 4.553 4.553 4.446 0.107 18496 6310 1 17 . 1 1 14 14 ILE C C 14 174.893 174.893 174.076 0.817 18496 6311 1 17 . 1 1 14 14 ILE CA C 14 60.586 60.586 59.623 0.962 18496 6312 1 17 . 1 1 14 14 ILE CB C 14 44.329 44.329 41.412 2.917 18496 6313 1 17 . 1 1 14 14 ILE H H 14 8.450 8.450 8.395 0.055 18496 6314 1 17 . 1 1 15 15 VAL N N 15 129.108 129.108 125.595 3.513 18496 6315 1 17 . 1 1 15 15 VAL HA H 15 4.196 4.196 4.424 -0.228 18496 6316 1 17 . 1 1 15 15 VAL C C 15 175.180 175.180 174.949 0.231 18496 6317 1 17 . 1 1 15 15 VAL CA C 15 63.288 63.288 60.950 2.338 18496 6318 1 17 . 1 1 15 15 VAL CB C 15 32.117 32.117 32.763 -0.646 18496 6319 1 17 . 1 1 15 15 VAL H H 15 8.867 8.867 8.521 0.346 18496 6320 1 17 . 1 1 16 16 LEU N N 16 127.846 127.846 129.012 -1.166 18496 6321 1 17 . 1 1 16 16 LEU HA H 16 4.317 4.317 4.641 -0.324 18496 6322 1 17 . 1 1 16 16 LEU C C 16 176.070 176.070 177.296 -1.226 18496 6323 1 17 . 1 1 16 16 LEU CA C 16 57.252 57.252 56.352 0.900 18496 6324 1 17 . 1 1 16 16 LEU CB C 16 42.035 42.035 42.640 -0.605 18496 6325 1 17 . 1 1 16 16 LEU H H 16 9.555 9.555 8.715 0.840 18496 6326 1 17 . 1 1 17 17 SER N N 17 107.073 107.073 110.260 -3.187 18496 6327 1 17 . 1 1 17 17 SER HA H 17 4.540 4.540 4.589 -0.049 18496 6328 1 17 . 1 1 17 17 SER C C 17 172.277 172.277 172.194 0.083 18496 6329 1 17 . 1 1 17 17 SER CA C 17 57.882 57.882 58.108 -0.226 18496 6330 1 17 . 1 1 17 17 SER CB C 17 64.046 64.046 65.131 -1.085 18496 6331 1 17 . 1 1 17 17 SER H H 17 7.699 7.699 7.826 -0.127 18496 6332 1 17 . 1 1 18 18 GLU N N 18 119.235 119.235 120.026 -0.791 18496 6333 1 17 . 1 1 18 18 GLU HA H 18 5.143 5.143 4.889 0.254 18496 6334 1 17 . 1 1 18 18 GLU C C 18 175.469 175.469 176.133 -0.664 18496 6335 1 17 . 1 1 18 18 GLU CA C 18 55.248 55.248 55.139 0.109 18496 6336 1 17 . 1 1 18 18 GLU CB C 18 33.454 33.454 31.068 2.386 18496 6337 1 17 . 1 1 18 18 GLU H H 18 8.437 8.437 8.513 -0.076 18496 6338 1 17 . 1 1 19 19 ASN N N 19 123.988 123.988 121.790 2.198 18496 6339 1 17 . 1 1 19 19 ASN HA H 19 5.097 5.097 4.713 0.384 18496 6340 1 17 . 1 1 19 19 ASN CA C 19 50.916 50.916 53.360 -2.444 18496 6341 1 17 . 1 1 19 19 ASN CB C 19 39.482 39.482 39.696 -0.214 18496 6342 1 17 . 1 1 19 19 ASN H H 19 8.779 8.779 8.482 0.297 18496 6343 1 17 . 1 1 20 20 ALA N N 20 120.854 120.854 122.696 -1.842 18496 6344 1 17 . 1 1 20 20 ALA HA H 20 4.239 4.239 4.180 0.059 18496 6345 1 17 . 1 1 20 20 ALA C C 20 179.032 179.032 178.070 0.962 18496 6346 1 17 . 1 1 20 20 ALA CA C 20 54.924 54.924 54.245 0.679 18496 6347 1 17 . 1 1 20 20 ALA CB C 20 18.621 18.621 18.699 -0.078 18496 6348 1 17 . 1 1 20 20 ALA H H 20 8.616 8.616 8.656 -0.040 18496 6349 1 17 . 1 1 21 21 LYS N N 21 115.771 115.771 116.600 -0.829 18496 6350 1 17 . 1 1 21 21 LYS HA H 21 4.497 4.497 4.295 0.202 18496 6351 1 17 . 1 1 21 21 LYS C C 21 176.615 176.615 176.833 -0.218 18496 6352 1 17 . 1 1 21 21 LYS CA C 21 55.503 55.503 55.338 0.165 18496 6353 1 17 . 1 1 21 21 LYS CB C 21 32.742 32.742 32.138 0.604 18496 6354 1 17 . 1 1 21 21 LYS H H 21 7.767 7.767 7.609 0.158 18496 6355 1 17 . 1 1 22 22 GLY N N 22 107.695 107.695 106.517 1.178 18496 6356 1 17 . 1 1 22 22 GLY C C 22 174.843 174.843 174.382 0.461 18496 6357 1 17 . 1 1 22 22 GLY CA C 22 45.297 45.297 45.211 0.086 18496 6358 1 17 . 1 1 22 22 GLY H H 22 8.317 8.317 7.907 0.410 18496 6359 1 17 . 1 1 23 23 TRP N N 23 121.316 121.316 121.305 0.011 18496 6360 1 17 . 1 1 23 23 TRP HA H 23 4.815 4.815 4.839 -0.024 18496 6361 1 17 . 1 1 23 23 TRP C C 23 176.754 176.754 176.536 0.218 18496 6362 1 17 . 1 1 23 23 TRP CA C 23 58.291 58.291 54.889 3.402 18496 6363 1 17 . 1 1 23 23 TRP CB C 23 28.127 28.127 27.926 0.201 18496 6364 1 17 . 1 1 23 23 TRP H H 23 7.983 7.983 8.048 -0.065 18496 6365 1 17 . 1 1 24 24 ARG N N 24 120.789 120.789 126.932 -6.143 18496 6366 1 17 . 1 1 24 24 ARG HA H 24 5.496 5.496 4.908 0.588 18496 6367 1 17 . 1 1 24 24 ARG C C 24 175.831 175.831 176.221 -0.390 18496 6368 1 17 . 1 1 24 24 ARG CA C 24 54.755 54.755 54.733 0.022 18496 6369 1 17 . 1 1 24 24 ARG CB C 24 33.735 33.735 30.022 3.713 18496 6370 1 17 . 1 1 24 24 ARG H H 24 9.046 9.046 9.278 -0.232 18496 6371 1 17 . 1 1 25 25 LYS N N 25 126.507 126.507 129.426 -2.919 18496 6372 1 17 . 1 1 25 25 LYS HA H 25 5.081 5.081 4.842 0.239 18496 6373 1 17 . 1 1 25 25 LYS C C 25 175.648 175.648 175.626 0.022 18496 6374 1 17 . 1 1 25 25 LYS CA C 25 56.071 56.071 56.982 -0.911 18496 6375 1 17 . 1 1 25 25 LYS CB C 25 32.214 32.214 32.751 -0.537 18496 6376 1 17 . 1 1 25 25 LYS H H 25 8.526 8.526 8.572 -0.046 18496 6377 1 17 . 1 1 26 26 GLU N N 26 126.009 126.009 124.085 1.924 18496 6378 1 17 . 1 1 26 26 GLU HA H 26 5.275 5.275 5.066 0.209 18496 6379 1 17 . 1 1 26 26 GLU C C 26 174.894 174.894 174.173 0.721 18496 6380 1 17 . 1 1 26 26 GLU CA C 26 55.271 55.271 55.035 0.236 18496 6381 1 17 . 1 1 26 26 GLU CB C 26 33.781 33.781 34.691 -0.911 18496 6382 1 17 . 1 1 26 26 GLU H H 26 9.125 9.125 9.074 0.051 18496 6383 1 17 . 1 1 27 27 LEU N N 27 121.930 121.930 124.784 -2.854 18496 6384 1 17 . 1 1 27 27 LEU HA H 27 5.788 5.788 4.885 0.903 18496 6385 1 17 . 1 1 27 27 LEU C C 27 173.941 173.941 174.388 -0.447 18496 6386 1 17 . 1 1 27 27 LEU CA C 27 53.859 53.859 53.864 -0.005 18496 6387 1 17 . 1 1 27 27 LEU CB C 27 44.020 44.020 44.212 -0.192 18496 6388 1 17 . 1 1 27 27 LEU H H 27 8.938 8.938 9.094 -0.156 18496 6389 1 17 . 1 1 28 28 ASN N N 28 124.630 124.630 125.101 -0.471 18496 6390 1 17 . 1 1 28 28 ASN HA H 28 5.411 5.411 5.228 0.183 18496 6391 1 17 . 1 1 28 28 ASN C C 28 174.366 174.366 173.262 1.104 18496 6392 1 17 . 1 1 28 28 ASN CA C 28 52.063 52.063 52.234 -0.171 18496 6393 1 17 . 1 1 28 28 ASN CB C 28 44.430 44.430 43.306 1.124 18496 6394 1 17 . 1 1 28 28 ASN H H 28 9.345 9.345 8.244 1.101 18496 6395 1 17 . 1 1 29 29 ARG N N 29 118.443 118.443 122.158 -3.715 18496 6396 1 17 . 1 1 29 29 ARG HA H 29 5.058 5.058 4.931 0.127 18496 6397 1 17 . 1 1 29 29 ARG C C 29 175.779 175.779 174.615 1.164 18496 6398 1 17 . 1 1 29 29 ARG CA C 29 56.091 56.091 55.694 0.397 18496 6399 1 17 . 1 1 29 29 ARG CB C 29 31.710 31.710 31.151 0.559 18496 6400 1 17 . 1 1 29 29 ARG H H 29 9.109 9.109 9.088 0.021 18496 6401 1 17 . 1 1 30 30 VAL N N 30 124.605 124.605 122.402 2.203 18496 6402 1 17 . 1 1 30 30 VAL HA H 30 4.535 4.535 5.289 -0.754 18496 6403 1 17 . 1 1 30 30 VAL C C 30 174.775 174.775 174.208 0.567 18496 6404 1 17 . 1 1 30 30 VAL CA C 30 60.921 60.921 59.184 1.737 18496 6405 1 17 . 1 1 30 30 VAL CB C 30 37.790 37.790 36.189 1.601 18496 6406 1 17 . 1 1 30 30 VAL H H 30 9.054 9.054 8.679 0.375 18496 6407 1 17 . 1 1 31 31 SER N N 31 120.794 120.794 114.853 5.941 18496 6408 1 17 . 1 1 31 31 SER HA H 31 4.652 4.652 5.099 -0.447 18496 6409 1 17 . 1 1 31 31 SER C C 31 174.214 174.214 175.297 -1.083 18496 6410 1 17 . 1 1 31 31 SER CA C 31 56.279 56.279 57.068 -0.789 18496 6411 1 17 . 1 1 31 31 SER CB C 31 64.128 64.128 64.045 0.083 18496 6412 1 17 . 1 1 31 31 SER H H 31 8.667 8.667 8.934 -0.267 18496 6413 1 17 . 1 1 32 32 TRP N N 32 132.303 132.303 128.070 4.233 18496 6414 1 17 . 1 1 32 32 TRP HA H 32 5.105 5.105 4.537 0.568 18496 6415 1 17 . 1 1 32 32 TRP C C 32 177.276 177.276 177.123 0.153 18496 6416 1 17 . 1 1 32 32 TRP CA C 32 56.198 56.198 58.366 -2.168 18496 6417 1 17 . 1 1 32 32 TRP CB C 32 29.968 29.968 28.241 1.728 18496 6418 1 17 . 1 1 32 32 TRP H H 32 9.282 9.282 9.169 0.113 18496 6419 1 17 . 1 1 33 33 ASN N N 33 124.979 124.979 123.358 1.621 18496 6420 1 17 . 1 1 33 33 ASN HA H 33 4.257 4.257 4.412 -0.155 18496 6421 1 17 . 1 1 33 33 ASN C C 33 174.030 174.030 174.783 -0.753 18496 6422 1 17 . 1 1 33 33 ASN CA C 33 54.709 54.709 54.719 -0.011 18496 6423 1 17 . 1 1 33 33 ASN CB C 33 37.921 37.921 36.915 1.006 18496 6424 1 17 . 1 1 33 33 ASN H H 33 9.813 9.813 8.830 0.983 18496 6425 1 17 . 1 1 34 34 ASP N N 34 111.880 111.880 113.553 -1.673 18496 6426 1 17 . 1 1 34 34 ASP HA H 34 4.126 4.126 4.237 -0.111 18496 6427 1 17 . 1 1 34 34 ASP CA C 34 56.130 56.130 55.411 0.719 18496 6428 1 17 . 1 1 34 34 ASP CB C 34 39.760 39.760 40.373 -0.613 18496 6429 1 17 . 1 1 34 34 ASP H H 34 9.251 9.251 8.218 1.033 18496 6430 1 17 . 1 1 35 35 ALA N N 35 121.811 121.811 121.169 0.642 18496 6431 1 17 . 1 1 35 35 ALA HA H 35 4.477 4.477 4.518 -0.041 18496 6432 1 17 . 1 1 35 35 ALA C C 35 177.778 177.778 177.017 0.761 18496 6433 1 17 . 1 1 35 35 ALA CA C 35 51.528 51.528 52.637 -1.109 18496 6434 1 17 . 1 1 35 35 ALA CB C 35 20.445 20.445 20.541 -0.096 18496 6435 1 17 . 1 1 35 35 ALA H H 35 7.625 7.625 7.716 -0.091 18496 6436 1 17 . 1 1 36 36 GLU N N 36 121.068 121.068 121.991 -0.923 18496 6437 1 17 . 1 1 36 36 GLU HA H 36 4.390 4.390 4.772 -0.382 18496 6438 1 17 . 1 1 36 36 GLU CA C 36 55.276 55.276 52.150 3.126 18496 6439 1 17 . 1 1 36 36 GLU CB C 36 28.575 28.575 31.198 -2.623 18496 6440 1 17 . 1 1 36 36 GLU H H 36 8.658 8.658 8.176 0.482 18496 6441 1 17 . 1 1 37 37 PRO HA H 37 4.289 4.289 4.709 -0.420 18496 6442 1 17 . 1 1 37 37 PRO C C 37 175.799 175.799 175.791 0.008 18496 6443 1 17 . 1 1 37 37 PRO CA C 37 63.105 63.105 62.335 0.770 18496 6444 1 17 . 1 1 37 37 PRO CB C 37 32.076 32.076 31.762 0.313 18496 6445 1 17 . 1 1 38 38 LYS N N 38 120.881 120.881 122.920 -2.039 18496 6446 1 17 . 1 1 38 38 LYS HA H 38 4.700 4.700 4.333 0.367 18496 6447 1 17 . 1 1 38 38 LYS C C 38 176.906 176.906 174.772 2.134 18496 6448 1 17 . 1 1 38 38 LYS CA C 38 54.399 54.399 54.200 0.199 18496 6449 1 17 . 1 1 38 38 LYS CB C 38 37.217 37.217 36.439 0.778 18496 6450 1 17 . 1 1 38 38 LYS H H 38 8.316 8.316 8.927 -0.611 18496 6451 1 17 . 1 1 39 39 TYR N N 39 119.792 119.792 118.348 1.444 18496 6452 1 17 . 1 1 39 39 TYR HA H 39 4.636 4.636 4.817 -0.181 18496 6453 1 17 . 1 1 39 39 TYR C C 39 175.834 175.834 174.780 1.054 18496 6454 1 17 . 1 1 39 39 TYR CA C 39 60.228 60.228 57.203 3.026 18496 6455 1 17 . 1 1 39 39 TYR CB C 39 38.683 38.683 39.210 -0.527 18496 6456 1 17 . 1 1 39 39 TYR H H 39 8.508 8.508 7.733 0.775 18496 6457 1 17 . 1 1 40 40 ASP N N 40 126.502 126.502 122.961 3.541 18496 6458 1 17 . 1 1 40 40 ASP HA H 40 5.597 5.597 5.388 0.209 18496 6459 1 17 . 1 1 40 40 ASP C C 40 175.283 175.283 174.169 1.114 18496 6460 1 17 . 1 1 40 40 ASP CA C 40 55.053 55.053 53.579 1.474 18496 6461 1 17 . 1 1 40 40 ASP CB C 40 48.656 48.656 45.423 3.233 18496 6462 1 17 . 1 1 40 40 ASP H H 40 9.219 9.219 8.533 0.686 18496 6463 1 17 . 1 1 41 41 ILE N N 41 125.910 125.910 125.209 0.701 18496 6464 1 17 . 1 1 41 41 ILE HA H 41 5.722 5.722 4.998 0.724 18496 6465 1 17 . 1 1 41 41 ILE C C 41 174.167 174.167 173.684 0.483 18496 6466 1 17 . 1 1 41 41 ILE CA C 41 60.734 60.734 59.848 0.886 18496 6467 1 17 . 1 1 41 41 ILE CB C 41 40.198 40.198 39.760 0.438 18496 6468 1 17 . 1 1 41 41 ILE H H 41 8.972 8.972 8.759 0.213 18496 6469 1 17 . 1 1 42 42 ARG N N 42 120.300 120.300 127.272 -6.972 18496 6470 1 17 . 1 1 42 42 ARG HA H 42 4.716 4.716 4.811 -0.095 18496 6471 1 17 . 1 1 42 42 ARG CA C 42 54.826 54.826 54.937 -0.111 18496 6472 1 17 . 1 1 42 42 ARG CB C 42 32.665 32.665 35.390 -2.725 18496 6473 1 17 . 1 1 42 42 ARG H H 42 8.320 8.320 8.741 -0.421 18496 6474 1 17 . 1 1 43 43 THR HA H 43 5.585 5.585 5.418 0.167 18496 6475 1 17 . 1 1 43 43 THR C C 43 173.294 173.294 173.290 0.004 18496 6476 1 17 . 1 1 43 43 THR CA C 43 60.847 60.847 59.339 1.508 18496 6477 1 17 . 1 1 43 43 THR CB C 43 69.961 69.961 70.826 -0.865 18496 6478 1 17 . 1 1 44 44 TRP N N 44 122.747 122.747 123.631 -0.884 18496 6479 1 17 . 1 1 44 44 TRP HA H 44 4.945 4.945 4.748 0.197 18496 6480 1 17 . 1 1 44 44 TRP C C 44 175.056 175.056 176.250 -1.194 18496 6481 1 17 . 1 1 44 44 TRP CA C 44 56.107 56.107 55.848 0.259 18496 6482 1 17 . 1 1 44 44 TRP CB C 44 34.506 34.506 32.438 2.068 18496 6483 1 17 . 1 1 44 44 TRP H H 44 9.180 9.180 8.878 0.302 18496 6484 1 17 . 1 1 45 45 SER N N 45 117.385 117.385 116.228 1.157 18496 6485 1 17 . 1 1 45 45 SER HA H 45 2.300 2.300 4.916 -2.616 18496 6486 1 17 . 1 1 45 45 SER CA C 45 56.481 56.481 56.625 -0.144 18496 6487 1 17 . 1 1 45 45 SER CB C 45 60.743 60.743 62.249 -1.506 18496 6488 1 17 . 1 1 45 45 SER H H 45 7.879 7.879 8.307 -0.428 18496 6489 1 17 . 1 1 46 46 PRO HA H 46 4.104 4.104 4.431 -0.327 18496 6490 1 17 . 1 1 46 46 PRO CA C 46 64.990 64.990 65.718 -0.728 18496 6491 1 17 . 1 1 46 46 PRO CB C 46 31.272 31.272 31.820 -0.548 18496 6492 1 17 . 1 1 47 47 ASP HA H 47 4.520 4.520 4.607 -0.087 18496 6493 1 17 . 1 1 47 47 ASP C C 47 175.629 175.629 175.690 -0.061 18496 6494 1 17 . 1 1 47 47 ASP CA C 47 53.453 53.453 53.130 0.323 18496 6495 1 17 . 1 1 47 47 ASP CB C 47 40.239 40.239 40.962 -0.723 18496 6496 1 17 . 1 1 48 48 HIS N N 48 111.320 111.320 116.284 -4.964 18496 6497 1 17 . 1 1 48 48 HIS HA H 48 3.916 3.916 4.538 -0.622 18496 6498 1 17 . 1 1 48 48 HIS CA C 48 60.347 60.347 57.687 2.660 18496 6499 1 17 . 1 1 48 48 HIS CB C 48 25.499 25.499 27.786 -2.287 18496 6500 1 17 . 1 1 48 48 HIS H H 48 8.269 8.269 8.169 0.100 18496 6501 1 17 . 1 1 49 49 GLU N N 49 114.659 114.659 117.621 -2.962 18496 6502 1 17 . 1 1 49 49 GLU HA H 49 4.447 4.447 4.412 0.035 18496 6503 1 17 . 1 1 49 49 GLU C C 49 176.394 176.394 176.733 -0.339 18496 6504 1 17 . 1 1 49 49 GLU CA C 49 57.940 57.940 57.458 0.482 18496 6505 1 17 . 1 1 49 49 GLU CB C 49 30.641 30.641 31.136 -0.495 18496 6506 1 17 . 1 1 49 49 GLU H H 49 7.381 7.381 8.517 -1.136 18496 6507 1 17 . 1 1 50 50 LYS N N 50 118.126 118.126 118.197 -0.071 18496 6508 1 17 . 1 1 50 50 LYS HA H 50 4.665 4.665 4.592 0.073 18496 6509 1 17 . 1 1 50 50 LYS CA C 50 54.431 54.431 54.693 -0.262 18496 6510 1 17 . 1 1 50 50 LYS CB C 50 36.543 36.543 36.572 -0.029 18496 6511 1 17 . 1 1 50 50 LYS H H 50 8.067 8.067 8.143 -0.076 18496 6512 1 17 . 1 1 51 51 MET HA H 51 4.936 4.936 4.448 0.488 18496 6513 1 17 . 1 1 51 51 MET CA C 51 54.048 54.048 53.000 1.048 18496 6514 1 17 . 1 1 51 51 MET CB C 51 33.768 33.768 34.895 -1.127 18496 6515 1 17 . 1 1 52 52 GLY C C 52 173.534 173.534 172.326 1.208 18496 6516 1 17 . 1 1 52 52 GLY CA C 52 43.060 43.060 44.375 -1.315 18496 6517 1 17 . 1 1 53 53 LYS N N 53 118.012 118.012 119.808 -1.796 18496 6518 1 17 . 1 1 53 53 LYS HA H 53 4.155 4.155 4.529 -0.374 18496 6519 1 17 . 1 1 53 53 LYS C C 53 176.818 176.818 176.056 0.762 18496 6520 1 17 . 1 1 53 53 LYS CA C 53 56.478 56.478 55.885 0.593 18496 6521 1 17 . 1 1 53 53 LYS CB C 53 33.117 33.117 33.665 -0.548 18496 6522 1 17 . 1 1 53 53 LYS H H 53 8.132 8.132 8.172 -0.040 18496 6523 1 17 . 1 1 54 54 GLY N N 54 109.836 109.836 108.031 1.805 18496 6524 1 17 . 1 1 54 54 GLY C C 54 170.848 170.848 172.789 -1.941 18496 6525 1 17 . 1 1 54 54 GLY CA C 54 46.701 46.701 44.901 1.800 18496 6526 1 17 . 1 1 54 54 GLY H H 54 8.079 8.079 8.199 -0.120 18496 6527 1 17 . 1 1 55 55 ILE N N 55 119.382 119.382 122.032 -2.650 18496 6528 1 17 . 1 1 55 55 ILE HA H 55 4.956 4.956 4.572 0.384 18496 6529 1 17 . 1 1 55 55 ILE C C 55 171.737 171.737 173.723 -1.986 18496 6530 1 17 . 1 1 55 55 ILE CA C 55 57.059 57.059 60.550 -3.491 18496 6531 1 17 . 1 1 55 55 ILE CB C 55 44.241 44.241 41.313 2.928 18496 6532 1 17 . 1 1 55 55 ILE H H 55 8.661 8.661 8.400 0.261 18496 6533 1 17 . 1 1 56 56 THR N N 56 113.795 113.795 122.509 -8.714 18496 6534 1 17 . 1 1 56 56 THR HA H 56 5.607 5.607 4.967 0.640 18496 6535 1 17 . 1 1 56 56 THR C C 56 174.417 174.417 173.690 0.727 18496 6536 1 17 . 1 1 56 56 THR CA C 56 59.098 59.098 61.418 -2.320 18496 6537 1 17 . 1 1 56 56 THR CB C 56 72.153 72.153 70.185 1.968 18496 6538 1 17 . 1 1 56 56 THR H H 56 7.916 7.916 8.435 -0.519 18496 6539 1 17 . 1 1 57 57 LEU N N 57 121.044 121.044 126.459 -5.415 18496 6540 1 17 . 1 1 57 57 LEU HA H 57 5.311 5.311 4.961 0.350 18496 6541 1 17 . 1 1 57 57 LEU C C 57 176.150 176.150 175.522 0.628 18496 6542 1 17 . 1 1 57 57 LEU CA C 57 53.264 53.264 53.958 -0.694 18496 6543 1 17 . 1 1 57 57 LEU CB C 57 45.901 45.901 45.299 0.602 18496 6544 1 17 . 1 1 57 57 LEU H H 57 9.421 9.421 9.223 0.199 18496 6545 1 17 . 1 1 58 58 SER N N 58 119.548 119.548 118.020 1.528 18496 6546 1 17 . 1 1 58 58 SER HA H 58 4.734 4.734 4.610 0.124 18496 6547 1 17 . 1 1 58 58 SER C C 58 174.786 174.786 175.852 -1.066 18496 6548 1 17 . 1 1 58 58 SER CA C 58 56.948 56.948 57.292 -0.344 18496 6549 1 17 . 1 1 58 58 SER CB C 58 65.726 65.726 65.213 0.513 18496 6550 1 17 . 1 1 58 58 SER H H 58 9.771 9.771 9.379 0.392 18496 6551 1 17 . 1 1 59 59 GLU N N 59 120.827 120.827 122.897 -2.070 18496 6552 1 17 . 1 1 59 59 GLU HA H 59 4.319 4.319 4.165 0.154 18496 6553 1 17 . 1 1 59 59 GLU C C 59 179.806 179.806 178.726 1.080 18496 6554 1 17 . 1 1 59 59 GLU CA C 59 60.913 60.913 61.248 -0.335 18496 6555 1 17 . 1 1 59 59 GLU CB C 59 29.538 29.538 29.239 0.299 18496 6556 1 17 . 1 1 59 59 GLU H H 59 9.394 9.394 9.110 0.284 18496 6557 1 17 . 1 1 60 60 GLU N N 60 119.587 119.587 119.276 0.311 18496 6558 1 17 . 1 1 60 60 GLU HA H 60 4.188 4.188 4.086 0.102 18496 6559 1 17 . 1 1 60 60 GLU C C 60 179.686 179.686 178.808 0.878 18496 6560 1 17 . 1 1 60 60 GLU CA C 60 60.279 60.279 59.623 0.656 18496 6561 1 17 . 1 1 60 60 GLU CB C 60 29.559 29.559 28.718 0.841 18496 6562 1 17 . 1 1 60 60 GLU H H 60 8.905 8.905 8.841 0.064 18496 6563 1 17 . 1 1 61 61 GLU N N 61 120.145 120.145 119.848 0.297 18496 6564 1 17 . 1 1 61 61 GLU HA H 61 4.037 4.037 4.080 -0.043 18496 6565 1 17 . 1 1 61 61 GLU C C 61 178.530 178.530 178.976 -0.446 18496 6566 1 17 . 1 1 61 61 GLU CA C 61 59.118 59.118 58.893 0.225 18496 6567 1 17 . 1 1 61 61 GLU CB C 61 30.976 30.976 29.301 1.675 18496 6568 1 17 . 1 1 61 61 GLU H H 61 8.013 8.013 8.415 -0.402 18496 6569 1 17 . 1 1 62 62 PHE N N 62 119.925 119.925 120.520 -0.595 18496 6570 1 17 . 1 1 62 62 PHE HA H 62 3.927 3.927 4.090 -0.163 18496 6571 1 17 . 1 1 62 62 PHE C C 62 176.783 176.783 177.519 -0.736 18496 6572 1 17 . 1 1 62 62 PHE CA C 62 61.827 61.827 61.249 0.578 18496 6573 1 17 . 1 1 62 62 PHE CB C 62 40.216 40.216 38.988 1.228 18496 6574 1 17 . 1 1 62 62 PHE H H 62 9.192 9.192 8.839 0.353 18496 6575 1 17 . 1 1 63 63 GLY N N 63 104.854 104.854 107.750 -2.896 18496 6576 1 17 . 1 1 63 63 GLY C C 63 176.854 176.854 175.868 0.986 18496 6577 1 17 . 1 1 63 63 GLY CA C 63 47.178 47.178 47.475 -0.297 18496 6578 1 17 . 1 1 63 63 GLY H H 63 8.316 8.316 8.729 -0.413 18496 6579 1 17 . 1 1 64 64 VAL N N 64 123.719 123.719 123.132 0.587 18496 6580 1 17 . 1 1 64 64 VAL HA H 64 3.663 3.663 3.576 0.087 18496 6581 1 17 . 1 1 64 64 VAL C C 64 177.644 177.644 177.725 -0.081 18496 6582 1 17 . 1 1 64 64 VAL CA C 64 67.090 67.090 66.158 0.932 18496 6583 1 17 . 1 1 64 64 VAL CB C 64 31.367 31.367 31.650 -0.283 18496 6584 1 17 . 1 1 64 64 VAL H H 64 7.759 7.759 7.831 -0.072 18496 6585 1 17 . 1 1 65 65 LEU N N 65 120.099 120.099 120.843 -0.744 18496 6586 1 17 . 1 1 65 65 LEU HA H 65 3.672 3.672 3.893 -0.221 18496 6587 1 17 . 1 1 65 65 LEU C C 65 177.636 177.636 178.364 -0.728 18496 6588 1 17 . 1 1 65 65 LEU CA C 65 58.552 58.552 58.320 0.232 18496 6589 1 17 . 1 1 65 65 LEU CB C 65 41.358 41.358 41.683 -0.325 18496 6590 1 17 . 1 1 65 65 LEU H H 65 7.660 7.660 7.673 -0.013 18496 6591 1 17 . 1 1 66 66 LEU N N 66 115.733 115.733 118.408 -2.675 18496 6592 1 17 . 1 1 66 66 LEU HA H 66 3.556 3.556 3.625 -0.069 18496 6593 1 17 . 1 1 66 66 LEU C C 66 179.729 179.729 178.814 0.915 18496 6594 1 17 . 1 1 66 66 LEU CA C 66 58.069 58.069 58.137 -0.068 18496 6595 1 17 . 1 1 66 66 LEU CB C 66 41.625 41.625 41.089 0.536 18496 6596 1 17 . 1 1 66 66 LEU H H 66 8.083 8.083 8.263 -0.180 18496 6597 1 17 . 1 1 67 67 LYS N N 67 119.120 119.120 119.904 -0.784 18496 6598 1 17 . 1 1 67 67 LYS HA H 67 3.965 3.965 3.809 0.156 18496 6599 1 17 . 1 1 67 67 LYS C C 67 179.379 179.379 179.023 0.356 18496 6600 1 17 . 1 1 67 67 LYS CA C 67 59.227 59.227 59.887 -0.660 18496 6601 1 17 . 1 1 67 67 LYS CB C 67 32.737 32.737 32.250 0.487 18496 6602 1 17 . 1 1 67 67 LYS H H 67 7.861 7.861 8.317 -0.456 18496 6603 1 17 . 1 1 68 68 GLU N N 68 116.924 116.924 118.764 -1.840 18496 6604 1 17 . 1 1 68 68 GLU HA H 68 4.409 4.409 4.075 0.334 18496 6605 1 17 . 1 1 68 68 GLU CA C 68 57.712 57.712 58.766 -1.054 18496 6606 1 17 . 1 1 68 68 GLU CB C 68 29.586 29.586 29.427 0.159 18496 6607 1 17 . 1 1 68 68 GLU H H 68 8.319 8.319 7.830 0.489 18496 6608 1 17 . 1 1 69 69 LEU N N 69 120.032 120.032 120.093 -0.061 18496 6609 1 17 . 1 1 69 69 LEU HA H 69 4.107 4.107 3.937 0.170 18496 6610 1 17 . 1 1 69 69 LEU CA C 69 57.563 57.563 57.479 0.084 18496 6611 1 17 . 1 1 69 69 LEU CB C 69 41.373 41.373 41.521 -0.148 18496 6612 1 17 . 1 1 69 69 LEU H H 69 8.233 8.233 8.459 -0.226 18496 6613 1 17 . 1 1 70 70 GLY N N 70 105.472 105.472 105.351 0.121 18496 6614 1 17 . 1 1 70 70 GLY C C 70 174.986 174.986 176.316 -1.330 18496 6615 1 17 . 1 1 70 70 GLY CA C 70 46.704 46.704 46.776 -0.072 18496 6616 1 17 . 1 1 70 70 GLY H H 70 7.960 7.960 8.595 -0.635 18496 6617 1 17 . 1 1 71 71 ASN N N 71 118.596 118.596 119.909 -1.313 18496 6618 1 17 . 1 1 71 71 ASN HA H 71 4.681 4.681 4.821 -0.140 18496 6619 1 17 . 1 1 71 71 ASN C C 71 176.412 176.412 177.865 -1.453 18496 6620 1 17 . 1 1 71 71 ASN CA C 71 54.407 54.407 55.181 -0.774 18496 6621 1 17 . 1 1 71 71 ASN CB C 71 38.729 38.729 38.609 0.120 18496 6622 1 17 . 1 1 71 71 ASN H H 71 7.857 7.857 7.719 0.138 18496 6623 1 17 . 1 1 72 72 LYS N N 72 119.973 119.973 120.298 -0.325 18496 6624 1 17 . 1 1 72 72 LYS HA H 72 4.282 4.282 4.122 0.160 18496 6625 1 17 . 1 1 72 72 LYS CA C 72 57.338 57.338 58.171 -0.833 18496 6626 1 17 . 1 1 72 72 LYS CB C 72 32.755 32.755 32.042 0.713 18496 6627 1 17 . 1 1 72 72 LYS H H 72 8.100 8.100 8.001 0.099 18496 6628 1 17 . 1 1 73 73 LEU HA H 73 4.281 4.281 4.287 -0.006 18496 6629 1 17 . 1 1 73 73 LEU CA C 73 55.774 55.774 54.913 0.861 18496 6630 1 17 . 1 1 73 73 LEU CB C 73 41.983 41.983 42.319 -0.336 18496 6631 1 18 . 1 1 2 2 ALA HA H 2 4.074 4.074 4.573 -0.499 18496 6632 1 18 . 1 1 2 2 ALA CA C 2 51.966 51.966 51.603 0.363 18496 6633 1 18 . 1 1 2 2 ALA CB C 2 19.732 19.732 19.941 -0.209 18496 6634 1 18 . 1 1 3 3 ASP HA H 3 4.632 4.632 4.555 0.077 18496 6635 1 18 . 1 1 3 3 ASP C C 3 175.822 175.822 176.372 -0.550 18496 6636 1 18 . 1 1 3 3 ASP CA C 3 54.440 54.440 55.469 -1.029 18496 6637 1 18 . 1 1 3 3 ASP CB C 3 41.577 41.577 41.281 0.297 18496 6638 1 18 . 1 1 4 4 LYS N N 4 121.655 121.655 120.015 1.640 18496 6639 1 18 . 1 1 4 4 LYS HA H 4 4.379 4.379 4.556 -0.177 18496 6640 1 18 . 1 1 4 4 LYS C C 4 176.011 176.011 175.968 0.043 18496 6641 1 18 . 1 1 4 4 LYS CA C 4 56.213 56.213 54.938 1.275 18496 6642 1 18 . 1 1 4 4 LYS CB C 4 33.407 33.407 31.893 1.514 18496 6643 1 18 . 1 1 4 4 LYS H H 4 8.394 8.394 8.084 0.310 18496 6644 1 18 . 1 1 5 5 LEU N N 5 125.369 125.369 125.435 -0.066 18496 6645 1 18 . 1 1 5 5 LEU HA H 5 4.351 4.351 4.309 0.042 18496 6646 1 18 . 1 1 5 5 LEU C C 5 175.682 175.682 176.363 -0.681 18496 6647 1 18 . 1 1 5 5 LEU CA C 5 55.117 55.117 55.054 0.063 18496 6648 1 18 . 1 1 5 5 LEU CB C 5 43.197 43.197 42.875 0.322 18496 6649 1 18 . 1 1 5 5 LEU H H 5 8.136 8.136 8.184 -0.048 18496 6650 1 18 . 1 1 6 6 LYS N N 6 126.844 126.844 125.936 0.908 18496 6651 1 18 . 1 1 6 6 LYS HA H 6 4.451 4.451 4.532 -0.080 18496 6652 1 18 . 1 1 6 6 LYS C C 6 174.665 174.665 175.387 -0.722 18496 6653 1 18 . 1 1 6 6 LYS CA C 6 55.974 55.974 56.151 -0.177 18496 6654 1 18 . 1 1 6 6 LYS CB C 6 34.386 34.386 33.168 1.218 18496 6655 1 18 . 1 1 6 6 LYS H H 6 8.615 8.615 8.578 0.037 18496 6656 1 18 . 1 1 7 7 PHE N N 7 119.818 119.818 119.727 0.091 18496 6657 1 18 . 1 1 7 7 PHE HA H 7 5.343 5.343 5.480 -0.137 18496 6658 1 18 . 1 1 7 7 PHE C C 7 173.569 173.569 173.819 -0.250 18496 6659 1 18 . 1 1 7 7 PHE CA C 7 55.813 55.813 55.584 0.229 18496 6660 1 18 . 1 1 7 7 PHE CB C 7 42.975 42.975 42.468 0.507 18496 6661 1 18 . 1 1 7 7 PHE H H 7 7.734 7.734 8.265 -0.531 18496 6662 1 18 . 1 1 8 8 GLU N N 8 119.165 119.165 119.334 -0.169 18496 6663 1 18 . 1 1 8 8 GLU HA H 8 4.158 4.158 4.262 -0.104 18496 6664 1 18 . 1 1 8 8 GLU C C 8 175.026 175.026 174.265 0.761 18496 6665 1 18 . 1 1 8 8 GLU CA C 8 55.221 55.221 54.884 0.337 18496 6666 1 18 . 1 1 8 8 GLU CB C 8 33.699 33.699 32.725 0.974 18496 6667 1 18 . 1 1 8 8 GLU H H 8 8.295 8.295 8.825 -0.530 18496 6668 1 18 . 1 1 9 9 ILE N N 9 127.619 127.619 128.092 -0.473 18496 6669 1 18 . 1 1 9 9 ILE HA H 9 3.768 3.768 4.210 -0.442 18496 6670 1 18 . 1 1 9 9 ILE C C 9 174.902 174.902 175.877 -0.975 18496 6671 1 18 . 1 1 9 9 ILE CA C 9 62.505 62.505 62.435 0.070 18496 6672 1 18 . 1 1 9 9 ILE CB C 9 36.094 36.094 37.638 -1.544 18496 6673 1 18 . 1 1 9 9 ILE H H 9 9.157 9.157 8.718 0.439 18496 6674 1 18 . 1 1 10 10 ILE N N 10 131.245 131.245 128.786 2.459 18496 6675 1 18 . 1 1 10 10 ILE HA H 10 3.861 3.861 4.086 -0.225 18496 6676 1 18 . 1 1 10 10 ILE C C 10 176.247 176.247 176.397 -0.150 18496 6677 1 18 . 1 1 10 10 ILE CA C 10 60.554 60.554 62.289 -1.735 18496 6678 1 18 . 1 1 10 10 ILE CB C 10 37.406 37.406 38.401 -0.995 18496 6679 1 18 . 1 1 10 10 ILE H H 10 8.428 8.428 8.992 -0.564 18496 6680 1 18 . 1 1 11 11 GLU N N 11 117.669 117.669 118.256 -0.587 18496 6681 1 18 . 1 1 11 11 GLU HA H 11 4.315 4.315 4.521 -0.206 18496 6682 1 18 . 1 1 11 11 GLU C C 11 174.155 174.155 174.661 -0.506 18496 6683 1 18 . 1 1 11 11 GLU CA C 11 55.755 55.755 55.337 0.418 18496 6684 1 18 . 1 1 11 11 GLU CB C 11 34.386 34.386 33.035 1.351 18496 6685 1 18 . 1 1 11 11 GLU H H 11 7.551 7.551 7.777 -0.226 18496 6686 1 18 . 1 1 12 12 GLU N N 12 128.587 128.587 124.940 3.647 18496 6687 1 18 . 1 1 12 12 GLU HA H 12 5.214 5.214 4.430 0.784 18496 6688 1 18 . 1 1 12 12 GLU C C 12 176.877 176.877 175.933 0.944 18496 6689 1 18 . 1 1 12 12 GLU CA C 12 54.801 54.801 57.457 -2.656 18496 6690 1 18 . 1 1 12 12 GLU CB C 12 30.137 30.137 30.057 0.080 18496 6691 1 18 . 1 1 12 12 GLU H H 12 8.762 8.762 8.829 -0.067 18496 6692 1 18 . 1 1 13 13 LEU N N 13 122.508 122.508 122.653 -0.145 18496 6693 1 18 . 1 1 13 13 LEU HA H 13 4.872 4.872 4.501 0.371 18496 6694 1 18 . 1 1 13 13 LEU C C 13 176.060 176.060 177.001 -0.941 18496 6695 1 18 . 1 1 13 13 LEU CA C 13 57.372 57.372 55.529 1.843 18496 6696 1 18 . 1 1 13 13 LEU CB C 13 42.284 42.284 43.378 -1.094 18496 6697 1 18 . 1 1 13 13 LEU H H 13 8.058 8.058 8.242 -0.184 18496 6698 1 18 . 1 1 14 14 ILE N N 14 115.422 115.422 117.927 -2.505 18496 6699 1 18 . 1 1 14 14 ILE HA H 14 4.553 4.553 4.490 0.063 18496 6700 1 18 . 1 1 14 14 ILE C C 14 174.893 174.893 174.180 0.713 18496 6701 1 18 . 1 1 14 14 ILE CA C 14 60.586 60.586 59.633 0.953 18496 6702 1 18 . 1 1 14 14 ILE CB C 14 44.329 44.329 41.525 2.804 18496 6703 1 18 . 1 1 14 14 ILE H H 14 8.450 8.450 8.338 0.112 18496 6704 1 18 . 1 1 15 15 VAL N N 15 129.108 129.108 126.078 3.030 18496 6705 1 18 . 1 1 15 15 VAL HA H 15 4.196 4.196 4.433 -0.237 18496 6706 1 18 . 1 1 15 15 VAL C C 15 175.180 175.180 175.058 0.122 18496 6707 1 18 . 1 1 15 15 VAL CA C 15 63.288 63.288 60.698 2.590 18496 6708 1 18 . 1 1 15 15 VAL CB C 15 32.117 32.117 33.424 -1.307 18496 6709 1 18 . 1 1 15 15 VAL H H 15 8.867 8.867 8.445 0.422 18496 6710 1 18 . 1 1 16 16 LEU N N 16 127.846 127.846 129.759 -1.913 18496 6711 1 18 . 1 1 16 16 LEU HA H 16 4.317 4.317 4.679 -0.362 18496 6712 1 18 . 1 1 16 16 LEU C C 16 176.070 176.070 176.884 -0.814 18496 6713 1 18 . 1 1 16 16 LEU CA C 16 57.252 57.252 55.703 1.549 18496 6714 1 18 . 1 1 16 16 LEU CB C 16 42.035 42.035 42.693 -0.658 18496 6715 1 18 . 1 1 16 16 LEU H H 16 9.555 9.555 8.960 0.595 18496 6716 1 18 . 1 1 17 17 SER N N 17 107.073 107.073 110.529 -3.456 18496 6717 1 18 . 1 1 17 17 SER HA H 17 4.540 4.540 4.633 -0.093 18496 6718 1 18 . 1 1 17 17 SER C C 17 172.277 172.277 172.270 0.007 18496 6719 1 18 . 1 1 17 17 SER CA C 17 57.882 57.882 58.000 -0.118 18496 6720 1 18 . 1 1 17 17 SER CB C 17 64.046 64.046 65.082 -1.036 18496 6721 1 18 . 1 1 17 17 SER H H 17 7.699 7.699 7.867 -0.168 18496 6722 1 18 . 1 1 18 18 GLU N N 18 119.235 119.235 119.726 -0.491 18496 6723 1 18 . 1 1 18 18 GLU HA H 18 5.143 5.143 4.948 0.195 18496 6724 1 18 . 1 1 18 18 GLU C C 18 175.469 175.469 176.315 -0.846 18496 6725 1 18 . 1 1 18 18 GLU CA C 18 55.248 55.248 55.202 0.046 18496 6726 1 18 . 1 1 18 18 GLU CB C 18 33.454 33.454 31.186 2.268 18496 6727 1 18 . 1 1 18 18 GLU H H 18 8.437 8.437 8.479 -0.042 18496 6728 1 18 . 1 1 19 19 ASN N N 19 123.988 123.988 121.181 2.807 18496 6729 1 18 . 1 1 19 19 ASN HA H 19 5.097 5.097 4.793 0.304 18496 6730 1 18 . 1 1 19 19 ASN CA C 19 50.916 50.916 52.967 -2.050 18496 6731 1 18 . 1 1 19 19 ASN CB C 19 39.482 39.482 39.081 0.401 18496 6732 1 18 . 1 1 19 19 ASN H H 19 8.779 8.779 8.412 0.367 18496 6733 1 18 . 1 1 20 20 ALA N N 20 120.854 120.854 123.186 -2.332 18496 6734 1 18 . 1 1 20 20 ALA HA H 20 4.239 4.239 4.152 0.087 18496 6735 1 18 . 1 1 20 20 ALA C C 20 179.032 179.032 177.885 1.147 18496 6736 1 18 . 1 1 20 20 ALA CA C 20 54.924 54.924 54.283 0.641 18496 6737 1 18 . 1 1 20 20 ALA CB C 20 18.621 18.621 18.209 0.412 18496 6738 1 18 . 1 1 20 20 ALA H H 20 8.616 8.616 8.473 0.143 18496 6739 1 18 . 1 1 21 21 LYS N N 21 115.771 115.771 116.647 -0.876 18496 6740 1 18 . 1 1 21 21 LYS HA H 21 4.497 4.497 4.232 0.265 18496 6741 1 18 . 1 1 21 21 LYS C C 21 176.615 176.615 176.441 0.174 18496 6742 1 18 . 1 1 21 21 LYS CA C 21 55.503 55.503 55.521 -0.018 18496 6743 1 18 . 1 1 21 21 LYS CB C 21 32.742 32.742 32.025 0.717 18496 6744 1 18 . 1 1 21 21 LYS H H 21 7.767 7.767 7.835 -0.068 18496 6745 1 18 . 1 1 22 22 GLY N N 22 107.695 107.695 106.766 0.929 18496 6746 1 18 . 1 1 22 22 GLY C C 22 174.843 174.843 174.032 0.811 18496 6747 1 18 . 1 1 22 22 GLY CA C 22 45.297 45.297 45.212 0.085 18496 6748 1 18 . 1 1 22 22 GLY H H 22 8.317 8.317 7.842 0.475 18496 6749 1 18 . 1 1 23 23 TRP N N 23 121.316 121.316 120.959 0.357 18496 6750 1 18 . 1 1 23 23 TRP HA H 23 4.815 4.815 4.879 -0.064 18496 6751 1 18 . 1 1 23 23 TRP C C 23 176.754 176.754 176.486 0.268 18496 6752 1 18 . 1 1 23 23 TRP CA C 23 58.291 58.291 54.855 3.436 18496 6753 1 18 . 1 1 23 23 TRP CB C 23 28.127 28.127 28.124 0.003 18496 6754 1 18 . 1 1 23 23 TRP H H 23 7.983 7.983 7.995 -0.012 18496 6755 1 18 . 1 1 24 24 ARG N N 24 120.789 120.789 126.974 -6.185 18496 6756 1 18 . 1 1 24 24 ARG HA H 24 5.496 5.496 4.886 0.610 18496 6757 1 18 . 1 1 24 24 ARG C C 24 175.831 175.831 176.226 -0.395 18496 6758 1 18 . 1 1 24 24 ARG CA C 24 54.755 54.755 54.540 0.215 18496 6759 1 18 . 1 1 24 24 ARG CB C 24 33.735 33.735 29.986 3.749 18496 6760 1 18 . 1 1 24 24 ARG H H 24 9.046 9.046 9.324 -0.278 18496 6761 1 18 . 1 1 25 25 LYS N N 25 126.507 126.507 129.305 -2.798 18496 6762 1 18 . 1 1 25 25 LYS HA H 25 5.081 5.081 4.792 0.289 18496 6763 1 18 . 1 1 25 25 LYS C C 25 175.648 175.648 175.725 -0.077 18496 6764 1 18 . 1 1 25 25 LYS CA C 25 56.071 56.071 57.153 -1.082 18496 6765 1 18 . 1 1 25 25 LYS CB C 25 32.214 32.214 32.785 -0.571 18496 6766 1 18 . 1 1 25 25 LYS H H 25 8.526 8.526 8.572 -0.046 18496 6767 1 18 . 1 1 26 26 GLU N N 26 126.009 126.009 123.917 2.092 18496 6768 1 18 . 1 1 26 26 GLU HA H 26 5.275 5.275 5.157 0.118 18496 6769 1 18 . 1 1 26 26 GLU C C 26 174.894 174.894 174.217 0.677 18496 6770 1 18 . 1 1 26 26 GLU CA C 26 55.271 55.271 55.107 0.164 18496 6771 1 18 . 1 1 26 26 GLU CB C 26 33.781 33.781 34.914 -1.133 18496 6772 1 18 . 1 1 26 26 GLU H H 26 9.125 9.125 9.321 -0.196 18496 6773 1 18 . 1 1 27 27 LEU N N 27 121.930 121.930 124.304 -2.374 18496 6774 1 18 . 1 1 27 27 LEU HA H 27 5.788 5.788 5.060 0.728 18496 6775 1 18 . 1 1 27 27 LEU C C 27 173.941 173.941 174.405 -0.464 18496 6776 1 18 . 1 1 27 27 LEU CA C 27 53.859 53.859 53.931 -0.071 18496 6777 1 18 . 1 1 27 27 LEU CB C 27 44.020 44.020 44.350 -0.330 18496 6778 1 18 . 1 1 27 27 LEU H H 27 8.938 8.938 9.131 -0.193 18496 6779 1 18 . 1 1 28 28 ASN N N 28 124.630 124.630 125.087 -0.457 18496 6780 1 18 . 1 1 28 28 ASN HA H 28 5.411 5.411 5.259 0.152 18496 6781 1 18 . 1 1 28 28 ASN C C 28 174.366 174.366 173.336 1.030 18496 6782 1 18 . 1 1 28 28 ASN CA C 28 52.063 52.063 52.261 -0.198 18496 6783 1 18 . 1 1 28 28 ASN CB C 28 44.430 44.430 43.355 1.075 18496 6784 1 18 . 1 1 28 28 ASN H H 28 9.345 9.345 8.322 1.023 18496 6785 1 18 . 1 1 29 29 ARG N N 29 118.443 118.443 122.226 -3.783 18496 6786 1 18 . 1 1 29 29 ARG HA H 29 5.058 5.058 4.953 0.105 18496 6787 1 18 . 1 1 29 29 ARG C C 29 175.779 175.779 174.646 1.133 18496 6788 1 18 . 1 1 29 29 ARG CA C 29 56.091 56.091 55.747 0.344 18496 6789 1 18 . 1 1 29 29 ARG CB C 29 31.710 31.710 31.146 0.564 18496 6790 1 18 . 1 1 29 29 ARG H H 29 9.109 9.109 8.993 0.116 18496 6791 1 18 . 1 1 30 30 VAL N N 30 124.605 124.605 122.514 2.091 18496 6792 1 18 . 1 1 30 30 VAL HA H 30 4.535 4.535 5.389 -0.854 18496 6793 1 18 . 1 1 30 30 VAL C C 30 174.775 174.775 174.312 0.463 18496 6794 1 18 . 1 1 30 30 VAL CA C 30 60.921 60.921 59.145 1.776 18496 6795 1 18 . 1 1 30 30 VAL CB C 30 37.790 37.790 36.213 1.577 18496 6796 1 18 . 1 1 30 30 VAL H H 30 9.054 9.054 8.727 0.327 18496 6797 1 18 . 1 1 31 31 SER N N 31 120.794 120.794 115.383 5.411 18496 6798 1 18 . 1 1 31 31 SER HA H 31 4.652 4.652 5.121 -0.469 18496 6799 1 18 . 1 1 31 31 SER C C 31 174.214 174.214 175.344 -1.130 18496 6800 1 18 . 1 1 31 31 SER CA C 31 56.279 56.279 57.086 -0.807 18496 6801 1 18 . 1 1 31 31 SER CB C 31 64.128 64.128 64.094 0.034 18496 6802 1 18 . 1 1 31 31 SER H H 31 8.667 8.667 8.910 -0.243 18496 6803 1 18 . 1 1 32 32 TRP N N 32 132.303 132.303 127.912 4.391 18496 6804 1 18 . 1 1 32 32 TRP HA H 32 5.105 5.105 4.533 0.572 18496 6805 1 18 . 1 1 32 32 TRP C C 32 177.276 177.276 177.117 0.159 18496 6806 1 18 . 1 1 32 32 TRP CA C 32 56.198 56.198 58.117 -1.919 18496 6807 1 18 . 1 1 32 32 TRP CB C 32 29.968 29.968 27.981 1.987 18496 6808 1 18 . 1 1 32 32 TRP H H 32 9.282 9.282 9.083 0.199 18496 6809 1 18 . 1 1 33 33 ASN N N 33 124.979 124.979 123.551 1.428 18496 6810 1 18 . 1 1 33 33 ASN HA H 33 4.257 4.257 4.400 -0.143 18496 6811 1 18 . 1 1 33 33 ASN C C 33 174.030 174.030 174.772 -0.742 18496 6812 1 18 . 1 1 33 33 ASN CA C 33 54.709 54.709 54.742 -0.034 18496 6813 1 18 . 1 1 33 33 ASN CB C 33 37.921 37.921 36.936 0.985 18496 6814 1 18 . 1 1 33 33 ASN H H 33 9.813 9.813 8.834 0.979 18496 6815 1 18 . 1 1 34 34 ASP N N 34 111.880 111.880 114.004 -2.124 18496 6816 1 18 . 1 1 34 34 ASP HA H 34 4.126 4.126 4.220 -0.094 18496 6817 1 18 . 1 1 34 34 ASP CA C 34 56.130 56.130 55.867 0.263 18496 6818 1 18 . 1 1 34 34 ASP CB C 34 39.760 39.760 40.187 -0.427 18496 6819 1 18 . 1 1 34 34 ASP H H 34 9.251 9.251 8.314 0.937 18496 6820 1 18 . 1 1 35 35 ALA N N 35 121.811 121.811 121.102 0.709 18496 6821 1 18 . 1 1 35 35 ALA HA H 35 4.477 4.477 4.473 0.004 18496 6822 1 18 . 1 1 35 35 ALA C C 35 177.778 177.778 177.261 0.517 18496 6823 1 18 . 1 1 35 35 ALA CA C 35 51.528 51.528 52.649 -1.121 18496 6824 1 18 . 1 1 35 35 ALA CB C 35 20.445 20.445 20.155 0.290 18496 6825 1 18 . 1 1 35 35 ALA H H 35 7.625 7.625 7.727 -0.102 18496 6826 1 18 . 1 1 36 36 GLU N N 36 121.068 121.068 121.471 -0.403 18496 6827 1 18 . 1 1 36 36 GLU HA H 36 4.390 4.390 4.759 -0.369 18496 6828 1 18 . 1 1 36 36 GLU CA C 36 55.276 55.276 52.067 3.209 18496 6829 1 18 . 1 1 36 36 GLU CB C 36 28.575 28.575 31.087 -2.512 18496 6830 1 18 . 1 1 36 36 GLU H H 36 8.658 8.658 8.331 0.327 18496 6831 1 18 . 1 1 37 37 PRO HA H 37 4.289 4.289 4.574 -0.285 18496 6832 1 18 . 1 1 37 37 PRO C C 37 175.799 175.799 175.870 -0.071 18496 6833 1 18 . 1 1 37 37 PRO CA C 37 63.105 63.105 62.523 0.582 18496 6834 1 18 . 1 1 37 37 PRO CB C 37 32.076 32.076 32.177 -0.101 18496 6835 1 18 . 1 1 38 38 LYS N N 38 120.881 120.881 123.307 -2.426 18496 6836 1 18 . 1 1 38 38 LYS HA H 38 4.700 4.700 4.302 0.398 18496 6837 1 18 . 1 1 38 38 LYS C C 38 176.906 176.906 174.523 2.383 18496 6838 1 18 . 1 1 38 38 LYS CA C 38 54.399 54.399 54.684 -0.285 18496 6839 1 18 . 1 1 38 38 LYS CB C 38 37.217 37.217 36.666 0.551 18496 6840 1 18 . 1 1 38 38 LYS H H 38 8.316 8.316 8.808 -0.492 18496 6841 1 18 . 1 1 39 39 TYR N N 39 119.792 119.792 118.522 1.270 18496 6842 1 18 . 1 1 39 39 TYR HA H 39 4.636 4.636 4.832 -0.196 18496 6843 1 18 . 1 1 39 39 TYR C C 39 175.834 175.834 174.701 1.133 18496 6844 1 18 . 1 1 39 39 TYR CA C 39 60.228 60.228 57.007 3.221 18496 6845 1 18 . 1 1 39 39 TYR CB C 39 38.683 38.683 38.946 -0.263 18496 6846 1 18 . 1 1 39 39 TYR H H 39 8.508 8.508 7.745 0.763 18496 6847 1 18 . 1 1 40 40 ASP N N 40 126.502 126.502 123.099 3.403 18496 6848 1 18 . 1 1 40 40 ASP HA H 40 5.597 5.597 5.382 0.215 18496 6849 1 18 . 1 1 40 40 ASP C C 40 175.283 175.283 174.104 1.179 18496 6850 1 18 . 1 1 40 40 ASP CA C 40 55.053 55.053 53.398 1.655 18496 6851 1 18 . 1 1 40 40 ASP CB C 40 48.656 48.656 45.509 3.147 18496 6852 1 18 . 1 1 40 40 ASP H H 40 9.219 9.219 8.484 0.735 18496 6853 1 18 . 1 1 41 41 ILE N N 41 125.910 125.910 124.911 0.999 18496 6854 1 18 . 1 1 41 41 ILE HA H 41 5.722 5.722 5.007 0.715 18496 6855 1 18 . 1 1 41 41 ILE C C 41 174.167 174.167 173.609 0.558 18496 6856 1 18 . 1 1 41 41 ILE CA C 41 60.734 60.734 59.827 0.907 18496 6857 1 18 . 1 1 41 41 ILE CB C 41 40.198 40.198 39.854 0.344 18496 6858 1 18 . 1 1 41 41 ILE H H 41 8.972 8.972 8.749 0.223 18496 6859 1 18 . 1 1 42 42 ARG N N 42 120.300 120.300 126.834 -6.534 18496 6860 1 18 . 1 1 42 42 ARG HA H 42 4.716 4.716 4.663 0.053 18496 6861 1 18 . 1 1 42 42 ARG CA C 42 54.826 54.826 54.802 0.024 18496 6862 1 18 . 1 1 42 42 ARG CB C 42 32.665 32.665 35.022 -2.357 18496 6863 1 18 . 1 1 42 42 ARG H H 42 8.320 8.320 8.749 -0.429 18496 6864 1 18 . 1 1 43 43 THR HA H 43 5.585 5.585 5.348 0.237 18496 6865 1 18 . 1 1 43 43 THR C C 43 173.294 173.294 172.930 0.364 18496 6866 1 18 . 1 1 43 43 THR CA C 43 60.847 60.847 59.585 1.262 18496 6867 1 18 . 1 1 43 43 THR CB C 43 69.961 69.961 70.856 -0.895 18496 6868 1 18 . 1 1 44 44 TRP N N 44 122.747 122.747 123.295 -0.548 18496 6869 1 18 . 1 1 44 44 TRP HA H 44 4.945 4.945 4.814 0.131 18496 6870 1 18 . 1 1 44 44 TRP C C 44 175.056 175.056 176.276 -1.220 18496 6871 1 18 . 1 1 44 44 TRP CA C 44 56.107 56.107 55.300 0.807 18496 6872 1 18 . 1 1 44 44 TRP CB C 44 34.506 34.506 31.902 2.604 18496 6873 1 18 . 1 1 44 44 TRP H H 44 9.180 9.180 8.840 0.340 18496 6874 1 18 . 1 1 45 45 SER N N 45 117.385 117.385 116.999 0.386 18496 6875 1 18 . 1 1 45 45 SER HA H 45 2.300 2.300 4.673 -2.373 18496 6876 1 18 . 1 1 45 45 SER CA C 45 56.481 56.481 57.282 -0.801 18496 6877 1 18 . 1 1 45 45 SER CB C 45 60.743 60.743 61.908 -1.165 18496 6878 1 18 . 1 1 45 45 SER H H 45 7.879 7.879 8.652 -0.773 18496 6879 1 18 . 1 1 46 46 PRO HA H 46 4.104 4.104 4.386 -0.282 18496 6880 1 18 . 1 1 46 46 PRO CA C 46 64.990 64.990 65.579 -0.589 18496 6881 1 18 . 1 1 46 46 PRO CB C 46 31.272 31.272 31.888 -0.616 18496 6882 1 18 . 1 1 47 47 ASP HA H 47 4.520 4.520 4.720 -0.200 18496 6883 1 18 . 1 1 47 47 ASP C C 47 175.629 175.629 175.143 0.486 18496 6884 1 18 . 1 1 47 47 ASP CA C 47 53.453 53.453 52.980 0.473 18496 6885 1 18 . 1 1 47 47 ASP CB C 47 40.239 40.239 40.865 -0.626 18496 6886 1 18 . 1 1 48 48 HIS N N 48 111.320 111.320 115.811 -4.491 18496 6887 1 18 . 1 1 48 48 HIS HA H 48 3.916 3.916 4.383 -0.467 18496 6888 1 18 . 1 1 48 48 HIS CA C 48 60.347 60.347 57.608 2.739 18496 6889 1 18 . 1 1 48 48 HIS CB C 48 25.499 25.499 27.780 -2.281 18496 6890 1 18 . 1 1 48 48 HIS H H 48 8.269 8.269 8.158 0.111 18496 6891 1 18 . 1 1 49 49 GLU N N 49 114.659 114.659 116.275 -1.616 18496 6892 1 18 . 1 1 49 49 GLU HA H 49 4.447 4.447 4.201 0.246 18496 6893 1 18 . 1 1 49 49 GLU C C 49 176.394 176.394 176.755 -0.361 18496 6894 1 18 . 1 1 49 49 GLU CA C 49 57.940 57.940 57.599 0.341 18496 6895 1 18 . 1 1 49 49 GLU CB C 49 30.641 30.641 30.212 0.429 18496 6896 1 18 . 1 1 49 49 GLU H H 49 7.381 7.381 8.704 -1.323 18496 6897 1 18 . 1 1 50 50 LYS N N 50 118.126 118.126 118.257 -0.131 18496 6898 1 18 . 1 1 50 50 LYS HA H 50 4.665 4.665 4.704 -0.039 18496 6899 1 18 . 1 1 50 50 LYS CA C 50 54.431 54.431 54.852 -0.421 18496 6900 1 18 . 1 1 50 50 LYS CB C 50 36.543 36.543 36.173 0.370 18496 6901 1 18 . 1 1 50 50 LYS H H 50 8.067 8.067 7.413 0.654 18496 6902 1 18 . 1 1 51 51 MET HA H 51 4.936 4.936 4.951 -0.015 18496 6903 1 18 . 1 1 51 51 MET CA C 51 54.048 54.048 53.153 0.895 18496 6904 1 18 . 1 1 51 51 MET CB C 51 33.768 33.768 35.843 -2.075 18496 6905 1 18 . 1 1 52 52 GLY C C 52 173.534 173.534 172.097 1.437 18496 6906 1 18 . 1 1 52 52 GLY CA C 52 43.060 43.060 44.475 -1.415 18496 6907 1 18 . 1 1 53 53 LYS N N 53 118.012 118.012 120.209 -2.197 18496 6908 1 18 . 1 1 53 53 LYS HA H 53 4.155 4.155 4.470 -0.315 18496 6909 1 18 . 1 1 53 53 LYS C C 53 176.818 176.818 175.951 0.867 18496 6910 1 18 . 1 1 53 53 LYS CA C 53 56.478 56.478 55.919 0.559 18496 6911 1 18 . 1 1 53 53 LYS CB C 53 33.117 33.117 33.435 -0.318 18496 6912 1 18 . 1 1 53 53 LYS H H 53 8.132 8.132 8.168 -0.036 18496 6913 1 18 . 1 1 54 54 GLY N N 54 109.836 109.836 108.637 1.199 18496 6914 1 18 . 1 1 54 54 GLY C C 54 170.848 170.848 172.779 -1.931 18496 6915 1 18 . 1 1 54 54 GLY CA C 54 46.701 46.701 44.658 2.043 18496 6916 1 18 . 1 1 54 54 GLY H H 54 8.079 8.079 8.151 -0.072 18496 6917 1 18 . 1 1 55 55 ILE N N 55 119.382 119.382 121.900 -2.518 18496 6918 1 18 . 1 1 55 55 ILE HA H 55 4.956 4.956 4.597 0.359 18496 6919 1 18 . 1 1 55 55 ILE C C 55 171.737 171.737 173.624 -1.887 18496 6920 1 18 . 1 1 55 55 ILE CA C 55 57.059 57.059 60.485 -3.426 18496 6921 1 18 . 1 1 55 55 ILE CB C 55 44.241 44.241 41.596 2.645 18496 6922 1 18 . 1 1 55 55 ILE H H 55 8.661 8.661 8.366 0.295 18496 6923 1 18 . 1 1 56 56 THR N N 56 113.795 113.795 122.417 -8.622 18496 6924 1 18 . 1 1 56 56 THR HA H 56 5.607 5.607 4.917 0.690 18496 6925 1 18 . 1 1 56 56 THR C C 56 174.417 174.417 173.722 0.695 18496 6926 1 18 . 1 1 56 56 THR CA C 56 59.098 59.098 61.661 -2.563 18496 6927 1 18 . 1 1 56 56 THR CB C 56 72.153 72.153 70.156 1.997 18496 6928 1 18 . 1 1 56 56 THR H H 56 7.916 7.916 8.445 -0.529 18496 6929 1 18 . 1 1 57 57 LEU N N 57 121.044 121.044 127.888 -6.844 18496 6930 1 18 . 1 1 57 57 LEU HA H 57 5.311 5.311 5.020 0.291 18496 6931 1 18 . 1 1 57 57 LEU C C 57 176.150 176.150 175.872 0.278 18496 6932 1 18 . 1 1 57 57 LEU CA C 57 53.264 53.264 53.707 -0.443 18496 6933 1 18 . 1 1 57 57 LEU CB C 57 45.901 45.901 45.231 0.670 18496 6934 1 18 . 1 1 57 57 LEU H H 57 9.421 9.421 9.201 0.220 18496 6935 1 18 . 1 1 58 58 SER N N 58 119.548 119.548 118.692 0.856 18496 6936 1 18 . 1 1 58 58 SER HA H 58 4.734 4.734 4.512 0.222 18496 6937 1 18 . 1 1 58 58 SER C C 58 174.786 174.786 175.842 -1.056 18496 6938 1 18 . 1 1 58 58 SER CA C 58 56.948 56.948 58.016 -1.068 18496 6939 1 18 . 1 1 58 58 SER CB C 58 65.726 65.726 64.102 1.624 18496 6940 1 18 . 1 1 58 58 SER H H 58 9.771 9.771 9.484 0.287 18496 6941 1 18 . 1 1 59 59 GLU N N 59 120.827 120.827 122.669 -1.842 18496 6942 1 18 . 1 1 59 59 GLU HA H 59 4.319 4.319 4.213 0.106 18496 6943 1 18 . 1 1 59 59 GLU C C 59 179.806 179.806 178.947 0.859 18496 6944 1 18 . 1 1 59 59 GLU CA C 59 60.913 60.913 60.606 0.307 18496 6945 1 18 . 1 1 59 59 GLU CB C 59 29.538 29.538 29.381 0.157 18496 6946 1 18 . 1 1 59 59 GLU H H 59 9.394 9.394 9.025 0.369 18496 6947 1 18 . 1 1 60 60 GLU N N 60 119.587 119.587 119.649 -0.062 18496 6948 1 18 . 1 1 60 60 GLU HA H 60 4.188 4.188 4.102 0.086 18496 6949 1 18 . 1 1 60 60 GLU C C 60 179.686 179.686 178.819 0.867 18496 6950 1 18 . 1 1 60 60 GLU CA C 60 60.279 60.279 59.528 0.751 18496 6951 1 18 . 1 1 60 60 GLU CB C 60 29.559 29.559 28.776 0.783 18496 6952 1 18 . 1 1 60 60 GLU H H 60 8.905 8.905 8.888 0.017 18496 6953 1 18 . 1 1 61 61 GLU N N 61 120.145 120.145 120.029 0.116 18496 6954 1 18 . 1 1 61 61 GLU HA H 61 4.037 4.037 4.108 -0.071 18496 6955 1 18 . 1 1 61 61 GLU C C 61 178.530 178.530 178.833 -0.303 18496 6956 1 18 . 1 1 61 61 GLU CA C 61 59.118 59.118 58.867 0.251 18496 6957 1 18 . 1 1 61 61 GLU CB C 61 30.976 30.976 29.358 1.618 18496 6958 1 18 . 1 1 61 61 GLU H H 61 8.013 8.013 8.350 -0.337 18496 6959 1 18 . 1 1 62 62 PHE N N 62 119.925 119.925 120.611 -0.686 18496 6960 1 18 . 1 1 62 62 PHE HA H 62 3.927 3.927 4.058 -0.131 18496 6961 1 18 . 1 1 62 62 PHE C C 62 176.783 176.783 177.641 -0.858 18496 6962 1 18 . 1 1 62 62 PHE CA C 62 61.827 61.827 61.416 0.410 18496 6963 1 18 . 1 1 62 62 PHE CB C 62 40.216 40.216 38.860 1.356 18496 6964 1 18 . 1 1 62 62 PHE H H 62 9.192 9.192 8.835 0.357 18496 6965 1 18 . 1 1 63 63 GLY N N 63 104.854 104.854 107.212 -2.358 18496 6966 1 18 . 1 1 63 63 GLY C C 63 176.854 176.854 175.964 0.890 18496 6967 1 18 . 1 1 63 63 GLY CA C 63 47.178 47.178 47.433 -0.255 18496 6968 1 18 . 1 1 63 63 GLY H H 63 8.316 8.316 8.642 -0.326 18496 6969 1 18 . 1 1 64 64 VAL N N 64 123.719 123.719 123.033 0.686 18496 6970 1 18 . 1 1 64 64 VAL HA H 64 3.663 3.663 3.717 -0.054 18496 6971 1 18 . 1 1 64 64 VAL C C 64 177.644 177.644 177.918 -0.274 18496 6972 1 18 . 1 1 64 64 VAL CA C 64 67.090 67.090 65.815 1.275 18496 6973 1 18 . 1 1 64 64 VAL CB C 64 31.367 31.367 31.109 0.258 18496 6974 1 18 . 1 1 64 64 VAL H H 64 7.759 7.759 7.695 0.064 18496 6975 1 18 . 1 1 65 65 LEU N N 65 120.099 120.099 121.298 -1.199 18496 6976 1 18 . 1 1 65 65 LEU HA H 65 3.672 3.672 3.919 -0.247 18496 6977 1 18 . 1 1 65 65 LEU C C 65 177.636 177.636 178.645 -1.009 18496 6978 1 18 . 1 1 65 65 LEU CA C 65 58.552 58.552 58.499 0.053 18496 6979 1 18 . 1 1 65 65 LEU CB C 65 41.358 41.358 41.747 -0.389 18496 6980 1 18 . 1 1 65 65 LEU H H 65 7.660 7.660 8.194 -0.534 18496 6981 1 18 . 1 1 66 66 LEU N N 66 115.733 115.733 118.325 -2.592 18496 6982 1 18 . 1 1 66 66 LEU HA H 66 3.556 3.556 3.621 -0.065 18496 6983 1 18 . 1 1 66 66 LEU C C 66 179.729 179.729 178.807 0.922 18496 6984 1 18 . 1 1 66 66 LEU CA C 66 58.069 58.069 58.110 -0.041 18496 6985 1 18 . 1 1 66 66 LEU CB C 66 41.625 41.625 40.990 0.635 18496 6986 1 18 . 1 1 66 66 LEU H H 66 8.083 8.083 8.176 -0.093 18496 6987 1 18 . 1 1 67 67 LYS N N 67 119.120 119.120 119.949 -0.829 18496 6988 1 18 . 1 1 67 67 LYS HA H 67 3.965 3.965 3.801 0.164 18496 6989 1 18 . 1 1 67 67 LYS C C 67 179.379 179.379 179.004 0.375 18496 6990 1 18 . 1 1 67 67 LYS CA C 67 59.227 59.227 59.846 -0.619 18496 6991 1 18 . 1 1 67 67 LYS CB C 67 32.737 32.737 32.233 0.503 18496 6992 1 18 . 1 1 67 67 LYS H H 67 7.861 7.861 8.257 -0.396 18496 6993 1 18 . 1 1 68 68 GLU N N 68 116.924 116.924 118.839 -1.915 18496 6994 1 18 . 1 1 68 68 GLU HA H 68 4.409 4.409 4.069 0.340 18496 6995 1 18 . 1 1 68 68 GLU CA C 68 57.712 57.712 58.770 -1.058 18496 6996 1 18 . 1 1 68 68 GLU CB C 68 29.586 29.586 29.406 0.180 18496 6997 1 18 . 1 1 68 68 GLU H H 68 8.319 8.319 7.870 0.449 18496 6998 1 18 . 1 1 69 69 LEU N N 69 120.032 120.032 119.948 0.084 18496 6999 1 18 . 1 1 69 69 LEU HA H 69 4.107 4.107 3.963 0.144 18496 7000 1 18 . 1 1 69 69 LEU CA C 69 57.563 57.563 57.467 0.096 18496 7001 1 18 . 1 1 69 69 LEU CB C 69 41.373 41.373 41.539 -0.166 18496 7002 1 18 . 1 1 69 69 LEU H H 69 8.233 8.233 8.531 -0.298 18496 7003 1 18 . 1 1 70 70 GLY N N 70 105.472 105.472 105.590 -0.118 18496 7004 1 18 . 1 1 70 70 GLY C C 70 174.986 174.986 175.613 -0.627 18496 7005 1 18 . 1 1 70 70 GLY CA C 70 46.704 46.704 46.782 -0.078 18496 7006 1 18 . 1 1 70 70 GLY H H 70 7.960 7.960 8.578 -0.618 18496 7007 1 18 . 1 1 71 71 ASN N N 71 118.596 118.596 119.314 -0.718 18496 7008 1 18 . 1 1 71 71 ASN HA H 71 4.681 4.681 4.863 -0.182 18496 7009 1 18 . 1 1 71 71 ASN C C 71 176.412 176.412 177.744 -1.332 18496 7010 1 18 . 1 1 71 71 ASN CA C 71 54.407 54.407 55.212 -0.805 18496 7011 1 18 . 1 1 71 71 ASN CB C 71 38.729 38.729 38.790 -0.061 18496 7012 1 18 . 1 1 71 71 ASN H H 71 7.857 7.857 7.719 0.138 18496 7013 1 18 . 1 1 72 72 LYS N N 72 119.973 119.973 120.765 -0.792 18496 7014 1 18 . 1 1 72 72 LYS HA H 72 4.282 4.282 4.119 0.163 18496 7015 1 18 . 1 1 72 72 LYS CA C 72 57.338 57.338 58.306 -0.968 18496 7016 1 18 . 1 1 72 72 LYS CB C 72 32.755 32.755 32.052 0.703 18496 7017 1 18 . 1 1 72 72 LYS H H 72 8.100 8.100 7.904 0.196 18496 7018 1 18 . 1 1 73 73 LEU HA H 73 4.281 4.281 4.357 -0.076 18496 7019 1 18 . 1 1 73 73 LEU CA C 73 55.774 55.774 54.712 1.062 18496 7020 1 18 . 1 1 73 73 LEU CB C 73 41.983 41.983 42.147 -0.164 18496 7021 1 19 . 1 1 2 2 ALA HA H 2 4.074 4.074 4.521 -0.447 18496 7022 1 19 . 1 1 2 2 ALA CA C 2 51.966 51.966 51.569 0.397 18496 7023 1 19 . 1 1 2 2 ALA CB C 2 19.732 19.732 20.118 -0.386 18496 7024 1 19 . 1 1 3 3 ASP HA H 3 4.632 4.632 4.492 0.140 18496 7025 1 19 . 1 1 3 3 ASP C C 3 175.822 175.822 176.272 -0.450 18496 7026 1 19 . 1 1 3 3 ASP CA C 3 54.440 54.440 55.565 -1.125 18496 7027 1 19 . 1 1 3 3 ASP CB C 3 41.577 41.577 41.260 0.317 18496 7028 1 19 . 1 1 4 4 LYS N N 4 121.655 121.655 119.742 1.913 18496 7029 1 19 . 1 1 4 4 LYS HA H 4 4.379 4.379 4.494 -0.115 18496 7030 1 19 . 1 1 4 4 LYS C C 4 176.011 176.011 175.393 0.618 18496 7031 1 19 . 1 1 4 4 LYS CA C 4 56.213 56.213 55.145 1.067 18496 7032 1 19 . 1 1 4 4 LYS CB C 4 33.407 33.407 31.828 1.579 18496 7033 1 19 . 1 1 4 4 LYS H H 4 8.394 8.394 7.991 0.403 18496 7034 1 19 . 1 1 5 5 LEU N N 5 125.369 125.369 124.789 0.580 18496 7035 1 19 . 1 1 5 5 LEU HA H 5 4.351 4.351 4.348 0.003 18496 7036 1 19 . 1 1 5 5 LEU C C 5 175.682 175.682 176.703 -1.021 18496 7037 1 19 . 1 1 5 5 LEU CA C 5 55.117 55.117 54.704 0.413 18496 7038 1 19 . 1 1 5 5 LEU CB C 5 43.197 43.197 42.883 0.314 18496 7039 1 19 . 1 1 5 5 LEU H H 5 8.136 8.136 8.204 -0.068 18496 7040 1 19 . 1 1 6 6 LYS N N 6 126.844 126.844 125.523 1.321 18496 7041 1 19 . 1 1 6 6 LYS HA H 6 4.451 4.451 4.533 -0.082 18496 7042 1 19 . 1 1 6 6 LYS C C 6 174.665 174.665 175.442 -0.777 18496 7043 1 19 . 1 1 6 6 LYS CA C 6 55.974 55.974 56.181 -0.207 18496 7044 1 19 . 1 1 6 6 LYS CB C 6 34.386 34.386 33.425 0.961 18496 7045 1 19 . 1 1 6 6 LYS H H 6 8.615 8.615 8.565 0.050 18496 7046 1 19 . 1 1 7 7 PHE N N 7 119.818 119.818 118.575 1.243 18496 7047 1 19 . 1 1 7 7 PHE HA H 7 5.343 5.343 5.528 -0.185 18496 7048 1 19 . 1 1 7 7 PHE C C 7 173.569 173.569 173.713 -0.144 18496 7049 1 19 . 1 1 7 7 PHE CA C 7 55.813 55.813 55.973 -0.160 18496 7050 1 19 . 1 1 7 7 PHE CB C 7 42.975 42.975 42.313 0.662 18496 7051 1 19 . 1 1 7 7 PHE H H 7 7.734 7.734 8.199 -0.465 18496 7052 1 19 . 1 1 8 8 GLU N N 8 119.165 119.165 119.102 0.063 18496 7053 1 19 . 1 1 8 8 GLU HA H 8 4.158 4.158 4.226 -0.068 18496 7054 1 19 . 1 1 8 8 GLU C C 8 175.026 175.026 174.267 0.759 18496 7055 1 19 . 1 1 8 8 GLU CA C 8 55.221 55.221 54.827 0.395 18496 7056 1 19 . 1 1 8 8 GLU CB C 8 33.699 33.699 32.705 0.994 18496 7057 1 19 . 1 1 8 8 GLU H H 8 8.295 8.295 8.809 -0.514 18496 7058 1 19 . 1 1 9 9 ILE N N 9 127.619 127.619 127.800 -0.181 18496 7059 1 19 . 1 1 9 9 ILE HA H 9 3.768 3.768 4.312 -0.544 18496 7060 1 19 . 1 1 9 9 ILE C C 9 174.902 174.902 175.924 -1.022 18496 7061 1 19 . 1 1 9 9 ILE CA C 9 62.505 62.505 62.516 -0.011 18496 7062 1 19 . 1 1 9 9 ILE CB C 9 36.094 36.094 37.650 -1.556 18496 7063 1 19 . 1 1 9 9 ILE H H 9 9.157 9.157 8.704 0.453 18496 7064 1 19 . 1 1 10 10 ILE N N 10 131.245 131.245 128.428 2.817 18496 7065 1 19 . 1 1 10 10 ILE HA H 10 3.861 3.861 4.125 -0.264 18496 7066 1 19 . 1 1 10 10 ILE C C 10 176.247 176.247 176.215 0.032 18496 7067 1 19 . 1 1 10 10 ILE CA C 10 60.554 60.554 61.989 -1.435 18496 7068 1 19 . 1 1 10 10 ILE CB C 10 37.406 37.406 38.399 -0.993 18496 7069 1 19 . 1 1 10 10 ILE H H 10 8.428 8.428 8.979 -0.551 18496 7070 1 19 . 1 1 11 11 GLU N N 11 117.669 117.669 118.926 -1.257 18496 7071 1 19 . 1 1 11 11 GLU HA H 11 4.315 4.315 4.476 -0.161 18496 7072 1 19 . 1 1 11 11 GLU C C 11 174.155 174.155 174.531 -0.376 18496 7073 1 19 . 1 1 11 11 GLU CA C 11 55.755 55.755 55.567 0.188 18496 7074 1 19 . 1 1 11 11 GLU CB C 11 34.386 34.386 32.806 1.580 18496 7075 1 19 . 1 1 11 11 GLU H H 11 7.551 7.551 7.781 -0.230 18496 7076 1 19 . 1 1 12 12 GLU N N 12 128.587 128.587 125.341 3.246 18496 7077 1 19 . 1 1 12 12 GLU HA H 12 5.214 5.214 4.438 0.776 18496 7078 1 19 . 1 1 12 12 GLU C C 12 176.877 176.877 176.082 0.795 18496 7079 1 19 . 1 1 12 12 GLU CA C 12 54.801 54.801 56.976 -2.175 18496 7080 1 19 . 1 1 12 12 GLU CB C 12 30.137 30.137 30.058 0.078 18496 7081 1 19 . 1 1 12 12 GLU H H 12 8.762 8.762 8.822 -0.060 18496 7082 1 19 . 1 1 13 13 LEU N N 13 122.508 122.508 122.311 0.197 18496 7083 1 19 . 1 1 13 13 LEU HA H 13 4.872 4.872 4.690 0.182 18496 7084 1 19 . 1 1 13 13 LEU C C 13 176.060 176.060 177.302 -1.242 18496 7085 1 19 . 1 1 13 13 LEU CA C 13 57.372 57.372 55.347 2.025 18496 7086 1 19 . 1 1 13 13 LEU CB C 13 42.284 42.284 43.615 -1.331 18496 7087 1 19 . 1 1 13 13 LEU H H 13 8.058 8.058 8.465 -0.407 18496 7088 1 19 . 1 1 14 14 ILE N N 14 115.422 115.422 118.059 -2.637 18496 7089 1 19 . 1 1 14 14 ILE HA H 14 4.553 4.553 4.477 0.076 18496 7090 1 19 . 1 1 14 14 ILE C C 14 174.893 174.893 174.089 0.804 18496 7091 1 19 . 1 1 14 14 ILE CA C 14 60.586 60.586 59.472 1.114 18496 7092 1 19 . 1 1 14 14 ILE CB C 14 44.329 44.329 41.238 3.091 18496 7093 1 19 . 1 1 14 14 ILE H H 14 8.450 8.450 8.387 0.063 18496 7094 1 19 . 1 1 15 15 VAL N N 15 129.108 129.108 124.751 4.357 18496 7095 1 19 . 1 1 15 15 VAL HA H 15 4.196 4.196 4.381 -0.185 18496 7096 1 19 . 1 1 15 15 VAL C C 15 175.180 175.180 174.788 0.392 18496 7097 1 19 . 1 1 15 15 VAL CA C 15 63.288 63.288 61.307 1.981 18496 7098 1 19 . 1 1 15 15 VAL CB C 15 32.117 32.117 33.369 -1.252 18496 7099 1 19 . 1 1 15 15 VAL H H 15 8.867 8.867 8.428 0.439 18496 7100 1 19 . 1 1 16 16 LEU N N 16 127.846 127.846 129.181 -1.335 18496 7101 1 19 . 1 1 16 16 LEU HA H 16 4.317 4.317 4.685 -0.368 18496 7102 1 19 . 1 1 16 16 LEU C C 16 176.070 176.070 177.230 -1.160 18496 7103 1 19 . 1 1 16 16 LEU CA C 16 57.252 57.252 56.177 1.075 18496 7104 1 19 . 1 1 16 16 LEU CB C 16 42.035 42.035 42.713 -0.678 18496 7105 1 19 . 1 1 16 16 LEU H H 16 9.555 9.555 9.075 0.480 18496 7106 1 19 . 1 1 17 17 SER N N 17 107.073 107.073 110.190 -3.117 18496 7107 1 19 . 1 1 17 17 SER HA H 17 4.540 4.540 4.557 -0.017 18496 7108 1 19 . 1 1 17 17 SER C C 17 172.277 172.277 172.270 0.007 18496 7109 1 19 . 1 1 17 17 SER CA C 17 57.882 57.882 58.081 -0.199 18496 7110 1 19 . 1 1 17 17 SER CB C 17 64.046 64.046 65.015 -0.969 18496 7111 1 19 . 1 1 17 17 SER H H 17 7.699 7.699 7.711 -0.012 18496 7112 1 19 . 1 1 18 18 GLU N N 18 119.235 119.235 120.365 -1.130 18496 7113 1 19 . 1 1 18 18 GLU HA H 18 5.143 5.143 5.048 0.095 18496 7114 1 19 . 1 1 18 18 GLU C C 18 175.469 175.469 176.230 -0.761 18496 7115 1 19 . 1 1 18 18 GLU CA C 18 55.248 55.248 55.111 0.138 18496 7116 1 19 . 1 1 18 18 GLU CB C 18 33.454 33.454 30.953 2.501 18496 7117 1 19 . 1 1 18 18 GLU H H 18 8.437 8.437 8.519 -0.082 18496 7118 1 19 . 1 1 19 19 ASN N N 19 123.988 123.988 120.345 3.643 18496 7119 1 19 . 1 1 19 19 ASN HA H 19 5.097 5.097 4.795 0.302 18496 7120 1 19 . 1 1 19 19 ASN CA C 19 50.916 50.916 52.669 -1.754 18496 7121 1 19 . 1 1 19 19 ASN CB C 19 39.482 39.482 39.990 -0.508 18496 7122 1 19 . 1 1 19 19 ASN H H 19 8.779 8.779 8.385 0.394 18496 7123 1 19 . 1 1 20 20 ALA N N 20 120.854 120.854 122.817 -1.963 18496 7124 1 19 . 1 1 20 20 ALA HA H 20 4.239 4.239 4.183 0.056 18496 7125 1 19 . 1 1 20 20 ALA C C 20 179.032 179.032 178.135 0.897 18496 7126 1 19 . 1 1 20 20 ALA CA C 20 54.924 54.924 54.241 0.683 18496 7127 1 19 . 1 1 20 20 ALA CB C 20 18.621 18.621 18.657 -0.036 18496 7128 1 19 . 1 1 20 20 ALA H H 20 8.616 8.616 8.685 -0.069 18496 7129 1 19 . 1 1 21 21 LYS N N 21 115.771 115.771 116.648 -0.877 18496 7130 1 19 . 1 1 21 21 LYS HA H 21 4.497 4.497 4.297 0.200 18496 7131 1 19 . 1 1 21 21 LYS C C 21 176.615 176.615 176.870 -0.255 18496 7132 1 19 . 1 1 21 21 LYS CA C 21 55.503 55.503 55.375 0.128 18496 7133 1 19 . 1 1 21 21 LYS CB C 21 32.742 32.742 32.172 0.570 18496 7134 1 19 . 1 1 21 21 LYS H H 21 7.767 7.767 7.638 0.129 18496 7135 1 19 . 1 1 22 22 GLY N N 22 107.695 107.695 106.273 1.422 18496 7136 1 19 . 1 1 22 22 GLY C C 22 174.843 174.843 174.110 0.733 18496 7137 1 19 . 1 1 22 22 GLY CA C 22 45.297 45.297 45.150 0.147 18496 7138 1 19 . 1 1 22 22 GLY H H 22 8.317 8.317 8.022 0.295 18496 7139 1 19 . 1 1 23 23 TRP N N 23 121.316 121.316 121.257 0.059 18496 7140 1 19 . 1 1 23 23 TRP HA H 23 4.815 4.815 4.885 -0.070 18496 7141 1 19 . 1 1 23 23 TRP C C 23 176.754 176.754 176.989 -0.235 18496 7142 1 19 . 1 1 23 23 TRP CA C 23 58.291 58.291 56.845 1.446 18496 7143 1 19 . 1 1 23 23 TRP CB C 23 28.127 28.127 27.824 0.303 18496 7144 1 19 . 1 1 23 23 TRP H H 23 7.983 7.983 7.545 0.438 18496 7145 1 19 . 1 1 24 24 ARG N N 24 120.789 120.789 127.208 -6.419 18496 7146 1 19 . 1 1 24 24 ARG HA H 24 5.496 5.496 4.756 0.740 18496 7147 1 19 . 1 1 24 24 ARG C C 24 175.831 175.831 176.032 -0.201 18496 7148 1 19 . 1 1 24 24 ARG CA C 24 54.755 54.755 54.666 0.089 18496 7149 1 19 . 1 1 24 24 ARG CB C 24 33.735 33.735 30.097 3.638 18496 7150 1 19 . 1 1 24 24 ARG H H 24 9.046 9.046 9.432 -0.386 18496 7151 1 19 . 1 1 25 25 LYS N N 25 126.507 126.507 129.333 -2.826 18496 7152 1 19 . 1 1 25 25 LYS HA H 25 5.081 5.081 4.727 0.354 18496 7153 1 19 . 1 1 25 25 LYS C C 25 175.648 175.648 175.612 0.036 18496 7154 1 19 . 1 1 25 25 LYS CA C 25 56.071 56.071 56.847 -0.776 18496 7155 1 19 . 1 1 25 25 LYS CB C 25 32.214 32.214 32.428 -0.214 18496 7156 1 19 . 1 1 25 25 LYS H H 25 8.526 8.526 9.118 -0.592 18496 7157 1 19 . 1 1 26 26 GLU N N 26 126.009 126.009 123.754 2.255 18496 7158 1 19 . 1 1 26 26 GLU HA H 26 5.275 5.275 5.006 0.269 18496 7159 1 19 . 1 1 26 26 GLU C C 26 174.894 174.894 173.828 1.066 18496 7160 1 19 . 1 1 26 26 GLU CA C 26 55.271 55.271 55.015 0.256 18496 7161 1 19 . 1 1 26 26 GLU CB C 26 33.781 33.781 34.808 -1.027 18496 7162 1 19 . 1 1 26 26 GLU H H 26 9.125 9.125 8.694 0.431 18496 7163 1 19 . 1 1 27 27 LEU N N 27 121.930 121.930 123.506 -1.576 18496 7164 1 19 . 1 1 27 27 LEU HA H 27 5.788 5.788 4.971 0.817 18496 7165 1 19 . 1 1 27 27 LEU C C 27 173.941 173.941 174.228 -0.287 18496 7166 1 19 . 1 1 27 27 LEU CA C 27 53.859 53.859 53.994 -0.135 18496 7167 1 19 . 1 1 27 27 LEU CB C 27 44.020 44.020 44.649 -0.629 18496 7168 1 19 . 1 1 27 27 LEU H H 27 8.938 8.938 8.954 -0.016 18496 7169 1 19 . 1 1 28 28 ASN N N 28 124.630 124.630 124.686 -0.056 18496 7170 1 19 . 1 1 28 28 ASN HA H 28 5.411 5.411 5.196 0.215 18496 7171 1 19 . 1 1 28 28 ASN C C 28 174.366 174.366 173.232 1.134 18496 7172 1 19 . 1 1 28 28 ASN CA C 28 52.063 52.063 52.171 -0.108 18496 7173 1 19 . 1 1 28 28 ASN CB C 28 44.430 44.430 43.282 1.147 18496 7174 1 19 . 1 1 28 28 ASN H H 28 9.345 9.345 8.323 1.022 18496 7175 1 19 . 1 1 29 29 ARG N N 29 118.443 118.443 122.400 -3.957 18496 7176 1 19 . 1 1 29 29 ARG HA H 29 5.058 5.058 4.870 0.188 18496 7177 1 19 . 1 1 29 29 ARG C C 29 175.779 175.779 174.723 1.056 18496 7178 1 19 . 1 1 29 29 ARG CA C 29 56.091 56.091 55.598 0.493 18496 7179 1 19 . 1 1 29 29 ARG CB C 29 31.710 31.710 31.131 0.579 18496 7180 1 19 . 1 1 29 29 ARG H H 29 9.109 9.109 9.017 0.092 18496 7181 1 19 . 1 1 30 30 VAL N N 30 124.605 124.605 121.692 2.913 18496 7182 1 19 . 1 1 30 30 VAL HA H 30 4.535 4.535 5.417 -0.882 18496 7183 1 19 . 1 1 30 30 VAL C C 30 174.775 174.775 174.426 0.349 18496 7184 1 19 . 1 1 30 30 VAL CA C 30 60.921 60.921 58.876 2.045 18496 7185 1 19 . 1 1 30 30 VAL CB C 30 37.790 37.790 36.234 1.556 18496 7186 1 19 . 1 1 30 30 VAL H H 30 9.054 9.054 8.967 0.087 18496 7187 1 19 . 1 1 31 31 SER N N 31 120.794 120.794 115.797 4.997 18496 7188 1 19 . 1 1 31 31 SER HA H 31 4.652 4.652 5.087 -0.435 18496 7189 1 19 . 1 1 31 31 SER C C 31 174.214 174.214 175.499 -1.285 18496 7190 1 19 . 1 1 31 31 SER CA C 31 56.279 56.279 56.951 -0.672 18496 7191 1 19 . 1 1 31 31 SER CB C 31 64.128 64.128 64.185 -0.057 18496 7192 1 19 . 1 1 31 31 SER H H 31 8.667 8.667 8.846 -0.179 18496 7193 1 19 . 1 1 32 32 TRP N N 32 132.303 132.303 128.026 4.277 18496 7194 1 19 . 1 1 32 32 TRP HA H 32 5.105 5.105 4.535 0.570 18496 7195 1 19 . 1 1 32 32 TRP C C 32 177.276 177.276 177.152 0.124 18496 7196 1 19 . 1 1 32 32 TRP CA C 32 56.198 56.198 57.900 -1.702 18496 7197 1 19 . 1 1 32 32 TRP CB C 32 29.968 29.968 28.035 1.933 18496 7198 1 19 . 1 1 32 32 TRP H H 32 9.282 9.282 9.133 0.149 18496 7199 1 19 . 1 1 33 33 ASN N N 33 124.979 124.979 123.562 1.417 18496 7200 1 19 . 1 1 33 33 ASN HA H 33 4.257 4.257 4.355 -0.098 18496 7201 1 19 . 1 1 33 33 ASN C C 33 174.030 174.030 174.753 -0.723 18496 7202 1 19 . 1 1 33 33 ASN CA C 33 54.709 54.709 54.774 -0.065 18496 7203 1 19 . 1 1 33 33 ASN CB C 33 37.921 37.921 37.009 0.912 18496 7204 1 19 . 1 1 33 33 ASN H H 33 9.813 9.813 8.845 0.968 18496 7205 1 19 . 1 1 34 34 ASP N N 34 111.880 111.880 113.465 -1.585 18496 7206 1 19 . 1 1 34 34 ASP HA H 34 4.126 4.126 4.234 -0.108 18496 7207 1 19 . 1 1 34 34 ASP CA C 34 56.130 56.130 55.435 0.695 18496 7208 1 19 . 1 1 34 34 ASP CB C 34 39.760 39.760 40.410 -0.650 18496 7209 1 19 . 1 1 34 34 ASP H H 34 9.251 9.251 8.225 1.026 18496 7210 1 19 . 1 1 35 35 ALA N N 35 121.811 121.811 121.383 0.428 18496 7211 1 19 . 1 1 35 35 ALA HA H 35 4.477 4.477 4.481 -0.004 18496 7212 1 19 . 1 1 35 35 ALA C C 35 177.778 177.778 177.116 0.662 18496 7213 1 19 . 1 1 35 35 ALA CA C 35 51.528 51.528 52.730 -1.202 18496 7214 1 19 . 1 1 35 35 ALA CB C 35 20.445 20.445 20.397 0.048 18496 7215 1 19 . 1 1 35 35 ALA H H 35 7.625 7.625 7.820 -0.195 18496 7216 1 19 . 1 1 36 36 GLU N N 36 121.068 121.068 121.603 -0.535 18496 7217 1 19 . 1 1 36 36 GLU HA H 36 4.390 4.390 4.761 -0.371 18496 7218 1 19 . 1 1 36 36 GLU CA C 36 55.276 55.276 52.084 3.192 18496 7219 1 19 . 1 1 36 36 GLU CB C 36 28.575 28.575 31.261 -2.686 18496 7220 1 19 . 1 1 36 36 GLU H H 36 8.658 8.658 8.260 0.398 18496 7221 1 19 . 1 1 37 37 PRO HA H 37 4.289 4.289 4.682 -0.393 18496 7222 1 19 . 1 1 37 37 PRO C C 37 175.799 175.799 175.986 -0.187 18496 7223 1 19 . 1 1 37 37 PRO CA C 37 63.105 63.105 62.205 0.900 18496 7224 1 19 . 1 1 37 37 PRO CB C 37 32.076 32.076 32.038 0.038 18496 7225 1 19 . 1 1 38 38 LYS N N 38 120.881 120.881 123.063 -2.182 18496 7226 1 19 . 1 1 38 38 LYS HA H 38 4.700 4.700 4.348 0.352 18496 7227 1 19 . 1 1 38 38 LYS C C 38 176.906 176.906 174.667 2.239 18496 7228 1 19 . 1 1 38 38 LYS CA C 38 54.399 54.399 54.498 -0.099 18496 7229 1 19 . 1 1 38 38 LYS CB C 38 37.217 37.217 36.510 0.707 18496 7230 1 19 . 1 1 38 38 LYS H H 38 8.316 8.316 8.811 -0.495 18496 7231 1 19 . 1 1 39 39 TYR N N 39 119.792 119.792 118.267 1.525 18496 7232 1 19 . 1 1 39 39 TYR HA H 39 4.636 4.636 4.817 -0.181 18496 7233 1 19 . 1 1 39 39 TYR C C 39 175.834 175.834 175.148 0.686 18496 7234 1 19 . 1 1 39 39 TYR CA C 39 60.228 60.228 57.330 2.898 18496 7235 1 19 . 1 1 39 39 TYR CB C 39 38.683 38.683 39.339 -0.656 18496 7236 1 19 . 1 1 39 39 TYR H H 39 8.508 8.508 7.695 0.813 18496 7237 1 19 . 1 1 40 40 ASP N N 40 126.502 126.502 122.478 4.024 18496 7238 1 19 . 1 1 40 40 ASP HA H 40 5.597 5.597 5.298 0.299 18496 7239 1 19 . 1 1 40 40 ASP C C 40 175.283 175.283 174.059 1.224 18496 7240 1 19 . 1 1 40 40 ASP CA C 40 55.053 55.053 53.836 1.217 18496 7241 1 19 . 1 1 40 40 ASP CB C 40 48.656 48.656 45.341 3.315 18496 7242 1 19 . 1 1 40 40 ASP H H 40 9.219 9.219 8.749 0.470 18496 7243 1 19 . 1 1 41 41 ILE N N 41 125.910 125.910 125.153 0.757 18496 7244 1 19 . 1 1 41 41 ILE HA H 41 5.722 5.722 4.972 0.750 18496 7245 1 19 . 1 1 41 41 ILE C C 41 174.167 174.167 173.559 0.608 18496 7246 1 19 . 1 1 41 41 ILE CA C 41 60.734 60.734 59.762 0.972 18496 7247 1 19 . 1 1 41 41 ILE CB C 41 40.198 40.198 39.978 0.220 18496 7248 1 19 . 1 1 41 41 ILE H H 41 8.972 8.972 8.701 0.271 18496 7249 1 19 . 1 1 42 42 ARG N N 42 120.300 120.300 127.396 -7.096 18496 7250 1 19 . 1 1 42 42 ARG HA H 42 4.716 4.716 4.848 -0.132 18496 7251 1 19 . 1 1 42 42 ARG CA C 42 54.826 54.826 55.051 -0.225 18496 7252 1 19 . 1 1 42 42 ARG CB C 42 32.665 32.665 35.586 -2.921 18496 7253 1 19 . 1 1 42 42 ARG H H 42 8.320 8.320 8.681 -0.361 18496 7254 1 19 . 1 1 43 43 THR HA H 43 5.585 5.585 5.466 0.119 18496 7255 1 19 . 1 1 43 43 THR C C 43 173.294 173.294 173.733 -0.439 18496 7256 1 19 . 1 1 43 43 THR CA C 43 60.847 60.847 60.712 0.136 18496 7257 1 19 . 1 1 43 43 THR CB C 43 69.961 69.961 70.539 -0.578 18496 7258 1 19 . 1 1 44 44 TRP N N 44 122.747 122.747 124.115 -1.368 18496 7259 1 19 . 1 1 44 44 TRP HA H 44 4.945 4.945 4.783 0.162 18496 7260 1 19 . 1 1 44 44 TRP C C 44 175.056 175.056 176.061 -1.005 18496 7261 1 19 . 1 1 44 44 TRP CA C 44 56.107 56.107 55.408 0.698 18496 7262 1 19 . 1 1 44 44 TRP CB C 44 34.506 34.506 31.730 2.776 18496 7263 1 19 . 1 1 44 44 TRP H H 44 9.180 9.180 8.970 0.210 18496 7264 1 19 . 1 1 45 45 SER N N 45 117.385 117.385 116.815 0.570 18496 7265 1 19 . 1 1 45 45 SER HA H 45 2.300 2.300 4.863 -2.563 18496 7266 1 19 . 1 1 45 45 SER CA C 45 56.481 56.481 58.218 -1.736 18496 7267 1 19 . 1 1 45 45 SER CB C 45 60.743 60.743 62.645 -1.902 18496 7268 1 19 . 1 1 45 45 SER H H 45 7.879 7.879 8.506 -0.627 18496 7269 1 19 . 1 1 46 46 PRO HA H 46 4.104 4.104 4.493 -0.389 18496 7270 1 19 . 1 1 46 46 PRO CA C 46 64.990 64.990 65.320 -0.330 18496 7271 1 19 . 1 1 46 46 PRO CB C 46 31.272 31.272 32.018 -0.746 18496 7272 1 19 . 1 1 47 47 ASP HA H 47 4.520 4.520 4.605 -0.085 18496 7273 1 19 . 1 1 47 47 ASP C C 47 175.629 175.629 175.520 0.109 18496 7274 1 19 . 1 1 47 47 ASP CA C 47 53.453 53.453 53.045 0.408 18496 7275 1 19 . 1 1 47 47 ASP CB C 47 40.239 40.239 41.221 -0.982 18496 7276 1 19 . 1 1 48 48 HIS N N 48 111.320 111.320 114.774 -3.454 18496 7277 1 19 . 1 1 48 48 HIS HA H 48 3.916 3.916 4.540 -0.624 18496 7278 1 19 . 1 1 48 48 HIS CA C 48 60.347 60.347 56.987 3.360 18496 7279 1 19 . 1 1 48 48 HIS CB C 48 25.499 25.499 28.826 -3.327 18496 7280 1 19 . 1 1 48 48 HIS H H 48 8.269 8.269 8.176 0.093 18496 7281 1 19 . 1 1 49 49 GLU N N 49 114.659 114.659 116.891 -2.232 18496 7282 1 19 . 1 1 49 49 GLU HA H 49 4.447 4.447 4.248 0.199 18496 7283 1 19 . 1 1 49 49 GLU C C 49 176.394 176.394 176.345 0.049 18496 7284 1 19 . 1 1 49 49 GLU CA C 49 57.940 57.940 58.133 -0.193 18496 7285 1 19 . 1 1 49 49 GLU CB C 49 30.641 30.641 30.378 0.263 18496 7286 1 19 . 1 1 49 49 GLU H H 49 7.381 7.381 8.642 -1.261 18496 7287 1 19 . 1 1 50 50 LYS N N 50 118.126 118.126 118.829 -0.703 18496 7288 1 19 . 1 1 50 50 LYS HA H 50 4.665 4.665 4.486 0.179 18496 7289 1 19 . 1 1 50 50 LYS CA C 50 54.431 54.431 54.755 -0.324 18496 7290 1 19 . 1 1 50 50 LYS CB C 50 36.543 36.543 35.520 1.022 18496 7291 1 19 . 1 1 50 50 LYS H H 50 8.067 8.067 7.659 0.408 18496 7292 1 19 . 1 1 51 51 MET HA H 51 4.936 4.936 4.352 0.584 18496 7293 1 19 . 1 1 51 51 MET CA C 51 54.048 54.048 52.924 1.124 18496 7294 1 19 . 1 1 51 51 MET CB C 51 33.768 33.768 35.020 -1.252 18496 7295 1 19 . 1 1 52 52 GLY C C 52 173.534 173.534 172.231 1.303 18496 7296 1 19 . 1 1 52 52 GLY CA C 52 43.060 43.060 44.474 -1.414 18496 7297 1 19 . 1 1 53 53 LYS N N 53 118.012 118.012 120.053 -2.041 18496 7298 1 19 . 1 1 53 53 LYS HA H 53 4.155 4.155 4.610 -0.455 18496 7299 1 19 . 1 1 53 53 LYS C C 53 176.818 176.818 175.834 0.984 18496 7300 1 19 . 1 1 53 53 LYS CA C 53 56.478 56.478 55.891 0.587 18496 7301 1 19 . 1 1 53 53 LYS CB C 53 33.117 33.117 33.782 -0.665 18496 7302 1 19 . 1 1 53 53 LYS H H 53 8.132 8.132 8.269 -0.137 18496 7303 1 19 . 1 1 54 54 GLY N N 54 109.836 109.836 108.792 1.044 18496 7304 1 19 . 1 1 54 54 GLY C C 54 170.848 170.848 172.935 -2.087 18496 7305 1 19 . 1 1 54 54 GLY CA C 54 46.701 46.701 44.779 1.922 18496 7306 1 19 . 1 1 54 54 GLY H H 54 8.079 8.079 8.235 -0.156 18496 7307 1 19 . 1 1 55 55 ILE N N 55 119.382 119.382 122.199 -2.817 18496 7308 1 19 . 1 1 55 55 ILE HA H 55 4.956 4.956 4.538 0.418 18496 7309 1 19 . 1 1 55 55 ILE C C 55 171.737 171.737 173.927 -2.190 18496 7310 1 19 . 1 1 55 55 ILE CA C 55 57.059 57.059 60.405 -3.346 18496 7311 1 19 . 1 1 55 55 ILE CB C 55 44.241 44.241 41.312 2.929 18496 7312 1 19 . 1 1 55 55 ILE H H 55 8.661 8.661 8.315 0.346 18496 7313 1 19 . 1 1 56 56 THR N N 56 113.795 113.795 122.607 -8.812 18496 7314 1 19 . 1 1 56 56 THR HA H 56 5.607 5.607 4.882 0.725 18496 7315 1 19 . 1 1 56 56 THR C C 56 174.417 174.417 173.667 0.750 18496 7316 1 19 . 1 1 56 56 THR CA C 56 59.098 59.098 61.840 -2.742 18496 7317 1 19 . 1 1 56 56 THR CB C 56 72.153 72.153 69.906 2.248 18496 7318 1 19 . 1 1 56 56 THR H H 56 7.916 7.916 8.490 -0.574 18496 7319 1 19 . 1 1 57 57 LEU N N 57 121.044 121.044 127.783 -6.739 18496 7320 1 19 . 1 1 57 57 LEU HA H 57 5.311 5.311 4.804 0.507 18496 7321 1 19 . 1 1 57 57 LEU C C 57 176.150 176.150 175.719 0.431 18496 7322 1 19 . 1 1 57 57 LEU CA C 57 53.264 53.264 53.843 -0.579 18496 7323 1 19 . 1 1 57 57 LEU CB C 57 45.901 45.901 43.801 2.100 18496 7324 1 19 . 1 1 57 57 LEU H H 57 9.421 9.421 9.137 0.284 18496 7325 1 19 . 1 1 58 58 SER N N 58 119.548 119.548 118.282 1.266 18496 7326 1 19 . 1 1 58 58 SER HA H 58 4.734 4.734 4.512 0.222 18496 7327 1 19 . 1 1 58 58 SER C C 58 174.786 174.786 175.868 -1.082 18496 7328 1 19 . 1 1 58 58 SER CA C 58 56.948 56.948 57.472 -0.524 18496 7329 1 19 . 1 1 58 58 SER CB C 58 65.726 65.726 65.179 0.547 18496 7330 1 19 . 1 1 58 58 SER H H 58 9.771 9.771 8.974 0.797 18496 7331 1 19 . 1 1 59 59 GLU N N 59 120.827 120.827 122.905 -2.078 18496 7332 1 19 . 1 1 59 59 GLU HA H 59 4.319 4.319 4.180 0.139 18496 7333 1 19 . 1 1 59 59 GLU C C 59 179.806 179.806 178.617 1.189 18496 7334 1 19 . 1 1 59 59 GLU CA C 59 60.913 60.913 61.212 -0.299 18496 7335 1 19 . 1 1 59 59 GLU CB C 59 29.538 29.538 29.355 0.183 18496 7336 1 19 . 1 1 59 59 GLU H H 59 9.394 9.394 9.086 0.308 18496 7337 1 19 . 1 1 60 60 GLU N N 60 119.587 119.587 119.465 0.122 18496 7338 1 19 . 1 1 60 60 GLU HA H 60 4.188 4.188 4.072 0.116 18496 7339 1 19 . 1 1 60 60 GLU C C 60 179.686 179.686 178.813 0.873 18496 7340 1 19 . 1 1 60 60 GLU CA C 60 60.279 60.279 59.558 0.721 18496 7341 1 19 . 1 1 60 60 GLU CB C 60 29.559 29.559 28.741 0.818 18496 7342 1 19 . 1 1 60 60 GLU H H 60 8.905 8.905 8.911 -0.006 18496 7343 1 19 . 1 1 61 61 GLU N N 61 120.145 120.145 119.936 0.209 18496 7344 1 19 . 1 1 61 61 GLU HA H 61 4.037 4.037 4.120 -0.083 18496 7345 1 19 . 1 1 61 61 GLU C C 61 178.530 178.530 178.793 -0.263 18496 7346 1 19 . 1 1 61 61 GLU CA C 61 59.118 59.118 58.749 0.369 18496 7347 1 19 . 1 1 61 61 GLU CB C 61 30.976 30.976 29.419 1.557 18496 7348 1 19 . 1 1 61 61 GLU H H 61 8.013 8.013 8.217 -0.204 18496 7349 1 19 . 1 1 62 62 PHE N N 62 119.925 119.925 120.566 -0.641 18496 7350 1 19 . 1 1 62 62 PHE HA H 62 3.927 3.927 3.974 -0.047 18496 7351 1 19 . 1 1 62 62 PHE C C 62 176.783 176.783 177.820 -1.037 18496 7352 1 19 . 1 1 62 62 PHE CA C 62 61.827 61.827 61.465 0.362 18496 7353 1 19 . 1 1 62 62 PHE CB C 62 40.216 40.216 38.754 1.462 18496 7354 1 19 . 1 1 62 62 PHE H H 62 9.192 9.192 8.942 0.250 18496 7355 1 19 . 1 1 63 63 GLY N N 63 104.854 104.854 106.766 -1.912 18496 7356 1 19 . 1 1 63 63 GLY C C 63 176.854 176.854 176.011 0.843 18496 7357 1 19 . 1 1 63 63 GLY CA C 63 47.178 47.178 47.375 -0.197 18496 7358 1 19 . 1 1 63 63 GLY H H 63 8.316 8.316 8.684 -0.368 18496 7359 1 19 . 1 1 64 64 VAL N N 64 123.719 123.719 122.740 0.979 18496 7360 1 19 . 1 1 64 64 VAL HA H 64 3.663 3.663 3.738 -0.075 18496 7361 1 19 . 1 1 64 64 VAL C C 64 177.644 177.644 177.831 -0.187 18496 7362 1 19 . 1 1 64 64 VAL CA C 64 67.090 67.090 65.574 1.516 18496 7363 1 19 . 1 1 64 64 VAL CB C 64 31.367 31.367 31.145 0.222 18496 7364 1 19 . 1 1 64 64 VAL H H 64 7.759 7.759 7.487 0.272 18496 7365 1 19 . 1 1 65 65 LEU N N 65 120.099 120.099 121.447 -1.348 18496 7366 1 19 . 1 1 65 65 LEU HA H 65 3.672 3.672 3.930 -0.258 18496 7367 1 19 . 1 1 65 65 LEU C C 65 177.636 177.636 178.630 -0.994 18496 7368 1 19 . 1 1 65 65 LEU CA C 65 58.552 58.552 58.547 0.005 18496 7369 1 19 . 1 1 65 65 LEU CB C 65 41.358 41.358 41.715 -0.357 18496 7370 1 19 . 1 1 65 65 LEU H H 65 7.660 7.660 8.394 -0.734 18496 7371 1 19 . 1 1 66 66 LEU N N 66 115.733 115.733 118.139 -2.406 18496 7372 1 19 . 1 1 66 66 LEU HA H 66 3.556 3.556 3.626 -0.070 18496 7373 1 19 . 1 1 66 66 LEU C C 66 179.729 179.729 178.802 0.927 18496 7374 1 19 . 1 1 66 66 LEU CA C 66 58.069 58.069 58.048 0.021 18496 7375 1 19 . 1 1 66 66 LEU CB C 66 41.625 41.625 40.960 0.665 18496 7376 1 19 . 1 1 66 66 LEU H H 66 8.083 8.083 8.019 0.064 18496 7377 1 19 . 1 1 67 67 LYS N N 67 119.120 119.120 119.992 -0.872 18496 7378 1 19 . 1 1 67 67 LYS HA H 67 3.965 3.965 3.801 0.164 18496 7379 1 19 . 1 1 67 67 LYS C C 67 179.379 179.379 179.052 0.327 18496 7380 1 19 . 1 1 67 67 LYS CA C 67 59.227 59.227 59.815 -0.587 18496 7381 1 19 . 1 1 67 67 LYS CB C 67 32.737 32.737 32.200 0.537 18496 7382 1 19 . 1 1 67 67 LYS H H 67 7.861 7.861 7.855 0.006 18496 7383 1 19 . 1 1 68 68 GLU N N 68 116.924 116.924 118.624 -1.700 18496 7384 1 19 . 1 1 68 68 GLU HA H 68 4.409 4.409 4.099 0.310 18496 7385 1 19 . 1 1 68 68 GLU CA C 68 57.712 57.712 58.530 -0.818 18496 7386 1 19 . 1 1 68 68 GLU CB C 68 29.586 29.586 29.529 0.057 18496 7387 1 19 . 1 1 68 68 GLU H H 68 8.319 8.319 7.815 0.504 18496 7388 1 19 . 1 1 69 69 LEU N N 69 120.032 120.032 120.066 -0.034 18496 7389 1 19 . 1 1 69 69 LEU HA H 69 4.107 4.107 3.949 0.158 18496 7390 1 19 . 1 1 69 69 LEU CA C 69 57.563 57.563 57.523 0.040 18496 7391 1 19 . 1 1 69 69 LEU CB C 69 41.373 41.373 41.531 -0.158 18496 7392 1 19 . 1 1 69 69 LEU H H 69 8.233 8.233 8.628 -0.395 18496 7393 1 19 . 1 1 70 70 GLY N N 70 105.472 105.472 105.377 0.095 18496 7394 1 19 . 1 1 70 70 GLY C C 70 174.986 174.986 176.050 -1.064 18496 7395 1 19 . 1 1 70 70 GLY CA C 70 46.704 46.704 46.730 -0.027 18496 7396 1 19 . 1 1 70 70 GLY H H 70 7.960 7.960 8.571 -0.611 18496 7397 1 19 . 1 1 71 71 ASN N N 71 118.596 118.596 119.725 -1.129 18496 7398 1 19 . 1 1 71 71 ASN HA H 71 4.681 4.681 4.753 -0.072 18496 7399 1 19 . 1 1 71 71 ASN C C 71 176.412 176.412 177.794 -1.382 18496 7400 1 19 . 1 1 71 71 ASN CA C 71 54.407 54.407 55.318 -0.911 18496 7401 1 19 . 1 1 71 71 ASN CB C 71 38.729 38.729 38.561 0.168 18496 7402 1 19 . 1 1 71 71 ASN H H 71 7.857 7.857 7.706 0.151 18496 7403 1 19 . 1 1 72 72 LYS N N 72 119.973 119.973 120.463 -0.490 18496 7404 1 19 . 1 1 72 72 LYS HA H 72 4.282 4.282 4.125 0.157 18496 7405 1 19 . 1 1 72 72 LYS CA C 72 57.338 57.338 58.246 -0.908 18496 7406 1 19 . 1 1 72 72 LYS CB C 72 32.755 32.755 32.116 0.639 18496 7407 1 19 . 1 1 72 72 LYS H H 72 8.100 8.100 7.916 0.184 18496 7408 1 19 . 1 1 73 73 LEU HA H 73 4.281 4.281 4.337 -0.056 18496 7409 1 19 . 1 1 73 73 LEU CA C 73 55.774 55.774 54.629 1.145 18496 7410 1 19 . 1 1 73 73 LEU CB C 73 41.983 41.983 42.044 -0.060 18496 7411 1 20 . 1 1 2 2 ALA HA H 2 4.074 4.074 4.595 -0.521 18496 7412 1 20 . 1 1 2 2 ALA CA C 2 51.966 51.966 51.593 0.374 18496 7413 1 20 . 1 1 2 2 ALA CB C 2 19.732 19.732 20.251 -0.519 18496 7414 1 20 . 1 1 3 3 ASP HA H 3 4.632 4.632 4.435 0.197 18496 7415 1 20 . 1 1 3 3 ASP C C 3 175.822 175.822 176.175 -0.353 18496 7416 1 20 . 1 1 3 3 ASP CA C 3 54.440 54.440 55.560 -1.120 18496 7417 1 20 . 1 1 3 3 ASP CB C 3 41.577 41.577 41.362 0.215 18496 7418 1 20 . 1 1 4 4 LYS N N 4 121.655 121.655 119.285 2.370 18496 7419 1 20 . 1 1 4 4 LYS HA H 4 4.379 4.379 4.524 -0.145 18496 7420 1 20 . 1 1 4 4 LYS C C 4 176.011 176.011 175.302 0.709 18496 7421 1 20 . 1 1 4 4 LYS CA C 4 56.213 56.213 55.138 1.075 18496 7422 1 20 . 1 1 4 4 LYS CB C 4 33.407 33.407 31.999 1.408 18496 7423 1 20 . 1 1 4 4 LYS H H 4 8.394 8.394 7.950 0.444 18496 7424 1 20 . 1 1 5 5 LEU N N 5 125.369 125.369 124.958 0.411 18496 7425 1 20 . 1 1 5 5 LEU HA H 5 4.351 4.351 4.375 -0.024 18496 7426 1 20 . 1 1 5 5 LEU C C 5 175.682 175.682 176.606 -0.924 18496 7427 1 20 . 1 1 5 5 LEU CA C 5 55.117 55.117 54.621 0.496 18496 7428 1 20 . 1 1 5 5 LEU CB C 5 43.197 43.197 42.931 0.266 18496 7429 1 20 . 1 1 5 5 LEU H H 5 8.136 8.136 8.244 -0.108 18496 7430 1 20 . 1 1 6 6 LYS N N 6 126.844 126.844 126.442 0.402 18496 7431 1 20 . 1 1 6 6 LYS HA H 6 4.451 4.451 4.448 0.003 18496 7432 1 20 . 1 1 6 6 LYS C C 6 174.665 174.665 175.381 -0.716 18496 7433 1 20 . 1 1 6 6 LYS CA C 6 55.974 55.974 56.367 -0.393 18496 7434 1 20 . 1 1 6 6 LYS CB C 6 34.386 34.386 33.203 1.183 18496 7435 1 20 . 1 1 6 6 LYS H H 6 8.615 8.615 8.588 0.027 18496 7436 1 20 . 1 1 7 7 PHE N N 7 119.818 119.818 119.220 0.598 18496 7437 1 20 . 1 1 7 7 PHE HA H 7 5.343 5.343 5.450 -0.107 18496 7438 1 20 . 1 1 7 7 PHE C C 7 173.569 173.569 173.564 0.005 18496 7439 1 20 . 1 1 7 7 PHE CA C 7 55.813 55.813 55.653 0.160 18496 7440 1 20 . 1 1 7 7 PHE CB C 7 42.975 42.975 42.459 0.516 18496 7441 1 20 . 1 1 7 7 PHE H H 7 7.734 7.734 8.180 -0.446 18496 7442 1 20 . 1 1 8 8 GLU N N 8 119.165 119.165 119.519 -0.354 18496 7443 1 20 . 1 1 8 8 GLU HA H 8 4.158 4.158 4.212 -0.054 18496 7444 1 20 . 1 1 8 8 GLU C C 8 175.026 175.026 174.270 0.756 18496 7445 1 20 . 1 1 8 8 GLU CA C 8 55.221 55.221 54.136 1.085 18496 7446 1 20 . 1 1 8 8 GLU CB C 8 33.699 33.699 33.084 0.615 18496 7447 1 20 . 1 1 8 8 GLU H H 8 8.295 8.295 8.612 -0.317 18496 7448 1 20 . 1 1 9 9 ILE N N 9 127.619 127.619 127.070 0.549 18496 7449 1 20 . 1 1 9 9 ILE HA H 9 3.768 3.768 4.180 -0.412 18496 7450 1 20 . 1 1 9 9 ILE C C 9 174.902 174.902 175.534 -0.632 18496 7451 1 20 . 1 1 9 9 ILE CA C 9 62.505 62.505 61.722 0.783 18496 7452 1 20 . 1 1 9 9 ILE CB C 9 36.094 36.094 37.521 -1.427 18496 7453 1 20 . 1 1 9 9 ILE H H 9 9.157 9.157 8.562 0.595 18496 7454 1 20 . 1 1 10 10 ILE N N 10 131.245 131.245 127.875 3.370 18496 7455 1 20 . 1 1 10 10 ILE HA H 10 3.861 3.861 4.020 -0.159 18496 7456 1 20 . 1 1 10 10 ILE C C 10 176.247 176.247 176.436 -0.189 18496 7457 1 20 . 1 1 10 10 ILE CA C 10 60.554 60.554 62.115 -1.561 18496 7458 1 20 . 1 1 10 10 ILE CB C 10 37.406 37.406 38.231 -0.825 18496 7459 1 20 . 1 1 10 10 ILE H H 10 8.428 8.428 8.538 -0.110 18496 7460 1 20 . 1 1 11 11 GLU N N 11 117.669 117.669 119.231 -1.562 18496 7461 1 20 . 1 1 11 11 GLU HA H 11 4.315 4.315 4.491 -0.176 18496 7462 1 20 . 1 1 11 11 GLU C C 11 174.155 174.155 174.546 -0.391 18496 7463 1 20 . 1 1 11 11 GLU CA C 11 55.755 55.755 55.447 0.308 18496 7464 1 20 . 1 1 11 11 GLU CB C 11 34.386 34.386 32.306 2.080 18496 7465 1 20 . 1 1 11 11 GLU H H 11 7.551 7.551 8.200 -0.649 18496 7466 1 20 . 1 1 12 12 GLU N N 12 128.587 128.587 126.882 1.705 18496 7467 1 20 . 1 1 12 12 GLU HA H 12 5.214 5.214 4.448 0.766 18496 7468 1 20 . 1 1 12 12 GLU C C 12 176.877 176.877 176.282 0.595 18496 7469 1 20 . 1 1 12 12 GLU CA C 12 54.801 54.801 57.601 -2.800 18496 7470 1 20 . 1 1 12 12 GLU CB C 12 30.137 30.137 29.875 0.262 18496 7471 1 20 . 1 1 12 12 GLU H H 12 8.762 8.762 8.957 -0.195 18496 7472 1 20 . 1 1 13 13 LEU N N 13 122.508 122.508 122.220 0.288 18496 7473 1 20 . 1 1 13 13 LEU HA H 13 4.872 4.872 4.735 0.137 18496 7474 1 20 . 1 1 13 13 LEU C C 13 176.060 176.060 177.396 -1.336 18496 7475 1 20 . 1 1 13 13 LEU CA C 13 57.372 57.372 55.366 2.006 18496 7476 1 20 . 1 1 13 13 LEU CB C 13 42.284 42.284 43.619 -1.335 18496 7477 1 20 . 1 1 13 13 LEU H H 13 8.058 8.058 8.661 -0.603 18496 7478 1 20 . 1 1 14 14 ILE N N 14 115.422 115.422 118.425 -3.003 18496 7479 1 20 . 1 1 14 14 ILE HA H 14 4.553 4.553 4.480 0.073 18496 7480 1 20 . 1 1 14 14 ILE C C 14 174.893 174.893 174.062 0.831 18496 7481 1 20 . 1 1 14 14 ILE CA C 14 60.586 60.586 59.572 1.014 18496 7482 1 20 . 1 1 14 14 ILE CB C 14 44.329 44.329 41.078 3.251 18496 7483 1 20 . 1 1 14 14 ILE H H 14 8.450 8.450 8.468 -0.018 18496 7484 1 20 . 1 1 15 15 VAL N N 15 129.108 129.108 125.971 3.137 18496 7485 1 20 . 1 1 15 15 VAL HA H 15 4.196 4.196 4.352 -0.156 18496 7486 1 20 . 1 1 15 15 VAL C C 15 175.180 175.180 174.956 0.224 18496 7487 1 20 . 1 1 15 15 VAL CA C 15 63.288 63.288 61.442 1.846 18496 7488 1 20 . 1 1 15 15 VAL CB C 15 32.117 32.117 33.089 -0.972 18496 7489 1 20 . 1 1 15 15 VAL H H 15 8.867 8.867 8.519 0.348 18496 7490 1 20 . 1 1 16 16 LEU N N 16 127.846 127.846 129.533 -1.687 18496 7491 1 20 . 1 1 16 16 LEU HA H 16 4.317 4.317 4.627 -0.310 18496 7492 1 20 . 1 1 16 16 LEU C C 16 176.070 176.070 177.247 -1.177 18496 7493 1 20 . 1 1 16 16 LEU CA C 16 57.252 57.252 56.401 0.851 18496 7494 1 20 . 1 1 16 16 LEU CB C 16 42.035 42.035 42.626 -0.591 18496 7495 1 20 . 1 1 16 16 LEU H H 16 9.555 9.555 8.897 0.658 18496 7496 1 20 . 1 1 17 17 SER N N 17 107.073 107.073 109.910 -2.837 18496 7497 1 20 . 1 1 17 17 SER HA H 17 4.540 4.540 4.573 -0.033 18496 7498 1 20 . 1 1 17 17 SER C C 17 172.277 172.277 172.358 -0.081 18496 7499 1 20 . 1 1 17 17 SER CA C 17 57.882 57.882 57.999 -0.117 18496 7500 1 20 . 1 1 17 17 SER CB C 17 64.046 64.046 65.036 -0.990 18496 7501 1 20 . 1 1 17 17 SER H H 17 7.699 7.699 7.657 0.042 18496 7502 1 20 . 1 1 18 18 GLU N N 18 119.235 119.235 119.878 -0.643 18496 7503 1 20 . 1 1 18 18 GLU HA H 18 5.143 5.143 4.893 0.250 18496 7504 1 20 . 1 1 18 18 GLU C C 18 175.469 175.469 176.443 -0.974 18496 7505 1 20 . 1 1 18 18 GLU CA C 18 55.248 55.248 55.467 -0.219 18496 7506 1 20 . 1 1 18 18 GLU CB C 18 33.454 33.454 30.854 2.600 18496 7507 1 20 . 1 1 18 18 GLU H H 18 8.437 8.437 8.510 -0.073 18496 7508 1 20 . 1 1 19 19 ASN N N 19 123.988 123.988 118.609 5.379 18496 7509 1 20 . 1 1 19 19 ASN HA H 19 5.097 5.097 4.911 0.186 18496 7510 1 20 . 1 1 19 19 ASN CA C 19 50.916 50.916 52.450 -1.534 18496 7511 1 20 . 1 1 19 19 ASN CB C 19 39.482 39.482 39.987 -0.505 18496 7512 1 20 . 1 1 19 19 ASN H H 19 8.779 8.779 8.128 0.651 18496 7513 1 20 . 1 1 20 20 ALA N N 20 120.854 120.854 123.484 -2.630 18496 7514 1 20 . 1 1 20 20 ALA HA H 20 4.239 4.239 4.171 0.068 18496 7515 1 20 . 1 1 20 20 ALA C C 20 179.032 179.032 177.672 1.360 18496 7516 1 20 . 1 1 20 20 ALA CA C 20 54.924 54.924 54.478 0.446 18496 7517 1 20 . 1 1 20 20 ALA CB C 20 18.621 18.621 18.483 0.138 18496 7518 1 20 . 1 1 20 20 ALA H H 20 8.616 8.616 8.479 0.137 18496 7519 1 20 . 1 1 21 21 LYS N N 21 115.771 115.771 116.646 -0.875 18496 7520 1 20 . 1 1 21 21 LYS HA H 21 4.497 4.497 4.262 0.235 18496 7521 1 20 . 1 1 21 21 LYS C C 21 176.615 176.615 176.550 0.065 18496 7522 1 20 . 1 1 21 21 LYS CA C 21 55.503 55.503 55.461 0.042 18496 7523 1 20 . 1 1 21 21 LYS CB C 21 32.742 32.742 32.062 0.680 18496 7524 1 20 . 1 1 21 21 LYS H H 21 7.767 7.767 7.754 0.013 18496 7525 1 20 . 1 1 22 22 GLY N N 22 107.695 107.695 106.588 1.107 18496 7526 1 20 . 1 1 22 22 GLY C C 22 174.843 174.843 173.881 0.962 18496 7527 1 20 . 1 1 22 22 GLY CA C 22 45.297 45.297 45.260 0.038 18496 7528 1 20 . 1 1 22 22 GLY H H 22 8.317 8.317 7.891 0.426 18496 7529 1 20 . 1 1 23 23 TRP N N 23 121.316 121.316 121.252 0.064 18496 7530 1 20 . 1 1 23 23 TRP HA H 23 4.815 4.815 4.757 0.058 18496 7531 1 20 . 1 1 23 23 TRP C C 23 176.754 176.754 176.535 0.219 18496 7532 1 20 . 1 1 23 23 TRP CA C 23 58.291 58.291 55.334 2.957 18496 7533 1 20 . 1 1 23 23 TRP CB C 23 28.127 28.127 27.844 0.283 18496 7534 1 20 . 1 1 23 23 TRP H H 23 7.983 7.983 8.002 -0.019 18496 7535 1 20 . 1 1 24 24 ARG N N 24 120.789 120.789 127.192 -6.403 18496 7536 1 20 . 1 1 24 24 ARG HA H 24 5.496 5.496 4.599 0.897 18496 7537 1 20 . 1 1 24 24 ARG C C 24 175.831 175.831 175.699 0.132 18496 7538 1 20 . 1 1 24 24 ARG CA C 24 54.755 54.755 54.761 -0.006 18496 7539 1 20 . 1 1 24 24 ARG CB C 24 33.735 33.735 29.775 3.960 18496 7540 1 20 . 1 1 24 24 ARG H H 24 9.046 9.046 9.318 -0.272 18496 7541 1 20 . 1 1 25 25 LYS N N 25 126.507 126.507 128.960 -2.453 18496 7542 1 20 . 1 1 25 25 LYS HA H 25 5.081 5.081 4.383 0.698 18496 7543 1 20 . 1 1 25 25 LYS C C 25 175.648 175.648 175.465 0.183 18496 7544 1 20 . 1 1 25 25 LYS CA C 25 56.071 56.071 56.894 -0.823 18496 7545 1 20 . 1 1 25 25 LYS CB C 25 32.214 32.214 32.250 -0.036 18496 7546 1 20 . 1 1 25 25 LYS H H 25 8.526 8.526 8.751 -0.225 18496 7547 1 20 . 1 1 26 26 GLU N N 26 126.009 126.009 123.548 2.461 18496 7548 1 20 . 1 1 26 26 GLU HA H 26 5.275 5.275 4.987 0.288 18496 7549 1 20 . 1 1 26 26 GLU C C 26 174.894 174.894 173.797 1.097 18496 7550 1 20 . 1 1 26 26 GLU CA C 26 55.271 55.271 54.868 0.403 18496 7551 1 20 . 1 1 26 26 GLU CB C 26 33.781 33.781 34.705 -0.923 18496 7552 1 20 . 1 1 26 26 GLU H H 26 9.125 9.125 8.568 0.557 18496 7553 1 20 . 1 1 27 27 LEU N N 27 121.930 121.930 124.122 -2.192 18496 7554 1 20 . 1 1 27 27 LEU HA H 27 5.788 5.788 5.001 0.787 18496 7555 1 20 . 1 1 27 27 LEU C C 27 173.941 173.941 174.297 -0.356 18496 7556 1 20 . 1 1 27 27 LEU CA C 27 53.859 53.859 53.888 -0.029 18496 7557 1 20 . 1 1 27 27 LEU CB C 27 44.020 44.020 44.376 -0.356 18496 7558 1 20 . 1 1 27 27 LEU H H 27 8.938 8.938 9.138 -0.200 18496 7559 1 20 . 1 1 28 28 ASN N N 28 124.630 124.630 124.934 -0.304 18496 7560 1 20 . 1 1 28 28 ASN HA H 28 5.411 5.411 5.281 0.130 18496 7561 1 20 . 1 1 28 28 ASN C C 28 174.366 174.366 173.281 1.085 18496 7562 1 20 . 1 1 28 28 ASN CA C 28 52.063 52.063 52.318 -0.255 18496 7563 1 20 . 1 1 28 28 ASN CB C 28 44.430 44.430 43.531 0.899 18496 7564 1 20 . 1 1 28 28 ASN H H 28 9.345 9.345 8.446 0.899 18496 7565 1 20 . 1 1 29 29 ARG N N 29 118.443 118.443 122.820 -4.377 18496 7566 1 20 . 1 1 29 29 ARG HA H 29 5.058 5.058 4.862 0.196 18496 7567 1 20 . 1 1 29 29 ARG C C 29 175.779 175.779 174.809 0.970 18496 7568 1 20 . 1 1 29 29 ARG CA C 29 56.091 56.091 55.592 0.499 18496 7569 1 20 . 1 1 29 29 ARG CB C 29 31.710 31.710 31.140 0.570 18496 7570 1 20 . 1 1 29 29 ARG H H 29 9.109 9.109 9.092 0.017 18496 7571 1 20 . 1 1 30 30 VAL N N 30 124.605 124.605 121.630 2.975 18496 7572 1 20 . 1 1 30 30 VAL HA H 30 4.535 4.535 5.401 -0.866 18496 7573 1 20 . 1 1 30 30 VAL C C 30 174.775 174.775 174.415 0.360 18496 7574 1 20 . 1 1 30 30 VAL CA C 30 60.921 60.921 58.795 2.126 18496 7575 1 20 . 1 1 30 30 VAL CB C 30 37.790 37.790 36.197 1.593 18496 7576 1 20 . 1 1 30 30 VAL H H 30 9.054 9.054 8.685 0.369 18496 7577 1 20 . 1 1 31 31 SER N N 31 120.794 120.794 115.254 5.540 18496 7578 1 20 . 1 1 31 31 SER HA H 31 4.652 4.652 5.174 -0.522 18496 7579 1 20 . 1 1 31 31 SER C C 31 174.214 174.214 175.441 -1.227 18496 7580 1 20 . 1 1 31 31 SER CA C 31 56.279 56.279 56.934 -0.655 18496 7581 1 20 . 1 1 31 31 SER CB C 31 64.128 64.128 64.240 -0.113 18496 7582 1 20 . 1 1 31 31 SER H H 31 8.667 8.667 8.907 -0.240 18496 7583 1 20 . 1 1 32 32 TRP N N 32 132.303 132.303 127.651 4.652 18496 7584 1 20 . 1 1 32 32 TRP HA H 32 5.105 5.105 4.526 0.579 18496 7585 1 20 . 1 1 32 32 TRP C C 32 177.276 177.276 177.197 0.079 18496 7586 1 20 . 1 1 32 32 TRP CA C 32 56.198 56.198 57.774 -1.576 18496 7587 1 20 . 1 1 32 32 TRP CB C 32 29.968 29.968 28.072 1.896 18496 7588 1 20 . 1 1 32 32 TRP H H 32 9.282 9.282 9.183 0.099 18496 7589 1 20 . 1 1 33 33 ASN N N 33 124.979 124.979 123.432 1.547 18496 7590 1 20 . 1 1 33 33 ASN HA H 33 4.257 4.257 4.358 -0.101 18496 7591 1 20 . 1 1 33 33 ASN C C 33 174.030 174.030 174.751 -0.721 18496 7592 1 20 . 1 1 33 33 ASN CA C 33 54.709 54.709 54.756 -0.047 18496 7593 1 20 . 1 1 33 33 ASN CB C 33 37.921 37.921 36.997 0.924 18496 7594 1 20 . 1 1 33 33 ASN H H 33 9.813 9.813 8.851 0.962 18496 7595 1 20 . 1 1 34 34 ASP N N 34 111.880 111.880 113.391 -1.511 18496 7596 1 20 . 1 1 34 34 ASP HA H 34 4.126 4.126 4.223 -0.097 18496 7597 1 20 . 1 1 34 34 ASP CA C 34 56.130 56.130 55.418 0.712 18496 7598 1 20 . 1 1 34 34 ASP CB C 34 39.760 39.760 40.364 -0.604 18496 7599 1 20 . 1 1 34 34 ASP H H 34 9.251 9.251 8.211 1.040 18496 7600 1 20 . 1 1 35 35 ALA N N 35 121.811 121.811 121.207 0.604 18496 7601 1 20 . 1 1 35 35 ALA HA H 35 4.477 4.477 4.495 -0.018 18496 7602 1 20 . 1 1 35 35 ALA C C 35 177.778 177.778 176.949 0.829 18496 7603 1 20 . 1 1 35 35 ALA CA C 35 51.528 51.528 52.591 -1.063 18496 7604 1 20 . 1 1 35 35 ALA CB C 35 20.445 20.445 20.427 0.018 18496 7605 1 20 . 1 1 35 35 ALA H H 35 7.625 7.625 7.777 -0.152 18496 7606 1 20 . 1 1 36 36 GLU N N 36 121.068 121.068 121.949 -0.881 18496 7607 1 20 . 1 1 36 36 GLU HA H 36 4.390 4.390 4.694 -0.304 18496 7608 1 20 . 1 1 36 36 GLU CA C 36 55.276 55.276 52.342 2.934 18496 7609 1 20 . 1 1 36 36 GLU CB C 36 28.575 28.575 30.970 -2.395 18496 7610 1 20 . 1 1 36 36 GLU H H 36 8.658 8.658 8.218 0.440 18496 7611 1 20 . 1 1 37 37 PRO HA H 37 4.289 4.289 4.721 -0.432 18496 7612 1 20 . 1 1 37 37 PRO C C 37 175.799 175.799 175.986 -0.187 18496 7613 1 20 . 1 1 37 37 PRO CA C 37 63.105 63.105 62.035 1.070 18496 7614 1 20 . 1 1 37 37 PRO CB C 37 32.076 32.076 31.810 0.266 18496 7615 1 20 . 1 1 38 38 LYS N N 38 120.881 120.881 123.468 -2.587 18496 7616 1 20 . 1 1 38 38 LYS HA H 38 4.700 4.700 4.306 0.394 18496 7617 1 20 . 1 1 38 38 LYS C C 38 176.906 176.906 174.778 2.128 18496 7618 1 20 . 1 1 38 38 LYS CA C 38 54.399 54.399 54.768 -0.369 18496 7619 1 20 . 1 1 38 38 LYS CB C 38 37.217 37.217 36.460 0.757 18496 7620 1 20 . 1 1 38 38 LYS H H 38 8.316 8.316 8.814 -0.498 18496 7621 1 20 . 1 1 39 39 TYR N N 39 119.792 119.792 118.961 0.831 18496 7622 1 20 . 1 1 39 39 TYR HA H 39 4.636 4.636 4.559 0.077 18496 7623 1 20 . 1 1 39 39 TYR C C 39 175.834 175.834 175.299 0.535 18496 7624 1 20 . 1 1 39 39 TYR CA C 39 60.228 60.228 57.720 2.508 18496 7625 1 20 . 1 1 39 39 TYR CB C 39 38.683 38.683 39.090 -0.407 18496 7626 1 20 . 1 1 39 39 TYR H H 39 8.508 8.508 7.742 0.766 18496 7627 1 20 . 1 1 40 40 ASP N N 40 126.502 126.502 122.121 4.381 18496 7628 1 20 . 1 1 40 40 ASP HA H 40 5.597 5.597 5.268 0.329 18496 7629 1 20 . 1 1 40 40 ASP C C 40 175.283 175.283 173.953 1.330 18496 7630 1 20 . 1 1 40 40 ASP CA C 40 55.053 55.053 53.928 1.125 18496 7631 1 20 . 1 1 40 40 ASP CB C 40 48.656 48.656 45.452 3.204 18496 7632 1 20 . 1 1 40 40 ASP H H 40 9.219 9.219 8.665 0.554 18496 7633 1 20 . 1 1 41 41 ILE N N 41 125.910 125.910 124.420 1.490 18496 7634 1 20 . 1 1 41 41 ILE HA H 41 5.722 5.722 4.961 0.761 18496 7635 1 20 . 1 1 41 41 ILE C C 41 174.167 174.167 173.418 0.749 18496 7636 1 20 . 1 1 41 41 ILE CA C 41 60.734 60.734 59.578 1.156 18496 7637 1 20 . 1 1 41 41 ILE CB C 41 40.198 40.198 40.101 0.097 18496 7638 1 20 . 1 1 41 41 ILE H H 41 8.972 8.972 8.848 0.124 18496 7639 1 20 . 1 1 42 42 ARG N N 42 120.300 120.300 126.791 -6.491 18496 7640 1 20 . 1 1 42 42 ARG HA H 42 4.716 4.716 4.601 0.115 18496 7641 1 20 . 1 1 42 42 ARG CA C 42 54.826 54.826 54.865 -0.039 18496 7642 1 20 . 1 1 42 42 ARG CB C 42 32.665 32.665 35.294 -2.629 18496 7643 1 20 . 1 1 42 42 ARG H H 42 8.320 8.320 8.595 -0.275 18496 7644 1 20 . 1 1 43 43 THR HA H 43 5.585 5.585 4.889 0.696 18496 7645 1 20 . 1 1 43 43 THR C C 43 173.294 173.294 172.734 0.560 18496 7646 1 20 . 1 1 43 43 THR CA C 43 60.847 60.847 59.596 1.251 18496 7647 1 20 . 1 1 43 43 THR CB C 43 69.961 69.961 70.372 -0.411 18496 7648 1 20 . 1 1 44 44 TRP N N 44 122.747 122.747 123.290 -0.543 18496 7649 1 20 . 1 1 44 44 TRP HA H 44 4.945 4.945 4.934 0.011 18496 7650 1 20 . 1 1 44 44 TRP C C 44 175.056 175.056 176.275 -1.219 18496 7651 1 20 . 1 1 44 44 TRP CA C 44 56.107 56.107 54.950 1.157 18496 7652 1 20 . 1 1 44 44 TRP CB C 44 34.506 34.506 31.572 2.934 18496 7653 1 20 . 1 1 44 44 TRP H H 44 9.180 9.180 7.995 1.185 18496 7654 1 20 . 1 1 45 45 SER N N 45 117.385 117.385 116.650 0.735 18496 7655 1 20 . 1 1 45 45 SER HA H 45 2.300 2.300 4.707 -2.407 18496 7656 1 20 . 1 1 45 45 SER CA C 45 56.481 56.481 58.840 -2.359 18496 7657 1 20 . 1 1 45 45 SER CB C 45 60.743 60.743 62.566 -1.823 18496 7658 1 20 . 1 1 45 45 SER H H 45 7.879 7.879 8.396 -0.517 18496 7659 1 20 . 1 1 46 46 PRO HA H 46 4.104 4.104 4.540 -0.436 18496 7660 1 20 . 1 1 46 46 PRO CA C 46 64.990 64.990 65.191 -0.201 18496 7661 1 20 . 1 1 46 46 PRO CB C 46 31.272 31.272 32.070 -0.798 18496 7662 1 20 . 1 1 47 47 ASP HA H 47 4.520 4.520 4.639 -0.119 18496 7663 1 20 . 1 1 47 47 ASP C C 47 175.629 175.629 176.281 -0.652 18496 7664 1 20 . 1 1 47 47 ASP CA C 47 53.453 53.453 53.234 0.219 18496 7665 1 20 . 1 1 47 47 ASP CB C 47 40.239 40.239 41.087 -0.848 18496 7666 1 20 . 1 1 48 48 HIS N N 48 111.320 111.320 115.582 -4.262 18496 7667 1 20 . 1 1 48 48 HIS HA H 48 3.916 3.916 4.428 -0.512 18496 7668 1 20 . 1 1 48 48 HIS CA C 48 60.347 60.347 56.992 3.355 18496 7669 1 20 . 1 1 48 48 HIS CB C 48 25.499 25.499 28.180 -2.681 18496 7670 1 20 . 1 1 48 48 HIS H H 48 8.269 8.269 8.132 0.137 18496 7671 1 20 . 1 1 49 49 GLU N N 49 114.659 114.659 117.956 -3.297 18496 7672 1 20 . 1 1 49 49 GLU HA H 49 4.447 4.447 4.228 0.219 18496 7673 1 20 . 1 1 49 49 GLU C C 49 176.394 176.394 176.153 0.241 18496 7674 1 20 . 1 1 49 49 GLU CA C 49 57.940 57.940 57.592 0.348 18496 7675 1 20 . 1 1 49 49 GLU CB C 49 30.641 30.641 30.480 0.161 18496 7676 1 20 . 1 1 49 49 GLU H H 49 7.381 7.381 8.488 -1.107 18496 7677 1 20 . 1 1 50 50 LYS N N 50 118.126 118.126 117.863 0.263 18496 7678 1 20 . 1 1 50 50 LYS HA H 50 4.665 4.665 4.489 0.176 18496 7679 1 20 . 1 1 50 50 LYS CA C 50 54.431 54.431 54.989 -0.558 18496 7680 1 20 . 1 1 50 50 LYS CB C 50 36.543 36.543 35.507 1.036 18496 7681 1 20 . 1 1 50 50 LYS H H 50 8.067 8.067 7.619 0.448 18496 7682 1 20 . 1 1 51 51 MET HA H 51 4.936 4.936 5.318 -0.382 18496 7683 1 20 . 1 1 51 51 MET CA C 51 54.048 54.048 53.477 0.571 18496 7684 1 20 . 1 1 51 51 MET CB C 51 33.768 33.768 35.579 -1.811 18496 7685 1 20 . 1 1 52 52 GLY C C 52 173.534 173.534 172.761 0.773 18496 7686 1 20 . 1 1 52 52 GLY CA C 52 43.060 43.060 44.334 -1.274 18496 7687 1 20 . 1 1 53 53 LYS N N 53 118.012 118.012 121.009 -2.997 18496 7688 1 20 . 1 1 53 53 LYS HA H 53 4.155 4.155 4.647 -0.492 18496 7689 1 20 . 1 1 53 53 LYS C C 53 176.818 176.818 176.358 0.460 18496 7690 1 20 . 1 1 53 53 LYS CA C 53 56.478 56.478 55.802 0.676 18496 7691 1 20 . 1 1 53 53 LYS CB C 53 33.117 33.117 33.737 -0.620 18496 7692 1 20 . 1 1 53 53 LYS H H 53 8.132 8.132 8.344 -0.212 18496 7693 1 20 . 1 1 54 54 GLY N N 54 109.836 109.836 109.257 0.579 18496 7694 1 20 . 1 1 54 54 GLY C C 54 170.848 170.848 172.827 -1.979 18496 7695 1 20 . 1 1 54 54 GLY CA C 54 46.701 46.701 44.813 1.888 18496 7696 1 20 . 1 1 54 54 GLY H H 54 8.079 8.079 8.290 -0.211 18496 7697 1 20 . 1 1 55 55 ILE N N 55 119.382 119.382 121.746 -2.364 18496 7698 1 20 . 1 1 55 55 ILE HA H 55 4.956 4.956 4.609 0.347 18496 7699 1 20 . 1 1 55 55 ILE C C 55 171.737 171.737 173.776 -2.039 18496 7700 1 20 . 1 1 55 55 ILE CA C 55 57.059 57.059 60.471 -3.412 18496 7701 1 20 . 1 1 55 55 ILE CB C 55 44.241 44.241 41.516 2.725 18496 7702 1 20 . 1 1 55 55 ILE H H 55 8.661 8.661 8.386 0.275 18496 7703 1 20 . 1 1 56 56 THR N N 56 113.795 113.795 122.861 -9.066 18496 7704 1 20 . 1 1 56 56 THR HA H 56 5.607 5.607 4.775 0.832 18496 7705 1 20 . 1 1 56 56 THR C C 56 174.417 174.417 173.669 0.748 18496 7706 1 20 . 1 1 56 56 THR CA C 56 59.098 59.098 61.842 -2.744 18496 7707 1 20 . 1 1 56 56 THR CB C 56 72.153 72.153 69.998 2.155 18496 7708 1 20 . 1 1 56 56 THR H H 56 7.916 7.916 8.458 -0.542 18496 7709 1 20 . 1 1 57 57 LEU N N 57 121.044 121.044 128.212 -7.168 18496 7710 1 20 . 1 1 57 57 LEU HA H 57 5.311 5.311 4.677 0.634 18496 7711 1 20 . 1 1 57 57 LEU C C 57 176.150 176.150 175.607 0.543 18496 7712 1 20 . 1 1 57 57 LEU CA C 57 53.264 53.264 53.876 -0.612 18496 7713 1 20 . 1 1 57 57 LEU CB C 57 45.901 45.901 43.795 2.106 18496 7714 1 20 . 1 1 57 57 LEU H H 57 9.421 9.421 9.092 0.329 18496 7715 1 20 . 1 1 58 58 SER N N 58 119.548 119.548 119.334 0.214 18496 7716 1 20 . 1 1 58 58 SER HA H 58 4.734 4.734 4.505 0.229 18496 7717 1 20 . 1 1 58 58 SER C C 58 174.786 174.786 175.677 -0.891 18496 7718 1 20 . 1 1 58 58 SER CA C 58 56.948 56.948 57.806 -0.858 18496 7719 1 20 . 1 1 58 58 SER CB C 58 65.726 65.726 64.128 1.598 18496 7720 1 20 . 1 1 58 58 SER H H 58 9.771 9.771 9.279 0.492 18496 7721 1 20 . 1 1 59 59 GLU N N 59 120.827 120.827 123.053 -2.226 18496 7722 1 20 . 1 1 59 59 GLU HA H 59 4.319 4.319 4.213 0.106 18496 7723 1 20 . 1 1 59 59 GLU C C 59 179.806 179.806 178.903 0.903 18496 7724 1 20 . 1 1 59 59 GLU CA C 59 60.913 60.913 60.688 0.225 18496 7725 1 20 . 1 1 59 59 GLU CB C 59 29.538 29.538 29.381 0.157 18496 7726 1 20 . 1 1 59 59 GLU H H 59 9.394 9.394 9.024 0.370 18496 7727 1 20 . 1 1 60 60 GLU N N 60 119.587 119.587 119.584 0.003 18496 7728 1 20 . 1 1 60 60 GLU HA H 60 4.188 4.188 4.090 0.098 18496 7729 1 20 . 1 1 60 60 GLU C C 60 179.686 179.686 178.827 0.859 18496 7730 1 20 . 1 1 60 60 GLU CA C 60 60.279 60.279 59.538 0.741 18496 7731 1 20 . 1 1 60 60 GLU CB C 60 29.559 29.559 28.770 0.789 18496 7732 1 20 . 1 1 60 60 GLU H H 60 8.905 8.905 8.892 0.013 18496 7733 1 20 . 1 1 61 61 GLU N N 61 120.145 120.145 119.930 0.215 18496 7734 1 20 . 1 1 61 61 GLU HA H 61 4.037 4.037 4.117 -0.080 18496 7735 1 20 . 1 1 61 61 GLU C C 61 178.530 178.530 178.782 -0.252 18496 7736 1 20 . 1 1 61 61 GLU CA C 61 59.118 59.118 58.812 0.306 18496 7737 1 20 . 1 1 61 61 GLU CB C 61 30.976 30.976 29.412 1.564 18496 7738 1 20 . 1 1 61 61 GLU H H 61 8.013 8.013 8.143 -0.130 18496 7739 1 20 . 1 1 62 62 PHE N N 62 119.925 119.925 120.530 -0.605 18496 7740 1 20 . 1 1 62 62 PHE HA H 62 3.927 3.927 3.975 -0.048 18496 7741 1 20 . 1 1 62 62 PHE C C 62 176.783 176.783 177.810 -1.027 18496 7742 1 20 . 1 1 62 62 PHE CA C 62 61.827 61.827 61.537 0.290 18496 7743 1 20 . 1 1 62 62 PHE CB C 62 40.216 40.216 38.697 1.520 18496 7744 1 20 . 1 1 62 62 PHE H H 62 9.192 9.192 8.998 0.194 18496 7745 1 20 . 1 1 63 63 GLY N N 63 104.854 104.854 106.660 -1.806 18496 7746 1 20 . 1 1 63 63 GLY C C 63 176.854 176.854 176.141 0.713 18496 7747 1 20 . 1 1 63 63 GLY CA C 63 47.178 47.178 47.393 -0.215 18496 7748 1 20 . 1 1 63 63 GLY H H 63 8.316 8.316 8.718 -0.402 18496 7749 1 20 . 1 1 64 64 VAL N N 64 123.719 123.719 122.807 0.912 18496 7750 1 20 . 1 1 64 64 VAL HA H 64 3.663 3.663 3.753 -0.090 18496 7751 1 20 . 1 1 64 64 VAL C C 64 177.644 177.644 177.914 -0.270 18496 7752 1 20 . 1 1 64 64 VAL CA C 64 67.090 67.090 65.450 1.640 18496 7753 1 20 . 1 1 64 64 VAL CB C 64 31.367 31.367 31.142 0.225 18496 7754 1 20 . 1 1 64 64 VAL H H 64 7.759 7.759 7.511 0.248 18496 7755 1 20 . 1 1 65 65 LEU N N 65 120.099 120.099 121.501 -1.402 18496 7756 1 20 . 1 1 65 65 LEU HA H 65 3.672 3.672 3.931 -0.259 18496 7757 1 20 . 1 1 65 65 LEU C C 65 177.636 177.636 178.640 -1.004 18496 7758 1 20 . 1 1 65 65 LEU CA C 65 58.552 58.552 58.589 -0.037 18496 7759 1 20 . 1 1 65 65 LEU CB C 65 41.358 41.358 41.741 -0.383 18496 7760 1 20 . 1 1 65 65 LEU H H 65 7.660 7.660 8.403 -0.743 18496 7761 1 20 . 1 1 66 66 LEU N N 66 115.733 115.733 118.018 -2.285 18496 7762 1 20 . 1 1 66 66 LEU HA H 66 3.556 3.556 3.622 -0.066 18496 7763 1 20 . 1 1 66 66 LEU C C 66 179.729 179.729 178.824 0.905 18496 7764 1 20 . 1 1 66 66 LEU CA C 66 58.069 58.069 58.060 0.009 18496 7765 1 20 . 1 1 66 66 LEU CB C 66 41.625 41.625 40.895 0.730 18496 7766 1 20 . 1 1 66 66 LEU H H 66 8.083 8.083 8.127 -0.044 18496 7767 1 20 . 1 1 67 67 LYS N N 67 119.120 119.120 119.979 -0.859 18496 7768 1 20 . 1 1 67 67 LYS HA H 67 3.965 3.965 3.803 0.162 18496 7769 1 20 . 1 1 67 67 LYS C C 67 179.379 179.379 179.023 0.356 18496 7770 1 20 . 1 1 67 67 LYS CA C 67 59.227 59.227 59.784 -0.557 18496 7771 1 20 . 1 1 67 67 LYS CB C 67 32.737 32.737 32.203 0.534 18496 7772 1 20 . 1 1 67 67 LYS H H 67 7.861 7.861 7.764 0.097 18496 7773 1 20 . 1 1 68 68 GLU N N 68 116.924 116.924 118.973 -2.049 18496 7774 1 20 . 1 1 68 68 GLU HA H 68 4.409 4.409 4.078 0.331 18496 7775 1 20 . 1 1 68 68 GLU CA C 68 57.712 57.712 58.676 -0.964 18496 7776 1 20 . 1 1 68 68 GLU CB C 68 29.586 29.586 29.399 0.187 18496 7777 1 20 . 1 1 68 68 GLU H H 68 8.319 8.319 7.891 0.428 18496 7778 1 20 . 1 1 69 69 LEU N N 69 120.032 120.032 120.015 0.017 18496 7779 1 20 . 1 1 69 69 LEU HA H 69 4.107 4.107 3.940 0.167 18496 7780 1 20 . 1 1 69 69 LEU CA C 69 57.563 57.563 57.534 0.029 18496 7781 1 20 . 1 1 69 69 LEU CB C 69 41.373 41.373 41.541 -0.168 18496 7782 1 20 . 1 1 69 69 LEU H H 69 8.233 8.233 8.628 -0.395 18496 7783 1 20 . 1 1 70 70 GLY N N 70 105.472 105.472 105.336 0.136 18496 7784 1 20 . 1 1 70 70 GLY C C 70 174.986 174.986 175.434 -0.448 18496 7785 1 20 . 1 1 70 70 GLY CA C 70 46.704 46.704 46.737 -0.034 18496 7786 1 20 . 1 1 70 70 GLY H H 70 7.960 7.960 8.505 -0.545 18496 7787 1 20 . 1 1 71 71 ASN N N 71 118.596 118.596 119.319 -0.723 18496 7788 1 20 . 1 1 71 71 ASN HA H 71 4.681 4.681 4.801 -0.120 18496 7789 1 20 . 1 1 71 71 ASN C C 71 176.412 176.412 177.977 -1.565 18496 7790 1 20 . 1 1 71 71 ASN CA C 71 54.407 54.407 55.117 -0.710 18496 7791 1 20 . 1 1 71 71 ASN CB C 71 38.729 38.729 38.662 0.067 18496 7792 1 20 . 1 1 71 71 ASN H H 71 7.857 7.857 7.689 0.168 18496 7793 1 20 . 1 1 72 72 LYS N N 72 119.973 119.973 120.413 -0.440 18496 7794 1 20 . 1 1 72 72 LYS HA H 72 4.282 4.282 4.137 0.145 18496 7795 1 20 . 1 1 72 72 LYS CA C 72 57.338 57.338 58.060 -0.722 18496 7796 1 20 . 1 1 72 72 LYS CB C 72 32.755 32.755 32.008 0.747 18496 7797 1 20 . 1 1 72 72 LYS H H 72 8.100 8.100 8.141 -0.041 18496 7798 1 20 . 1 1 73 73 LEU HA H 73 4.281 4.281 4.317 -0.036 18496 7799 1 20 . 1 1 73 73 LEU CA C 73 55.774 55.774 54.899 0.875 18496 7800 1 20 . 1 1 73 73 LEU CB C 73 41.983 41.983 42.170 -0.187 18496 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 63 2.873 0.579 2.837 18496 2 1 1 "Average Difference" HA 77 0.467 -0.041 0.468 18496 3 1 1 "Average Difference" C 58 0.861 -0.061 0.866 18496 4 1 1 "Average Difference" CA 72 1.258 -0.160 1.257 18496 5 1 1 "Average Difference" CB 67 1.401 -0.356 1.366 18496 6 1 1 "Average Difference" HN 63 0.468 -0.080 0.465 18496 7 1 2 "Average Difference" N 63 2.706 0.644 2.650 18496 8 1 2 "Average Difference" HA 77 0.452 -0.019 0.454 18496 9 1 2 "Average Difference" C 58 0.867 -0.026 0.874 18496 10 1 2 "Average Difference" CA 72 1.244 -0.140 1.245 18496 11 1 2 "Average Difference" CB 67 1.319 -0.275 1.300 18496 12 1 2 "Average Difference" HN 63 0.441 -0.042 0.443 18496 13 1 3 "Average Difference" N 63 2.669 0.470 2.648 18496 14 1 3 "Average Difference" HA 77 0.436 -0.020 0.438 18496 15 1 3 "Average Difference" C 58 0.858 -0.050 0.864 18496 16 1 3 "Average Difference" CA 72 1.313 -0.164 1.312 18496 17 1 3 "Average Difference" CB 67 1.334 -0.298 1.310 18496 18 1 3 "Average Difference" HN 63 0.447 -0.047 0.448 18496 19 1 4 "Average Difference" N 63 2.664 0.642 2.606 18496 20 1 4 "Average Difference" HA 77 0.443 -0.024 0.445 18496 21 1 4 "Average Difference" C 58 0.860 -0.032 0.867 18496 22 1 4 "Average Difference" CA 72 1.250 -0.129 1.252 18496 23 1 4 "Average Difference" CB 67 1.301 -0.288 1.278 18496 24 1 4 "Average Difference" HN 63 0.430 -0.037 0.432 18496 25 1 5 "Average Difference" N 63 2.709 0.513 2.681 18496 26 1 5 "Average Difference" HA 77 0.450 -0.025 0.452 18496 27 1 5 "Average Difference" C 58 0.894 -0.034 0.901 18496 28 1 5 "Average Difference" CA 72 1.206 -0.098 1.210 18496 29 1 5 "Average Difference" CB 67 1.324 -0.287 1.302 18496 30 1 5 "Average Difference" HN 63 0.426 -0.033 0.428 18496 31 1 6 "Average Difference" N 63 2.706 0.560 2.669 18496 32 1 6 "Average Difference" HA 77 0.440 -0.015 0.443 18496 33 1 6 "Average Difference" C 58 0.853 -0.017 0.860 18496 34 1 6 "Average Difference" CA 72 1.229 -0.172 1.226 18496 35 1 6 "Average Difference" CB 67 1.269 -0.282 1.247 18496 36 1 6 "Average Difference" HN 63 0.407 -0.027 0.409 18496 37 1 7 "Average Difference" N 63 2.667 0.651 2.607 18496 38 1 7 "Average Difference" HA 77 0.462 -0.036 0.464 18496 39 1 7 "Average Difference" C 58 0.886 -0.067 0.891 18496 40 1 7 "Average Difference" CA 72 1.273 -0.154 1.273 18496 41 1 7 "Average Difference" CB 67 1.332 -0.311 1.305 18496 42 1 7 "Average Difference" HN 63 0.454 -0.071 0.452 18496 43 1 8 "Average Difference" N 63 2.708 0.514 2.680 18496 44 1 8 "Average Difference" HA 77 0.433 -0.023 0.436 18496 45 1 8 "Average Difference" C 58 0.905 -0.043 0.912 18496 46 1 8 "Average Difference" CA 72 1.253 -0.173 1.250 18496 47 1 8 "Average Difference" CB 67 1.261 -0.249 1.245 18496 48 1 8 "Average Difference" HN 63 0.441 -0.062 0.440 18496 49 1 9 "Average Difference" N 63 2.614 0.548 2.576 18496 50 1 9 "Average Difference" HA 77 0.430 -0.013 0.433 18496 51 1 9 "Average Difference" C 58 0.895 -0.002 0.903 18496 52 1 9 "Average Difference" CA 72 1.300 -0.136 1.302 18496 53 1 9 "Average Difference" CB 67 1.327 -0.278 1.308 18496 54 1 9 "Average Difference" HN 63 0.448 -0.042 0.450 18496 55 1 10 "Average Difference" N 63 2.641 0.594 2.594 18496 56 1 10 "Average Difference" HA 77 0.432 -0.019 0.434 18496 57 1 10 "Average Difference" C 58 0.853 0.003 0.861 18496 58 1 10 "Average Difference" CA 72 1.288 -0.164 1.286 18496 59 1 10 "Average Difference" CB 67 1.362 -0.316 1.335 18496 60 1 10 "Average Difference" HN 63 0.440 -0.071 0.438 18496 61 1 11 "Average Difference" N 63 2.700 0.486 2.677 18496 62 1 11 "Average Difference" HA 77 0.459 -0.026 0.461 18496 63 1 11 "Average Difference" C 58 0.904 -0.060 0.910 18496 64 1 11 "Average Difference" CA 72 1.237 -0.168 1.234 18496 65 1 11 "Average Difference" CB 67 1.399 -0.333 1.369 18496 66 1 11 "Average Difference" HN 63 0.454 -0.069 0.452 18496 67 1 12 "Average Difference" N 63 2.685 0.599 2.638 18496 68 1 12 "Average Difference" HA 77 0.446 -0.021 0.448 18496 69 1 12 "Average Difference" C 58 0.896 -0.006 0.904 18496 70 1 12 "Average Difference" CA 72 1.255 -0.093 1.260 18496 71 1 12 "Average Difference" CB 67 1.289 -0.268 1.271 18496 72 1 12 "Average Difference" HN 63 0.421 -0.057 0.420 18496 73 1 13 "Average Difference" N 63 2.603 0.550 2.565 18496 74 1 13 "Average Difference" HA 77 0.449 -0.032 0.451 18496 75 1 13 "Average Difference" C 58 0.887 -0.007 0.895 18496 76 1 13 "Average Difference" CA 72 1.244 -0.123 1.246 18496 77 1 13 "Average Difference" CB 67 1.334 -0.277 1.314 18496 78 1 13 "Average Difference" HN 63 0.416 -0.032 0.418 18496 79 1 14 "Average Difference" N 63 2.742 0.515 2.715 18496 80 1 14 "Average Difference" HA 77 0.447 -0.018 0.450 18496 81 1 14 "Average Difference" C 58 0.862 -0.042 0.869 18496 82 1 14 "Average Difference" CA 72 1.248 -0.162 1.247 18496 83 1 14 "Average Difference" CB 67 1.307 -0.282 1.286 18496 84 1 14 "Average Difference" HN 63 0.443 -0.049 0.444 18496 85 1 15 "Average Difference" N 63 2.655 0.583 2.611 18496 86 1 15 "Average Difference" HA 77 0.429 -0.015 0.432 18496 87 1 15 "Average Difference" C 58 0.896 -0.007 0.904 18496 88 1 15 "Average Difference" CA 72 1.306 -0.178 1.303 18496 89 1 15 "Average Difference" CB 67 1.335 -0.279 1.316 18496 90 1 15 "Average Difference" HN 63 0.440 -0.036 0.442 18496 91 1 16 "Average Difference" N 63 2.620 0.490 2.595 18496 92 1 16 "Average Difference" HA 77 0.450 -0.029 0.452 18496 93 1 16 "Average Difference" C 58 0.891 -0.043 0.898 18496 94 1 16 "Average Difference" CA 72 1.262 -0.160 1.260 18496 95 1 16 "Average Difference" CB 67 1.342 -0.315 1.315 18496 96 1 16 "Average Difference" HN 63 0.428 -0.032 0.430 18496 97 1 17 "Average Difference" N 63 2.683 0.560 2.645 18496 98 1 17 "Average Difference" HA 77 0.445 -0.021 0.448 18496 99 1 17 "Average Difference" C 58 0.884 -0.015 0.891 18496 100 1 17 "Average Difference" CA 72 1.257 -0.162 1.256 18496 101 1 17 "Average Difference" CB 67 1.304 -0.254 1.288 18496 102 1 17 "Average Difference" HN 63 0.434 -0.035 0.436 18496 103 1 18 "Average Difference" N 63 2.657 0.622 2.604 18496 104 1 18 "Average Difference" HA 77 0.420 -0.012 0.422 18496 105 1 18 "Average Difference" C 58 0.873 -0.036 0.880 18496 106 1 18 "Average Difference" CA 72 1.307 -0.163 1.306 18496 107 1 18 "Average Difference" CB 67 1.317 -0.305 1.291 18496 108 1 18 "Average Difference" HN 63 0.441 -0.036 0.443 18496 109 1 19 "Average Difference" N 63 2.729 0.504 2.703 18496 110 1 19 "Average Difference" HA 77 0.455 -0.022 0.457 18496 111 1 19 "Average Difference" C 58 0.912 -0.003 0.919 18496 112 1 19 "Average Difference" CA 72 1.221 -0.130 1.222 18496 113 1 19 "Average Difference" CB 67 1.426 -0.279 1.409 18496 114 1 19 "Average Difference" HN 63 0.451 -0.048 0.452 18496 115 1 20 "Average Difference" N 63 2.838 0.571 2.802 18496 116 1 20 "Average Difference" HA 77 0.457 -0.037 0.459 18496 117 1 20 "Average Difference" C 58 0.885 -0.029 0.892 18496 118 1 20 "Average Difference" CA 72 1.279 -0.163 1.277 18496 119 1 20 "Average Difference" CB 67 1.415 -0.337 1.385 18496 120 1 20 "Average Difference" HN 63 0.461 -0.068 0.460 18496 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 18496 _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 2 2 ALA HA H 2 4.074 4.074 4.541 -0.467 18496 2 1 . 1 1 2 2 ALA CA C 2 51.966 51.966 51.526 0.440 18496 3 1 . 1 1 2 2 ALA CB C 2 19.732 19.732 20.021 -0.289 18496 4 1 . 1 1 3 3 ASP HA H 3 4.632 4.632 4.488 0.144 18496 5 1 . 1 1 3 3 ASP C C 3 175.822 175.822 176.264 -0.442 18496 6 1 . 1 1 3 3 ASP CA C 3 54.440 54.440 55.518 -1.078 18496 7 1 . 1 1 3 3 ASP CB C 3 41.577 41.577 41.287 0.290 18496 8 1 . 1 1 4 4 LYS N N 4 121.655 121.655 119.677 1.978 18496 9 1 . 1 1 4 4 LYS HA H 4 4.379 4.379 4.535 -0.156 18496 10 1 . 1 1 4 4 LYS C C 4 176.011 176.011 175.556 0.455 18496 11 1 . 1 1 4 4 LYS CA C 4 56.213 56.213 55.059 1.154 18496 12 1 . 1 1 4 4 LYS CB C 4 33.407 33.407 31.931 1.476 18496 13 1 . 1 1 4 4 LYS H H 4 8.394 8.394 7.978 0.415 18496 14 1 . 1 1 5 5 LEU N N 5 125.369 125.369 124.815 0.554 18496 15 1 . 1 1 5 5 LEU HA H 5 4.351 4.351 4.336 0.015 18496 16 1 . 1 1 5 5 LEU C C 5 175.682 175.682 176.643 -0.961 18496 17 1 . 1 1 5 5 LEU CA C 5 55.117 55.117 54.820 0.297 18496 18 1 . 1 1 5 5 LEU CB C 5 43.197 43.197 42.913 0.284 18496 19 1 . 1 1 5 5 LEU H H 5 8.136 8.136 8.201 -0.065 18496 20 1 . 1 1 6 6 LYS N N 6 126.844 126.844 125.797 1.047 18496 21 1 . 1 1 6 6 LYS HA H 6 4.451 4.451 4.476 -0.025 18496 22 1 . 1 1 6 6 LYS C C 6 174.665 174.665 175.457 -0.792 18496 23 1 . 1 1 6 6 LYS CA C 6 55.974 55.974 56.331 -0.357 18496 24 1 . 1 1 6 6 LYS CB C 6 34.386 34.386 33.113 1.273 18496 25 1 . 1 1 6 6 LYS H H 6 8.615 8.615 8.583 0.032 18496 26 1 . 1 1 7 7 PHE N N 7 119.818 119.818 119.554 0.264 18496 27 1 . 1 1 7 7 PHE HA H 7 5.343 5.343 5.493 -0.150 18496 28 1 . 1 1 7 7 PHE C C 7 173.569 173.569 173.742 -0.173 18496 29 1 . 1 1 7 7 PHE CA C 7 55.813 55.813 55.730 0.083 18496 30 1 . 1 1 7 7 PHE CB C 7 42.975 42.975 42.521 0.454 18496 31 1 . 1 1 7 7 PHE H H 7 7.734 7.734 8.207 -0.473 18496 32 1 . 1 1 8 8 GLU N N 8 119.165 119.165 119.658 -0.493 18496 33 1 . 1 1 8 8 GLU HA H 8 4.158 4.158 4.268 -0.110 18496 34 1 . 1 1 8 8 GLU C C 8 175.026 175.026 174.426 0.600 18496 35 1 . 1 1 8 8 GLU CA C 8 55.221 55.221 54.576 0.645 18496 36 1 . 1 1 8 8 GLU CB C 8 33.699 33.699 32.923 0.776 18496 37 1 . 1 1 8 8 GLU H H 8 8.295 8.295 8.711 -0.416 18496 38 1 . 1 1 9 9 ILE N N 9 127.619 127.619 127.650 -0.031 18496 39 1 . 1 1 9 9 ILE HA H 9 3.768 3.768 4.193 -0.425 18496 40 1 . 1 1 9 9 ILE C C 9 174.902 174.902 175.833 -0.931 18496 41 1 . 1 1 9 9 ILE CA C 9 62.505 62.505 62.339 0.166 18496 42 1 . 1 1 9 9 ILE CB C 9 36.094 36.094 37.622 -1.528 18496 43 1 . 1 1 9 9 ILE H H 9 9.157 9.157 8.665 0.492 18496 44 1 . 1 1 10 10 ILE N N 10 131.245 131.245 128.651 2.594 18496 45 1 . 1 1 10 10 ILE HA H 10 3.861 3.861 4.078 -0.217 18496 46 1 . 1 1 10 10 ILE C C 10 176.247 176.247 176.410 -0.163 18496 47 1 . 1 1 10 10 ILE CA C 10 60.554 60.554 62.173 -1.619 18496 48 1 . 1 1 10 10 ILE CB C 10 37.406 37.406 38.385 -0.979 18496 49 1 . 1 1 10 10 ILE H H 10 8.428 8.428 8.875 -0.447 18496 50 1 . 1 1 11 11 GLU N N 11 117.669 117.669 118.433 -0.764 18496 51 1 . 1 1 11 11 GLU HA H 11 4.315 4.315 4.504 -0.189 18496 52 1 . 1 1 11 11 GLU C C 11 174.155 174.155 174.498 -0.343 18496 53 1 . 1 1 11 11 GLU CA C 11 55.755 55.755 55.532 0.223 18496 54 1 . 1 1 11 11 GLU CB C 11 34.386 34.386 32.758 1.628 18496 55 1 . 1 1 11 11 GLU H H 11 7.551 7.551 7.898 -0.347 18496 56 1 . 1 1 12 12 GLU N N 12 128.587 128.587 125.302 3.285 18496 57 1 . 1 1 12 12 GLU HA H 12 5.214 5.214 4.492 0.722 18496 58 1 . 1 1 12 12 GLU C C 12 176.877 176.877 175.845 1.032 18496 59 1 . 1 1 12 12 GLU CA C 12 54.801 54.801 57.245 -2.444 18496 60 1 . 1 1 12 12 GLU CB C 12 30.137 30.137 30.142 -0.005 18496 61 1 . 1 1 12 12 GLU H H 12 8.762 8.762 8.852 -0.090 18496 62 1 . 1 1 13 13 LEU N N 13 122.508 122.508 123.268 -0.760 18496 63 1 . 1 1 13 13 LEU HA H 13 4.872 4.872 4.607 0.265 18496 64 1 . 1 1 13 13 LEU C C 13 176.060 176.060 177.094 -1.034 18496 65 1 . 1 1 13 13 LEU CA C 13 57.372 57.372 55.595 1.777 18496 66 1 . 1 1 13 13 LEU CB C 13 42.284 42.284 43.447 -1.163 18496 67 1 . 1 1 13 13 LEU H H 13 8.058 8.058 8.600 -0.542 18496 68 1 . 1 1 14 14 ILE N N 14 115.422 115.422 117.965 -2.542 18496 69 1 . 1 1 14 14 ILE HA H 14 4.553 4.553 4.461 0.092 18496 70 1 . 1 1 14 14 ILE C C 14 174.893 174.893 174.108 0.785 18496 71 1 . 1 1 14 14 ILE CA C 14 60.586 60.586 59.599 0.987 18496 72 1 . 1 1 14 14 ILE CB C 14 44.329 44.329 41.308 3.021 18496 73 1 . 1 1 14 14 ILE H H 14 8.450 8.450 8.371 0.079 18496 74 1 . 1 1 15 15 VAL N N 15 129.108 129.108 125.786 3.322 18496 75 1 . 1 1 15 15 VAL HA H 15 4.196 4.196 4.403 -0.207 18496 76 1 . 1 1 15 15 VAL C C 15 175.180 175.180 175.036 0.144 18496 77 1 . 1 1 15 15 VAL CA C 15 63.288 63.288 61.037 2.251 18496 78 1 . 1 1 15 15 VAL CB C 15 32.117 32.117 32.961 -0.844 18496 79 1 . 1 1 15 15 VAL H H 15 8.867 8.867 8.500 0.367 18496 80 1 . 1 1 16 16 LEU N N 16 127.846 127.846 129.380 -1.534 18496 81 1 . 1 1 16 16 LEU HA H 16 4.317 4.317 4.639 -0.322 18496 82 1 . 1 1 16 16 LEU C C 16 176.070 176.070 177.223 -1.153 18496 83 1 . 1 1 16 16 LEU CA C 16 57.252 57.252 56.242 1.010 18496 84 1 . 1 1 16 16 LEU CB C 16 42.035 42.035 42.661 -0.626 18496 85 1 . 1 1 16 16 LEU H H 16 9.555 9.555 8.812 0.743 18496 86 1 . 1 1 17 17 SER N N 17 107.073 107.073 110.239 -3.166 18496 87 1 . 1 1 17 17 SER HA H 17 4.540 4.540 4.602 -0.062 18496 88 1 . 1 1 17 17 SER C C 17 172.277 172.277 172.259 0.018 18496 89 1 . 1 1 17 17 SER CA C 17 57.882 57.882 58.052 -0.170 18496 90 1 . 1 1 17 17 SER CB C 17 64.046 64.046 65.052 -1.006 18496 91 1 . 1 1 17 17 SER H H 17 7.699 7.699 7.836 -0.137 18496 92 1 . 1 1 18 18 GLU N N 18 119.235 119.235 119.892 -0.657 18496 93 1 . 1 1 18 18 GLU HA H 18 5.143 5.143 5.021 0.122 18496 94 1 . 1 1 18 18 GLU C C 18 175.469 175.469 176.269 -0.800 18496 95 1 . 1 1 18 18 GLU CA C 18 55.248 55.248 55.121 0.127 18496 96 1 . 1 1 18 18 GLU CB C 18 33.454 33.454 31.124 2.330 18496 97 1 . 1 1 18 18 GLU H H 18 8.437 8.437 8.495 -0.058 18496 98 1 . 1 1 19 19 ASN N N 19 123.988 123.988 121.194 2.794 18496 99 1 . 1 1 19 19 ASN HA H 19 5.097 5.097 4.774 0.323 18496 100 1 . 1 1 19 19 ASN CA C 19 50.916 50.916 53.052 -2.136 18496 101 1 . 1 1 19 19 ASN CB C 19 39.482 39.482 39.514 -0.032 18496 102 1 . 1 1 19 19 ASN H H 19 8.779 8.779 8.387 0.392 18496 103 1 . 1 1 20 20 ALA N N 20 120.854 120.854 122.780 -1.926 18496 104 1 . 1 1 20 20 ALA HA H 20 4.239 4.239 4.164 0.075 18496 105 1 . 1 1 20 20 ALA C C 20 179.032 179.032 177.988 1.043 18496 106 1 . 1 1 20 20 ALA CA C 20 54.924 54.924 54.300 0.624 18496 107 1 . 1 1 20 20 ALA CB C 20 18.621 18.621 18.541 0.080 18496 108 1 . 1 1 20 20 ALA H H 20 8.616 8.616 8.585 0.031 18496 109 1 . 1 1 21 21 LYS N N 21 115.771 115.771 116.582 -0.811 18496 110 1 . 1 1 21 21 LYS HA H 21 4.497 4.497 4.245 0.252 18496 111 1 . 1 1 21 21 LYS C C 21 176.615 176.615 176.730 -0.115 18496 112 1 . 1 1 21 21 LYS CA C 21 55.503 55.503 55.418 0.085 18496 113 1 . 1 1 21 21 LYS CB C 21 32.742 32.742 31.997 0.745 18496 114 1 . 1 1 21 21 LYS H H 21 7.767 7.767 7.733 0.034 18496 115 1 . 1 1 22 22 GLY N N 22 107.695 107.695 106.684 1.011 18496 116 1 . 1 1 22 22 GLY C C 22 174.843 174.843 174.191 0.652 18496 117 1 . 1 1 22 22 GLY CA C 22 45.297 45.297 45.224 0.073 18496 118 1 . 1 1 22 22 GLY H H 22 8.317 8.317 7.859 0.458 18496 119 1 . 1 1 23 23 TRP N N 23 121.316 121.316 121.190 0.126 18496 120 1 . 1 1 23 23 TRP HA H 23 4.815 4.815 4.828 -0.013 18496 121 1 . 1 1 23 23 TRP C C 23 176.754 176.754 176.486 0.268 18496 122 1 . 1 1 23 23 TRP CA C 23 58.291 58.291 55.122 3.169 18496 123 1 . 1 1 23 23 TRP CB C 23 28.127 28.127 28.008 0.119 18496 124 1 . 1 1 23 23 TRP H H 23 7.983 7.983 7.986 -0.003 18496 125 1 . 1 1 24 24 ARG N N 24 120.789 120.789 126.982 -6.193 18496 126 1 . 1 1 24 24 ARG HA H 24 5.496 5.496 4.870 0.626 18496 127 1 . 1 1 24 24 ARG C C 24 175.831 175.831 176.046 -0.215 18496 128 1 . 1 1 24 24 ARG CA C 24 54.755 54.755 54.630 0.125 18496 129 1 . 1 1 24 24 ARG CB C 24 33.735 33.735 30.076 3.659 18496 130 1 . 1 1 24 24 ARG H H 24 9.046 9.046 9.344 -0.298 18496 131 1 . 1 1 25 25 LYS N N 25 126.507 126.507 129.230 -2.723 18496 132 1 . 1 1 25 25 LYS HA H 25 5.081 5.081 4.765 0.316 18496 133 1 . 1 1 25 25 LYS C C 25 175.648 175.648 175.616 0.032 18496 134 1 . 1 1 25 25 LYS CA C 25 56.071 56.071 56.919 -0.848 18496 135 1 . 1 1 25 25 LYS CB C 25 32.214 32.214 32.755 -0.541 18496 136 1 . 1 1 25 25 LYS H H 25 8.526 8.526 8.613 -0.087 18496 137 1 . 1 1 26 26 GLU N N 26 126.009 126.009 123.890 2.119 18496 138 1 . 1 1 26 26 GLU HA H 26 5.275 5.275 5.082 0.193 18496 139 1 . 1 1 26 26 GLU C C 26 174.894 174.894 174.092 0.802 18496 140 1 . 1 1 26 26 GLU CA C 26 55.271 55.271 55.020 0.250 18496 141 1 . 1 1 26 26 GLU CB C 26 33.781 33.781 34.709 -0.928 18496 142 1 . 1 1 26 26 GLU H H 26 9.125 9.125 8.999 0.126 18496 143 1 . 1 1 27 27 LEU N N 27 121.930 121.930 124.486 -2.556 18496 144 1 . 1 1 27 27 LEU HA H 27 5.788 5.788 4.882 0.906 18496 145 1 . 1 1 27 27 LEU C C 27 173.941 173.941 174.347 -0.406 18496 146 1 . 1 1 27 27 LEU CA C 27 53.859 53.859 53.897 -0.037 18496 147 1 . 1 1 27 27 LEU CB C 27 44.020 44.020 44.230 -0.210 18496 148 1 . 1 1 27 27 LEU H H 27 8.938 8.938 9.078 -0.140 18496 149 1 . 1 1 28 28 ASN N N 28 124.630 124.630 125.011 -0.381 18496 150 1 . 1 1 28 28 ASN HA H 28 5.411 5.411 5.231 0.180 18496 151 1 . 1 1 28 28 ASN C C 28 174.366 174.366 173.263 1.103 18496 152 1 . 1 1 28 28 ASN CA C 28 52.063 52.063 52.267 -0.204 18496 153 1 . 1 1 28 28 ASN CB C 28 44.430 44.430 43.362 1.068 18496 154 1 . 1 1 28 28 ASN H H 28 9.345 9.345 8.265 1.080 18496 155 1 . 1 1 29 29 ARG N N 29 118.443 118.443 122.370 -3.927 18496 156 1 . 1 1 29 29 ARG HA H 29 5.058 5.058 4.890 0.168 18496 157 1 . 1 1 29 29 ARG C C 29 175.779 175.779 174.648 1.131 18496 158 1 . 1 1 29 29 ARG CA C 29 56.091 56.091 55.693 0.398 18496 159 1 . 1 1 29 29 ARG CB C 29 31.710 31.710 31.172 0.538 18496 160 1 . 1 1 29 29 ARG H H 29 9.109 9.109 9.066 0.043 18496 161 1 . 1 1 30 30 VAL N N 30 124.605 124.605 122.181 2.424 18496 162 1 . 1 1 30 30 VAL HA H 30 4.535 4.535 5.387 -0.852 18496 163 1 . 1 1 30 30 VAL C C 30 174.775 174.775 174.364 0.411 18496 164 1 . 1 1 30 30 VAL CA C 30 60.921 60.921 59.025 1.896 18496 165 1 . 1 1 30 30 VAL CB C 30 37.790 37.790 36.195 1.595 18496 166 1 . 1 1 30 30 VAL H H 30 9.054 9.054 8.634 0.420 18496 167 1 . 1 1 31 31 SER N N 31 120.794 120.794 115.288 5.506 18496 168 1 . 1 1 31 31 SER HA H 31 4.652 4.652 5.113 -0.461 18496 169 1 . 1 1 31 31 SER C C 31 174.214 174.214 175.411 -1.197 18496 170 1 . 1 1 31 31 SER CA C 31 56.279 56.279 57.058 -0.779 18496 171 1 . 1 1 31 31 SER CB C 31 64.128 64.128 64.110 0.018 18496 172 1 . 1 1 31 31 SER H H 31 8.667 8.667 8.842 -0.175 18496 173 1 . 1 1 32 32 TRP N N 32 132.303 132.303 128.000 4.303 18496 174 1 . 1 1 32 32 TRP HA H 32 5.105 5.105 4.533 0.572 18496 175 1 . 1 1 32 32 TRP C C 32 177.276 177.276 177.134 0.142 18496 176 1 . 1 1 32 32 TRP CA C 32 56.198 56.198 58.116 -1.918 18496 177 1 . 1 1 32 32 TRP CB C 32 29.968 29.968 28.065 1.903 18496 178 1 . 1 1 32 32 TRP H H 32 9.282 9.282 9.200 0.082 18496 179 1 . 1 1 33 33 ASN N N 33 124.979 124.979 123.433 1.546 18496 180 1 . 1 1 33 33 ASN HA H 33 4.257 4.257 4.383 -0.125 18496 181 1 . 1 1 33 33 ASN C C 33 174.030 174.030 174.752 -0.722 18496 182 1 . 1 1 33 33 ASN CA C 33 54.709 54.709 54.761 -0.052 18496 183 1 . 1 1 33 33 ASN CB C 33 37.921 37.921 36.998 0.923 18496 184 1 . 1 1 33 33 ASN H H 33 9.813 9.813 8.829 0.984 18496 185 1 . 1 1 34 34 ASP N N 34 111.880 111.880 113.681 -1.802 18496 186 1 . 1 1 34 34 ASP HA H 34 4.126 4.126 4.236 -0.110 18496 187 1 . 1 1 34 34 ASP CA C 34 56.130 56.130 55.518 0.612 18496 188 1 . 1 1 34 34 ASP CB C 34 39.760 39.760 40.281 -0.521 18496 189 1 . 1 1 34 34 ASP H H 34 9.251 9.251 8.248 1.002 18496 190 1 . 1 1 35 35 ALA N N 35 121.811 121.811 121.156 0.655 18496 191 1 . 1 1 35 35 ALA HA H 35 4.477 4.477 4.490 -0.013 18496 192 1 . 1 1 35 35 ALA C C 35 177.778 177.778 177.069 0.709 18496 193 1 . 1 1 35 35 ALA CA C 35 51.528 51.528 52.619 -1.091 18496 194 1 . 1 1 35 35 ALA CB C 35 20.445 20.445 20.429 0.016 18496 195 1 . 1 1 35 35 ALA H H 35 7.625 7.625 7.758 -0.133 18496 196 1 . 1 1 36 36 GLU N N 36 121.068 121.068 121.749 -0.681 18496 197 1 . 1 1 36 36 GLU HA H 36 4.390 4.390 4.730 -0.340 18496 198 1 . 1 1 36 36 GLU CA C 36 55.276 55.276 52.271 3.005 18496 199 1 . 1 1 36 36 GLU CB C 36 28.575 28.575 30.947 -2.372 18496 200 1 . 1 1 36 36 GLU H H 36 8.658 8.658 8.246 0.412 18496 201 1 . 1 1 37 37 PRO HA H 37 4.289 4.289 4.687 -0.398 18496 202 1 . 1 1 37 37 PRO C C 37 175.799 175.799 175.912 -0.113 18496 203 1 . 1 1 37 37 PRO CA C 37 63.105 63.105 62.287 0.818 18496 204 1 . 1 1 37 37 PRO CB C 37 32.076 32.076 31.934 0.142 18496 205 1 . 1 1 38 38 LYS N N 38 120.881 120.881 123.122 -2.241 18496 206 1 . 1 1 38 38 LYS HA H 38 4.700 4.700 4.337 0.363 18496 207 1 . 1 1 38 38 LYS C C 38 176.906 176.906 174.650 2.256 18496 208 1 . 1 1 38 38 LYS CA C 38 54.399 54.399 54.666 -0.267 18496 209 1 . 1 1 38 38 LYS CB C 38 37.217 37.217 36.468 0.749 18496 210 1 . 1 1 38 38 LYS H H 38 8.316 8.316 8.824 -0.508 18496 211 1 . 1 1 39 39 TYR N N 39 119.792 119.792 118.632 1.160 18496 212 1 . 1 1 39 39 TYR HA H 39 4.636 4.636 4.694 -0.058 18496 213 1 . 1 1 39 39 TYR C C 39 175.834 175.834 174.895 0.939 18496 214 1 . 1 1 39 39 TYR CA C 39 60.228 60.228 57.412 2.816 18496 215 1 . 1 1 39 39 TYR CB C 39 38.683 38.683 39.052 -0.369 18496 216 1 . 1 1 39 39 TYR H H 39 8.508 8.508 7.831 0.677 18496 217 1 . 1 1 40 40 ASP N N 40 126.502 126.502 122.849 3.653 18496 218 1 . 1 1 40 40 ASP HA H 40 5.597 5.597 5.321 0.276 18496 219 1 . 1 1 40 40 ASP C C 40 175.283 175.283 174.074 1.209 18496 220 1 . 1 1 40 40 ASP CA C 40 55.053 55.053 53.651 1.402 18496 221 1 . 1 1 40 40 ASP CB C 40 48.656 48.656 45.411 3.245 18496 222 1 . 1 1 40 40 ASP H H 40 9.219 9.219 8.536 0.683 18496 223 1 . 1 1 41 41 ILE N N 41 125.910 125.910 124.989 0.921 18496 224 1 . 1 1 41 41 ILE HA H 41 5.722 5.722 4.958 0.764 18496 225 1 . 1 1 41 41 ILE C C 41 174.167 174.167 173.592 0.575 18496 226 1 . 1 1 41 41 ILE CA C 41 60.734 60.734 59.806 0.928 18496 227 1 . 1 1 41 41 ILE CB C 41 40.198 40.198 39.904 0.294 18496 228 1 . 1 1 41 41 ILE H H 41 8.972 8.972 8.711 0.261 18496 229 1 . 1 1 42 42 ARG N N 42 120.300 120.300 126.953 -6.653 18496 230 1 . 1 1 42 42 ARG HA H 42 4.716 4.716 4.753 -0.037 18496 231 1 . 1 1 42 42 ARG CA C 42 54.826 54.826 54.885 -0.059 18496 232 1 . 1 1 42 42 ARG CB C 42 32.665 32.665 35.339 -2.674 18496 233 1 . 1 1 42 42 ARG H H 42 8.320 8.320 8.654 -0.334 18496 234 1 . 1 1 43 43 THR HA H 43 5.585 5.585 5.370 0.215 18496 235 1 . 1 1 43 43 THR C C 43 173.294 173.294 173.221 0.073 18496 236 1 . 1 1 43 43 THR CA C 43 60.847 60.847 59.775 1.072 18496 237 1 . 1 1 43 43 THR CB C 43 69.961 69.961 70.790 -0.829 18496 238 1 . 1 1 44 44 TRP N N 44 122.747 122.747 123.695 -0.948 18496 239 1 . 1 1 44 44 TRP HA H 44 4.945 4.945 4.809 0.136 18496 240 1 . 1 1 44 44 TRP C C 44 175.056 175.056 176.122 -1.066 18496 241 1 . 1 1 44 44 TRP CA C 44 56.107 56.107 55.495 0.612 18496 242 1 . 1 1 44 44 TRP CB C 44 34.506 34.506 32.202 2.304 18496 243 1 . 1 1 44 44 TRP H H 44 9.180 9.180 8.769 0.411 18496 244 1 . 1 1 45 45 SER N N 45 117.385 117.385 116.591 0.794 18496 245 1 . 1 1 45 45 SER HA H 45 2.300 2.300 4.825 -2.525 18496 246 1 . 1 1 45 45 SER CA C 45 56.481 56.481 57.293 -0.812 18496 247 1 . 1 1 45 45 SER CB C 45 60.743 60.743 62.212 -1.469 18496 248 1 . 1 1 45 45 SER H H 45 7.879 7.879 8.396 -0.517 18496 249 1 . 1 1 46 46 PRO HA H 46 4.104 4.104 4.467 -0.363 18496 250 1 . 1 1 46 46 PRO CA C 46 64.990 64.990 65.535 -0.545 18496 251 1 . 1 1 46 46 PRO CB C 46 31.272 31.272 31.918 -0.646 18496 252 1 . 1 1 47 47 ASP HA H 47 4.520 4.520 4.634 -0.115 18496 253 1 . 1 1 47 47 ASP C C 47 175.629 175.629 175.610 0.019 18496 254 1 . 1 1 47 47 ASP CA C 47 53.453 53.453 53.126 0.327 18496 255 1 . 1 1 47 47 ASP CB C 47 40.239 40.239 40.952 -0.713 18496 256 1 . 1 1 48 48 HIS N N 48 111.320 111.320 115.744 -4.424 18496 257 1 . 1 1 48 48 HIS HA H 48 3.916 3.916 4.478 -0.562 18496 258 1 . 1 1 48 48 HIS CA C 48 60.347 60.347 57.449 2.898 18496 259 1 . 1 1 48 48 HIS CB C 48 25.499 25.499 28.157 -2.658 18496 260 1 . 1 1 48 48 HIS H H 48 8.269 8.269 8.186 0.083 18496 261 1 . 1 1 49 49 GLU N N 49 114.659 114.659 116.352 -1.693 18496 262 1 . 1 1 49 49 GLU HA H 49 4.447 4.447 4.330 0.117 18496 263 1 . 1 1 49 49 GLU C C 49 176.394 176.394 176.395 -0.001 18496 264 1 . 1 1 49 49 GLU CA C 49 57.940 57.940 57.801 0.139 18496 265 1 . 1 1 49 49 GLU CB C 49 30.641 30.641 30.759 -0.118 18496 266 1 . 1 1 49 49 GLU H H 49 7.381 7.381 8.519 -1.138 18496 267 1 . 1 1 50 50 LYS N N 50 118.126 118.126 118.012 0.114 18496 268 1 . 1 1 50 50 LYS HA H 50 4.665 4.665 4.586 0.079 18496 269 1 . 1 1 50 50 LYS CA C 50 54.431 54.431 54.692 -0.261 18496 270 1 . 1 1 50 50 LYS CB C 50 36.543 36.543 36.169 0.373 18496 271 1 . 1 1 50 50 LYS H H 50 8.067 8.067 7.774 0.293 18496 272 1 . 1 1 51 51 MET HA H 51 4.936 4.936 4.584 0.352 18496 273 1 . 1 1 51 51 MET CA C 51 54.048 54.048 53.057 0.991 18496 274 1 . 1 1 51 51 MET CB C 51 33.768 33.768 35.093 -1.325 18496 275 1 . 1 1 52 52 GLY C C 52 173.534 173.534 172.311 1.223 18496 276 1 . 1 1 52 52 GLY CA C 52 43.060 43.060 44.384 -1.324 18496 277 1 . 1 1 53 53 LYS N N 53 118.012 118.012 119.907 -1.895 18496 278 1 . 1 1 53 53 LYS HA H 53 4.155 4.155 4.507 -0.352 18496 279 1 . 1 1 53 53 LYS C C 53 176.818 176.818 176.106 0.712 18496 280 1 . 1 1 53 53 LYS CA C 53 56.478 56.478 56.024 0.454 18496 281 1 . 1 1 53 53 LYS CB C 53 33.117 33.117 33.496 -0.379 18496 282 1 . 1 1 53 53 LYS H H 53 8.132 8.132 8.206 -0.074 18496 283 1 . 1 1 54 54 GLY N N 54 109.836 109.836 108.573 1.263 18496 284 1 . 1 1 54 54 GLY C C 54 170.848 170.848 172.826 -1.977 18496 285 1 . 1 1 54 54 GLY CA C 54 46.701 46.701 44.791 1.910 18496 286 1 . 1 1 54 54 GLY H H 54 8.079 8.079 8.203 -0.124 18496 287 1 . 1 1 55 55 ILE N N 55 119.382 119.382 121.529 -2.147 18496 288 1 . 1 1 55 55 ILE HA H 55 4.956 4.956 4.594 0.362 18496 289 1 . 1 1 55 55 ILE C C 55 171.737 171.737 173.666 -1.929 18496 290 1 . 1 1 55 55 ILE CA C 55 57.059 57.059 60.531 -3.472 18496 291 1 . 1 1 55 55 ILE CB C 55 44.241 44.241 41.481 2.760 18496 292 1 . 1 1 55 55 ILE H H 55 8.661 8.661 8.355 0.306 18496 293 1 . 1 1 56 56 THR N N 56 113.795 113.795 122.593 -8.798 18496 294 1 . 1 1 56 56 THR HA H 56 5.607 5.607 4.878 0.729 18496 295 1 . 1 1 56 56 THR C C 56 174.417 174.417 173.657 0.760 18496 296 1 . 1 1 56 56 THR CA C 56 59.098 59.098 61.644 -2.546 18496 297 1 . 1 1 56 56 THR CB C 56 72.153 72.153 70.117 2.036 18496 298 1 . 1 1 56 56 THR H H 56 7.916 7.916 8.404 -0.488 18496 299 1 . 1 1 57 57 LEU N N 57 121.044 121.044 127.551 -6.507 18496 300 1 . 1 1 57 57 LEU HA H 57 5.311 5.311 4.901 0.410 18496 301 1 . 1 1 57 57 LEU C C 57 176.150 176.150 175.656 0.494 18496 302 1 . 1 1 57 57 LEU CA C 57 53.264 53.264 53.770 -0.506 18496 303 1 . 1 1 57 57 LEU CB C 57 45.901 45.901 44.798 1.103 18496 304 1 . 1 1 57 57 LEU H H 57 9.421 9.421 9.132 0.289 18496 305 1 . 1 1 58 58 SER N N 58 119.548 119.548 118.526 1.022 18496 306 1 . 1 1 58 58 SER HA H 58 4.734 4.734 4.512 0.222 18496 307 1 . 1 1 58 58 SER C C 58 174.786 174.786 175.695 -0.909 18496 308 1 . 1 1 58 58 SER CA C 58 56.948 56.948 57.771 -0.823 18496 309 1 . 1 1 58 58 SER CB C 58 65.726 65.726 64.448 1.278 18496 310 1 . 1 1 58 58 SER H H 58 9.771 9.771 9.382 0.389 18496 311 1 . 1 1 59 59 GLU N N 59 120.827 120.827 123.006 -2.179 18496 312 1 . 1 1 59 59 GLU HA H 59 4.319 4.319 4.196 0.123 18496 313 1 . 1 1 59 59 GLU C C 59 179.806 179.806 178.796 1.010 18496 314 1 . 1 1 59 59 GLU CA C 59 60.913 60.913 60.926 -0.013 18496 315 1 . 1 1 59 59 GLU CB C 59 29.538 29.538 29.379 0.159 18496 316 1 . 1 1 59 59 GLU H H 59 9.394 9.394 9.087 0.307 18496 317 1 . 1 1 60 60 GLU N N 60 119.587 119.587 119.422 0.165 18496 318 1 . 1 1 60 60 GLU HA H 60 4.188 4.188 4.104 0.084 18496 319 1 . 1 1 60 60 GLU C C 60 179.686 179.686 178.817 0.869 18496 320 1 . 1 1 60 60 GLU CA C 60 60.279 60.279 59.528 0.751 18496 321 1 . 1 1 60 60 GLU CB C 60 29.559 29.559 28.757 0.802 18496 322 1 . 1 1 60 60 GLU H H 60 8.905 8.905 8.863 0.042 18496 323 1 . 1 1 61 61 GLU N N 61 120.145 120.145 120.041 0.104 18496 324 1 . 1 1 61 61 GLU HA H 61 4.037 4.037 4.100 -0.063 18496 325 1 . 1 1 61 61 GLU C C 61 178.530 178.530 178.871 -0.341 18496 326 1 . 1 1 61 61 GLU CA C 61 59.118 59.118 58.900 0.218 18496 327 1 . 1 1 61 61 GLU CB C 61 30.976 30.976 29.344 1.632 18496 328 1 . 1 1 61 61 GLU H H 61 8.013 8.013 8.331 -0.318 18496 329 1 . 1 1 62 62 PHE N N 62 119.925 119.925 120.533 -0.608 18496 330 1 . 1 1 62 62 PHE HA H 62 3.927 3.927 4.063 -0.136 18496 331 1 . 1 1 62 62 PHE C C 62 176.783 176.783 177.638 -0.855 18496 332 1 . 1 1 62 62 PHE CA C 62 61.827 61.827 61.293 0.534 18496 333 1 . 1 1 62 62 PHE CB C 62 40.216 40.216 38.832 1.384 18496 334 1 . 1 1 62 62 PHE H H 62 9.192 9.192 8.896 0.296 18496 335 1 . 1 1 63 63 GLY N N 63 104.854 104.854 107.308 -2.454 18496 336 1 . 1 1 63 63 GLY C C 63 176.854 176.854 176.005 0.849 18496 337 1 . 1 1 63 63 GLY CA C 63 47.178 47.178 47.424 -0.246 18496 338 1 . 1 1 63 63 GLY H H 63 8.316 8.316 8.585 -0.269 18496 339 1 . 1 1 64 64 VAL N N 64 123.719 123.719 123.003 0.716 18496 340 1 . 1 1 64 64 VAL HA H 64 3.663 3.663 3.686 -0.023 18496 341 1 . 1 1 64 64 VAL C C 64 177.644 177.644 177.795 -0.151 18496 342 1 . 1 1 64 64 VAL CA C 64 67.090 67.090 65.867 1.223 18496 343 1 . 1 1 64 64 VAL CB C 64 31.367 31.367 31.280 0.087 18496 344 1 . 1 1 64 64 VAL H H 64 7.759 7.759 7.715 0.044 18496 345 1 . 1 1 65 65 LEU N N 65 120.099 120.099 121.247 -1.148 18496 346 1 . 1 1 65 65 LEU HA H 65 3.672 3.672 3.917 -0.244 18496 347 1 . 1 1 65 65 LEU C C 65 177.636 177.636 178.572 -0.936 18496 348 1 . 1 1 65 65 LEU CA C 65 58.552 58.552 58.471 0.081 18496 349 1 . 1 1 65 65 LEU CB C 65 41.358 41.358 41.719 -0.361 18496 350 1 . 1 1 65 65 LEU H H 65 7.660 7.660 8.118 -0.458 18496 351 1 . 1 1 66 66 LEU N N 66 115.733 115.733 118.183 -2.450 18496 352 1 . 1 1 66 66 LEU HA H 66 3.556 3.556 3.626 -0.070 18496 353 1 . 1 1 66 66 LEU C C 66 179.729 179.729 178.818 0.911 18496 354 1 . 1 1 66 66 LEU CA C 66 58.069 58.069 58.086 -0.017 18496 355 1 . 1 1 66 66 LEU CB C 66 41.625 41.625 40.972 0.653 18496 356 1 . 1 1 66 66 LEU H H 66 8.083 8.083 8.183 -0.100 18496 357 1 . 1 1 67 67 LYS N N 67 119.120 119.120 119.956 -0.836 18496 358 1 . 1 1 67 67 LYS HA H 67 3.965 3.965 3.804 0.161 18496 359 1 . 1 1 67 67 LYS C C 67 179.379 179.379 179.019 0.360 18496 360 1 . 1 1 67 67 LYS CA C 67 59.227 59.227 59.829 -0.602 18496 361 1 . 1 1 67 67 LYS CB C 67 32.737 32.737 32.227 0.510 18496 362 1 . 1 1 67 67 LYS H H 67 7.861 7.861 8.100 -0.239 18496 363 1 . 1 1 68 68 GLU N N 68 116.924 116.924 118.797 -1.873 18496 364 1 . 1 1 68 68 GLU HA H 68 4.409 4.409 4.083 0.326 18496 365 1 . 1 1 68 68 GLU CA C 68 57.712 57.712 58.713 -1.001 18496 366 1 . 1 1 68 68 GLU CB C 68 29.586 29.586 29.457 0.129 18496 367 1 . 1 1 68 68 GLU H H 68 8.319 8.319 7.892 0.427 18496 368 1 . 1 1 69 69 LEU N N 69 120.032 120.032 120.003 0.029 18496 369 1 . 1 1 69 69 LEU HA H 69 4.107 4.107 3.942 0.165 18496 370 1 . 1 1 69 69 LEU CA C 69 57.563 57.563 57.518 0.045 18496 371 1 . 1 1 69 69 LEU CB C 69 41.373 41.373 41.522 -0.149 18496 372 1 . 1 1 69 69 LEU H H 69 8.233 8.233 8.541 -0.308 18496 373 1 . 1 1 70 70 GLY N N 70 105.472 105.472 105.426 0.046 18496 374 1 . 1 1 70 70 GLY C C 70 174.986 174.986 175.852 -0.866 18496 375 1 . 1 1 70 70 GLY CA C 70 46.704 46.704 46.780 -0.077 18496 376 1 . 1 1 70 70 GLY H H 70 7.960 7.960 8.563 -0.603 18496 377 1 . 1 1 71 71 ASN N N 71 118.596 118.596 119.424 -0.828 18496 378 1 . 1 1 71 71 ASN HA H 71 4.681 4.681 4.816 -0.135 18496 379 1 . 1 1 71 71 ASN C C 71 176.412 176.412 177.737 -1.325 18496 380 1 . 1 1 71 71 ASN CA C 71 54.407 54.407 55.138 -0.731 18496 381 1 . 1 1 71 71 ASN CB C 71 38.729 38.729 38.637 0.092 18496 382 1 . 1 1 71 71 ASN H H 71 7.857 7.857 7.726 0.131 18496 383 1 . 1 1 72 72 LYS N N 72 119.973 119.973 120.120 -0.147 18496 384 1 . 1 1 72 72 LYS HA H 72 4.282 4.282 4.141 0.141 18496 385 1 . 1 1 72 72 LYS CA C 72 57.338 57.338 58.034 -0.696 18496 386 1 . 1 1 72 72 LYS CB C 72 32.755 32.755 32.075 0.680 18496 387 1 . 1 1 72 72 LYS H H 72 8.100 8.100 7.973 0.127 18496 388 1 . 1 1 73 73 LEU HA H 73 4.281 4.281 4.301 -0.020 18496 389 1 . 1 1 73 73 LEU CA C 73 55.774 55.774 54.891 0.883 18496 390 1 . 1 1 73 73 LEU CB C 73 41.983 41.983 42.209 -0.226 18496 stop_ save_