data_25148 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 25148 _Entry.PDB_ID 2MT4 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 25148 _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 4 4 GLU HA H 4 4.138 4.138 4.174 -0.036 25148 2 1 1 . 1 1 4 4 GLU C C 4 179.152 179.152 178.172 0.980 25148 3 1 1 . 1 1 4 4 GLU CA C 4 59.566 59.566 59.178 0.388 25148 4 1 1 . 1 1 4 4 GLU CB C 4 29.407 29.407 29.234 0.173 25148 5 1 1 . 1 1 5 5 LEU N N 5 121.360 121.360 116.410 4.950 25148 6 1 1 . 1 1 5 5 LEU HA H 5 4.195 4.195 4.108 0.087 25148 7 1 1 . 1 1 5 5 LEU C C 5 178.179 178.179 178.256 -0.077 25148 8 1 1 . 1 1 5 5 LEU CA C 5 57.830 57.830 57.590 0.240 25148 9 1 1 . 1 1 5 5 LEU CB C 5 41.630 41.630 41.221 0.409 25148 10 1 1 . 1 1 5 5 LEU H H 5 7.877 7.877 7.876 0.001 25148 11 1 1 . 1 1 6 6 LEU N N 6 118.058 118.058 119.074 -1.016 25148 12 1 1 . 1 1 6 6 LEU HA H 6 3.919 3.919 3.887 0.032 25148 13 1 1 . 1 1 6 6 LEU C C 6 180.274 180.274 179.203 1.071 25148 14 1 1 . 1 1 6 6 LEU CA C 6 58.221 58.221 57.620 0.601 25148 15 1 1 . 1 1 6 6 LEU CB C 6 40.684 40.684 41.100 -0.416 25148 16 1 1 . 1 1 6 6 LEU H H 6 7.685 7.685 7.519 0.166 25148 17 1 1 . 1 1 7 7 ASP N N 7 120.662 120.662 118.303 2.359 25148 18 1 1 . 1 1 7 7 ASP HA H 7 4.416 4.416 4.476 -0.060 25148 19 1 1 . 1 1 7 7 ASP C C 7 178.738 178.738 177.881 0.857 25148 20 1 1 . 1 1 7 7 ASP CA C 7 57.519 57.519 56.105 1.415 25148 21 1 1 . 1 1 7 7 ASP CB C 7 40.167 40.167 40.882 -0.715 25148 22 1 1 . 1 1 7 7 ASP H H 7 8.427 8.427 7.680 0.747 25148 23 1 1 . 1 1 8 8 ALA N N 8 122.612 122.612 123.035 -0.423 25148 24 1 1 . 1 1 8 8 ALA HA H 8 4.146 4.146 4.047 0.099 25148 25 1 1 . 1 1 8 8 ALA C C 8 180.787 180.787 179.897 0.890 25148 26 1 1 . 1 1 8 8 ALA CA C 8 55.165 55.165 55.158 0.007 25148 27 1 1 . 1 1 8 8 ALA CB C 8 17.711 17.711 18.396 -0.685 25148 28 1 1 . 1 1 8 8 ALA H H 8 7.847 7.847 7.766 0.081 25148 29 1 1 . 1 1 9 9 LEU N N 9 116.977 116.977 117.364 -0.387 25148 30 1 1 . 1 1 9 9 LEU HA H 9 4.115 4.115 3.899 0.216 25148 31 1 1 . 1 1 9 9 LEU C C 9 179.510 179.510 179.336 0.174 25148 32 1 1 . 1 1 9 9 LEU CA C 9 57.468 57.468 57.943 -0.475 25148 33 1 1 . 1 1 9 9 LEU CB C 9 41.203 41.203 41.571 -0.367 25148 34 1 1 . 1 1 9 9 LEU H H 9 8.256 8.256 7.940 0.316 25148 35 1 1 . 1 1 10 10 THR N N 10 118.764 118.764 116.493 2.271 25148 36 1 1 . 1 1 10 10 THR HA H 10 4.487 4.487 3.934 0.553 25148 37 1 1 . 1 1 10 10 THR C C 10 176.567 176.567 176.843 -0.276 25148 38 1 1 . 1 1 10 10 THR CA C 10 68.768 68.768 67.157 1.611 25148 39 1 1 . 1 1 10 10 THR CB C 10 66.961 66.961 68.749 -1.788 25148 40 1 1 . 1 1 10 10 THR H H 10 8.218 8.218 7.381 0.837 25148 41 1 1 . 1 1 11 11 ILE N N 11 122.555 122.555 120.022 2.533 25148 42 1 1 . 1 1 11 11 ILE HA H 11 3.779 3.779 3.723 0.056 25148 43 1 1 . 1 1 11 11 ILE C C 11 177.793 177.793 177.511 0.282 25148 44 1 1 . 1 1 11 11 ILE CA C 11 64.695 64.695 64.939 -0.244 25148 45 1 1 . 1 1 11 11 ILE CB C 11 37.856 37.856 37.702 0.154 25148 46 1 1 . 1 1 11 11 ILE H H 11 7.632 7.632 7.744 -0.112 25148 47 1 1 . 1 1 12 12 LEU N N 12 120.469 120.469 117.731 2.738 25148 48 1 1 . 1 1 12 12 LEU HA H 12 4.065 4.065 4.106 -0.041 25148 49 1 1 . 1 1 12 12 LEU C C 12 179.139 179.139 179.274 -0.135 25148 50 1 1 . 1 1 12 12 LEU CA C 12 57.944 57.944 56.987 0.957 25148 51 1 1 . 1 1 12 12 LEU CB C 12 42.170 42.170 41.542 0.628 25148 52 1 1 . 1 1 12 12 LEU H H 12 7.951 7.951 7.504 0.447 25148 53 1 1 . 1 1 13 13 GLU N N 13 119.669 119.669 120.677 -1.008 25148 54 1 1 . 1 1 13 13 GLU HA H 13 4.183 4.183 4.009 0.174 25148 55 1 1 . 1 1 13 13 GLU C C 13 179.007 179.007 177.729 1.278 25148 56 1 1 . 1 1 13 13 GLU CA C 13 59.703 59.703 58.918 0.785 25148 57 1 1 . 1 1 13 13 GLU CB C 13 30.110 30.110 29.488 0.622 25148 58 1 1 . 1 1 13 13 GLU H H 13 8.003 8.003 7.906 0.097 25148 59 1 1 . 1 1 14 14 LYS N N 14 118.935 118.935 116.791 2.144 25148 60 1 1 . 1 1 14 14 LYS HA H 14 4.124 4.124 4.066 0.058 25148 61 1 1 . 1 1 14 14 LYS CA C 14 58.847 58.847 57.692 1.155 25148 62 1 1 . 1 1 14 14 LYS CB C 14 33.053 33.053 32.762 0.291 25148 63 1 1 . 1 1 14 14 LYS H H 14 7.862 7.862 7.429 0.433 25148 64 1 1 . 1 1 15 15 GLU HA H 15 3.693 3.693 4.346 -0.653 25148 65 1 1 . 1 1 15 15 GLU CA C 15 56.688 56.688 54.950 1.738 25148 66 1 1 . 1 1 15 15 GLU CB C 15 32.204 32.204 30.088 2.116 25148 67 1 1 . 1 1 16 16 LYS HA H 16 4.678 4.678 4.246 0.432 25148 68 1 1 . 1 1 16 16 LYS CA C 16 55.135 55.135 56.737 -1.602 25148 69 1 1 . 1 1 16 16 LYS CB C 16 34.049 34.049 32.075 1.974 25148 70 1 1 . 1 1 17 17 GLY CA C 17 46.541 46.541 45.260 1.281 25148 71 1 1 . 1 1 18 18 ILE N N 18 115.364 115.364 121.657 -6.293 25148 72 1 1 . 1 1 18 18 ILE HA H 18 4.079 4.079 4.167 -0.088 25148 73 1 1 . 1 1 18 18 ILE C C 18 174.751 174.751 175.178 -0.427 25148 74 1 1 . 1 1 18 18 ILE CA C 18 60.333 60.333 59.954 0.379 25148 75 1 1 . 1 1 18 18 ILE CB C 18 39.044 39.044 37.092 1.952 25148 76 1 1 . 1 1 18 18 ILE H H 18 8.203 8.203 7.516 0.687 25148 77 1 1 . 1 1 19 19 SER N N 19 119.891 119.891 119.992 -0.101 25148 78 1 1 . 1 1 19 19 SER HA H 19 4.362 4.362 4.400 -0.038 25148 79 1 1 . 1 1 19 19 SER CA C 19 58.476 58.476 58.893 -0.417 25148 80 1 1 . 1 1 19 19 SER CB C 19 63.533 63.533 63.885 -0.352 25148 81 1 1 . 1 1 19 19 SER H H 19 8.253 8.253 8.378 -0.125 25148 82 1 1 . 1 1 20 20 LYS N N 20 124.782 124.782 128.419 -3.637 25148 83 1 1 . 1 1 20 20 LYS HA H 20 4.137 4.137 4.094 0.043 25148 84 1 1 . 1 1 20 20 LYS C C 20 177.889 177.889 177.479 0.410 25148 85 1 1 . 1 1 20 20 LYS CA C 20 59.485 59.485 59.057 0.428 25148 86 1 1 . 1 1 20 20 LYS CB C 20 32.711 32.711 32.039 0.672 25148 87 1 1 . 1 1 20 20 LYS H H 20 8.918 8.918 8.750 0.168 25148 88 1 1 . 1 1 21 21 GLU N N 21 117.831 117.831 118.512 -0.681 25148 89 1 1 . 1 1 21 21 GLU HA H 21 3.957 3.957 4.042 -0.085 25148 90 1 1 . 1 1 21 21 GLU C C 21 178.822 178.822 178.493 0.329 25148 91 1 1 . 1 1 21 21 GLU CA C 21 59.529 59.529 58.816 0.713 25148 92 1 1 . 1 1 21 21 GLU CB C 21 29.237 29.237 28.839 0.398 25148 93 1 1 . 1 1 21 21 GLU H H 21 8.361 8.361 8.714 -0.353 25148 94 1 1 . 1 1 22 22 ILE N N 22 118.690 118.690 119.120 -0.430 25148 95 1 1 . 1 1 22 22 ILE HA H 22 3.884 3.884 3.951 -0.067 25148 96 1 1 . 1 1 22 22 ILE C C 22 179.247 179.247 177.451 1.796 25148 97 1 1 . 1 1 22 22 ILE CA C 22 63.735 63.735 63.987 -0.252 25148 98 1 1 . 1 1 22 22 ILE CB C 22 37.415 37.415 38.207 -0.792 25148 99 1 1 . 1 1 22 22 ILE H H 22 7.353 7.353 7.346 0.007 25148 100 1 1 . 1 1 23 23 ILE N N 23 120.880 120.880 120.818 0.062 25148 101 1 1 . 1 1 23 23 ILE HA H 23 3.733 3.733 3.736 -0.003 25148 102 1 1 . 1 1 23 23 ILE C C 23 177.817 177.817 177.988 -0.171 25148 103 1 1 . 1 1 23 23 ILE CA C 23 64.172 64.172 63.584 0.588 25148 104 1 1 . 1 1 23 23 ILE CB C 23 36.473 36.473 36.807 -0.334 25148 105 1 1 . 1 1 23 23 ILE H H 23 7.571 7.571 7.128 0.443 25148 106 1 1 . 1 1 24 24 ILE N N 24 121.460 121.460 118.719 2.741 25148 107 1 1 . 1 1 24 24 ILE HA H 24 3.486 3.486 3.619 -0.133 25148 108 1 1 . 1 1 24 24 ILE C C 24 177.759 177.759 177.634 0.125 25148 109 1 1 . 1 1 24 24 ILE CA C 24 66.641 66.641 65.972 0.669 25148 110 1 1 . 1 1 24 24 ILE CB C 24 37.307 37.307 37.346 -0.039 25148 111 1 1 . 1 1 24 24 ILE H H 24 8.709 8.709 7.745 0.964 25148 112 1 1 . 1 1 25 25 GLU N N 25 119.323 119.323 119.184 0.139 25148 113 1 1 . 1 1 25 25 GLU HA H 25 4.177 4.177 4.388 -0.211 25148 114 1 1 . 1 1 25 25 GLU C C 25 179.348 179.348 178.766 0.582 25148 115 1 1 . 1 1 25 25 GLU CA C 25 59.951 59.951 58.825 1.125 25148 116 1 1 . 1 1 25 25 GLU CB C 25 29.340 29.340 29.248 0.092 25148 117 1 1 . 1 1 25 25 GLU H H 25 8.048 8.048 7.660 0.388 25148 118 1 1 . 1 1 26 26 ALA N N 26 122.390 122.390 122.730 -0.340 25148 119 1 1 . 1 1 26 26 ALA HA H 26 4.325 4.325 4.108 0.217 25148 120 1 1 . 1 1 26 26 ALA C C 26 181.440 181.440 179.709 1.731 25148 121 1 1 . 1 1 26 26 ALA CA C 26 54.935 54.935 54.925 0.010 25148 122 1 1 . 1 1 26 26 ALA CB C 26 17.834 17.834 18.290 -0.456 25148 123 1 1 . 1 1 26 26 ALA H H 26 7.768 7.768 7.870 -0.102 25148 124 1 1 . 1 1 27 27 ILE N N 27 122.342 122.342 119.741 2.601 25148 125 1 1 . 1 1 27 27 ILE HA H 27 3.575 3.575 3.607 -0.032 25148 126 1 1 . 1 1 27 27 ILE C C 27 177.541 177.541 178.067 -0.526 25148 127 1 1 . 1 1 27 27 ILE CA C 27 66.536 66.536 65.631 0.905 25148 128 1 1 . 1 1 27 27 ILE CB C 27 37.886 37.886 37.710 0.176 25148 129 1 1 . 1 1 27 27 ILE H H 27 8.805 8.805 7.545 1.260 25148 130 1 1 . 1 1 28 28 GLU N N 28 120.188 120.188 119.384 0.804 25148 131 1 1 . 1 1 28 28 GLU HA H 28 3.687 3.687 3.890 -0.203 25148 132 1 1 . 1 1 28 28 GLU C C 28 178.707 178.707 178.990 -0.283 25148 133 1 1 . 1 1 28 28 GLU CA C 28 61.458 61.458 59.925 1.533 25148 134 1 1 . 1 1 28 28 GLU CB C 28 29.624 29.624 29.249 0.375 25148 135 1 1 . 1 1 28 28 GLU H H 28 8.882 8.882 7.675 1.207 25148 136 1 1 . 1 1 29 29 ALA N N 29 119.293 119.293 121.105 -1.812 25148 137 1 1 . 1 1 29 29 ALA HA H 29 4.214 4.214 4.056 0.158 25148 138 1 1 . 1 1 29 29 ALA C C 29 181.200 181.200 179.728 1.472 25148 139 1 1 . 1 1 29 29 ALA CA C 29 55.435 55.435 54.896 0.539 25148 140 1 1 . 1 1 29 29 ALA CB C 29 18.090 18.090 18.069 0.021 25148 141 1 1 . 1 1 29 29 ALA H H 29 8.065 8.065 7.941 0.124 25148 142 1 1 . 1 1 30 30 ALA N N 30 121.729 121.729 121.891 -0.162 25148 143 1 1 . 1 1 30 30 ALA HA H 30 4.307 4.307 4.130 0.177 25148 144 1 1 . 1 1 30 30 ALA C C 30 181.315 181.315 179.540 1.775 25148 145 1 1 . 1 1 30 30 ALA CA C 30 54.594 54.594 54.678 -0.084 25148 146 1 1 . 1 1 30 30 ALA CB C 30 18.704 18.704 18.369 0.336 25148 147 1 1 . 1 1 30 30 ALA H H 30 8.099 8.099 7.544 0.555 25148 148 1 1 . 1 1 31 31 LEU N N 31 120.900 120.900 121.010 -0.110 25148 149 1 1 . 1 1 31 31 LEU HA H 31 4.347 4.347 4.046 0.301 25148 150 1 1 . 1 1 31 31 LEU C C 31 179.137 179.137 179.274 -0.137 25148 151 1 1 . 1 1 31 31 LEU CA C 31 57.569 57.569 59.288 -1.719 25148 152 1 1 . 1 1 31 31 LEU CB C 31 42.353 42.353 41.964 0.389 25148 153 1 1 . 1 1 31 31 LEU H H 31 8.863 8.863 8.198 0.665 25148 154 1 1 . 1 1 32 32 ILE N N 32 122.410 122.410 118.245 4.165 25148 155 1 1 . 1 1 32 32 ILE HA H 32 3.699 3.699 3.687 0.012 25148 156 1 1 . 1 1 32 32 ILE C C 32 178.303 178.303 177.663 0.640 25148 157 1 1 . 1 1 32 32 ILE CA C 32 66.066 66.066 65.213 0.853 25148 158 1 1 . 1 1 32 32 ILE CB C 32 37.882 37.882 37.949 -0.067 25148 159 1 1 . 1 1 32 32 ILE H H 32 8.234 8.234 8.492 -0.258 25148 160 1 1 . 1 1 33 33 SER N N 33 114.201 114.201 115.608 -1.407 25148 161 1 1 . 1 1 33 33 SER HA H 33 4.311 4.311 4.173 0.138 25148 162 1 1 . 1 1 33 33 SER C C 33 177.012 177.012 176.634 0.378 25148 163 1 1 . 1 1 33 33 SER CA C 33 61.860 61.860 61.804 0.056 25148 164 1 1 . 1 1 33 33 SER CB C 33 62.508 62.508 63.153 -0.645 25148 165 1 1 . 1 1 33 33 SER H H 33 7.558 7.558 7.772 -0.214 25148 166 1 1 . 1 1 34 34 ALA N N 34 122.893 122.893 124.565 -1.672 25148 167 1 1 . 1 1 34 34 ALA HA H 34 4.215 4.215 4.138 0.077 25148 168 1 1 . 1 1 34 34 ALA C C 34 180.814 180.814 179.173 1.641 25148 169 1 1 . 1 1 34 34 ALA CA C 34 55.283 55.283 54.899 0.384 25148 170 1 1 . 1 1 34 34 ALA CB C 34 18.273 18.273 18.370 -0.097 25148 171 1 1 . 1 1 34 34 ALA H H 34 8.409 8.409 8.148 0.261 25148 172 1 1 . 1 1 35 35 TYR N N 35 120.259 120.259 118.995 1.264 25148 173 1 1 . 1 1 35 35 TYR HA H 35 4.393 4.393 4.418 -0.025 25148 174 1 1 . 1 1 35 35 TYR C C 35 177.892 177.892 177.882 0.010 25148 175 1 1 . 1 1 35 35 TYR CA C 35 63.071 63.071 60.291 2.780 25148 176 1 1 . 1 1 35 35 TYR CB C 35 38.021 38.021 39.000 -0.979 25148 177 1 1 . 1 1 35 35 TYR H H 35 8.975 8.975 8.132 0.843 25148 178 1 1 . 1 1 36 36 LYS N N 36 120.942 120.942 121.063 -0.121 25148 179 1 1 . 1 1 36 36 LYS HA H 36 4.032 4.032 4.053 -0.021 25148 180 1 1 . 1 1 36 36 LYS C C 36 177.797 177.797 178.878 -1.081 25148 181 1 1 . 1 1 36 36 LYS CA C 36 59.900 59.900 59.283 0.617 25148 182 1 1 . 1 1 36 36 LYS CB C 36 32.429 32.429 32.200 0.229 25148 183 1 1 . 1 1 36 36 LYS H H 36 8.654 8.654 8.097 0.557 25148 184 1 1 . 1 1 37 37 ARG N N 37 115.139 115.139 117.211 -2.072 25148 185 1 1 . 1 1 37 37 ARG HA H 37 4.101 4.101 4.049 0.052 25148 186 1 1 . 1 1 37 37 ARG C C 37 177.517 177.517 178.140 -0.623 25148 187 1 1 . 1 1 37 37 ARG CA C 37 58.276 58.276 58.362 -0.086 25148 188 1 1 . 1 1 37 37 ARG CB C 37 31.014 31.014 29.404 1.611 25148 189 1 1 . 1 1 37 37 ARG H H 37 8.138 8.138 7.733 0.405 25148 190 1 1 . 1 1 38 38 ASN N N 38 112.555 112.555 116.945 -4.390 25148 191 1 1 . 1 1 38 38 ASN HA H 38 4.540 4.540 4.209 0.331 25148 192 1 1 . 1 1 38 38 ASN C C 38 173.994 173.994 175.173 -1.179 25148 193 1 1 . 1 1 38 38 ASN CA C 38 54.722 54.722 55.284 -0.562 25148 194 1 1 . 1 1 38 38 ASN CB C 38 42.077 42.077 38.837 3.240 25148 195 1 1 . 1 1 38 38 ASN H H 38 7.426 7.426 7.559 -0.133 25148 196 1 1 . 1 1 39 39 PHE N N 39 116.711 116.711 115.875 0.836 25148 197 1 1 . 1 1 39 39 PHE HA H 39 4.569 4.569 4.757 -0.188 25148 198 1 1 . 1 1 39 39 PHE CA C 39 58.913 58.913 56.339 2.574 25148 199 1 1 . 1 1 39 39 PHE CB C 39 39.781 39.781 38.407 1.374 25148 200 1 1 . 1 1 39 39 PHE H H 39 7.959 7.959 7.385 0.574 25148 201 1 1 . 1 1 40 40 ASN HA H 40 4.018 4.018 4.583 -0.565 25148 202 1 1 . 1 1 40 40 ASN CA C 40 58.944 58.944 54.993 3.951 25148 203 1 1 . 1 1 41 41 GLN HA H 41 4.298 4.298 4.449 -0.151 25148 204 1 1 . 1 1 41 41 GLN C C 41 175.237 175.237 175.649 -0.412 25148 205 1 1 . 1 1 41 41 GLN CA C 41 57.360 57.360 56.477 0.883 25148 206 1 1 . 1 1 41 41 GLN CB C 41 28.724 28.724 28.101 0.623 25148 207 1 1 . 1 1 42 42 ALA N N 42 120.514 120.514 120.940 -0.426 25148 208 1 1 . 1 1 42 42 ALA HA H 42 4.622 4.622 4.513 0.109 25148 209 1 1 . 1 1 42 42 ALA C C 42 175.922 175.922 176.429 -0.507 25148 210 1 1 . 1 1 42 42 ALA CA C 42 51.841 51.841 52.238 -0.397 25148 211 1 1 . 1 1 42 42 ALA CB C 42 21.576 21.576 20.550 1.026 25148 212 1 1 . 1 1 42 42 ALA H H 42 7.817 7.817 8.068 -0.251 25148 213 1 1 . 1 1 43 43 GLN N N 43 117.594 117.594 116.274 1.320 25148 214 1 1 . 1 1 43 43 GLN HA H 43 4.265 4.265 4.437 -0.172 25148 215 1 1 . 1 1 43 43 GLN C C 43 174.942 174.942 173.881 1.061 25148 216 1 1 . 1 1 43 43 GLN CA C 43 57.047 57.047 55.258 1.789 25148 217 1 1 . 1 1 43 43 GLN CB C 43 30.863 30.863 31.079 -0.216 25148 218 1 1 . 1 1 43 43 GLN H H 43 7.400 7.400 7.537 -0.137 25148 219 1 1 . 1 1 44 44 ASN N N 44 120.467 120.467 120.274 0.193 25148 220 1 1 . 1 1 44 44 ASN HA H 44 5.005 5.005 4.714 0.291 25148 221 1 1 . 1 1 44 44 ASN C C 44 174.365 174.365 173.717 0.648 25148 222 1 1 . 1 1 44 44 ASN CA C 44 52.381 52.381 53.197 -0.816 25148 223 1 1 . 1 1 44 44 ASN CB C 44 38.177 38.177 39.213 -1.036 25148 224 1 1 . 1 1 44 44 ASN H H 44 9.123 9.123 8.666 0.457 25148 225 1 1 . 1 1 45 45 VAL N N 45 115.479 115.479 117.346 -1.867 25148 226 1 1 . 1 1 45 45 VAL HA H 45 5.376 5.376 4.180 1.196 25148 227 1 1 . 1 1 45 45 VAL C C 45 174.908 174.908 173.902 1.006 25148 228 1 1 . 1 1 45 45 VAL CA C 45 59.022 59.022 61.684 -2.663 25148 229 1 1 . 1 1 45 45 VAL CB C 45 35.776 35.776 35.311 0.465 25148 230 1 1 . 1 1 45 45 VAL H H 45 7.732 7.732 8.256 -0.524 25148 231 1 1 . 1 1 46 46 ARG N N 46 121.146 121.146 126.114 -4.968 25148 232 1 1 . 1 1 46 46 ARG HA H 46 4.566 4.566 4.773 -0.207 25148 233 1 1 . 1 1 46 46 ARG C C 46 173.790 173.790 174.587 -0.797 25148 234 1 1 . 1 1 46 46 ARG CA C 46 54.762 54.762 54.928 -0.166 25148 235 1 1 . 1 1 46 46 ARG CB C 46 33.946 33.946 32.480 1.466 25148 236 1 1 . 1 1 46 46 ARG H H 46 8.850 8.850 9.061 -0.211 25148 237 1 1 . 1 1 47 47 VAL N N 47 122.339 122.339 125.286 -2.947 25148 238 1 1 . 1 1 47 47 VAL HA H 47 4.741 4.741 4.532 0.209 25148 239 1 1 . 1 1 47 47 VAL C C 47 173.541 173.541 175.968 -2.427 25148 240 1 1 . 1 1 47 47 VAL CA C 47 60.893 60.893 61.336 -0.443 25148 241 1 1 . 1 1 47 47 VAL CB C 47 33.563 33.563 32.880 0.683 25148 242 1 1 . 1 1 47 47 VAL H H 47 8.444 8.444 8.524 -0.080 25148 243 1 1 . 1 1 48 48 ASP N N 48 127.701 127.701 126.366 1.335 25148 244 1 1 . 1 1 48 48 ASP HA H 48 4.946 4.946 4.976 -0.030 25148 245 1 1 . 1 1 48 48 ASP C C 48 173.744 173.744 174.630 -0.886 25148 246 1 1 . 1 1 48 48 ASP CA C 48 52.651 52.651 52.946 -0.295 25148 247 1 1 . 1 1 48 48 ASP CB C 48 45.225 45.225 43.699 1.526 25148 248 1 1 . 1 1 48 48 ASP H H 48 9.068 9.068 8.712 0.356 25148 249 1 1 . 1 1 49 49 LEU N N 49 130.945 130.945 127.019 3.926 25148 250 1 1 . 1 1 49 49 LEU HA H 49 4.774 4.774 4.640 0.134 25148 251 1 1 . 1 1 49 49 LEU C C 49 174.531 174.531 175.855 -1.324 25148 252 1 1 . 1 1 49 49 LEU CA C 49 54.337 54.337 54.437 -0.100 25148 253 1 1 . 1 1 49 49 LEU CB C 49 43.192 43.192 44.023 -0.831 25148 254 1 1 . 1 1 49 49 LEU H H 49 9.369 9.369 8.028 1.341 25148 255 1 1 . 1 1 50 50 ASN N N 50 126.268 126.268 124.067 2.201 25148 256 1 1 . 1 1 50 50 ASN HA H 50 4.629 4.629 5.027 -0.398 25148 257 1 1 . 1 1 50 50 ASN C C 50 176.602 176.602 175.360 1.242 25148 258 1 1 . 1 1 50 50 ASN CA C 50 54.048 54.048 52.733 1.315 25148 259 1 1 . 1 1 50 50 ASN CB C 50 39.891 39.891 39.803 0.088 25148 260 1 1 . 1 1 50 50 ASN H H 50 8.672 8.672 8.705 -0.033 25148 261 1 1 . 1 1 51 51 ARG N N 51 125.897 125.897 124.259 1.638 25148 262 1 1 . 1 1 51 51 ARG HA H 51 3.789 3.789 4.243 -0.454 25148 263 1 1 . 1 1 51 51 ARG C C 51 175.681 175.681 176.163 -0.482 25148 264 1 1 . 1 1 51 51 ARG CA C 51 58.162 58.162 58.520 -0.358 25148 265 1 1 . 1 1 51 51 ARG CB C 51 29.944 29.944 29.862 0.082 25148 266 1 1 . 1 1 51 51 ARG H H 51 8.984 8.984 8.822 0.162 25148 267 1 1 . 1 1 52 52 GLU N N 52 116.733 116.733 117.804 -1.071 25148 268 1 1 . 1 1 52 52 GLU HA H 52 4.368 4.368 4.158 0.210 25148 269 1 1 . 1 1 52 52 GLU C C 52 178.049 178.049 177.305 0.744 25148 270 1 1 . 1 1 52 52 GLU CA C 52 58.048 58.048 57.997 0.051 25148 271 1 1 . 1 1 52 52 GLU CB C 52 30.716 30.716 29.205 1.511 25148 272 1 1 . 1 1 52 52 GLU H H 52 8.541 8.541 8.269 0.272 25148 273 1 1 . 1 1 53 53 THR N N 53 106.556 106.556 112.595 -6.039 25148 274 1 1 . 1 1 53 53 THR HA H 53 4.424 4.424 4.485 -0.061 25148 275 1 1 . 1 1 53 53 THR C C 53 176.352 176.352 174.978 1.374 25148 276 1 1 . 1 1 53 53 THR CA C 53 61.320 61.320 61.533 -0.213 25148 277 1 1 . 1 1 53 53 THR CB C 53 71.220 71.220 70.122 1.098 25148 278 1 1 . 1 1 53 53 THR H H 53 8.085 8.085 7.673 0.412 25148 279 1 1 . 1 1 54 54 GLY N N 54 111.843 111.843 110.499 1.344 25148 280 1 1 . 1 1 54 54 GLY C C 54 172.690 172.690 174.360 -1.670 25148 281 1 1 . 1 1 54 54 GLY CA C 54 45.417 45.417 46.209 -0.792 25148 282 1 1 . 1 1 54 54 GLY H H 54 8.330 8.330 7.703 0.627 25148 283 1 1 . 1 1 55 55 SER N N 55 113.844 113.844 114.087 -0.243 25148 284 1 1 . 1 1 55 55 SER HA H 55 4.279 4.279 4.685 -0.406 25148 285 1 1 . 1 1 55 55 SER C C 55 174.127 174.127 173.107 1.020 25148 286 1 1 . 1 1 55 55 SER CA C 55 59.229 59.229 57.846 1.383 25148 287 1 1 . 1 1 55 55 SER CB C 55 63.939 63.939 65.325 -1.386 25148 288 1 1 . 1 1 55 55 SER H H 55 7.653 7.653 7.554 0.099 25148 289 1 1 . 1 1 56 56 ILE N N 56 125.286 125.286 120.239 5.047 25148 290 1 1 . 1 1 56 56 ILE HA H 56 5.082 5.082 4.649 0.433 25148 291 1 1 . 1 1 56 56 ILE C C 56 175.346 175.346 174.347 0.999 25148 292 1 1 . 1 1 56 56 ILE CA C 56 59.967 59.967 60.332 -0.365 25148 293 1 1 . 1 1 56 56 ILE CB C 56 40.165 40.165 42.327 -2.162 25148 294 1 1 . 1 1 56 56 ILE H H 56 8.478 8.478 8.455 0.023 25148 295 1 1 . 1 1 57 57 ARG N N 57 126.332 126.332 127.129 -0.797 25148 296 1 1 . 1 1 57 57 ARG HA H 57 4.740 4.740 4.567 0.173 25148 297 1 1 . 1 1 57 57 ARG C C 57 173.921 173.921 173.607 0.314 25148 298 1 1 . 1 1 57 57 ARG CA C 57 54.311 54.311 53.899 0.412 25148 299 1 1 . 1 1 57 57 ARG CB C 57 35.805 35.805 33.312 2.493 25148 300 1 1 . 1 1 57 57 ARG H H 57 8.590 8.590 8.337 0.253 25148 301 1 1 . 1 1 58 58 VAL N N 58 120.987 120.987 123.236 -2.249 25148 302 1 1 . 1 1 58 58 VAL HA H 58 4.334 4.334 4.029 0.305 25148 303 1 1 . 1 1 58 58 VAL C C 58 174.204 174.204 174.110 0.094 25148 304 1 1 . 1 1 58 58 VAL CA C 58 60.861 60.861 60.649 0.212 25148 305 1 1 . 1 1 58 58 VAL CB C 58 33.383 33.383 31.448 1.935 25148 306 1 1 . 1 1 58 58 VAL H H 58 8.585 8.585 8.237 0.348 25148 307 1 1 . 1 1 59 59 PHE N N 59 124.913 124.913 126.188 -1.275 25148 308 1 1 . 1 1 59 59 PHE HA H 59 5.046 5.046 5.329 -0.283 25148 309 1 1 . 1 1 59 59 PHE C C 59 174.446 174.446 174.325 0.121 25148 310 1 1 . 1 1 59 59 PHE CA C 59 56.695 56.695 55.568 1.127 25148 311 1 1 . 1 1 59 59 PHE CB C 59 42.779 42.779 43.310 -0.531 25148 312 1 1 . 1 1 59 59 PHE H H 59 8.920 8.920 8.501 0.419 25148 313 1 1 . 1 1 60 60 ALA N N 60 124.035 124.035 124.227 -0.192 25148 314 1 1 . 1 1 60 60 ALA HA H 60 5.102 5.102 4.802 0.300 25148 315 1 1 . 1 1 60 60 ALA C C 60 176.017 176.017 176.270 -0.253 25148 316 1 1 . 1 1 60 60 ALA CA C 60 50.083 50.083 50.786 -0.703 25148 317 1 1 . 1 1 60 60 ALA CB C 60 22.400 22.400 20.631 1.769 25148 318 1 1 . 1 1 60 60 ALA H H 60 9.457 9.457 8.673 0.784 25148 319 1 1 . 1 1 61 61 ARG N N 61 121.530 121.530 124.166 -2.636 25148 320 1 1 . 1 1 61 61 ARG HA H 61 4.958 4.958 5.080 -0.122 25148 321 1 1 . 1 1 61 61 ARG C C 61 176.737 176.737 175.767 0.970 25148 322 1 1 . 1 1 61 61 ARG CA C 61 55.375 55.375 55.529 -0.154 25148 323 1 1 . 1 1 61 61 ARG CB C 61 31.230 31.230 31.401 -0.171 25148 324 1 1 . 1 1 61 61 ARG H H 61 8.447 8.447 8.668 -0.221 25148 325 1 1 . 1 1 62 62 LYS N N 62 124.784 124.784 125.820 -1.036 25148 326 1 1 . 1 1 62 62 LYS HA H 62 4.709 4.709 4.488 0.221 25148 327 1 1 . 1 1 62 62 LYS C C 62 173.899 173.899 174.869 -0.970 25148 328 1 1 . 1 1 62 62 LYS CA C 62 54.812 54.812 54.965 -0.153 25148 329 1 1 . 1 1 62 62 LYS CB C 62 37.147 37.147 35.889 1.258 25148 330 1 1 . 1 1 62 62 LYS H H 62 9.137 9.137 7.985 1.152 25148 331 1 1 . 1 1 63 63 ASP N N 63 122.552 122.552 123.342 -0.790 25148 332 1 1 . 1 1 63 63 ASP HA H 63 4.877 4.877 4.758 0.119 25148 333 1 1 . 1 1 63 63 ASP C C 63 175.560 175.560 176.400 -0.840 25148 334 1 1 . 1 1 63 63 ASP CA C 63 54.576 54.576 54.131 0.445 25148 335 1 1 . 1 1 63 63 ASP CB C 63 42.841 42.841 41.259 1.582 25148 336 1 1 . 1 1 63 63 ASP H H 63 8.334 8.334 8.716 -0.382 25148 337 1 1 . 1 1 64 64 VAL N N 64 123.109 123.109 126.635 -3.526 25148 338 1 1 . 1 1 64 64 VAL HA H 64 4.557 4.557 4.493 0.064 25148 339 1 1 . 1 1 64 64 VAL C C 64 177.260 177.260 175.428 1.832 25148 340 1 1 . 1 1 64 64 VAL CA C 64 62.268 62.268 63.392 -1.124 25148 341 1 1 . 1 1 64 64 VAL CB C 64 30.348 30.348 30.859 -0.511 25148 342 1 1 . 1 1 64 64 VAL H H 64 8.693 8.693 7.999 0.694 25148 343 1 1 . 1 1 65 65 VAL N N 65 122.320 122.320 121.491 0.829 25148 344 1 1 . 1 1 65 65 VAL HA H 65 4.939 4.939 4.577 0.362 25148 345 1 1 . 1 1 65 65 VAL C C 65 174.754 174.754 175.320 -0.566 25148 346 1 1 . 1 1 65 65 VAL CA C 65 59.173 59.173 59.358 -0.186 25148 347 1 1 . 1 1 65 65 VAL CB C 65 36.289 36.289 35.496 0.793 25148 348 1 1 . 1 1 65 65 VAL H H 65 8.656 8.656 8.400 0.256 25148 349 1 1 . 1 1 66 66 ASP N N 66 119.805 119.805 123.260 -3.455 25148 350 1 1 . 1 1 66 66 ASP HA H 66 4.499 4.499 4.328 0.171 25148 351 1 1 . 1 1 66 66 ASP C C 66 176.565 176.565 175.596 0.969 25148 352 1 1 . 1 1 66 66 ASP CA C 66 57.236 57.236 56.488 0.748 25148 353 1 1 . 1 1 66 66 ASP CB C 66 41.662 41.662 41.224 0.438 25148 354 1 1 . 1 1 66 66 ASP H H 66 8.628 8.628 8.895 -0.267 25148 355 1 1 . 1 1 67 67 GLU N N 67 117.604 117.604 117.021 0.583 25148 356 1 1 . 1 1 67 67 GLU HA H 67 4.350 4.350 4.307 0.043 25148 357 1 1 . 1 1 67 67 GLU C C 67 173.736 173.736 174.217 -0.481 25148 358 1 1 . 1 1 67 67 GLU CA C 67 55.203 55.203 54.591 0.612 25148 359 1 1 . 1 1 67 67 GLU CB C 67 32.240 32.240 32.314 -0.074 25148 360 1 1 . 1 1 67 67 GLU H H 67 7.525 7.525 7.847 -0.322 25148 361 1 1 . 1 1 68 68 VAL N N 68 125.774 125.774 124.071 1.703 25148 362 1 1 . 1 1 68 68 VAL HA H 68 3.578 3.578 3.714 -0.136 25148 363 1 1 . 1 1 68 68 VAL C C 68 175.885 175.885 175.415 0.470 25148 364 1 1 . 1 1 68 68 VAL CA C 68 63.397 63.397 64.543 -1.147 25148 365 1 1 . 1 1 68 68 VAL CB C 68 32.452 32.452 31.593 0.859 25148 366 1 1 . 1 1 68 68 VAL H H 68 8.573 8.573 8.384 0.189 25148 367 1 1 . 1 1 69 69 TYR N N 69 129.859 129.859 124.411 5.448 25148 368 1 1 . 1 1 69 69 TYR HA H 69 4.642 4.642 4.564 0.078 25148 369 1 1 . 1 1 69 69 TYR C C 69 176.100 176.100 175.837 0.263 25148 370 1 1 . 1 1 69 69 TYR CA C 69 59.092 59.092 58.403 0.689 25148 371 1 1 . 1 1 69 69 TYR CB C 69 39.830 39.830 40.090 -0.260 25148 372 1 1 . 1 1 69 69 TYR H H 69 9.801 9.801 7.878 1.923 25148 373 1 1 . 1 1 70 70 ASP N N 70 120.204 120.204 119.114 1.090 25148 374 1 1 . 1 1 70 70 ASP HA H 70 4.772 4.772 4.863 -0.091 25148 375 1 1 . 1 1 70 70 ASP C C 70 176.622 176.622 176.708 -0.086 25148 376 1 1 . 1 1 70 70 ASP CA C 70 52.885 52.885 53.413 -0.528 25148 377 1 1 . 1 1 70 70 ASP CB C 70 41.878 41.878 41.048 0.830 25148 378 1 1 . 1 1 70 70 ASP H H 70 8.348 8.348 8.086 0.262 25148 379 1 1 . 1 1 71 71 GLN N N 71 125.440 125.440 122.857 2.583 25148 380 1 1 . 1 1 71 71 GLN HA H 71 4.315 4.315 4.053 0.262 25148 381 1 1 . 1 1 71 71 GLN C C 71 175.819 175.819 176.818 -0.999 25148 382 1 1 . 1 1 71 71 GLN CA C 71 57.914 57.914 58.302 -0.388 25148 383 1 1 . 1 1 71 71 GLN CB C 71 28.307 28.307 28.450 -0.143 25148 384 1 1 . 1 1 71 71 GLN H H 71 9.097 9.097 8.882 0.215 25148 385 1 1 . 1 1 72 72 ARG N N 72 116.306 116.306 115.991 0.315 25148 386 1 1 . 1 1 72 72 ARG HA H 72 4.252 4.252 4.156 0.096 25148 387 1 1 . 1 1 72 72 ARG C C 72 178.087 178.087 175.983 2.104 25148 388 1 1 . 1 1 72 72 ARG CA C 72 58.532 58.532 57.496 1.036 25148 389 1 1 . 1 1 72 72 ARG CB C 72 30.143 30.143 30.780 -0.637 25148 390 1 1 . 1 1 72 72 ARG H H 72 8.534 8.534 8.300 0.234 25148 391 1 1 . 1 1 73 73 LEU N N 73 116.734 116.734 114.764 1.970 25148 392 1 1 . 1 1 73 73 LEU HA H 73 4.621 4.621 4.643 -0.022 25148 393 1 1 . 1 1 73 73 LEU C C 73 175.946 175.946 175.139 0.807 25148 394 1 1 . 1 1 73 73 LEU CA C 73 55.250 55.250 55.236 0.014 25148 395 1 1 . 1 1 73 73 LEU CB C 73 46.960 46.960 44.859 2.101 25148 396 1 1 . 1 1 73 73 LEU H H 73 7.460 7.460 7.395 0.065 25148 397 1 1 . 1 1 74 74 GLU N N 74 118.787 118.787 121.780 -2.993 25148 398 1 1 . 1 1 74 74 GLU HA H 74 5.403 5.403 4.581 0.822 25148 399 1 1 . 1 1 74 74 GLU C C 74 173.709 173.709 173.918 -0.209 25148 400 1 1 . 1 1 74 74 GLU CA C 74 54.914 54.914 56.335 -1.421 25148 401 1 1 . 1 1 74 74 GLU CB C 74 35.053 35.053 34.041 1.012 25148 402 1 1 . 1 1 74 74 GLU H H 74 7.752 7.752 8.280 -0.528 25148 403 1 1 . 1 1 75 75 ILE N N 75 119.803 119.803 120.767 -0.964 25148 404 1 1 . 1 1 75 75 ILE HA H 75 4.507 4.507 4.570 -0.063 25148 405 1 1 . 1 1 75 75 ILE C C 75 172.126 172.126 173.690 -1.564 25148 406 1 1 . 1 1 75 75 ILE CA C 75 58.664 58.664 60.405 -1.741 25148 407 1 1 . 1 1 75 75 ILE CB C 75 42.560 42.560 41.920 0.640 25148 408 1 1 . 1 1 75 75 ILE H H 75 8.975 8.975 8.266 0.709 25148 409 1 1 . 1 1 76 76 SER N N 76 123.236 123.236 123.839 -0.603 25148 410 1 1 . 1 1 76 76 SER HA H 76 4.505 4.505 4.738 -0.233 25148 411 1 1 . 1 1 76 76 SER C C 76 176.145 176.145 175.826 0.319 25148 412 1 1 . 1 1 76 76 SER CA C 76 58.108 58.108 57.948 0.160 25148 413 1 1 . 1 1 76 76 SER CB C 76 65.000 65.000 64.019 0.981 25148 414 1 1 . 1 1 76 76 SER H H 76 8.810 8.810 8.630 0.180 25148 415 1 1 . 1 1 77 77 ILE N N 77 120.629 120.629 127.308 -6.679 25148 416 1 1 . 1 1 77 77 ILE HA H 77 3.935 3.935 3.783 0.152 25148 417 1 1 . 1 1 77 77 ILE C C 77 175.806 175.806 176.664 -0.858 25148 418 1 1 . 1 1 77 77 ILE CA C 77 61.928 61.928 63.878 -1.950 25148 419 1 1 . 1 1 77 77 ILE CB C 77 38.031 38.031 38.364 -0.333 25148 420 1 1 . 1 1 77 77 ILE H H 77 8.321 8.321 8.155 0.166 25148 421 1 1 . 1 1 78 78 GLU N N 78 121.032 121.032 117.212 3.820 25148 422 1 1 . 1 1 78 78 GLU HA H 78 4.082 4.082 4.005 0.077 25148 423 1 1 . 1 1 78 78 GLU C C 78 179.829 179.829 178.479 1.350 25148 424 1 1 . 1 1 78 78 GLU CA C 78 60.180 60.180 58.847 1.333 25148 425 1 1 . 1 1 78 78 GLU CB C 78 28.988 28.988 28.928 0.060 25148 426 1 1 . 1 1 78 78 GLU H H 78 8.222 8.222 8.294 -0.072 25148 427 1 1 . 1 1 79 79 GLU N N 79 120.710 120.710 121.164 -0.454 25148 428 1 1 . 1 1 79 79 GLU HA H 79 4.012 4.012 4.099 -0.087 25148 429 1 1 . 1 1 79 79 GLU C C 79 180.339 180.339 178.981 1.358 25148 430 1 1 . 1 1 79 79 GLU CA C 79 59.332 59.332 58.784 0.548 25148 431 1 1 . 1 1 79 79 GLU CB C 79 29.317 29.317 29.383 -0.066 25148 432 1 1 . 1 1 79 79 GLU H H 79 7.908 7.908 7.761 0.147 25148 433 1 1 . 1 1 80 80 ALA N N 80 122.879 122.879 122.057 0.822 25148 434 1 1 . 1 1 80 80 ALA HA H 80 3.966 3.966 4.171 -0.205 25148 435 1 1 . 1 1 80 80 ALA C C 80 179.833 179.833 179.915 -0.082 25148 436 1 1 . 1 1 80 80 ALA CA C 80 55.881 55.881 54.998 0.883 25148 437 1 1 . 1 1 80 80 ALA CB C 80 18.870 18.870 18.140 0.730 25148 438 1 1 . 1 1 80 80 ALA H H 80 9.132 9.132 8.039 1.093 25148 439 1 1 . 1 1 81 81 GLN N N 81 115.829 115.829 116.612 -0.783 25148 440 1 1 . 1 1 81 81 GLN HA H 81 4.749 4.749 4.326 0.423 25148 441 1 1 . 1 1 81 81 GLN C C 81 178.126 178.126 177.949 0.177 25148 442 1 1 . 1 1 81 81 GLN CA C 81 57.682 57.682 58.048 -0.366 25148 443 1 1 . 1 1 81 81 GLN CB C 81 27.307 27.307 28.638 -1.331 25148 444 1 1 . 1 1 81 81 GLN H H 81 8.709 8.709 7.769 0.940 25148 445 1 1 . 1 1 82 82 GLY N N 82 105.531 105.531 106.660 -1.129 25148 446 1 1 . 1 1 82 82 GLY C C 82 174.917 174.917 175.010 -0.093 25148 447 1 1 . 1 1 82 82 GLY CA C 82 45.915 45.915 46.495 -0.580 25148 448 1 1 . 1 1 82 82 GLY H H 82 7.479 7.479 7.901 -0.422 25148 449 1 1 . 1 1 83 83 ILE N N 83 122.828 122.828 113.778 9.050 25148 450 1 1 . 1 1 83 83 ILE HA H 83 3.970 3.970 4.442 -0.472 25148 451 1 1 . 1 1 83 83 ILE C C 83 177.209 177.209 175.561 1.648 25148 452 1 1 . 1 1 83 83 ILE CA C 83 64.305 64.305 61.648 2.657 25148 453 1 1 . 1 1 83 83 ILE CB C 83 38.452 38.452 40.207 -1.755 25148 454 1 1 . 1 1 83 83 ILE H H 83 7.634 7.634 7.538 0.096 25148 455 1 1 . 1 1 84 84 HIS N N 84 118.927 118.927 120.029 -1.102 25148 456 1 1 . 1 1 84 84 HIS HA H 84 4.713 4.713 4.938 -0.225 25148 457 1 1 . 1 1 84 84 HIS CA C 84 55.487 55.487 54.410 1.077 25148 458 1 1 . 1 1 84 84 HIS CB C 84 33.506 33.506 32.314 1.192 25148 459 1 1 . 1 1 84 84 HIS H H 84 8.155 8.155 8.424 -0.269 25148 460 1 1 . 1 1 85 85 PRO HA H 85 4.456 4.456 4.634 -0.178 25148 461 1 1 . 1 1 85 85 PRO C C 85 177.357 177.357 177.285 0.072 25148 462 1 1 . 1 1 85 85 PRO CA C 85 64.475 64.475 64.103 0.372 25148 463 1 1 . 1 1 85 85 PRO CB C 85 32.489 32.489 32.127 0.362 25148 464 1 1 . 1 1 86 86 GLU N N 86 116.314 116.314 117.811 -1.497 25148 465 1 1 . 1 1 86 86 GLU HA H 86 4.286 4.286 4.101 0.185 25148 466 1 1 . 1 1 86 86 GLU C C 86 177.624 177.624 177.353 0.271 25148 467 1 1 . 1 1 86 86 GLU CA C 86 56.619 56.619 57.290 -0.671 25148 468 1 1 . 1 1 86 86 GLU CB C 86 29.389 29.389 29.688 -0.299 25148 469 1 1 . 1 1 86 86 GLU H H 86 8.938 8.938 7.754 1.184 25148 470 1 1 . 1 1 87 87 TYR N N 87 119.773 119.773 120.218 -0.445 25148 471 1 1 . 1 1 87 87 TYR HA H 87 4.744 4.744 4.238 0.506 25148 472 1 1 . 1 1 87 87 TYR C C 87 174.533 174.533 176.512 -1.979 25148 473 1 1 . 1 1 87 87 TYR CA C 87 59.117 59.117 59.438 -0.321 25148 474 1 1 . 1 1 87 87 TYR CB C 87 38.859 38.859 38.894 -0.035 25148 475 1 1 . 1 1 87 87 TYR H H 87 7.447 7.447 7.400 0.047 25148 476 1 1 . 1 1 88 88 MET N N 88 118.298 118.298 117.117 1.181 25148 477 1 1 . 1 1 88 88 MET HA H 88 4.770 4.770 4.726 0.044 25148 478 1 1 . 1 1 88 88 MET C C 88 175.638 175.638 174.071 1.567 25148 479 1 1 . 1 1 88 88 MET CA C 88 53.133 53.133 54.643 -1.510 25148 480 1 1 . 1 1 88 88 MET CB C 88 37.102 37.102 35.513 1.589 25148 481 1 1 . 1 1 88 88 MET H H 88 9.023 9.023 8.270 0.753 25148 482 1 1 . 1 1 89 89 VAL N N 89 120.157 120.157 124.099 -3.942 25148 483 1 1 . 1 1 89 89 VAL HA H 89 3.330 3.330 3.604 -0.274 25148 484 1 1 . 1 1 89 89 VAL C C 89 177.432 177.432 176.697 0.735 25148 485 1 1 . 1 1 89 89 VAL CA C 89 65.675 65.675 64.870 0.805 25148 486 1 1 . 1 1 89 89 VAL CB C 89 31.321 31.321 30.980 0.341 25148 487 1 1 . 1 1 89 89 VAL H H 89 8.313 8.313 8.628 -0.315 25148 488 1 1 . 1 1 90 90 GLY N N 90 116.935 116.935 115.660 1.275 25148 489 1 1 . 1 1 90 90 GLY C C 90 175.196 175.196 174.371 0.825 25148 490 1 1 . 1 1 90 90 GLY CA C 90 44.685 44.685 44.746 -0.061 25148 491 1 1 . 1 1 90 90 GLY H H 90 8.551 8.551 8.963 -0.412 25148 492 1 1 . 1 1 91 91 ASP N N 91 121.616 121.616 122.462 -0.846 25148 493 1 1 . 1 1 91 91 ASP HA H 91 4.790 4.790 4.922 -0.132 25148 494 1 1 . 1 1 91 91 ASP C C 91 174.431 174.431 174.884 -0.453 25148 495 1 1 . 1 1 91 91 ASP CA C 91 55.011 55.011 53.536 1.475 25148 496 1 1 . 1 1 91 91 ASP CB C 91 42.079 42.079 42.387 -0.308 25148 497 1 1 . 1 1 91 91 ASP H H 91 8.073 8.073 8.182 -0.109 25148 498 1 1 . 1 1 92 92 VAL N N 92 118.919 118.919 114.779 4.140 25148 499 1 1 . 1 1 92 92 VAL HA H 92 4.709 4.709 5.033 -0.324 25148 500 1 1 . 1 1 92 92 VAL C C 92 175.602 175.602 174.467 1.135 25148 501 1 1 . 1 1 92 92 VAL CA C 92 61.527 61.527 59.474 2.053 25148 502 1 1 . 1 1 92 92 VAL CB C 92 34.110 34.110 34.817 -0.707 25148 503 1 1 . 1 1 92 92 VAL H H 92 8.216 8.216 8.102 0.114 25148 504 1 1 . 1 1 93 93 VAL N N 93 123.922 123.922 123.427 0.495 25148 505 1 1 . 1 1 93 93 VAL HA H 93 4.231 4.231 4.219 0.012 25148 506 1 1 . 1 1 93 93 VAL C C 93 174.105 174.105 174.339 -0.234 25148 507 1 1 . 1 1 93 93 VAL CA C 93 59.644 59.644 59.313 0.331 25148 508 1 1 . 1 1 93 93 VAL CB C 93 34.661 34.661 35.255 -0.594 25148 509 1 1 . 1 1 93 93 VAL H H 93 8.812 8.812 7.884 0.928 25148 510 1 1 . 1 1 94 94 GLU N N 94 123.605 123.605 128.122 -4.517 25148 511 1 1 . 1 1 94 94 GLU HA H 94 5.347 5.347 5.329 0.018 25148 512 1 1 . 1 1 94 94 GLU C C 94 175.708 175.708 175.710 -0.002 25148 513 1 1 . 1 1 94 94 GLU CA C 94 54.979 54.979 55.013 -0.034 25148 514 1 1 . 1 1 94 94 GLU CB C 94 31.612 31.612 32.011 -0.399 25148 515 1 1 . 1 1 94 94 GLU H H 94 8.312 8.312 8.192 0.120 25148 516 1 1 . 1 1 95 95 ILE N N 95 123.581 123.581 123.634 -0.053 25148 517 1 1 . 1 1 95 95 ILE HA H 95 4.601 4.601 4.535 0.066 25148 518 1 1 . 1 1 95 95 ILE C C 95 175.081 175.081 175.058 0.023 25148 519 1 1 . 1 1 95 95 ILE CA C 95 58.601 58.601 59.710 -1.109 25148 520 1 1 . 1 1 95 95 ILE CB C 95 41.727 41.727 42.312 -0.585 25148 521 1 1 . 1 1 95 95 ILE H H 95 9.045 9.045 8.186 0.859 25148 522 1 1 . 1 1 96 96 GLU N N 96 128.094 128.094 127.988 0.106 25148 523 1 1 . 1 1 96 96 GLU HA H 96 4.098 4.098 4.160 -0.062 25148 524 1 1 . 1 1 96 96 GLU C C 96 176.845 176.845 175.640 1.205 25148 525 1 1 . 1 1 96 96 GLU CA C 96 57.853 57.853 57.956 -0.103 25148 526 1 1 . 1 1 96 96 GLU CB C 96 28.323 28.323 29.247 -0.924 25148 527 1 1 . 1 1 96 96 GLU H H 96 9.256 9.256 8.931 0.325 25148 528 1 1 . 1 1 97 97 VAL N N 97 118.446 118.446 123.841 -5.395 25148 529 1 1 . 1 1 97 97 VAL HA H 97 4.568 4.568 4.155 0.413 25148 530 1 1 . 1 1 97 97 VAL C C 97 175.051 175.051 175.119 -0.068 25148 531 1 1 . 1 1 97 97 VAL CA C 97 59.796 59.796 61.398 -1.602 25148 532 1 1 . 1 1 97 97 VAL CB C 97 32.399 32.399 33.057 -0.658 25148 533 1 1 . 1 1 97 97 VAL H H 97 8.609 8.609 8.857 -0.248 25148 534 1 1 . 1 1 98 98 THR N N 98 119.118 119.118 117.844 1.274 25148 535 1 1 . 1 1 98 98 THR HA H 98 3.320 3.320 3.865 -0.545 25148 536 1 1 . 1 1 98 98 THR CA C 98 61.628 61.628 59.787 1.841 25148 537 1 1 . 1 1 98 98 THR CB C 98 70.031 70.031 69.212 0.819 25148 538 1 1 . 1 1 98 98 THR H H 98 7.396 7.396 7.401 -0.005 25148 539 1 1 . 1 1 99 99 PRO HA H 99 4.458 4.458 4.649 -0.191 25148 540 1 1 . 1 1 99 99 PRO CA C 99 62.348 62.348 62.524 -0.176 25148 541 1 1 . 1 1 99 99 PRO CB C 99 33.182 33.182 32.563 0.619 25148 542 1 1 . 1 1 100 100 LYS HA H 100 4.126 4.126 4.142 -0.016 25148 543 1 1 . 1 1 100 100 LYS CA C 100 58.773 58.773 58.248 0.525 25148 544 1 1 . 1 1 100 100 LYS CB C 100 32.195 32.195 32.147 0.048 25148 545 1 1 . 1 1 101 101 ASP HA H 101 4.924 4.924 4.831 0.093 25148 546 1 1 . 1 1 101 101 ASP C C 101 176.884 176.884 176.224 0.660 25148 547 1 1 . 1 1 101 101 ASP CA C 101 54.134 54.134 53.732 0.402 25148 548 1 1 . 1 1 101 101 ASP CB C 101 40.272 40.272 40.544 -0.272 25148 549 1 1 . 1 1 102 102 PHE N N 102 118.703 118.703 121.600 -2.897 25148 550 1 1 . 1 1 102 102 PHE HA H 102 4.295 4.295 4.205 0.090 25148 551 1 1 . 1 1 102 102 PHE C C 102 176.477 176.477 177.052 -0.575 25148 552 1 1 . 1 1 102 102 PHE CA C 102 60.748 60.748 60.258 0.490 25148 553 1 1 . 1 1 102 102 PHE CB C 102 39.667 39.667 39.160 0.506 25148 554 1 1 . 1 1 102 102 PHE H H 102 7.862 7.862 7.687 0.175 25148 555 1 1 . 1 1 103 103 GLY CA C 103 47.430 47.430 47.291 0.139 25148 556 1 1 . 1 1 104 104 ARG N N 104 121.819 121.819 120.899 0.920 25148 557 1 1 . 1 1 104 104 ARG HA H 104 4.176 4.176 4.164 0.012 25148 558 1 1 . 1 1 104 104 ARG C C 104 178.912 178.912 178.643 0.269 25148 559 1 1 . 1 1 104 104 ARG CA C 104 59.235 59.235 58.529 0.706 25148 560 1 1 . 1 1 104 104 ARG CB C 104 30.000 30.000 30.371 -0.371 25148 561 1 1 . 1 1 104 104 ARG H H 104 7.809 7.809 7.495 0.314 25148 562 1 1 . 1 1 105 105 ILE N N 105 120.331 120.331 120.691 -0.360 25148 563 1 1 . 1 1 105 105 ILE HA H 105 3.836 3.836 3.636 0.200 25148 564 1 1 . 1 1 105 105 ILE C C 105 179.206 179.206 177.516 1.690 25148 565 1 1 . 1 1 105 105 ILE CA C 105 63.025 63.025 64.764 -1.739 25148 566 1 1 . 1 1 105 105 ILE CB C 105 38.127 38.127 37.544 0.583 25148 567 1 1 . 1 1 105 105 ILE H H 105 7.203 7.203 7.433 -0.230 25148 568 1 1 . 1 1 106 106 ALA N N 106 124.867 124.867 122.475 2.392 25148 569 1 1 . 1 1 106 106 ALA HA H 106 3.665 3.665 3.540 0.125 25148 570 1 1 . 1 1 106 106 ALA C C 106 178.590 178.590 178.876 -0.286 25148 571 1 1 . 1 1 106 106 ALA CA C 106 54.842 54.842 55.443 -0.601 25148 572 1 1 . 1 1 106 106 ALA CB C 106 18.659 18.659 17.691 0.968 25148 573 1 1 . 1 1 106 106 ALA H H 106 8.813 8.813 8.206 0.607 25148 574 1 1 . 1 1 107 107 ALA N N 107 119.597 119.597 120.382 -0.785 25148 575 1 1 . 1 1 107 107 ALA HA H 107 4.014 4.014 3.937 0.077 25148 576 1 1 . 1 1 107 107 ALA C C 107 180.214 180.214 179.475 0.739 25148 577 1 1 . 1 1 107 107 ALA CA C 107 55.454 55.454 54.699 0.755 25148 578 1 1 . 1 1 107 107 ALA CB C 107 18.260 18.260 18.133 0.127 25148 579 1 1 . 1 1 107 107 ALA H H 107 8.012 8.012 7.717 0.295 25148 580 1 1 . 1 1 108 108 GLN N N 108 116.896 116.896 118.521 -1.625 25148 581 1 1 . 1 1 108 108 GLN HA H 108 4.054 4.054 4.022 0.032 25148 582 1 1 . 1 1 108 108 GLN C C 108 178.784 178.784 178.452 0.332 25148 583 1 1 . 1 1 108 108 GLN CA C 108 58.705 58.705 58.953 -0.248 25148 584 1 1 . 1 1 108 108 GLN CB C 108 28.647 28.647 28.785 -0.139 25148 585 1 1 . 1 1 108 108 GLN H H 108 7.498 7.498 8.009 -0.511 25148 586 1 1 . 1 1 109 109 THR N N 109 117.495 117.495 116.405 1.090 25148 587 1 1 . 1 1 109 109 THR HA H 109 3.917 3.917 4.252 -0.335 25148 588 1 1 . 1 1 109 109 THR C C 109 175.732 175.732 175.971 -0.239 25148 589 1 1 . 1 1 109 109 THR CA C 109 66.989 66.989 66.038 0.951 25148 590 1 1 . 1 1 109 109 THR CB C 109 68.766 68.766 68.851 -0.085 25148 591 1 1 . 1 1 109 109 THR H H 109 8.203 8.203 8.163 0.040 25148 592 1 1 . 1 1 110 110 ALA N N 110 122.308 122.308 124.234 -1.926 25148 593 1 1 . 1 1 110 110 ALA HA H 110 3.854 3.854 4.049 -0.195 25148 594 1 1 . 1 1 110 110 ALA C C 110 178.380 178.380 178.835 -0.455 25148 595 1 1 . 1 1 110 110 ALA CA C 110 55.903 55.903 54.994 0.909 25148 596 1 1 . 1 1 110 110 ALA CB C 110 18.524 18.524 18.407 0.117 25148 597 1 1 . 1 1 110 110 ALA H H 110 8.668 8.668 8.303 0.365 25148 598 1 1 . 1 1 111 111 LYS N N 111 115.552 115.552 118.248 -2.696 25148 599 1 1 . 1 1 111 111 LYS HA H 111 3.923 3.923 3.998 -0.075 25148 600 1 1 . 1 1 111 111 LYS C C 111 179.111 179.111 178.737 0.374 25148 601 1 1 . 1 1 111 111 LYS CA C 111 59.825 59.825 59.199 0.626 25148 602 1 1 . 1 1 111 111 LYS CB C 111 32.251 32.251 31.700 0.551 25148 603 1 1 . 1 1 111 111 LYS H H 111 7.642 7.642 8.346 -0.704 25148 604 1 1 . 1 1 112 112 GLN N N 112 120.178 120.178 118.762 1.416 25148 605 1 1 . 1 1 112 112 GLN HA H 112 4.060 4.060 4.133 -0.073 25148 606 1 1 . 1 1 112 112 GLN C C 112 178.355 178.355 178.201 0.154 25148 607 1 1 . 1 1 112 112 GLN CA C 112 59.240 59.240 58.204 1.036 25148 608 1 1 . 1 1 112 112 GLN CB C 112 28.250 28.250 28.510 -0.260 25148 609 1 1 . 1 1 112 112 GLN H H 112 7.798 7.798 7.647 0.151 25148 610 1 1 . 1 1 113 113 VAL N N 113 119.799 119.799 121.158 -1.359 25148 611 1 1 . 1 1 113 113 VAL HA H 113 3.705 3.705 3.744 -0.039 25148 612 1 1 . 1 1 113 113 VAL C C 113 178.303 178.303 177.896 0.407 25148 613 1 1 . 1 1 113 113 VAL CA C 113 66.277 66.277 65.396 0.881 25148 614 1 1 . 1 1 113 113 VAL CB C 113 31.954 31.954 31.379 0.575 25148 615 1 1 . 1 1 113 113 VAL H H 113 8.105 8.105 7.646 0.459 25148 616 1 1 . 1 1 114 114 VAL N N 114 118.265 118.265 116.235 2.030 25148 617 1 1 . 1 1 114 114 VAL HA H 114 3.392 3.392 3.589 -0.197 25148 618 1 1 . 1 1 114 114 VAL C C 114 177.360 177.360 177.900 -0.540 25148 619 1 1 . 1 1 114 114 VAL CA C 114 67.832 67.832 66.762 1.070 25148 620 1 1 . 1 1 114 114 VAL CB C 114 31.801 31.801 30.911 0.890 25148 621 1 1 . 1 1 114 114 VAL H H 114 8.180 8.180 7.897 0.283 25148 622 1 1 . 1 1 115 115 THR N N 115 113.460 113.460 115.665 -2.205 25148 623 1 1 . 1 1 115 115 THR HA H 115 3.856 3.856 3.938 -0.082 25148 624 1 1 . 1 1 115 115 THR C C 115 176.529 176.529 176.577 -0.048 25148 625 1 1 . 1 1 115 115 THR CA C 115 66.706 66.706 66.437 0.269 25148 626 1 1 . 1 1 115 115 THR CB C 115 69.008 69.008 68.470 0.538 25148 627 1 1 . 1 1 115 115 THR H H 115 8.143 8.143 7.651 0.492 25148 628 1 1 . 1 1 116 116 GLN N N 116 120.129 120.129 120.638 -0.509 25148 629 1 1 . 1 1 116 116 GLN HA H 116 4.054 4.054 4.011 0.043 25148 630 1 1 . 1 1 116 116 GLN C C 116 178.100 178.100 178.545 -0.445 25148 631 1 1 . 1 1 116 116 GLN CA C 116 58.950 58.950 59.249 -0.299 25148 632 1 1 . 1 1 116 116 GLN CB C 116 28.244 28.244 28.477 -0.233 25148 633 1 1 . 1 1 116 116 GLN H H 116 7.936 7.936 7.609 0.327 25148 634 1 1 . 1 1 117 117 ARG N N 117 117.838 117.838 118.559 -0.721 25148 635 1 1 . 1 1 117 117 ARG HA H 117 4.174 4.174 4.297 -0.123 25148 636 1 1 . 1 1 117 117 ARG C C 117 179.138 179.138 178.791 0.347 25148 637 1 1 . 1 1 117 117 ARG CA C 117 57.461 57.461 57.829 -0.368 25148 638 1 1 . 1 1 117 117 ARG CB C 117 29.548 29.548 29.493 0.055 25148 639 1 1 . 1 1 117 117 ARG H H 117 8.240 8.240 7.778 0.462 25148 640 1 1 . 1 1 118 118 VAL N N 118 120.278 120.278 119.506 0.772 25148 641 1 1 . 1 1 118 118 VAL HA H 118 3.709 3.709 3.736 -0.027 25148 642 1 1 . 1 1 118 118 VAL C C 118 177.597 177.597 177.685 -0.088 25148 643 1 1 . 1 1 118 118 VAL CA C 118 66.246 66.246 66.799 -0.552 25148 644 1 1 . 1 1 118 118 VAL CB C 118 31.785 31.785 31.428 0.357 25148 645 1 1 . 1 1 118 118 VAL H H 118 8.480 8.480 7.219 1.261 25148 646 1 1 . 1 1 119 119 ARG N N 119 120.197 120.197 118.646 1.551 25148 647 1 1 . 1 1 119 119 ARG HA H 119 4.173 4.173 4.309 -0.136 25148 648 1 1 . 1 1 119 119 ARG C C 119 178.864 178.864 178.751 0.113 25148 649 1 1 . 1 1 119 119 ARG CA C 119 58.772 58.772 58.618 0.154 25148 650 1 1 . 1 1 119 119 ARG CB C 119 29.873 29.873 29.653 0.220 25148 651 1 1 . 1 1 119 119 ARG H H 119 7.899 7.899 7.666 0.233 25148 652 1 1 . 1 1 120 120 GLU N N 120 118.768 118.768 120.499 -1.731 25148 653 1 1 . 1 1 120 120 GLU HA H 120 4.110 4.110 4.092 0.018 25148 654 1 1 . 1 1 120 120 GLU C C 120 177.823 177.823 178.525 -0.702 25148 655 1 1 . 1 1 120 120 GLU CA C 120 58.223 58.223 58.925 -0.702 25148 656 1 1 . 1 1 120 120 GLU CB C 120 29.854 29.854 29.482 0.372 25148 657 1 1 . 1 1 120 120 GLU H H 120 8.084 8.084 8.387 -0.303 25148 658 1 1 . 1 1 121 121 ALA N N 121 121.984 121.984 121.357 0.627 25148 659 1 1 . 1 1 121 121 ALA HA H 121 4.296 4.296 4.037 0.259 25148 660 1 1 . 1 1 121 121 ALA C C 121 178.586 178.586 180.083 -1.497 25148 661 1 1 . 1 1 121 121 ALA CA C 121 53.475 53.475 55.041 -1.566 25148 662 1 1 . 1 1 121 121 ALA CB C 121 18.856 18.856 18.343 0.513 25148 663 1 1 . 1 1 121 121 ALA H H 121 7.810 7.810 7.933 -0.123 25148 664 1 1 . 1 1 122 122 GLU N N 122 118.229 118.229 116.793 1.436 25148 665 1 1 . 1 1 122 122 GLU HA H 122 4.241 4.241 4.093 0.148 25148 666 1 1 . 1 1 122 122 GLU C C 122 176.839 176.839 178.204 -1.365 25148 667 1 1 . 1 1 122 122 GLU CA C 122 57.118 57.118 58.057 -0.939 25148 668 1 1 . 1 1 122 122 GLU CB C 122 30.018 30.018 29.317 0.701 25148 669 1 1 . 1 1 122 122 GLU H H 122 7.938 7.938 7.942 -0.004 25148 670 1 1 . 1 1 123 123 ARG N N 123 120.601 120.601 120.261 0.340 25148 671 1 1 . 1 1 123 123 ARG HA H 123 4.348 4.348 4.155 0.193 25148 672 1 1 . 1 1 123 123 ARG C C 123 176.071 176.071 176.335 -0.264 25148 673 1 1 . 1 1 123 123 ARG CA C 123 56.510 56.510 56.940 -0.430 25148 674 1 1 . 1 1 123 123 ARG CB C 123 30.765 30.765 30.809 -0.044 25148 675 1 1 . 1 1 123 123 ARG H H 123 7.977 7.977 7.482 0.495 25148 676 1 2 . 1 1 4 4 GLU HA H 4 4.138 4.138 4.126 0.012 25148 677 1 2 . 1 1 4 4 GLU C C 4 179.152 179.152 177.877 1.275 25148 678 1 2 . 1 1 4 4 GLU CA C 4 59.566 59.566 59.039 0.527 25148 679 1 2 . 1 1 4 4 GLU CB C 4 29.407 29.407 29.512 -0.105 25148 680 1 2 . 1 1 5 5 LEU N N 5 121.360 121.360 116.569 4.791 25148 681 1 2 . 1 1 5 5 LEU HA H 5 4.195 4.195 4.041 0.154 25148 682 1 2 . 1 1 5 5 LEU C C 5 178.179 178.179 178.181 -0.002 25148 683 1 2 . 1 1 5 5 LEU CA C 5 57.830 57.830 57.566 0.264 25148 684 1 2 . 1 1 5 5 LEU CB C 5 41.630 41.630 41.517 0.114 25148 685 1 2 . 1 1 5 5 LEU H H 5 7.877 7.877 7.992 -0.115 25148 686 1 2 . 1 1 6 6 LEU N N 6 118.058 118.058 119.034 -0.976 25148 687 1 2 . 1 1 6 6 LEU HA H 6 3.919 3.919 3.919 0.000 25148 688 1 2 . 1 1 6 6 LEU C C 6 180.274 180.274 179.051 1.223 25148 689 1 2 . 1 1 6 6 LEU CA C 6 58.221 58.221 57.569 0.652 25148 690 1 2 . 1 1 6 6 LEU CB C 6 40.684 40.684 41.237 -0.554 25148 691 1 2 . 1 1 6 6 LEU H H 6 7.685 7.685 7.527 0.158 25148 692 1 2 . 1 1 7 7 ASP N N 7 120.662 120.662 118.799 1.863 25148 693 1 2 . 1 1 7 7 ASP HA H 7 4.416 4.416 4.372 0.044 25148 694 1 2 . 1 1 7 7 ASP C C 7 178.738 178.738 177.857 0.881 25148 695 1 2 . 1 1 7 7 ASP CA C 7 57.519 57.519 57.106 0.413 25148 696 1 2 . 1 1 7 7 ASP CB C 7 40.167 40.167 40.746 -0.579 25148 697 1 2 . 1 1 7 7 ASP H H 7 8.427 8.427 7.737 0.691 25148 698 1 2 . 1 1 8 8 ALA N N 8 122.612 122.612 122.642 -0.030 25148 699 1 2 . 1 1 8 8 ALA HA H 8 4.146 4.146 4.037 0.109 25148 700 1 2 . 1 1 8 8 ALA C C 8 180.787 180.787 179.821 0.966 25148 701 1 2 . 1 1 8 8 ALA CA C 8 55.165 55.165 55.219 -0.054 25148 702 1 2 . 1 1 8 8 ALA CB C 8 17.711 17.711 18.387 -0.676 25148 703 1 2 . 1 1 8 8 ALA H H 8 7.847 7.847 7.541 0.306 25148 704 1 2 . 1 1 9 9 LEU N N 9 116.977 116.977 117.457 -0.480 25148 705 1 2 . 1 1 9 9 LEU HA H 9 4.115 4.115 3.855 0.260 25148 706 1 2 . 1 1 9 9 LEU C C 9 179.510 179.510 179.418 0.092 25148 707 1 2 . 1 1 9 9 LEU CA C 9 57.468 57.468 58.004 -0.536 25148 708 1 2 . 1 1 9 9 LEU CB C 9 41.203 41.203 41.624 -0.421 25148 709 1 2 . 1 1 9 9 LEU H H 9 8.256 8.256 7.746 0.510 25148 710 1 2 . 1 1 10 10 THR N N 10 118.764 118.764 115.941 2.823 25148 711 1 2 . 1 1 10 10 THR HA H 10 4.487 4.487 3.880 0.607 25148 712 1 2 . 1 1 10 10 THR C C 10 176.567 176.567 176.716 -0.149 25148 713 1 2 . 1 1 10 10 THR CA C 10 68.768 68.768 66.855 1.913 25148 714 1 2 . 1 1 10 10 THR CB C 10 66.961 66.961 68.698 -1.737 25148 715 1 2 . 1 1 10 10 THR H H 10 8.218 8.218 7.445 0.773 25148 716 1 2 . 1 1 11 11 ILE N N 11 122.555 122.555 120.172 2.383 25148 717 1 2 . 1 1 11 11 ILE HA H 11 3.779 3.779 3.761 0.018 25148 718 1 2 . 1 1 11 11 ILE C C 11 177.793 177.793 177.968 -0.175 25148 719 1 2 . 1 1 11 11 ILE CA C 11 64.695 64.695 64.945 -0.250 25148 720 1 2 . 1 1 11 11 ILE CB C 11 37.856 37.856 37.751 0.105 25148 721 1 2 . 1 1 11 11 ILE H H 11 7.632 7.632 7.822 -0.190 25148 722 1 2 . 1 1 12 12 LEU N N 12 120.469 120.469 117.607 2.862 25148 723 1 2 . 1 1 12 12 LEU HA H 12 4.065 4.065 4.118 -0.053 25148 724 1 2 . 1 1 12 12 LEU C C 12 179.139 179.139 178.819 0.320 25148 725 1 2 . 1 1 12 12 LEU CA C 12 57.944 57.944 56.796 1.148 25148 726 1 2 . 1 1 12 12 LEU CB C 12 42.170 42.170 41.234 0.936 25148 727 1 2 . 1 1 12 12 LEU H H 12 7.951 7.951 7.452 0.499 25148 728 1 2 . 1 1 13 13 GLU N N 13 119.669 119.669 118.893 0.776 25148 729 1 2 . 1 1 13 13 GLU HA H 13 4.183 4.183 4.037 0.146 25148 730 1 2 . 1 1 13 13 GLU C C 13 179.007 179.007 177.317 1.690 25148 731 1 2 . 1 1 13 13 GLU CA C 13 59.703 59.703 58.565 1.138 25148 732 1 2 . 1 1 13 13 GLU CB C 13 30.110 30.110 29.378 0.732 25148 733 1 2 . 1 1 13 13 GLU H H 13 8.003 8.003 7.835 0.168 25148 734 1 2 . 1 1 14 14 LYS N N 14 118.935 118.935 116.847 2.088 25148 735 1 2 . 1 1 14 14 LYS HA H 14 4.124 4.124 4.075 0.049 25148 736 1 2 . 1 1 14 14 LYS CA C 14 58.847 58.847 57.469 1.378 25148 737 1 2 . 1 1 14 14 LYS CB C 14 33.053 33.053 32.232 0.821 25148 738 1 2 . 1 1 14 14 LYS H H 14 7.862 7.862 7.390 0.472 25148 739 1 2 . 1 1 15 15 GLU HA H 15 3.693 3.693 4.248 -0.555 25148 740 1 2 . 1 1 15 15 GLU CA C 15 56.688 56.688 56.634 0.054 25148 741 1 2 . 1 1 15 15 GLU CB C 15 32.204 32.204 30.403 1.801 25148 742 1 2 . 1 1 16 16 LYS HA H 16 4.678 4.678 4.357 0.321 25148 743 1 2 . 1 1 16 16 LYS CA C 16 55.135 55.135 55.638 -0.503 25148 744 1 2 . 1 1 16 16 LYS CB C 16 34.049 34.049 32.877 1.172 25148 745 1 2 . 1 1 17 17 GLY CA C 17 46.541 46.541 45.427 1.114 25148 746 1 2 . 1 1 18 18 ILE N N 18 115.364 115.364 121.498 -6.134 25148 747 1 2 . 1 1 18 18 ILE HA H 18 4.079 4.079 4.278 -0.199 25148 748 1 2 . 1 1 18 18 ILE C C 18 174.751 174.751 175.094 -0.343 25148 749 1 2 . 1 1 18 18 ILE CA C 18 60.333 60.333 60.488 -0.155 25148 750 1 2 . 1 1 18 18 ILE CB C 18 39.044 39.044 39.186 -0.142 25148 751 1 2 . 1 1 18 18 ILE H H 18 8.203 8.203 7.626 0.577 25148 752 1 2 . 1 1 19 19 SER N N 19 119.891 119.891 120.922 -1.031 25148 753 1 2 . 1 1 19 19 SER HA H 19 4.362 4.362 4.840 -0.478 25148 754 1 2 . 1 1 19 19 SER CA C 19 58.476 58.476 57.254 1.222 25148 755 1 2 . 1 1 19 19 SER CB C 19 63.533 63.533 65.447 -1.914 25148 756 1 2 . 1 1 19 19 SER H H 19 8.253 8.253 8.683 -0.430 25148 757 1 2 . 1 1 20 20 LYS N N 20 124.782 124.782 126.697 -1.915 25148 758 1 2 . 1 1 20 20 LYS HA H 20 4.137 4.137 4.063 0.074 25148 759 1 2 . 1 1 20 20 LYS C C 20 177.889 177.889 177.516 0.373 25148 760 1 2 . 1 1 20 20 LYS CA C 20 59.485 59.485 59.088 0.397 25148 761 1 2 . 1 1 20 20 LYS CB C 20 32.711 32.711 32.012 0.699 25148 762 1 2 . 1 1 20 20 LYS H H 20 8.918 8.918 9.001 -0.083 25148 763 1 2 . 1 1 21 21 GLU N N 21 117.831 117.831 117.951 -0.120 25148 764 1 2 . 1 1 21 21 GLU HA H 21 3.957 3.957 4.077 -0.120 25148 765 1 2 . 1 1 21 21 GLU C C 21 178.822 178.822 178.479 0.343 25148 766 1 2 . 1 1 21 21 GLU CA C 21 59.529 59.529 58.981 0.548 25148 767 1 2 . 1 1 21 21 GLU CB C 21 29.237 29.237 28.942 0.295 25148 768 1 2 . 1 1 21 21 GLU H H 21 8.361 8.361 8.676 -0.315 25148 769 1 2 . 1 1 22 22 ILE N N 22 118.690 118.690 119.166 -0.476 25148 770 1 2 . 1 1 22 22 ILE HA H 22 3.884 3.884 3.920 -0.036 25148 771 1 2 . 1 1 22 22 ILE C C 22 179.247 179.247 177.614 1.633 25148 772 1 2 . 1 1 22 22 ILE CA C 22 63.735 63.735 63.903 -0.168 25148 773 1 2 . 1 1 22 22 ILE CB C 22 37.415 37.415 38.140 -0.725 25148 774 1 2 . 1 1 22 22 ILE H H 22 7.353 7.353 7.426 -0.073 25148 775 1 2 . 1 1 23 23 ILE N N 23 120.880 120.880 121.108 -0.228 25148 776 1 2 . 1 1 23 23 ILE HA H 23 3.733 3.733 3.735 -0.002 25148 777 1 2 . 1 1 23 23 ILE C C 23 177.817 177.817 177.805 0.012 25148 778 1 2 . 1 1 23 23 ILE CA C 23 64.172 64.172 63.025 1.147 25148 779 1 2 . 1 1 23 23 ILE CB C 23 36.473 36.473 37.009 -0.536 25148 780 1 2 . 1 1 23 23 ILE H H 23 7.571 7.571 7.550 0.021 25148 781 1 2 . 1 1 24 24 ILE N N 24 121.460 121.460 119.628 1.832 25148 782 1 2 . 1 1 24 24 ILE HA H 24 3.486 3.486 3.595 -0.109 25148 783 1 2 . 1 1 24 24 ILE C C 24 177.759 177.759 178.082 -0.323 25148 784 1 2 . 1 1 24 24 ILE CA C 24 66.641 66.641 66.091 0.550 25148 785 1 2 . 1 1 24 24 ILE CB C 24 37.307 37.307 37.507 -0.200 25148 786 1 2 . 1 1 24 24 ILE H H 24 8.709 8.709 8.125 0.584 25148 787 1 2 . 1 1 25 25 GLU N N 25 119.323 119.323 118.178 1.145 25148 788 1 2 . 1 1 25 25 GLU HA H 25 4.177 4.177 4.484 -0.307 25148 789 1 2 . 1 1 25 25 GLU C C 25 179.348 179.348 178.445 0.903 25148 790 1 2 . 1 1 25 25 GLU CA C 25 59.951 59.951 58.877 1.074 25148 791 1 2 . 1 1 25 25 GLU CB C 25 29.340 29.340 29.116 0.224 25148 792 1 2 . 1 1 25 25 GLU H H 25 8.048 8.048 7.969 0.079 25148 793 1 2 . 1 1 26 26 ALA N N 26 122.390 122.390 122.920 -0.530 25148 794 1 2 . 1 1 26 26 ALA HA H 26 4.325 4.325 4.099 0.226 25148 795 1 2 . 1 1 26 26 ALA C C 26 181.440 181.440 179.852 1.588 25148 796 1 2 . 1 1 26 26 ALA CA C 26 54.935 54.935 54.981 -0.046 25148 797 1 2 . 1 1 26 26 ALA CB C 26 17.834 17.834 18.221 -0.387 25148 798 1 2 . 1 1 26 26 ALA H H 26 7.768 7.768 7.811 -0.043 25148 799 1 2 . 1 1 27 27 ILE N N 27 122.342 122.342 119.203 3.139 25148 800 1 2 . 1 1 27 27 ILE HA H 27 3.575 3.575 3.619 -0.044 25148 801 1 2 . 1 1 27 27 ILE C C 27 177.541 177.541 178.113 -0.572 25148 802 1 2 . 1 1 27 27 ILE CA C 27 66.536 66.536 65.527 1.009 25148 803 1 2 . 1 1 27 27 ILE CB C 27 37.886 37.886 37.628 0.258 25148 804 1 2 . 1 1 27 27 ILE H H 27 8.805 8.805 7.664 1.141 25148 805 1 2 . 1 1 28 28 GLU N N 28 120.188 120.188 119.526 0.662 25148 806 1 2 . 1 1 28 28 GLU HA H 28 3.687 3.687 3.903 -0.216 25148 807 1 2 . 1 1 28 28 GLU C C 28 178.707 178.707 178.895 -0.188 25148 808 1 2 . 1 1 28 28 GLU CA C 28 61.458 61.458 59.983 1.475 25148 809 1 2 . 1 1 28 28 GLU CB C 28 29.624 29.624 29.188 0.436 25148 810 1 2 . 1 1 28 28 GLU H H 28 8.882 8.882 7.645 1.237 25148 811 1 2 . 1 1 29 29 ALA N N 29 119.293 119.293 121.119 -1.826 25148 812 1 2 . 1 1 29 29 ALA HA H 29 4.214 4.214 4.068 0.146 25148 813 1 2 . 1 1 29 29 ALA C C 29 181.200 181.200 179.744 1.456 25148 814 1 2 . 1 1 29 29 ALA CA C 29 55.435 55.435 54.901 0.534 25148 815 1 2 . 1 1 29 29 ALA CB C 29 18.090 18.090 18.104 -0.014 25148 816 1 2 . 1 1 29 29 ALA H H 29 8.065 8.065 7.750 0.315 25148 817 1 2 . 1 1 30 30 ALA N N 30 121.729 121.729 122.009 -0.280 25148 818 1 2 . 1 1 30 30 ALA HA H 30 4.307 4.307 4.151 0.156 25148 819 1 2 . 1 1 30 30 ALA C C 30 181.315 181.315 179.566 1.749 25148 820 1 2 . 1 1 30 30 ALA CA C 30 54.594 54.594 54.894 -0.300 25148 821 1 2 . 1 1 30 30 ALA CB C 30 18.704 18.704 18.339 0.365 25148 822 1 2 . 1 1 30 30 ALA H H 30 8.099 8.099 7.597 0.502 25148 823 1 2 . 1 1 31 31 LEU N N 31 120.900 120.900 120.607 0.293 25148 824 1 2 . 1 1 31 31 LEU HA H 31 4.347 4.347 4.158 0.189 25148 825 1 2 . 1 1 31 31 LEU C C 31 179.137 179.137 179.347 -0.210 25148 826 1 2 . 1 1 31 31 LEU CA C 31 57.569 57.569 58.036 -0.467 25148 827 1 2 . 1 1 31 31 LEU CB C 31 42.353 42.353 41.045 1.308 25148 828 1 2 . 1 1 31 31 LEU H H 31 8.863 8.863 8.196 0.667 25148 829 1 2 . 1 1 32 32 ILE N N 32 122.410 122.410 119.128 3.282 25148 830 1 2 . 1 1 32 32 ILE HA H 32 3.699 3.699 3.689 0.010 25148 831 1 2 . 1 1 32 32 ILE C C 32 178.303 178.303 177.828 0.475 25148 832 1 2 . 1 1 32 32 ILE CA C 32 66.066 66.066 65.458 0.608 25148 833 1 2 . 1 1 32 32 ILE CB C 32 37.882 37.882 37.938 -0.056 25148 834 1 2 . 1 1 32 32 ILE H H 32 8.234 8.234 8.314 -0.080 25148 835 1 2 . 1 1 33 33 SER N N 33 114.201 114.201 115.742 -1.541 25148 836 1 2 . 1 1 33 33 SER HA H 33 4.311 4.311 4.127 0.184 25148 837 1 2 . 1 1 33 33 SER C C 33 177.012 177.012 176.637 0.375 25148 838 1 2 . 1 1 33 33 SER CA C 33 61.860 61.860 62.032 -0.172 25148 839 1 2 . 1 1 33 33 SER CB C 33 62.508 62.508 63.215 -0.708 25148 840 1 2 . 1 1 33 33 SER H H 33 7.558 7.558 7.854 -0.296 25148 841 1 2 . 1 1 34 34 ALA N N 34 122.893 122.893 124.512 -1.619 25148 842 1 2 . 1 1 34 34 ALA HA H 34 4.215 4.215 4.083 0.132 25148 843 1 2 . 1 1 34 34 ALA C C 34 180.814 180.814 179.329 1.485 25148 844 1 2 . 1 1 34 34 ALA CA C 34 55.283 55.283 54.969 0.314 25148 845 1 2 . 1 1 34 34 ALA CB C 34 18.273 18.273 18.296 -0.023 25148 846 1 2 . 1 1 34 34 ALA H H 34 8.409 8.409 8.094 0.315 25148 847 1 2 . 1 1 35 35 TYR N N 35 120.259 120.259 118.929 1.330 25148 848 1 2 . 1 1 35 35 TYR HA H 35 4.393 4.393 4.392 0.001 25148 849 1 2 . 1 1 35 35 TYR C C 35 177.892 177.892 177.199 0.693 25148 850 1 2 . 1 1 35 35 TYR CA C 35 63.071 63.071 60.569 2.502 25148 851 1 2 . 1 1 35 35 TYR CB C 35 38.021 38.021 38.976 -0.955 25148 852 1 2 . 1 1 35 35 TYR H H 35 8.975 8.975 8.091 0.884 25148 853 1 2 . 1 1 36 36 LYS N N 36 120.942 120.942 120.142 0.800 25148 854 1 2 . 1 1 36 36 LYS HA H 36 4.032 4.032 4.044 -0.012 25148 855 1 2 . 1 1 36 36 LYS C C 36 177.797 177.797 178.025 -0.228 25148 856 1 2 . 1 1 36 36 LYS CA C 36 59.900 59.900 59.123 0.777 25148 857 1 2 . 1 1 36 36 LYS CB C 36 32.429 32.429 32.235 0.194 25148 858 1 2 . 1 1 36 36 LYS H H 36 8.654 8.654 8.098 0.556 25148 859 1 2 . 1 1 37 37 ARG N N 37 115.139 115.139 115.761 -0.622 25148 860 1 2 . 1 1 37 37 ARG HA H 37 4.101 4.101 4.106 -0.005 25148 861 1 2 . 1 1 37 37 ARG C C 37 177.517 177.517 177.868 -0.351 25148 862 1 2 . 1 1 37 37 ARG CA C 37 58.276 58.276 58.235 0.041 25148 863 1 2 . 1 1 37 37 ARG CB C 37 31.014 31.014 30.044 0.970 25148 864 1 2 . 1 1 37 37 ARG H H 37 8.138 8.138 7.710 0.428 25148 865 1 2 . 1 1 38 38 ASN N N 38 112.555 112.555 116.652 -4.097 25148 866 1 2 . 1 1 38 38 ASN HA H 38 4.540 4.540 4.307 0.233 25148 867 1 2 . 1 1 38 38 ASN C C 38 173.994 173.994 175.323 -1.329 25148 868 1 2 . 1 1 38 38 ASN CA C 38 54.722 54.722 55.318 -0.596 25148 869 1 2 . 1 1 38 38 ASN CB C 38 42.077 42.077 39.173 2.904 25148 870 1 2 . 1 1 38 38 ASN H H 38 7.426 7.426 7.532 -0.106 25148 871 1 2 . 1 1 39 39 PHE N N 39 116.711 116.711 117.521 -0.810 25148 872 1 2 . 1 1 39 39 PHE HA H 39 4.569 4.569 4.809 -0.240 25148 873 1 2 . 1 1 39 39 PHE CA C 39 58.913 58.913 56.113 2.800 25148 874 1 2 . 1 1 39 39 PHE CB C 39 39.781 39.781 38.574 1.207 25148 875 1 2 . 1 1 39 39 PHE H H 39 7.959 7.959 7.412 0.547 25148 876 1 2 . 1 1 40 40 ASN HA H 40 4.018 4.018 4.552 -0.534 25148 877 1 2 . 1 1 40 40 ASN CA C 40 58.944 58.944 55.166 3.778 25148 878 1 2 . 1 1 41 41 GLN HA H 41 4.298 4.298 4.526 -0.228 25148 879 1 2 . 1 1 41 41 GLN C C 41 175.237 175.237 175.728 -0.491 25148 880 1 2 . 1 1 41 41 GLN CA C 41 57.360 57.360 56.589 0.771 25148 881 1 2 . 1 1 41 41 GLN CB C 41 28.724 28.724 27.993 0.731 25148 882 1 2 . 1 1 42 42 ALA N N 42 120.514 120.514 120.913 -0.399 25148 883 1 2 . 1 1 42 42 ALA HA H 42 4.622 4.622 4.494 0.128 25148 884 1 2 . 1 1 42 42 ALA C C 42 175.922 175.922 176.315 -0.393 25148 885 1 2 . 1 1 42 42 ALA CA C 42 51.841 51.841 52.243 -0.403 25148 886 1 2 . 1 1 42 42 ALA CB C 42 21.576 21.576 20.536 1.040 25148 887 1 2 . 1 1 42 42 ALA H H 42 7.817 7.817 8.081 -0.264 25148 888 1 2 . 1 1 43 43 GLN N N 43 117.594 117.594 116.446 1.148 25148 889 1 2 . 1 1 43 43 GLN HA H 43 4.265 4.265 4.382 -0.117 25148 890 1 2 . 1 1 43 43 GLN C C 43 174.942 174.942 173.460 1.482 25148 891 1 2 . 1 1 43 43 GLN CA C 43 57.047 57.047 55.556 1.490 25148 892 1 2 . 1 1 43 43 GLN CB C 43 30.863 30.863 31.191 -0.328 25148 893 1 2 . 1 1 43 43 GLN H H 43 7.400 7.400 7.513 -0.113 25148 894 1 2 . 1 1 44 44 ASN N N 44 120.467 120.467 121.652 -1.185 25148 895 1 2 . 1 1 44 44 ASN HA H 44 5.005 5.005 4.662 0.343 25148 896 1 2 . 1 1 44 44 ASN C C 44 174.365 174.365 174.301 0.064 25148 897 1 2 . 1 1 44 44 ASN CA C 44 52.381 52.381 53.130 -0.749 25148 898 1 2 . 1 1 44 44 ASN CB C 44 38.177 38.177 39.177 -1.000 25148 899 1 2 . 1 1 44 44 ASN H H 44 9.123 9.123 8.566 0.557 25148 900 1 2 . 1 1 45 45 VAL N N 45 115.479 115.479 116.670 -1.191 25148 901 1 2 . 1 1 45 45 VAL HA H 45 5.376 5.376 4.243 1.133 25148 902 1 2 . 1 1 45 45 VAL C C 45 174.908 174.908 173.652 1.256 25148 903 1 2 . 1 1 45 45 VAL CA C 45 59.022 59.022 61.694 -2.672 25148 904 1 2 . 1 1 45 45 VAL CB C 45 35.776 35.776 34.097 1.679 25148 905 1 2 . 1 1 45 45 VAL H H 45 7.732 7.732 8.045 -0.313 25148 906 1 2 . 1 1 46 46 ARG N N 46 121.146 121.146 124.341 -3.195 25148 907 1 2 . 1 1 46 46 ARG HA H 46 4.566 4.566 4.858 -0.292 25148 908 1 2 . 1 1 46 46 ARG C C 46 173.790 173.790 173.995 -0.205 25148 909 1 2 . 1 1 46 46 ARG CA C 46 54.762 54.762 54.000 0.762 25148 910 1 2 . 1 1 46 46 ARG CB C 46 33.946 33.946 33.612 0.334 25148 911 1 2 . 1 1 46 46 ARG H H 46 8.850 8.850 9.110 -0.260 25148 912 1 2 . 1 1 47 47 VAL N N 47 122.339 122.339 124.299 -1.960 25148 913 1 2 . 1 1 47 47 VAL HA H 47 4.741 4.741 4.660 0.081 25148 914 1 2 . 1 1 47 47 VAL C C 47 173.541 173.541 175.879 -2.338 25148 915 1 2 . 1 1 47 47 VAL CA C 47 60.893 60.893 61.182 -0.289 25148 916 1 2 . 1 1 47 47 VAL CB C 47 33.563 33.563 33.455 0.108 25148 917 1 2 . 1 1 47 47 VAL H H 47 8.444 8.444 8.549 -0.105 25148 918 1 2 . 1 1 48 48 ASP N N 48 127.701 127.701 128.326 -0.625 25148 919 1 2 . 1 1 48 48 ASP HA H 48 4.946 4.946 4.986 -0.040 25148 920 1 2 . 1 1 48 48 ASP C C 48 173.744 173.744 174.504 -0.760 25148 921 1 2 . 1 1 48 48 ASP CA C 48 52.651 52.651 53.202 -0.551 25148 922 1 2 . 1 1 48 48 ASP CB C 48 45.225 45.225 43.158 2.067 25148 923 1 2 . 1 1 48 48 ASP H H 48 9.068 9.068 8.806 0.262 25148 924 1 2 . 1 1 49 49 LEU N N 49 130.945 130.945 125.883 5.062 25148 925 1 2 . 1 1 49 49 LEU HA H 49 4.774 4.774 4.431 0.343 25148 926 1 2 . 1 1 49 49 LEU C C 49 174.531 174.531 175.822 -1.291 25148 927 1 2 . 1 1 49 49 LEU CA C 49 54.337 54.337 54.769 -0.432 25148 928 1 2 . 1 1 49 49 LEU CB C 49 43.192 43.192 43.546 -0.354 25148 929 1 2 . 1 1 49 49 LEU H H 49 9.369 9.369 8.624 0.745 25148 930 1 2 . 1 1 50 50 ASN N N 50 126.268 126.268 124.008 2.260 25148 931 1 2 . 1 1 50 50 ASN HA H 50 4.629 4.629 5.056 -0.427 25148 932 1 2 . 1 1 50 50 ASN C C 50 176.602 176.602 175.228 1.374 25148 933 1 2 . 1 1 50 50 ASN CA C 50 54.048 54.048 52.501 1.547 25148 934 1 2 . 1 1 50 50 ASN CB C 50 39.891 39.891 39.122 0.769 25148 935 1 2 . 1 1 50 50 ASN H H 50 8.672 8.672 8.894 -0.222 25148 936 1 2 . 1 1 51 51 ARG N N 51 125.897 125.897 124.515 1.382 25148 937 1 2 . 1 1 51 51 ARG HA H 51 3.789 3.789 4.101 -0.312 25148 938 1 2 . 1 1 51 51 ARG C C 51 175.681 175.681 176.335 -0.654 25148 939 1 2 . 1 1 51 51 ARG CA C 51 58.162 58.162 58.538 -0.376 25148 940 1 2 . 1 1 51 51 ARG CB C 51 29.944 29.944 29.834 0.110 25148 941 1 2 . 1 1 51 51 ARG H H 51 8.984 8.984 8.701 0.283 25148 942 1 2 . 1 1 52 52 GLU N N 52 116.733 116.733 118.413 -1.680 25148 943 1 2 . 1 1 52 52 GLU HA H 52 4.368 4.368 4.241 0.127 25148 944 1 2 . 1 1 52 52 GLU C C 52 178.049 178.049 177.457 0.592 25148 945 1 2 . 1 1 52 52 GLU CA C 52 58.048 58.048 58.405 -0.357 25148 946 1 2 . 1 1 52 52 GLU CB C 52 30.716 30.716 29.363 1.353 25148 947 1 2 . 1 1 52 52 GLU H H 52 8.541 8.541 8.434 0.107 25148 948 1 2 . 1 1 53 53 THR N N 53 106.556 106.556 108.841 -2.285 25148 949 1 2 . 1 1 53 53 THR HA H 53 4.424 4.424 4.536 -0.112 25148 950 1 2 . 1 1 53 53 THR C C 53 176.352 176.352 175.354 0.998 25148 951 1 2 . 1 1 53 53 THR CA C 53 61.320 61.320 60.689 0.631 25148 952 1 2 . 1 1 53 53 THR CB C 53 71.220 71.220 69.653 1.567 25148 953 1 2 . 1 1 53 53 THR H H 53 8.085 8.085 7.582 0.503 25148 954 1 2 . 1 1 54 54 GLY N N 54 111.843 111.843 110.625 1.218 25148 955 1 2 . 1 1 54 54 GLY C C 54 172.690 172.690 174.393 -1.703 25148 956 1 2 . 1 1 54 54 GLY CA C 54 45.417 45.417 46.273 -0.856 25148 957 1 2 . 1 1 54 54 GLY H H 54 8.330 8.330 7.865 0.465 25148 958 1 2 . 1 1 55 55 SER N N 55 113.844 113.844 114.003 -0.159 25148 959 1 2 . 1 1 55 55 SER HA H 55 4.279 4.279 4.718 -0.439 25148 960 1 2 . 1 1 55 55 SER C C 55 174.127 174.127 173.127 1.000 25148 961 1 2 . 1 1 55 55 SER CA C 55 59.229 59.229 57.593 1.636 25148 962 1 2 . 1 1 55 55 SER CB C 55 63.939 63.939 65.860 -1.921 25148 963 1 2 . 1 1 55 55 SER H H 55 7.653 7.653 7.539 0.114 25148 964 1 2 . 1 1 56 56 ILE N N 56 125.286 125.286 120.164 5.122 25148 965 1 2 . 1 1 56 56 ILE HA H 56 5.082 5.082 4.655 0.427 25148 966 1 2 . 1 1 56 56 ILE C C 56 175.346 175.346 174.405 0.941 25148 967 1 2 . 1 1 56 56 ILE CA C 56 59.967 59.967 60.616 -0.649 25148 968 1 2 . 1 1 56 56 ILE CB C 56 40.165 40.165 41.942 -1.777 25148 969 1 2 . 1 1 56 56 ILE H H 56 8.478 8.478 8.457 0.021 25148 970 1 2 . 1 1 57 57 ARG N N 57 126.332 126.332 126.929 -0.597 25148 971 1 2 . 1 1 57 57 ARG HA H 57 4.740 4.740 4.581 0.159 25148 972 1 2 . 1 1 57 57 ARG C C 57 173.921 173.921 173.628 0.293 25148 973 1 2 . 1 1 57 57 ARG CA C 57 54.311 54.311 53.597 0.714 25148 974 1 2 . 1 1 57 57 ARG CB C 57 35.805 35.805 33.543 2.262 25148 975 1 2 . 1 1 57 57 ARG H H 57 8.590 8.590 8.249 0.341 25148 976 1 2 . 1 1 58 58 VAL N N 58 120.987 120.987 123.483 -2.496 25148 977 1 2 . 1 1 58 58 VAL HA H 58 4.334 4.334 4.607 -0.273 25148 978 1 2 . 1 1 58 58 VAL C C 58 174.204 174.204 174.560 -0.356 25148 979 1 2 . 1 1 58 58 VAL CA C 58 60.861 60.861 60.578 0.283 25148 980 1 2 . 1 1 58 58 VAL CB C 58 33.383 33.383 31.645 1.738 25148 981 1 2 . 1 1 58 58 VAL H H 58 8.585 8.585 8.250 0.335 25148 982 1 2 . 1 1 59 59 PHE N N 59 124.913 124.913 126.016 -1.103 25148 983 1 2 . 1 1 59 59 PHE HA H 59 5.046 5.046 5.336 -0.290 25148 984 1 2 . 1 1 59 59 PHE C C 59 174.446 174.446 174.129 0.317 25148 985 1 2 . 1 1 59 59 PHE CA C 59 56.695 56.695 55.185 1.510 25148 986 1 2 . 1 1 59 59 PHE CB C 59 42.779 42.779 43.277 -0.498 25148 987 1 2 . 1 1 59 59 PHE H H 59 8.920 8.920 9.214 -0.294 25148 988 1 2 . 1 1 60 60 ALA N N 60 124.035 124.035 122.469 1.566 25148 989 1 2 . 1 1 60 60 ALA HA H 60 5.102 5.102 4.816 0.286 25148 990 1 2 . 1 1 60 60 ALA C C 60 176.017 176.017 176.369 -0.352 25148 991 1 2 . 1 1 60 60 ALA CA C 60 50.083 50.083 50.516 -0.432 25148 992 1 2 . 1 1 60 60 ALA CB C 60 22.400 22.400 20.678 1.722 25148 993 1 2 . 1 1 60 60 ALA H H 60 9.457 9.457 8.848 0.609 25148 994 1 2 . 1 1 61 61 ARG N N 61 121.530 121.530 125.194 -3.664 25148 995 1 2 . 1 1 61 61 ARG HA H 61 4.958 4.958 4.861 0.097 25148 996 1 2 . 1 1 61 61 ARG C C 61 176.737 176.737 175.826 0.911 25148 997 1 2 . 1 1 61 61 ARG CA C 61 55.375 55.375 56.111 -0.736 25148 998 1 2 . 1 1 61 61 ARG CB C 61 31.230 31.230 31.301 -0.071 25148 999 1 2 . 1 1 61 61 ARG H H 61 8.447 8.447 8.736 -0.289 25148 1000 1 2 . 1 1 62 62 LYS N N 62 124.784 124.784 125.361 -0.577 25148 1001 1 2 . 1 1 62 62 LYS HA H 62 4.709 4.709 4.500 0.209 25148 1002 1 2 . 1 1 62 62 LYS C C 62 173.899 173.899 174.834 -0.935 25148 1003 1 2 . 1 1 62 62 LYS CA C 62 54.812 54.812 55.071 -0.259 25148 1004 1 2 . 1 1 62 62 LYS CB C 62 37.147 37.147 35.982 1.165 25148 1005 1 2 . 1 1 62 62 LYS H H 62 9.137 9.137 8.599 0.538 25148 1006 1 2 . 1 1 63 63 ASP N N 63 122.552 122.552 125.503 -2.951 25148 1007 1 2 . 1 1 63 63 ASP HA H 63 4.877 4.877 4.617 0.260 25148 1008 1 2 . 1 1 63 63 ASP C C 63 175.560 175.560 176.175 -0.615 25148 1009 1 2 . 1 1 63 63 ASP CA C 63 54.576 54.576 55.049 -0.473 25148 1010 1 2 . 1 1 63 63 ASP CB C 63 42.841 42.841 41.671 1.170 25148 1011 1 2 . 1 1 63 63 ASP H H 63 8.334 8.334 8.820 -0.486 25148 1012 1 2 . 1 1 64 64 VAL N N 64 123.109 123.109 126.610 -3.501 25148 1013 1 2 . 1 1 64 64 VAL HA H 64 4.557 4.557 4.508 0.049 25148 1014 1 2 . 1 1 64 64 VAL C C 64 177.260 177.260 175.493 1.767 25148 1015 1 2 . 1 1 64 64 VAL CA C 64 62.268 62.268 63.201 -0.933 25148 1016 1 2 . 1 1 64 64 VAL CB C 64 30.348 30.348 31.284 -0.936 25148 1017 1 2 . 1 1 64 64 VAL H H 64 8.693 8.693 7.966 0.727 25148 1018 1 2 . 1 1 65 65 VAL N N 65 122.320 122.320 122.478 -0.158 25148 1019 1 2 . 1 1 65 65 VAL HA H 65 4.939 4.939 4.584 0.355 25148 1020 1 2 . 1 1 65 65 VAL C C 65 174.754 174.754 175.094 -0.340 25148 1021 1 2 . 1 1 65 65 VAL CA C 65 59.173 59.173 59.683 -0.510 25148 1022 1 2 . 1 1 65 65 VAL CB C 65 36.289 36.289 35.885 0.404 25148 1023 1 2 . 1 1 65 65 VAL H H 65 8.656 8.656 8.513 0.143 25148 1024 1 2 . 1 1 66 66 ASP N N 66 119.805 119.805 122.823 -3.018 25148 1025 1 2 . 1 1 66 66 ASP HA H 66 4.499 4.499 4.335 0.164 25148 1026 1 2 . 1 1 66 66 ASP C C 66 176.565 176.565 175.309 1.256 25148 1027 1 2 . 1 1 66 66 ASP CA C 66 57.236 57.236 56.655 0.581 25148 1028 1 2 . 1 1 66 66 ASP CB C 66 41.662 41.662 41.204 0.458 25148 1029 1 2 . 1 1 66 66 ASP H H 66 8.628 8.628 8.956 -0.328 25148 1030 1 2 . 1 1 67 67 GLU N N 67 117.604 117.604 117.736 -0.132 25148 1031 1 2 . 1 1 67 67 GLU HA H 67 4.350 4.350 4.467 -0.117 25148 1032 1 2 . 1 1 67 67 GLU C C 67 173.736 173.736 174.773 -1.037 25148 1033 1 2 . 1 1 67 67 GLU CA C 67 55.203 55.203 55.192 0.011 25148 1034 1 2 . 1 1 67 67 GLU CB C 67 32.240 32.240 32.935 -0.695 25148 1035 1 2 . 1 1 67 67 GLU H H 67 7.525 7.525 7.947 -0.422 25148 1036 1 2 . 1 1 68 68 VAL N N 68 125.774 125.774 123.116 2.658 25148 1037 1 2 . 1 1 68 68 VAL HA H 68 3.578 3.578 3.938 -0.360 25148 1038 1 2 . 1 1 68 68 VAL C C 68 175.885 175.885 175.592 0.293 25148 1039 1 2 . 1 1 68 68 VAL CA C 68 63.397 63.397 63.747 -0.350 25148 1040 1 2 . 1 1 68 68 VAL CB C 68 32.452 32.452 31.086 1.366 25148 1041 1 2 . 1 1 68 68 VAL H H 68 8.573 8.573 8.442 0.131 25148 1042 1 2 . 1 1 69 69 TYR N N 69 129.859 129.859 126.103 3.756 25148 1043 1 2 . 1 1 69 69 TYR HA H 69 4.642 4.642 4.634 0.008 25148 1044 1 2 . 1 1 69 69 TYR C C 69 176.100 176.100 175.588 0.512 25148 1045 1 2 . 1 1 69 69 TYR CA C 69 59.092 59.092 59.398 -0.306 25148 1046 1 2 . 1 1 69 69 TYR CB C 69 39.830 39.830 40.662 -0.832 25148 1047 1 2 . 1 1 69 69 TYR H H 69 9.801 9.801 8.519 1.282 25148 1048 1 2 . 1 1 70 70 ASP N N 70 120.204 120.204 120.561 -0.357 25148 1049 1 2 . 1 1 70 70 ASP HA H 70 4.772 4.772 4.919 -0.147 25148 1050 1 2 . 1 1 70 70 ASP C C 70 176.622 176.622 176.019 0.603 25148 1051 1 2 . 1 1 70 70 ASP CA C 70 52.885 52.885 53.365 -0.480 25148 1052 1 2 . 1 1 70 70 ASP CB C 70 41.878 41.878 41.562 0.316 25148 1053 1 2 . 1 1 70 70 ASP H H 70 8.348 8.348 8.094 0.254 25148 1054 1 2 . 1 1 71 71 GLN N N 71 125.440 125.440 125.061 0.379 25148 1055 1 2 . 1 1 71 71 GLN HA H 71 4.315 4.315 4.033 0.282 25148 1056 1 2 . 1 1 71 71 GLN C C 71 175.819 175.819 176.827 -1.008 25148 1057 1 2 . 1 1 71 71 GLN CA C 71 57.914 57.914 58.215 -0.301 25148 1058 1 2 . 1 1 71 71 GLN CB C 71 28.307 28.307 28.703 -0.396 25148 1059 1 2 . 1 1 71 71 GLN H H 71 9.097 9.097 8.857 0.240 25148 1060 1 2 . 1 1 72 72 ARG N N 72 116.306 116.306 115.700 0.606 25148 1061 1 2 . 1 1 72 72 ARG HA H 72 4.252 4.252 4.109 0.143 25148 1062 1 2 . 1 1 72 72 ARG C C 72 178.087 178.087 176.374 1.713 25148 1063 1 2 . 1 1 72 72 ARG CA C 72 58.532 58.532 57.269 1.263 25148 1064 1 2 . 1 1 72 72 ARG CB C 72 30.143 30.143 30.782 -0.639 25148 1065 1 2 . 1 1 72 72 ARG H H 72 8.534 8.534 8.130 0.404 25148 1066 1 2 . 1 1 73 73 LEU N N 73 116.734 116.734 113.460 3.274 25148 1067 1 2 . 1 1 73 73 LEU HA H 73 4.621 4.621 4.703 -0.082 25148 1068 1 2 . 1 1 73 73 LEU C C 73 175.946 175.946 175.053 0.893 25148 1069 1 2 . 1 1 73 73 LEU CA C 73 55.250 55.250 55.413 -0.162 25148 1070 1 2 . 1 1 73 73 LEU CB C 73 46.960 46.960 44.396 2.564 25148 1071 1 2 . 1 1 73 73 LEU H H 73 7.460 7.460 7.495 -0.035 25148 1072 1 2 . 1 1 74 74 GLU N N 74 118.787 118.787 122.090 -3.303 25148 1073 1 2 . 1 1 74 74 GLU HA H 74 5.403 5.403 4.664 0.739 25148 1074 1 2 . 1 1 74 74 GLU C C 74 173.709 173.709 174.565 -0.856 25148 1075 1 2 . 1 1 74 74 GLU CA C 74 54.914 54.914 55.719 -0.805 25148 1076 1 2 . 1 1 74 74 GLU CB C 74 35.053 35.053 33.532 1.520 25148 1077 1 2 . 1 1 74 74 GLU H H 74 7.752 7.752 8.083 -0.331 25148 1078 1 2 . 1 1 75 75 ILE N N 75 119.803 119.803 122.013 -2.210 25148 1079 1 2 . 1 1 75 75 ILE HA H 75 4.507 4.507 4.506 0.001 25148 1080 1 2 . 1 1 75 75 ILE C C 75 172.126 172.126 173.844 -1.718 25148 1081 1 2 . 1 1 75 75 ILE CA C 75 58.664 58.664 60.231 -1.567 25148 1082 1 2 . 1 1 75 75 ILE CB C 75 42.560 42.560 41.935 0.625 25148 1083 1 2 . 1 1 75 75 ILE H H 75 8.975 8.975 8.583 0.392 25148 1084 1 2 . 1 1 76 76 SER N N 76 123.236 123.236 124.218 -0.982 25148 1085 1 2 . 1 1 76 76 SER HA H 76 4.505 4.505 4.889 -0.384 25148 1086 1 2 . 1 1 76 76 SER C C 76 176.145 176.145 175.810 0.335 25148 1087 1 2 . 1 1 76 76 SER CA C 76 58.108 58.108 58.103 0.005 25148 1088 1 2 . 1 1 76 76 SER CB C 76 65.000 65.000 64.144 0.855 25148 1089 1 2 . 1 1 76 76 SER H H 76 8.810 8.810 8.488 0.322 25148 1090 1 2 . 1 1 77 77 ILE N N 77 120.629 120.629 124.868 -4.239 25148 1091 1 2 . 1 1 77 77 ILE HA H 77 3.935 3.935 3.721 0.214 25148 1092 1 2 . 1 1 77 77 ILE C C 77 175.806 175.806 176.925 -1.119 25148 1093 1 2 . 1 1 77 77 ILE CA C 77 61.928 61.928 63.713 -1.785 25148 1094 1 2 . 1 1 77 77 ILE CB C 77 38.031 38.031 38.114 -0.083 25148 1095 1 2 . 1 1 77 77 ILE H H 77 8.321 8.321 8.053 0.268 25148 1096 1 2 . 1 1 78 78 GLU N N 78 121.032 121.032 117.538 3.494 25148 1097 1 2 . 1 1 78 78 GLU HA H 78 4.082 4.082 3.973 0.109 25148 1098 1 2 . 1 1 78 78 GLU C C 78 179.829 179.829 178.373 1.456 25148 1099 1 2 . 1 1 78 78 GLU CA C 78 60.180 60.180 59.092 1.088 25148 1100 1 2 . 1 1 78 78 GLU CB C 78 28.988 28.988 28.671 0.317 25148 1101 1 2 . 1 1 78 78 GLU H H 78 8.222 8.222 8.292 -0.070 25148 1102 1 2 . 1 1 79 79 GLU N N 79 120.710 120.710 121.251 -0.541 25148 1103 1 2 . 1 1 79 79 GLU HA H 79 4.012 4.012 4.076 -0.064 25148 1104 1 2 . 1 1 79 79 GLU C C 79 180.339 180.339 179.110 1.229 25148 1105 1 2 . 1 1 79 79 GLU CA C 79 59.332 59.332 58.785 0.547 25148 1106 1 2 . 1 1 79 79 GLU CB C 79 29.317 29.317 29.272 0.045 25148 1107 1 2 . 1 1 79 79 GLU H H 79 7.908 7.908 7.769 0.139 25148 1108 1 2 . 1 1 80 80 ALA N N 80 122.879 122.879 121.858 1.021 25148 1109 1 2 . 1 1 80 80 ALA HA H 80 3.966 3.966 4.176 -0.210 25148 1110 1 2 . 1 1 80 80 ALA C C 80 179.833 179.833 179.960 -0.127 25148 1111 1 2 . 1 1 80 80 ALA CA C 80 55.881 55.881 55.003 0.878 25148 1112 1 2 . 1 1 80 80 ALA CB C 80 18.870 18.870 18.130 0.740 25148 1113 1 2 . 1 1 80 80 ALA H H 80 9.132 9.132 7.989 1.143 25148 1114 1 2 . 1 1 81 81 GLN N N 81 115.829 115.829 116.507 -0.678 25148 1115 1 2 . 1 1 81 81 GLN HA H 81 4.749 4.749 4.344 0.405 25148 1116 1 2 . 1 1 81 81 GLN C C 81 178.126 178.126 177.929 0.197 25148 1117 1 2 . 1 1 81 81 GLN CA C 81 57.682 57.682 57.970 -0.288 25148 1118 1 2 . 1 1 81 81 GLN CB C 81 27.307 27.307 28.668 -1.361 25148 1119 1 2 . 1 1 81 81 GLN H H 81 8.709 8.709 7.787 0.922 25148 1120 1 2 . 1 1 82 82 GLY N N 82 105.531 105.531 106.737 -1.206 25148 1121 1 2 . 1 1 82 82 GLY C C 82 174.917 174.917 175.003 -0.086 25148 1122 1 2 . 1 1 82 82 GLY CA C 82 45.915 45.915 46.494 -0.579 25148 1123 1 2 . 1 1 82 82 GLY H H 82 7.479 7.479 7.960 -0.481 25148 1124 1 2 . 1 1 83 83 ILE N N 83 122.828 122.828 113.962 8.866 25148 1125 1 2 . 1 1 83 83 ILE HA H 83 3.970 3.970 4.381 -0.411 25148 1126 1 2 . 1 1 83 83 ILE C C 83 177.209 177.209 175.707 1.502 25148 1127 1 2 . 1 1 83 83 ILE CA C 83 64.305 64.305 61.394 2.911 25148 1128 1 2 . 1 1 83 83 ILE CB C 83 38.452 38.452 40.225 -1.774 25148 1129 1 2 . 1 1 83 83 ILE H H 83 7.634 7.634 7.381 0.253 25148 1130 1 2 . 1 1 84 84 HIS N N 84 118.927 118.927 120.183 -1.256 25148 1131 1 2 . 1 1 84 84 HIS HA H 84 4.713 4.713 4.906 -0.193 25148 1132 1 2 . 1 1 84 84 HIS CA C 84 55.487 55.487 54.641 0.846 25148 1133 1 2 . 1 1 84 84 HIS CB C 84 33.506 33.506 32.097 1.409 25148 1134 1 2 . 1 1 84 84 HIS H H 84 8.155 8.155 8.357 -0.202 25148 1135 1 2 . 1 1 85 85 PRO HA H 85 4.456 4.456 4.638 -0.182 25148 1136 1 2 . 1 1 85 85 PRO C C 85 177.357 177.357 177.283 0.074 25148 1137 1 2 . 1 1 85 85 PRO CA C 85 64.475 64.475 64.114 0.361 25148 1138 1 2 . 1 1 85 85 PRO CB C 85 32.489 32.489 32.131 0.358 25148 1139 1 2 . 1 1 86 86 GLU N N 86 116.314 116.314 117.057 -0.743 25148 1140 1 2 . 1 1 86 86 GLU HA H 86 4.286 4.286 4.131 0.155 25148 1141 1 2 . 1 1 86 86 GLU C C 86 177.624 177.624 177.250 0.374 25148 1142 1 2 . 1 1 86 86 GLU CA C 86 56.619 56.619 57.173 -0.554 25148 1143 1 2 . 1 1 86 86 GLU CB C 86 29.389 29.389 29.609 -0.220 25148 1144 1 2 . 1 1 86 86 GLU H H 86 8.938 8.938 7.803 1.135 25148 1145 1 2 . 1 1 87 87 TYR N N 87 119.773 119.773 120.134 -0.361 25148 1146 1 2 . 1 1 87 87 TYR HA H 87 4.744 4.744 4.211 0.533 25148 1147 1 2 . 1 1 87 87 TYR C C 87 174.533 174.533 176.303 -1.770 25148 1148 1 2 . 1 1 87 87 TYR CA C 87 59.117 59.117 59.335 -0.218 25148 1149 1 2 . 1 1 87 87 TYR CB C 87 38.859 38.859 38.761 0.098 25148 1150 1 2 . 1 1 87 87 TYR H H 87 7.447 7.447 7.359 0.088 25148 1151 1 2 . 1 1 88 88 MET N N 88 118.298 118.298 117.069 1.229 25148 1152 1 2 . 1 1 88 88 MET HA H 88 4.770 4.770 4.729 0.041 25148 1153 1 2 . 1 1 88 88 MET C C 88 175.638 175.638 173.888 1.750 25148 1154 1 2 . 1 1 88 88 MET CA C 88 53.133 53.133 54.629 -1.496 25148 1155 1 2 . 1 1 88 88 MET CB C 88 37.102 37.102 35.531 1.571 25148 1156 1 2 . 1 1 88 88 MET H H 88 9.023 9.023 8.303 0.720 25148 1157 1 2 . 1 1 89 89 VAL N N 89 120.157 120.157 124.581 -4.424 25148 1158 1 2 . 1 1 89 89 VAL HA H 89 3.330 3.330 3.690 -0.360 25148 1159 1 2 . 1 1 89 89 VAL C C 89 177.432 177.432 176.817 0.615 25148 1160 1 2 . 1 1 89 89 VAL CA C 89 65.675 65.675 64.688 0.987 25148 1161 1 2 . 1 1 89 89 VAL CB C 89 31.321 31.321 30.860 0.461 25148 1162 1 2 . 1 1 89 89 VAL H H 89 8.313 8.313 8.632 -0.319 25148 1163 1 2 . 1 1 90 90 GLY N N 90 116.935 116.935 115.541 1.394 25148 1164 1 2 . 1 1 90 90 GLY C C 90 175.196 175.196 174.442 0.754 25148 1165 1 2 . 1 1 90 90 GLY CA C 90 44.685 44.685 44.716 -0.031 25148 1166 1 2 . 1 1 90 90 GLY H H 90 8.551 8.551 8.876 -0.325 25148 1167 1 2 . 1 1 91 91 ASP N N 91 121.616 121.616 122.184 -0.568 25148 1168 1 2 . 1 1 91 91 ASP HA H 91 4.790 4.790 4.875 -0.085 25148 1169 1 2 . 1 1 91 91 ASP C C 91 174.431 174.431 174.926 -0.495 25148 1170 1 2 . 1 1 91 91 ASP CA C 91 55.011 55.011 54.100 0.911 25148 1171 1 2 . 1 1 91 91 ASP CB C 91 42.079 42.079 42.061 0.018 25148 1172 1 2 . 1 1 91 91 ASP H H 91 8.073 8.073 8.072 0.001 25148 1173 1 2 . 1 1 92 92 VAL N N 92 118.919 118.919 115.316 3.603 25148 1174 1 2 . 1 1 92 92 VAL HA H 92 4.709 4.709 4.975 -0.266 25148 1175 1 2 . 1 1 92 92 VAL C C 92 175.602 175.602 174.272 1.330 25148 1176 1 2 . 1 1 92 92 VAL CA C 92 61.527 61.527 59.537 1.990 25148 1177 1 2 . 1 1 92 92 VAL CB C 92 34.110 34.110 34.683 -0.573 25148 1178 1 2 . 1 1 92 92 VAL H H 92 8.216 8.216 8.064 0.152 25148 1179 1 2 . 1 1 93 93 VAL N N 93 123.922 123.922 123.424 0.498 25148 1180 1 2 . 1 1 93 93 VAL HA H 93 4.231 4.231 4.275 -0.044 25148 1181 1 2 . 1 1 93 93 VAL C C 93 174.105 174.105 174.217 -0.112 25148 1182 1 2 . 1 1 93 93 VAL CA C 93 59.644 59.644 59.218 0.426 25148 1183 1 2 . 1 1 93 93 VAL CB C 93 34.661 34.661 35.421 -0.760 25148 1184 1 2 . 1 1 93 93 VAL H H 93 8.812 8.812 8.070 0.742 25148 1185 1 2 . 1 1 94 94 GLU N N 94 123.605 123.605 128.143 -4.538 25148 1186 1 2 . 1 1 94 94 GLU HA H 94 5.347 5.347 5.200 0.147 25148 1187 1 2 . 1 1 94 94 GLU C C 94 175.708 175.708 175.731 -0.023 25148 1188 1 2 . 1 1 94 94 GLU CA C 94 54.979 54.979 55.048 -0.070 25148 1189 1 2 . 1 1 94 94 GLU CB C 94 31.612 31.612 32.072 -0.460 25148 1190 1 2 . 1 1 94 94 GLU H H 94 8.312 8.312 8.601 -0.289 25148 1191 1 2 . 1 1 95 95 ILE N N 95 123.581 123.581 123.691 -0.110 25148 1192 1 2 . 1 1 95 95 ILE HA H 95 4.601 4.601 4.513 0.088 25148 1193 1 2 . 1 1 95 95 ILE C C 95 175.081 175.081 175.572 -0.491 25148 1194 1 2 . 1 1 95 95 ILE CA C 95 58.601 58.601 59.733 -1.132 25148 1195 1 2 . 1 1 95 95 ILE CB C 95 41.727 41.727 42.185 -0.458 25148 1196 1 2 . 1 1 95 95 ILE H H 95 9.045 9.045 8.340 0.705 25148 1197 1 2 . 1 1 96 96 GLU N N 96 128.094 128.094 126.960 1.134 25148 1198 1 2 . 1 1 96 96 GLU HA H 96 4.098 4.098 3.931 0.167 25148 1199 1 2 . 1 1 96 96 GLU C C 96 176.845 176.845 175.827 1.018 25148 1200 1 2 . 1 1 96 96 GLU CA C 96 57.853 57.853 58.395 -0.542 25148 1201 1 2 . 1 1 96 96 GLU CB C 96 28.323 28.323 29.518 -1.195 25148 1202 1 2 . 1 1 96 96 GLU H H 96 9.256 9.256 8.968 0.288 25148 1203 1 2 . 1 1 97 97 VAL N N 97 118.446 118.446 124.956 -6.510 25148 1204 1 2 . 1 1 97 97 VAL HA H 97 4.568 4.568 4.193 0.375 25148 1205 1 2 . 1 1 97 97 VAL C C 97 175.051 175.051 174.371 0.680 25148 1206 1 2 . 1 1 97 97 VAL CA C 97 59.796 59.796 60.667 -0.871 25148 1207 1 2 . 1 1 97 97 VAL CB C 97 32.399 32.399 33.175 -0.776 25148 1208 1 2 . 1 1 97 97 VAL H H 97 8.609 8.609 8.741 -0.132 25148 1209 1 2 . 1 1 98 98 THR N N 98 119.118 119.118 117.016 2.102 25148 1210 1 2 . 1 1 98 98 THR HA H 98 3.320 3.320 3.904 -0.584 25148 1211 1 2 . 1 1 98 98 THR CA C 98 61.628 61.628 59.078 2.550 25148 1212 1 2 . 1 1 98 98 THR CB C 98 70.031 70.031 69.507 0.523 25148 1213 1 2 . 1 1 98 98 THR H H 98 7.396 7.396 7.267 0.129 25148 1214 1 2 . 1 1 99 99 PRO HA H 99 4.458 4.458 4.628 -0.170 25148 1215 1 2 . 1 1 99 99 PRO CA C 99 62.348 62.348 62.454 -0.106 25148 1216 1 2 . 1 1 99 99 PRO CB C 99 33.182 33.182 32.659 0.523 25148 1217 1 2 . 1 1 100 100 LYS HA H 100 4.126 4.126 4.099 0.027 25148 1218 1 2 . 1 1 100 100 LYS CA C 100 58.773 58.773 58.220 0.553 25148 1219 1 2 . 1 1 100 100 LYS CB C 100 32.195 32.195 32.268 -0.073 25148 1220 1 2 . 1 1 101 101 ASP HA H 101 4.924 4.924 4.784 0.140 25148 1221 1 2 . 1 1 101 101 ASP C C 101 176.884 176.884 176.664 0.220 25148 1222 1 2 . 1 1 101 101 ASP CA C 101 54.134 54.134 53.420 0.714 25148 1223 1 2 . 1 1 101 101 ASP CB C 101 40.272 40.272 40.858 -0.585 25148 1224 1 2 . 1 1 102 102 PHE N N 102 118.703 118.703 121.304 -2.601 25148 1225 1 2 . 1 1 102 102 PHE HA H 102 4.295 4.295 4.139 0.156 25148 1226 1 2 . 1 1 102 102 PHE C C 102 176.477 176.477 177.297 -0.820 25148 1227 1 2 . 1 1 102 102 PHE CA C 102 60.748 60.748 60.186 0.562 25148 1228 1 2 . 1 1 102 102 PHE CB C 102 39.667 39.667 39.081 0.586 25148 1229 1 2 . 1 1 102 102 PHE H H 102 7.862 7.862 7.732 0.130 25148 1230 1 2 . 1 1 103 103 GLY CA C 103 47.430 47.430 47.264 0.166 25148 1231 1 2 . 1 1 104 104 ARG N N 104 121.819 121.819 120.250 1.569 25148 1232 1 2 . 1 1 104 104 ARG HA H 104 4.176 4.176 4.258 -0.082 25148 1233 1 2 . 1 1 104 104 ARG C C 104 178.912 178.912 178.457 0.455 25148 1234 1 2 . 1 1 104 104 ARG CA C 104 59.235 59.235 57.654 1.581 25148 1235 1 2 . 1 1 104 104 ARG CB C 104 30.000 30.000 30.047 -0.048 25148 1236 1 2 . 1 1 104 104 ARG H H 104 7.809 7.809 7.478 0.331 25148 1237 1 2 . 1 1 105 105 ILE N N 105 120.331 120.331 120.622 -0.291 25148 1238 1 2 . 1 1 105 105 ILE HA H 105 3.836 3.836 3.673 0.163 25148 1239 1 2 . 1 1 105 105 ILE C C 105 179.206 179.206 177.991 1.215 25148 1240 1 2 . 1 1 105 105 ILE CA C 105 63.025 63.025 62.980 0.045 25148 1241 1 2 . 1 1 105 105 ILE CB C 105 38.127 38.127 36.123 2.005 25148 1242 1 2 . 1 1 105 105 ILE H H 105 7.203 7.203 7.391 -0.188 25148 1243 1 2 . 1 1 106 106 ALA N N 106 124.867 124.867 122.595 2.272 25148 1244 1 2 . 1 1 106 106 ALA HA H 106 3.665 3.665 3.568 0.097 25148 1245 1 2 . 1 1 106 106 ALA C C 106 178.590 178.590 178.962 -0.372 25148 1246 1 2 . 1 1 106 106 ALA CA C 106 54.842 54.842 55.172 -0.330 25148 1247 1 2 . 1 1 106 106 ALA CB C 106 18.659 18.659 17.913 0.746 25148 1248 1 2 . 1 1 106 106 ALA H H 106 8.813 8.813 8.266 0.547 25148 1249 1 2 . 1 1 107 107 ALA N N 107 119.597 119.597 120.833 -1.236 25148 1250 1 2 . 1 1 107 107 ALA HA H 107 4.014 4.014 3.901 0.113 25148 1251 1 2 . 1 1 107 107 ALA C C 107 180.214 180.214 179.147 1.067 25148 1252 1 2 . 1 1 107 107 ALA CA C 107 55.454 55.454 54.824 0.630 25148 1253 1 2 . 1 1 107 107 ALA CB C 107 18.260 18.260 18.101 0.159 25148 1254 1 2 . 1 1 107 107 ALA H H 107 8.012 8.012 7.398 0.614 25148 1255 1 2 . 1 1 108 108 GLN N N 108 116.896 116.896 118.364 -1.468 25148 1256 1 2 . 1 1 108 108 GLN HA H 108 4.054 4.054 3.940 0.114 25148 1257 1 2 . 1 1 108 108 GLN C C 108 178.784 178.784 178.124 0.660 25148 1258 1 2 . 1 1 108 108 GLN CA C 108 58.705 58.705 59.043 -0.338 25148 1259 1 2 . 1 1 108 108 GLN CB C 108 28.647 28.647 28.727 -0.080 25148 1260 1 2 . 1 1 108 108 GLN H H 108 7.498 7.498 8.128 -0.630 25148 1261 1 2 . 1 1 109 109 THR N N 109 117.495 117.495 114.043 3.452 25148 1262 1 2 . 1 1 109 109 THR HA H 109 3.917 3.917 4.330 -0.413 25148 1263 1 2 . 1 1 109 109 THR C C 109 175.732 175.732 175.950 -0.218 25148 1264 1 2 . 1 1 109 109 THR CA C 109 66.989 66.989 65.586 1.403 25148 1265 1 2 . 1 1 109 109 THR CB C 109 68.766 68.766 68.720 0.046 25148 1266 1 2 . 1 1 109 109 THR H H 109 8.203 8.203 8.194 0.009 25148 1267 1 2 . 1 1 110 110 ALA N N 110 122.308 122.308 125.436 -3.128 25148 1268 1 2 . 1 1 110 110 ALA HA H 110 3.854 3.854 4.077 -0.223 25148 1269 1 2 . 1 1 110 110 ALA C C 110 178.380 178.380 178.850 -0.470 25148 1270 1 2 . 1 1 110 110 ALA CA C 110 55.903 55.903 55.078 0.825 25148 1271 1 2 . 1 1 110 110 ALA CB C 110 18.524 18.524 18.396 0.128 25148 1272 1 2 . 1 1 110 110 ALA H H 110 8.668 8.668 7.361 1.307 25148 1273 1 2 . 1 1 111 111 LYS N N 111 115.552 115.552 117.860 -2.308 25148 1274 1 2 . 1 1 111 111 LYS HA H 111 3.923 3.923 3.951 -0.028 25148 1275 1 2 . 1 1 111 111 LYS C C 111 179.111 179.111 178.952 0.159 25148 1276 1 2 . 1 1 111 111 LYS CA C 111 59.825 59.825 59.439 0.386 25148 1277 1 2 . 1 1 111 111 LYS CB C 111 32.251 32.251 31.883 0.368 25148 1278 1 2 . 1 1 111 111 LYS H H 111 7.642 7.642 8.631 -0.989 25148 1279 1 2 . 1 1 112 112 GLN N N 112 120.178 120.178 118.666 1.512 25148 1280 1 2 . 1 1 112 112 GLN HA H 112 4.060 4.060 4.135 -0.075 25148 1281 1 2 . 1 1 112 112 GLN C C 112 178.355 178.355 178.271 0.084 25148 1282 1 2 . 1 1 112 112 GLN CA C 112 59.240 59.240 58.107 1.133 25148 1283 1 2 . 1 1 112 112 GLN CB C 112 28.250 28.250 28.494 -0.244 25148 1284 1 2 . 1 1 112 112 GLN H H 112 7.798 7.798 7.677 0.121 25148 1285 1 2 . 1 1 113 113 VAL N N 113 119.799 119.799 121.049 -1.250 25148 1286 1 2 . 1 1 113 113 VAL HA H 113 3.705 3.705 3.735 -0.030 25148 1287 1 2 . 1 1 113 113 VAL C C 113 178.303 178.303 177.786 0.517 25148 1288 1 2 . 1 1 113 113 VAL CA C 113 66.277 66.277 66.703 -0.426 25148 1289 1 2 . 1 1 113 113 VAL CB C 113 31.954 31.954 32.014 -0.060 25148 1290 1 2 . 1 1 113 113 VAL H H 113 8.105 8.105 7.459 0.646 25148 1291 1 2 . 1 1 114 114 VAL N N 114 118.265 118.265 116.952 1.313 25148 1292 1 2 . 1 1 114 114 VAL HA H 114 3.392 3.392 3.685 -0.293 25148 1293 1 2 . 1 1 114 114 VAL C C 114 177.360 177.360 177.849 -0.489 25148 1294 1 2 . 1 1 114 114 VAL CA C 114 67.832 67.832 66.549 1.284 25148 1295 1 2 . 1 1 114 114 VAL CB C 114 31.801 31.801 30.636 1.165 25148 1296 1 2 . 1 1 114 114 VAL H H 114 8.180 8.180 8.441 -0.261 25148 1297 1 2 . 1 1 115 115 THR N N 115 113.460 113.460 114.485 -1.025 25148 1298 1 2 . 1 1 115 115 THR HA H 115 3.856 3.856 4.039 -0.183 25148 1299 1 2 . 1 1 115 115 THR C C 115 176.529 176.529 176.326 0.203 25148 1300 1 2 . 1 1 115 115 THR CA C 115 66.706 66.706 66.408 0.298 25148 1301 1 2 . 1 1 115 115 THR CB C 115 69.008 69.008 68.516 0.492 25148 1302 1 2 . 1 1 115 115 THR H H 115 8.143 8.143 7.658 0.485 25148 1303 1 2 . 1 1 116 116 GLN N N 116 120.129 120.129 120.061 0.068 25148 1304 1 2 . 1 1 116 116 GLN HA H 116 4.054 4.054 4.046 0.008 25148 1305 1 2 . 1 1 116 116 GLN C C 116 178.100 178.100 178.692 -0.592 25148 1306 1 2 . 1 1 116 116 GLN CA C 116 58.950 58.950 58.917 0.033 25148 1307 1 2 . 1 1 116 116 GLN CB C 116 28.244 28.244 28.446 -0.202 25148 1308 1 2 . 1 1 116 116 GLN H H 116 7.936 7.936 7.460 0.476 25148 1309 1 2 . 1 1 117 117 ARG N N 117 117.838 117.838 119.549 -1.711 25148 1310 1 2 . 1 1 117 117 ARG HA H 117 4.174 4.174 4.063 0.111 25148 1311 1 2 . 1 1 117 117 ARG C C 117 179.138 179.138 178.582 0.556 25148 1312 1 2 . 1 1 117 117 ARG CA C 117 57.461 57.461 58.474 -1.013 25148 1313 1 2 . 1 1 117 117 ARG CB C 117 29.548 29.548 29.521 0.027 25148 1314 1 2 . 1 1 117 117 ARG H H 117 8.240 8.240 8.211 0.029 25148 1315 1 2 . 1 1 118 118 VAL N N 118 120.278 120.278 119.669 0.609 25148 1316 1 2 . 1 1 118 118 VAL HA H 118 3.709 3.709 3.699 0.010 25148 1317 1 2 . 1 1 118 118 VAL C C 118 177.597 177.597 178.328 -0.731 25148 1318 1 2 . 1 1 118 118 VAL CA C 118 66.246 66.246 66.365 -0.119 25148 1319 1 2 . 1 1 118 118 VAL CB C 118 31.785 31.785 31.226 0.559 25148 1320 1 2 . 1 1 118 118 VAL H H 118 8.480 8.480 7.588 0.892 25148 1321 1 2 . 1 1 119 119 ARG N N 119 120.197 120.197 119.375 0.822 25148 1322 1 2 . 1 1 119 119 ARG HA H 119 4.173 4.173 4.129 0.044 25148 1323 1 2 . 1 1 119 119 ARG C C 119 178.864 178.864 178.980 -0.116 25148 1324 1 2 . 1 1 119 119 ARG CA C 119 58.772 58.772 58.820 -0.048 25148 1325 1 2 . 1 1 119 119 ARG CB C 119 29.873 29.873 29.614 0.259 25148 1326 1 2 . 1 1 119 119 ARG H H 119 7.899 7.899 7.956 -0.057 25148 1327 1 2 . 1 1 120 120 GLU N N 120 118.768 118.768 119.599 -0.831 25148 1328 1 2 . 1 1 120 120 GLU HA H 120 4.110 4.110 4.165 -0.055 25148 1329 1 2 . 1 1 120 120 GLU C C 120 177.823 177.823 178.764 -0.941 25148 1330 1 2 . 1 1 120 120 GLU CA C 120 58.223 58.223 58.525 -0.302 25148 1331 1 2 . 1 1 120 120 GLU CB C 120 29.854 29.854 29.297 0.557 25148 1332 1 2 . 1 1 120 120 GLU H H 120 8.084 8.084 7.528 0.556 25148 1333 1 2 . 1 1 121 121 ALA N N 121 121.984 121.984 121.713 0.271 25148 1334 1 2 . 1 1 121 121 ALA HA H 121 4.296 4.296 4.050 0.246 25148 1335 1 2 . 1 1 121 121 ALA C C 121 178.586 178.586 179.947 -1.361 25148 1336 1 2 . 1 1 121 121 ALA CA C 121 53.475 53.475 55.160 -1.685 25148 1337 1 2 . 1 1 121 121 ALA CB C 121 18.856 18.856 18.279 0.577 25148 1338 1 2 . 1 1 121 121 ALA H H 121 7.810 7.810 8.549 -0.739 25148 1339 1 2 . 1 1 122 122 GLU N N 122 118.229 118.229 118.205 0.024 25148 1340 1 2 . 1 1 122 122 GLU HA H 122 4.241 4.241 3.988 0.253 25148 1341 1 2 . 1 1 122 122 GLU C C 122 176.839 176.839 178.645 -1.806 25148 1342 1 2 . 1 1 122 122 GLU CA C 122 57.118 57.118 58.535 -1.417 25148 1343 1 2 . 1 1 122 122 GLU CB C 122 30.018 30.018 29.177 0.841 25148 1344 1 2 . 1 1 122 122 GLU H H 122 7.938 7.938 8.055 -0.117 25148 1345 1 2 . 1 1 123 123 ARG N N 123 120.601 120.601 120.293 0.308 25148 1346 1 2 . 1 1 123 123 ARG HA H 123 4.348 4.348 4.095 0.253 25148 1347 1 2 . 1 1 123 123 ARG C C 123 176.071 176.071 176.298 -0.227 25148 1348 1 2 . 1 1 123 123 ARG CA C 123 56.510 56.510 56.913 -0.403 25148 1349 1 2 . 1 1 123 123 ARG CB C 123 30.765 30.765 30.716 0.049 25148 1350 1 2 . 1 1 123 123 ARG H H 123 7.977 7.977 7.565 0.412 25148 1351 1 3 . 1 1 4 4 GLU HA H 4 4.138 4.138 4.094 0.044 25148 1352 1 3 . 1 1 4 4 GLU C C 4 179.152 179.152 178.466 0.686 25148 1353 1 3 . 1 1 4 4 GLU CA C 4 59.566 59.566 59.407 0.159 25148 1354 1 3 . 1 1 4 4 GLU CB C 4 29.407 29.407 29.351 0.056 25148 1355 1 3 . 1 1 5 5 LEU N N 5 121.360 121.360 120.121 1.239 25148 1356 1 3 . 1 1 5 5 LEU HA H 5 4.195 4.195 4.143 0.052 25148 1357 1 3 . 1 1 5 5 LEU C C 5 178.179 178.179 177.940 0.239 25148 1358 1 3 . 1 1 5 5 LEU CA C 5 57.830 57.830 57.862 -0.032 25148 1359 1 3 . 1 1 5 5 LEU CB C 5 41.630 41.630 41.736 -0.106 25148 1360 1 3 . 1 1 5 5 LEU H H 5 7.877 7.877 7.423 0.454 25148 1361 1 3 . 1 1 6 6 LEU N N 6 118.058 118.058 118.823 -0.765 25148 1362 1 3 . 1 1 6 6 LEU HA H 6 3.919 3.919 3.941 -0.022 25148 1363 1 3 . 1 1 6 6 LEU C C 6 180.274 180.274 179.126 1.148 25148 1364 1 3 . 1 1 6 6 LEU CA C 6 58.221 58.221 57.928 0.293 25148 1365 1 3 . 1 1 6 6 LEU CB C 6 40.684 40.684 41.370 -0.687 25148 1366 1 3 . 1 1 6 6 LEU H H 6 7.685 7.685 7.404 0.281 25148 1367 1 3 . 1 1 7 7 ASP N N 7 120.662 120.662 118.673 1.989 25148 1368 1 3 . 1 1 7 7 ASP HA H 7 4.416 4.416 4.406 0.010 25148 1369 1 3 . 1 1 7 7 ASP C C 7 178.738 178.738 177.904 0.834 25148 1370 1 3 . 1 1 7 7 ASP CA C 7 57.519 57.519 57.035 0.485 25148 1371 1 3 . 1 1 7 7 ASP CB C 7 40.167 40.167 41.583 -1.416 25148 1372 1 3 . 1 1 7 7 ASP H H 7 8.427 8.427 8.496 -0.069 25148 1373 1 3 . 1 1 8 8 ALA N N 8 122.612 122.612 123.129 -0.517 25148 1374 1 3 . 1 1 8 8 ALA HA H 8 4.146 4.146 4.037 0.109 25148 1375 1 3 . 1 1 8 8 ALA C C 8 180.787 180.787 179.804 0.983 25148 1376 1 3 . 1 1 8 8 ALA CA C 8 55.165 55.165 55.169 -0.004 25148 1377 1 3 . 1 1 8 8 ALA CB C 8 17.711 17.711 18.277 -0.566 25148 1378 1 3 . 1 1 8 8 ALA H H 8 7.847 7.847 7.862 -0.015 25148 1379 1 3 . 1 1 9 9 LEU N N 9 116.977 116.977 117.601 -0.624 25148 1380 1 3 . 1 1 9 9 LEU HA H 9 4.115 4.115 3.842 0.273 25148 1381 1 3 . 1 1 9 9 LEU C C 9 179.510 179.510 179.329 0.181 25148 1382 1 3 . 1 1 9 9 LEU CA C 9 57.468 57.468 58.052 -0.584 25148 1383 1 3 . 1 1 9 9 LEU CB C 9 41.203 41.203 41.601 -0.398 25148 1384 1 3 . 1 1 9 9 LEU H H 9 8.256 8.256 7.614 0.642 25148 1385 1 3 . 1 1 10 10 THR N N 10 118.764 118.764 116.062 2.702 25148 1386 1 3 . 1 1 10 10 THR HA H 10 4.487 4.487 3.838 0.649 25148 1387 1 3 . 1 1 10 10 THR C C 10 176.567 176.567 176.699 -0.132 25148 1388 1 3 . 1 1 10 10 THR CA C 10 68.768 68.768 66.855 1.913 25148 1389 1 3 . 1 1 10 10 THR CB C 10 66.961 66.961 68.626 -1.665 25148 1390 1 3 . 1 1 10 10 THR H H 10 8.218 8.218 7.346 0.872 25148 1391 1 3 . 1 1 11 11 ILE N N 11 122.555 122.555 119.976 2.579 25148 1392 1 3 . 1 1 11 11 ILE HA H 11 3.779 3.779 3.717 0.062 25148 1393 1 3 . 1 1 11 11 ILE C C 11 177.793 177.793 177.660 0.133 25148 1394 1 3 . 1 1 11 11 ILE CA C 11 64.695 64.695 65.090 -0.395 25148 1395 1 3 . 1 1 11 11 ILE CB C 11 37.856 37.856 37.746 0.110 25148 1396 1 3 . 1 1 11 11 ILE H H 11 7.632 7.632 7.737 -0.105 25148 1397 1 3 . 1 1 12 12 LEU N N 12 120.469 120.469 117.034 3.435 25148 1398 1 3 . 1 1 12 12 LEU HA H 12 4.065 4.065 4.089 -0.024 25148 1399 1 3 . 1 1 12 12 LEU C C 12 179.139 179.139 179.395 -0.256 25148 1400 1 3 . 1 1 12 12 LEU CA C 12 57.944 57.944 56.708 1.236 25148 1401 1 3 . 1 1 12 12 LEU CB C 12 42.170 42.170 41.184 0.986 25148 1402 1 3 . 1 1 12 12 LEU H H 12 7.951 7.951 7.602 0.349 25148 1403 1 3 . 1 1 13 13 GLU N N 13 119.669 119.669 120.859 -1.190 25148 1404 1 3 . 1 1 13 13 GLU HA H 13 4.183 4.183 3.993 0.190 25148 1405 1 3 . 1 1 13 13 GLU C C 13 179.007 179.007 177.747 1.260 25148 1406 1 3 . 1 1 13 13 GLU CA C 13 59.703 59.703 58.834 0.869 25148 1407 1 3 . 1 1 13 13 GLU CB C 13 30.110 30.110 28.994 1.116 25148 1408 1 3 . 1 1 13 13 GLU H H 13 8.003 8.003 7.702 0.301 25148 1409 1 3 . 1 1 14 14 LYS N N 14 118.935 118.935 116.864 2.071 25148 1410 1 3 . 1 1 14 14 LYS HA H 14 4.124 4.124 4.040 0.084 25148 1411 1 3 . 1 1 14 14 LYS CA C 14 58.847 58.847 57.666 1.181 25148 1412 1 3 . 1 1 14 14 LYS CB C 14 33.053 33.053 32.799 0.254 25148 1413 1 3 . 1 1 14 14 LYS H H 14 7.862 7.862 7.428 0.434 25148 1414 1 3 . 1 1 15 15 GLU HA H 15 3.693 3.693 4.281 -0.588 25148 1415 1 3 . 1 1 15 15 GLU CA C 15 56.688 56.688 56.586 0.102 25148 1416 1 3 . 1 1 15 15 GLU CB C 15 32.204 32.204 30.227 1.976 25148 1417 1 3 . 1 1 16 16 LYS HA H 16 4.678 4.678 4.298 0.380 25148 1418 1 3 . 1 1 16 16 LYS CA C 16 55.135 55.135 56.524 -1.389 25148 1419 1 3 . 1 1 16 16 LYS CB C 16 34.049 34.049 33.301 0.748 25148 1420 1 3 . 1 1 17 17 GLY CA C 17 46.541 46.541 45.401 1.140 25148 1421 1 3 . 1 1 18 18 ILE N N 18 115.364 115.364 119.664 -4.300 25148 1422 1 3 . 1 1 18 18 ILE HA H 18 4.079 4.079 4.228 -0.149 25148 1423 1 3 . 1 1 18 18 ILE C C 18 174.751 174.751 174.753 -0.002 25148 1424 1 3 . 1 1 18 18 ILE CA C 18 60.333 60.333 60.453 -0.120 25148 1425 1 3 . 1 1 18 18 ILE CB C 18 39.044 39.044 40.411 -1.367 25148 1426 1 3 . 1 1 18 18 ILE H H 18 8.203 8.203 7.613 0.590 25148 1427 1 3 . 1 1 19 19 SER N N 19 119.891 119.891 120.299 -0.408 25148 1428 1 3 . 1 1 19 19 SER HA H 19 4.362 4.362 4.872 -0.510 25148 1429 1 3 . 1 1 19 19 SER CA C 19 58.476 58.476 57.004 1.472 25148 1430 1 3 . 1 1 19 19 SER CB C 19 63.533 63.533 64.558 -1.025 25148 1431 1 3 . 1 1 19 19 SER H H 19 8.253 8.253 8.546 -0.293 25148 1432 1 3 . 1 1 20 20 LYS N N 20 124.782 124.782 127.076 -2.294 25148 1433 1 3 . 1 1 20 20 LYS HA H 20 4.137 4.137 4.172 -0.035 25148 1434 1 3 . 1 1 20 20 LYS C C 20 177.889 177.889 177.418 0.471 25148 1435 1 3 . 1 1 20 20 LYS CA C 20 59.485 59.485 58.922 0.563 25148 1436 1 3 . 1 1 20 20 LYS CB C 20 32.711 32.711 32.184 0.527 25148 1437 1 3 . 1 1 20 20 LYS H H 20 8.918 8.918 8.886 0.032 25148 1438 1 3 . 1 1 21 21 GLU N N 21 117.831 117.831 118.398 -0.567 25148 1439 1 3 . 1 1 21 21 GLU HA H 21 3.957 3.957 4.055 -0.098 25148 1440 1 3 . 1 1 21 21 GLU C C 21 178.822 178.822 178.765 0.057 25148 1441 1 3 . 1 1 21 21 GLU CA C 21 59.529 59.529 59.131 0.398 25148 1442 1 3 . 1 1 21 21 GLU CB C 21 29.237 29.237 29.240 -0.003 25148 1443 1 3 . 1 1 21 21 GLU H H 21 8.361 8.361 8.565 -0.204 25148 1444 1 3 . 1 1 22 22 ILE N N 22 118.690 118.690 118.590 0.100 25148 1445 1 3 . 1 1 22 22 ILE HA H 22 3.884 3.884 3.904 -0.020 25148 1446 1 3 . 1 1 22 22 ILE C C 22 179.247 179.247 177.568 1.679 25148 1447 1 3 . 1 1 22 22 ILE CA C 22 63.735 63.735 64.142 -0.407 25148 1448 1 3 . 1 1 22 22 ILE CB C 22 37.415 37.415 37.922 -0.507 25148 1449 1 3 . 1 1 22 22 ILE H H 22 7.353 7.353 7.403 -0.050 25148 1450 1 3 . 1 1 23 23 ILE N N 23 120.880 120.880 120.887 -0.007 25148 1451 1 3 . 1 1 23 23 ILE HA H 23 3.733 3.733 3.699 0.034 25148 1452 1 3 . 1 1 23 23 ILE C C 23 177.817 177.817 178.018 -0.201 25148 1453 1 3 . 1 1 23 23 ILE CA C 23 64.172 64.172 63.970 0.202 25148 1454 1 3 . 1 1 23 23 ILE CB C 23 36.473 36.473 36.750 -0.277 25148 1455 1 3 . 1 1 23 23 ILE H H 23 7.571 7.571 7.148 0.423 25148 1456 1 3 . 1 1 24 24 ILE N N 24 121.460 121.460 119.666 1.794 25148 1457 1 3 . 1 1 24 24 ILE HA H 24 3.486 3.486 3.549 -0.063 25148 1458 1 3 . 1 1 24 24 ILE C C 24 177.759 177.759 177.982 -0.223 25148 1459 1 3 . 1 1 24 24 ILE CA C 24 66.641 66.641 66.172 0.469 25148 1460 1 3 . 1 1 24 24 ILE CB C 24 37.307 37.307 37.473 -0.166 25148 1461 1 3 . 1 1 24 24 ILE H H 24 8.709 8.709 7.720 0.989 25148 1462 1 3 . 1 1 25 25 GLU N N 25 119.323 119.323 118.271 1.052 25148 1463 1 3 . 1 1 25 25 GLU HA H 25 4.177 4.177 4.389 -0.212 25148 1464 1 3 . 1 1 25 25 GLU C C 25 179.348 179.348 178.671 0.677 25148 1465 1 3 . 1 1 25 25 GLU CA C 25 59.951 59.951 59.113 0.838 25148 1466 1 3 . 1 1 25 25 GLU CB C 25 29.340 29.340 29.258 0.082 25148 1467 1 3 . 1 1 25 25 GLU H H 25 8.048 8.048 8.215 -0.167 25148 1468 1 3 . 1 1 26 26 ALA N N 26 122.390 122.390 122.868 -0.478 25148 1469 1 3 . 1 1 26 26 ALA HA H 26 4.325 4.325 4.106 0.219 25148 1470 1 3 . 1 1 26 26 ALA C C 26 181.440 181.440 179.769 1.671 25148 1471 1 3 . 1 1 26 26 ALA CA C 26 54.935 54.935 54.914 0.021 25148 1472 1 3 . 1 1 26 26 ALA CB C 26 17.834 17.834 18.250 -0.416 25148 1473 1 3 . 1 1 26 26 ALA H H 26 7.768 7.768 7.511 0.257 25148 1474 1 3 . 1 1 27 27 ILE N N 27 122.342 122.342 119.169 3.173 25148 1475 1 3 . 1 1 27 27 ILE HA H 27 3.575 3.575 3.609 -0.034 25148 1476 1 3 . 1 1 27 27 ILE C C 27 177.541 177.541 178.071 -0.530 25148 1477 1 3 . 1 1 27 27 ILE CA C 27 66.536 66.536 65.650 0.886 25148 1478 1 3 . 1 1 27 27 ILE CB C 27 37.886 37.886 37.698 0.188 25148 1479 1 3 . 1 1 27 27 ILE H H 27 8.805 8.805 7.725 1.080 25148 1480 1 3 . 1 1 28 28 GLU N N 28 120.188 120.188 119.583 0.605 25148 1481 1 3 . 1 1 28 28 GLU HA H 28 3.687 3.687 3.910 -0.223 25148 1482 1 3 . 1 1 28 28 GLU C C 28 178.707 178.707 178.918 -0.211 25148 1483 1 3 . 1 1 28 28 GLU CA C 28 61.458 61.458 59.945 1.513 25148 1484 1 3 . 1 1 28 28 GLU CB C 28 29.624 29.624 29.171 0.453 25148 1485 1 3 . 1 1 28 28 GLU H H 28 8.882 8.882 7.721 1.161 25148 1486 1 3 . 1 1 29 29 ALA N N 29 119.293 119.293 121.210 -1.917 25148 1487 1 3 . 1 1 29 29 ALA HA H 29 4.214 4.214 4.065 0.149 25148 1488 1 3 . 1 1 29 29 ALA C C 29 181.200 181.200 179.724 1.476 25148 1489 1 3 . 1 1 29 29 ALA CA C 29 55.435 55.435 54.913 0.522 25148 1490 1 3 . 1 1 29 29 ALA CB C 29 18.090 18.090 18.067 0.023 25148 1491 1 3 . 1 1 29 29 ALA H H 29 8.065 8.065 7.865 0.200 25148 1492 1 3 . 1 1 30 30 ALA N N 30 121.729 121.729 122.069 -0.340 25148 1493 1 3 . 1 1 30 30 ALA HA H 30 4.307 4.307 4.159 0.148 25148 1494 1 3 . 1 1 30 30 ALA C C 30 181.315 181.315 179.496 1.819 25148 1495 1 3 . 1 1 30 30 ALA CA C 30 54.594 54.594 54.849 -0.255 25148 1496 1 3 . 1 1 30 30 ALA CB C 30 18.704 18.704 18.364 0.340 25148 1497 1 3 . 1 1 30 30 ALA H H 30 8.099 8.099 7.460 0.639 25148 1498 1 3 . 1 1 31 31 LEU N N 31 120.900 120.900 120.415 0.485 25148 1499 1 3 . 1 1 31 31 LEU HA H 31 4.347 4.347 4.111 0.236 25148 1500 1 3 . 1 1 31 31 LEU C C 31 179.137 179.137 179.371 -0.234 25148 1501 1 3 . 1 1 31 31 LEU CA C 31 57.569 57.569 58.215 -0.646 25148 1502 1 3 . 1 1 31 31 LEU CB C 31 42.353 42.353 41.110 1.243 25148 1503 1 3 . 1 1 31 31 LEU H H 31 8.863 8.863 8.155 0.708 25148 1504 1 3 . 1 1 32 32 ILE N N 32 122.410 122.410 118.751 3.659 25148 1505 1 3 . 1 1 32 32 ILE HA H 32 3.699 3.699 3.707 -0.008 25148 1506 1 3 . 1 1 32 32 ILE C C 32 178.303 178.303 177.836 0.467 25148 1507 1 3 . 1 1 32 32 ILE CA C 32 66.066 66.066 65.233 0.833 25148 1508 1 3 . 1 1 32 32 ILE CB C 32 37.882 37.882 37.924 -0.042 25148 1509 1 3 . 1 1 32 32 ILE H H 32 8.234 8.234 8.517 -0.283 25148 1510 1 3 . 1 1 33 33 SER N N 33 114.201 114.201 115.668 -1.467 25148 1511 1 3 . 1 1 33 33 SER HA H 33 4.311 4.311 4.141 0.170 25148 1512 1 3 . 1 1 33 33 SER C C 33 177.012 177.012 176.722 0.290 25148 1513 1 3 . 1 1 33 33 SER CA C 33 61.860 61.860 61.682 0.178 25148 1514 1 3 . 1 1 33 33 SER CB C 33 62.508 62.508 63.192 -0.684 25148 1515 1 3 . 1 1 33 33 SER H H 33 7.558 7.558 7.737 -0.179 25148 1516 1 3 . 1 1 34 34 ALA N N 34 122.893 122.893 124.455 -1.562 25148 1517 1 3 . 1 1 34 34 ALA HA H 34 4.215 4.215 4.080 0.135 25148 1518 1 3 . 1 1 34 34 ALA C C 34 180.814 180.814 179.251 1.563 25148 1519 1 3 . 1 1 34 34 ALA CA C 34 55.283 55.283 54.967 0.316 25148 1520 1 3 . 1 1 34 34 ALA CB C 34 18.273 18.273 18.334 -0.061 25148 1521 1 3 . 1 1 34 34 ALA H H 34 8.409 8.409 8.318 0.091 25148 1522 1 3 . 1 1 35 35 TYR N N 35 120.259 120.259 118.747 1.512 25148 1523 1 3 . 1 1 35 35 TYR HA H 35 4.393 4.393 4.404 -0.011 25148 1524 1 3 . 1 1 35 35 TYR C C 35 177.892 177.892 177.102 0.790 25148 1525 1 3 . 1 1 35 35 TYR CA C 35 63.071 63.071 60.404 2.667 25148 1526 1 3 . 1 1 35 35 TYR CB C 35 38.021 38.021 39.015 -0.994 25148 1527 1 3 . 1 1 35 35 TYR H H 35 8.975 8.975 8.031 0.944 25148 1528 1 3 . 1 1 36 36 LYS N N 36 120.942 120.942 119.956 0.986 25148 1529 1 3 . 1 1 36 36 LYS HA H 36 4.032 4.032 4.050 -0.018 25148 1530 1 3 . 1 1 36 36 LYS C C 36 177.797 177.797 178.073 -0.276 25148 1531 1 3 . 1 1 36 36 LYS CA C 36 59.900 59.900 58.964 0.936 25148 1532 1 3 . 1 1 36 36 LYS CB C 36 32.429 32.429 32.207 0.222 25148 1533 1 3 . 1 1 36 36 LYS H H 36 8.654 8.654 7.848 0.806 25148 1534 1 3 . 1 1 37 37 ARG N N 37 115.139 115.139 116.330 -1.191 25148 1535 1 3 . 1 1 37 37 ARG HA H 37 4.101 4.101 4.119 -0.018 25148 1536 1 3 . 1 1 37 37 ARG C C 37 177.517 177.517 178.105 -0.588 25148 1537 1 3 . 1 1 37 37 ARG CA C 37 58.276 58.276 58.199 0.077 25148 1538 1 3 . 1 1 37 37 ARG CB C 37 31.014 31.014 29.887 1.127 25148 1539 1 3 . 1 1 37 37 ARG H H 37 8.138 8.138 7.767 0.371 25148 1540 1 3 . 1 1 38 38 ASN N N 38 112.555 112.555 116.696 -4.141 25148 1541 1 3 . 1 1 38 38 ASN HA H 38 4.540 4.540 4.273 0.267 25148 1542 1 3 . 1 1 38 38 ASN C C 38 173.994 173.994 175.406 -1.412 25148 1543 1 3 . 1 1 38 38 ASN CA C 38 54.722 54.722 55.325 -0.603 25148 1544 1 3 . 1 1 38 38 ASN CB C 38 42.077 42.077 39.004 3.073 25148 1545 1 3 . 1 1 38 38 ASN H H 38 7.426 7.426 7.434 -0.008 25148 1546 1 3 . 1 1 39 39 PHE N N 39 116.711 116.711 117.104 -0.393 25148 1547 1 3 . 1 1 39 39 PHE HA H 39 4.569 4.569 4.842 -0.273 25148 1548 1 3 . 1 1 39 39 PHE CA C 39 58.913 58.913 56.000 2.913 25148 1549 1 3 . 1 1 39 39 PHE CB C 39 39.781 39.781 38.533 1.248 25148 1550 1 3 . 1 1 39 39 PHE H H 39 7.959 7.959 7.383 0.576 25148 1551 1 3 . 1 1 40 40 ASN HA H 40 4.018 4.018 4.540 -0.522 25148 1552 1 3 . 1 1 40 40 ASN CA C 40 58.944 58.944 55.107 3.837 25148 1553 1 3 . 1 1 41 41 GLN HA H 41 4.298 4.298 4.442 -0.144 25148 1554 1 3 . 1 1 41 41 GLN C C 41 175.237 175.237 175.731 -0.494 25148 1555 1 3 . 1 1 41 41 GLN CA C 41 57.360 57.360 56.687 0.673 25148 1556 1 3 . 1 1 41 41 GLN CB C 41 28.724 28.724 27.833 0.891 25148 1557 1 3 . 1 1 42 42 ALA N N 42 120.514 120.514 121.500 -0.986 25148 1558 1 3 . 1 1 42 42 ALA HA H 42 4.622 4.622 4.438 0.184 25148 1559 1 3 . 1 1 42 42 ALA C C 42 175.922 175.922 176.620 -0.698 25148 1560 1 3 . 1 1 42 42 ALA CA C 42 51.841 51.841 52.274 -0.433 25148 1561 1 3 . 1 1 42 42 ALA CB C 42 21.576 21.576 20.397 1.179 25148 1562 1 3 . 1 1 42 42 ALA H H 42 7.817 7.817 8.146 -0.329 25148 1563 1 3 . 1 1 43 43 GLN N N 43 117.594 117.594 114.887 2.707 25148 1564 1 3 . 1 1 43 43 GLN HA H 43 4.265 4.265 4.644 -0.379 25148 1565 1 3 . 1 1 43 43 GLN C C 43 174.942 174.942 173.752 1.190 25148 1566 1 3 . 1 1 43 43 GLN CA C 43 57.047 57.047 54.977 2.070 25148 1567 1 3 . 1 1 43 43 GLN CB C 43 30.863 30.863 31.747 -0.884 25148 1568 1 3 . 1 1 43 43 GLN H H 43 7.400 7.400 7.535 -0.135 25148 1569 1 3 . 1 1 44 44 ASN N N 44 120.467 120.467 120.133 0.334 25148 1570 1 3 . 1 1 44 44 ASN HA H 44 5.005 5.005 4.720 0.285 25148 1571 1 3 . 1 1 44 44 ASN C C 44 174.365 174.365 174.348 0.017 25148 1572 1 3 . 1 1 44 44 ASN CA C 44 52.381 52.381 52.958 -0.577 25148 1573 1 3 . 1 1 44 44 ASN CB C 44 38.177 38.177 39.084 -0.907 25148 1574 1 3 . 1 1 44 44 ASN H H 44 9.123 9.123 8.586 0.537 25148 1575 1 3 . 1 1 45 45 VAL N N 45 115.479 115.479 116.287 -0.808 25148 1576 1 3 . 1 1 45 45 VAL HA H 45 5.376 5.376 4.251 1.125 25148 1577 1 3 . 1 1 45 45 VAL C C 45 174.908 174.908 174.050 0.858 25148 1578 1 3 . 1 1 45 45 VAL CA C 45 59.022 59.022 62.213 -3.191 25148 1579 1 3 . 1 1 45 45 VAL CB C 45 35.776 35.776 34.888 0.888 25148 1580 1 3 . 1 1 45 45 VAL H H 45 7.732 7.732 8.168 -0.436 25148 1581 1 3 . 1 1 46 46 ARG N N 46 121.146 121.146 126.094 -4.948 25148 1582 1 3 . 1 1 46 46 ARG HA H 46 4.566 4.566 4.824 -0.258 25148 1583 1 3 . 1 1 46 46 ARG C C 46 173.790 173.790 174.361 -0.571 25148 1584 1 3 . 1 1 46 46 ARG CA C 46 54.762 54.762 54.082 0.680 25148 1585 1 3 . 1 1 46 46 ARG CB C 46 33.946 33.946 31.941 2.006 25148 1586 1 3 . 1 1 46 46 ARG H H 46 8.850 8.850 9.139 -0.289 25148 1587 1 3 . 1 1 47 47 VAL N N 47 122.339 122.339 125.283 -2.944 25148 1588 1 3 . 1 1 47 47 VAL HA H 47 4.741 4.741 4.541 0.200 25148 1589 1 3 . 1 1 47 47 VAL C C 47 173.541 173.541 176.157 -2.616 25148 1590 1 3 . 1 1 47 47 VAL CA C 47 60.893 60.893 61.623 -0.730 25148 1591 1 3 . 1 1 47 47 VAL CB C 47 33.563 33.563 33.131 0.432 25148 1592 1 3 . 1 1 47 47 VAL H H 47 8.444 8.444 8.577 -0.133 25148 1593 1 3 . 1 1 48 48 ASP N N 48 127.701 127.701 128.067 -0.366 25148 1594 1 3 . 1 1 48 48 ASP HA H 48 4.946 4.946 4.966 -0.020 25148 1595 1 3 . 1 1 48 48 ASP C C 48 173.744 173.744 174.278 -0.534 25148 1596 1 3 . 1 1 48 48 ASP CA C 48 52.651 52.651 53.223 -0.572 25148 1597 1 3 . 1 1 48 48 ASP CB C 48 45.225 45.225 43.822 1.403 25148 1598 1 3 . 1 1 48 48 ASP H H 48 9.068 9.068 8.716 0.352 25148 1599 1 3 . 1 1 49 49 LEU N N 49 130.945 130.945 125.937 5.008 25148 1600 1 3 . 1 1 49 49 LEU HA H 49 4.774 4.774 4.710 0.064 25148 1601 1 3 . 1 1 49 49 LEU C C 49 174.531 174.531 175.741 -1.210 25148 1602 1 3 . 1 1 49 49 LEU CA C 49 54.337 54.337 54.565 -0.228 25148 1603 1 3 . 1 1 49 49 LEU CB C 49 43.192 43.192 43.828 -0.636 25148 1604 1 3 . 1 1 49 49 LEU H H 49 9.369 9.369 8.612 0.757 25148 1605 1 3 . 1 1 50 50 ASN N N 50 126.268 126.268 124.751 1.517 25148 1606 1 3 . 1 1 50 50 ASN HA H 50 4.629 4.629 5.044 -0.415 25148 1607 1 3 . 1 1 50 50 ASN C C 50 176.602 176.602 175.337 1.265 25148 1608 1 3 . 1 1 50 50 ASN CA C 50 54.048 54.048 52.418 1.630 25148 1609 1 3 . 1 1 50 50 ASN CB C 50 39.891 39.891 39.108 0.783 25148 1610 1 3 . 1 1 50 50 ASN H H 50 8.672 8.672 8.928 -0.256 25148 1611 1 3 . 1 1 51 51 ARG N N 51 125.897 125.897 124.799 1.098 25148 1612 1 3 . 1 1 51 51 ARG HA H 51 3.789 3.789 4.023 -0.234 25148 1613 1 3 . 1 1 51 51 ARG C C 51 175.681 175.681 176.515 -0.834 25148 1614 1 3 . 1 1 51 51 ARG CA C 51 58.162 58.162 58.401 -0.239 25148 1615 1 3 . 1 1 51 51 ARG CB C 51 29.944 29.944 29.886 0.058 25148 1616 1 3 . 1 1 51 51 ARG H H 51 8.984 8.984 8.722 0.262 25148 1617 1 3 . 1 1 52 52 GLU N N 52 116.733 116.733 118.610 -1.877 25148 1618 1 3 . 1 1 52 52 GLU HA H 52 4.368 4.368 4.205 0.163 25148 1619 1 3 . 1 1 52 52 GLU C C 52 178.049 178.049 177.474 0.575 25148 1620 1 3 . 1 1 52 52 GLU CA C 52 58.048 58.048 58.298 -0.250 25148 1621 1 3 . 1 1 52 52 GLU CB C 52 30.716 30.716 29.343 1.373 25148 1622 1 3 . 1 1 52 52 GLU H H 52 8.541 8.541 8.556 -0.015 25148 1623 1 3 . 1 1 53 53 THR N N 53 106.556 106.556 107.389 -0.833 25148 1624 1 3 . 1 1 53 53 THR HA H 53 4.424 4.424 4.597 -0.173 25148 1625 1 3 . 1 1 53 53 THR C C 53 176.352 176.352 175.006 1.346 25148 1626 1 3 . 1 1 53 53 THR CA C 53 61.320 61.320 61.057 0.263 25148 1627 1 3 . 1 1 53 53 THR CB C 53 71.220 71.220 69.546 1.674 25148 1628 1 3 . 1 1 53 53 THR H H 53 8.085 8.085 7.534 0.551 25148 1629 1 3 . 1 1 54 54 GLY N N 54 111.843 111.843 110.298 1.545 25148 1630 1 3 . 1 1 54 54 GLY C C 54 172.690 172.690 174.260 -1.570 25148 1631 1 3 . 1 1 54 54 GLY CA C 54 45.417 45.417 46.286 -0.869 25148 1632 1 3 . 1 1 54 54 GLY H H 54 8.330 8.330 7.830 0.500 25148 1633 1 3 . 1 1 55 55 SER N N 55 113.844 113.844 113.750 0.094 25148 1634 1 3 . 1 1 55 55 SER HA H 55 4.279 4.279 4.648 -0.369 25148 1635 1 3 . 1 1 55 55 SER C C 55 174.127 174.127 173.147 0.980 25148 1636 1 3 . 1 1 55 55 SER CA C 55 59.229 59.229 58.070 1.159 25148 1637 1 3 . 1 1 55 55 SER CB C 55 63.939 63.939 65.388 -1.449 25148 1638 1 3 . 1 1 55 55 SER H H 55 7.653 7.653 7.533 0.120 25148 1639 1 3 . 1 1 56 56 ILE N N 56 125.286 125.286 119.947 5.339 25148 1640 1 3 . 1 1 56 56 ILE HA H 56 5.082 5.082 4.717 0.365 25148 1641 1 3 . 1 1 56 56 ILE C C 56 175.346 175.346 174.265 1.081 25148 1642 1 3 . 1 1 56 56 ILE CA C 56 59.967 59.967 60.437 -0.470 25148 1643 1 3 . 1 1 56 56 ILE CB C 56 40.165 40.165 42.362 -2.197 25148 1644 1 3 . 1 1 56 56 ILE H H 56 8.478 8.478 8.475 0.003 25148 1645 1 3 . 1 1 57 57 ARG N N 57 126.332 126.332 127.257 -0.925 25148 1646 1 3 . 1 1 57 57 ARG HA H 57 4.740 4.740 4.587 0.153 25148 1647 1 3 . 1 1 57 57 ARG C C 57 173.921 173.921 173.564 0.357 25148 1648 1 3 . 1 1 57 57 ARG CA C 57 54.311 54.311 53.865 0.446 25148 1649 1 3 . 1 1 57 57 ARG CB C 57 35.805 35.805 33.180 2.625 25148 1650 1 3 . 1 1 57 57 ARG H H 57 8.590 8.590 8.425 0.165 25148 1651 1 3 . 1 1 58 58 VAL N N 58 120.987 120.987 123.339 -2.352 25148 1652 1 3 . 1 1 58 58 VAL HA H 58 4.334 4.334 4.007 0.327 25148 1653 1 3 . 1 1 58 58 VAL C C 58 174.204 174.204 174.035 0.169 25148 1654 1 3 . 1 1 58 58 VAL CA C 58 60.861 60.861 61.742 -0.881 25148 1655 1 3 . 1 1 58 58 VAL CB C 58 33.383 33.383 32.138 1.245 25148 1656 1 3 . 1 1 58 58 VAL H H 58 8.585 8.585 8.245 0.340 25148 1657 1 3 . 1 1 59 59 PHE N N 59 124.913 124.913 126.654 -1.741 25148 1658 1 3 . 1 1 59 59 PHE HA H 59 5.046 5.046 5.402 -0.356 25148 1659 1 3 . 1 1 59 59 PHE C C 59 174.446 174.446 174.487 -0.041 25148 1660 1 3 . 1 1 59 59 PHE CA C 59 56.695 56.695 55.223 1.472 25148 1661 1 3 . 1 1 59 59 PHE CB C 59 42.779 42.779 43.119 -0.340 25148 1662 1 3 . 1 1 59 59 PHE H H 59 8.920 8.920 8.586 0.334 25148 1663 1 3 . 1 1 60 60 ALA N N 60 124.035 124.035 124.045 -0.010 25148 1664 1 3 . 1 1 60 60 ALA HA H 60 5.102 5.102 4.766 0.336 25148 1665 1 3 . 1 1 60 60 ALA C C 60 176.017 176.017 176.638 -0.621 25148 1666 1 3 . 1 1 60 60 ALA CA C 60 50.083 50.083 50.767 -0.684 25148 1667 1 3 . 1 1 60 60 ALA CB C 60 22.400 22.400 20.404 1.996 25148 1668 1 3 . 1 1 60 60 ALA H H 60 9.457 9.457 8.814 0.643 25148 1669 1 3 . 1 1 61 61 ARG N N 61 121.530 121.530 125.089 -3.559 25148 1670 1 3 . 1 1 61 61 ARG HA H 61 4.958 4.958 4.645 0.313 25148 1671 1 3 . 1 1 61 61 ARG C C 61 176.737 176.737 175.490 1.247 25148 1672 1 3 . 1 1 61 61 ARG CA C 61 55.375 55.375 55.792 -0.417 25148 1673 1 3 . 1 1 61 61 ARG CB C 61 31.230 31.230 30.768 0.462 25148 1674 1 3 . 1 1 61 61 ARG H H 61 8.447 8.447 8.725 -0.278 25148 1675 1 3 . 1 1 62 62 LYS N N 62 124.784 124.784 125.865 -1.081 25148 1676 1 3 . 1 1 62 62 LYS HA H 62 4.709 4.709 4.445 0.264 25148 1677 1 3 . 1 1 62 62 LYS C C 62 173.899 173.899 174.961 -1.062 25148 1678 1 3 . 1 1 62 62 LYS CA C 62 54.812 54.812 55.028 -0.216 25148 1679 1 3 . 1 1 62 62 LYS CB C 62 37.147 37.147 35.248 1.899 25148 1680 1 3 . 1 1 62 62 LYS H H 62 9.137 9.137 8.000 1.137 25148 1681 1 3 . 1 1 63 63 ASP N N 63 122.552 122.552 125.220 -2.668 25148 1682 1 3 . 1 1 63 63 ASP HA H 63 4.877 4.877 4.651 0.226 25148 1683 1 3 . 1 1 63 63 ASP C C 63 175.560 175.560 176.541 -0.981 25148 1684 1 3 . 1 1 63 63 ASP CA C 63 54.576 54.576 54.380 0.196 25148 1685 1 3 . 1 1 63 63 ASP CB C 63 42.841 42.841 41.178 1.663 25148 1686 1 3 . 1 1 63 63 ASP H H 63 8.334 8.334 8.762 -0.428 25148 1687 1 3 . 1 1 64 64 VAL N N 64 123.109 123.109 126.779 -3.670 25148 1688 1 3 . 1 1 64 64 VAL HA H 64 4.557 4.557 4.417 0.140 25148 1689 1 3 . 1 1 64 64 VAL C C 64 177.260 177.260 175.307 1.953 25148 1690 1 3 . 1 1 64 64 VAL CA C 64 62.268 62.268 63.247 -0.979 25148 1691 1 3 . 1 1 64 64 VAL CB C 64 30.348 30.348 31.335 -0.987 25148 1692 1 3 . 1 1 64 64 VAL H H 64 8.693 8.693 8.547 0.146 25148 1693 1 3 . 1 1 65 65 VAL N N 65 122.320 122.320 121.609 0.711 25148 1694 1 3 . 1 1 65 65 VAL HA H 65 4.939 4.939 4.472 0.467 25148 1695 1 3 . 1 1 65 65 VAL C C 65 174.754 174.754 174.774 -0.020 25148 1696 1 3 . 1 1 65 65 VAL CA C 65 59.173 59.173 60.203 -1.030 25148 1697 1 3 . 1 1 65 65 VAL CB C 65 36.289 36.289 35.285 1.004 25148 1698 1 3 . 1 1 65 65 VAL H H 65 8.656 8.656 8.418 0.238 25148 1699 1 3 . 1 1 66 66 ASP N N 66 119.805 119.805 122.098 -2.293 25148 1700 1 3 . 1 1 66 66 ASP HA H 66 4.499 4.499 4.308 0.191 25148 1701 1 3 . 1 1 66 66 ASP C C 66 176.565 176.565 175.667 0.898 25148 1702 1 3 . 1 1 66 66 ASP CA C 66 57.236 57.236 56.513 0.723 25148 1703 1 3 . 1 1 66 66 ASP CB C 66 41.662 41.662 41.219 0.443 25148 1704 1 3 . 1 1 66 66 ASP H H 66 8.628 8.628 8.708 -0.080 25148 1705 1 3 . 1 1 67 67 GLU N N 67 117.604 117.604 116.108 1.496 25148 1706 1 3 . 1 1 67 67 GLU HA H 67 4.350 4.350 4.319 0.031 25148 1707 1 3 . 1 1 67 67 GLU C C 67 173.736 173.736 175.265 -1.529 25148 1708 1 3 . 1 1 67 67 GLU CA C 67 55.203 55.203 54.328 0.875 25148 1709 1 3 . 1 1 67 67 GLU CB C 67 32.240 32.240 32.880 -0.640 25148 1710 1 3 . 1 1 67 67 GLU H H 67 7.525 7.525 7.488 0.037 25148 1711 1 3 . 1 1 68 68 VAL N N 68 125.774 125.774 123.410 2.364 25148 1712 1 3 . 1 1 68 68 VAL HA H 68 3.578 3.578 3.632 -0.054 25148 1713 1 3 . 1 1 68 68 VAL C C 68 175.885 175.885 175.691 0.194 25148 1714 1 3 . 1 1 68 68 VAL CA C 68 63.397 63.397 64.018 -0.621 25148 1715 1 3 . 1 1 68 68 VAL CB C 68 32.452 32.452 31.488 0.964 25148 1716 1 3 . 1 1 68 68 VAL H H 68 8.573 8.573 8.332 0.241 25148 1717 1 3 . 1 1 69 69 TYR N N 69 129.859 129.859 125.867 3.992 25148 1718 1 3 . 1 1 69 69 TYR HA H 69 4.642 4.642 4.674 -0.032 25148 1719 1 3 . 1 1 69 69 TYR C C 69 176.100 176.100 175.639 0.461 25148 1720 1 3 . 1 1 69 69 TYR CA C 69 59.092 59.092 57.355 1.738 25148 1721 1 3 . 1 1 69 69 TYR CB C 69 39.830 39.830 39.653 0.177 25148 1722 1 3 . 1 1 69 69 TYR H H 69 9.801 9.801 8.303 1.498 25148 1723 1 3 . 1 1 70 70 ASP N N 70 120.204 120.204 120.742 -0.538 25148 1724 1 3 . 1 1 70 70 ASP HA H 70 4.772 4.772 4.878 -0.106 25148 1725 1 3 . 1 1 70 70 ASP C C 70 176.622 176.622 176.191 0.431 25148 1726 1 3 . 1 1 70 70 ASP CA C 70 52.885 52.885 53.105 -0.220 25148 1727 1 3 . 1 1 70 70 ASP CB C 70 41.878 41.878 41.236 0.642 25148 1728 1 3 . 1 1 70 70 ASP H H 70 8.348 8.348 8.023 0.326 25148 1729 1 3 . 1 1 71 71 GLN N N 71 125.440 125.440 124.479 0.961 25148 1730 1 3 . 1 1 71 71 GLN HA H 71 4.315 4.315 4.052 0.263 25148 1731 1 3 . 1 1 71 71 GLN C C 71 175.819 175.819 176.679 -0.860 25148 1732 1 3 . 1 1 71 71 GLN CA C 71 57.914 57.914 57.993 -0.079 25148 1733 1 3 . 1 1 71 71 GLN CB C 71 28.307 28.307 28.918 -0.611 25148 1734 1 3 . 1 1 71 71 GLN H H 71 9.097 9.097 8.769 0.328 25148 1735 1 3 . 1 1 72 72 ARG N N 72 116.306 116.306 114.593 1.713 25148 1736 1 3 . 1 1 72 72 ARG HA H 72 4.252 4.252 4.185 0.067 25148 1737 1 3 . 1 1 72 72 ARG C C 72 178.087 178.087 175.230 2.857 25148 1738 1 3 . 1 1 72 72 ARG CA C 72 58.532 58.532 57.424 1.108 25148 1739 1 3 . 1 1 72 72 ARG CB C 72 30.143 30.143 30.751 -0.608 25148 1740 1 3 . 1 1 72 72 ARG H H 72 8.534 8.534 7.972 0.562 25148 1741 1 3 . 1 1 73 73 LEU N N 73 116.734 116.734 113.675 3.059 25148 1742 1 3 . 1 1 73 73 LEU HA H 73 4.621 4.621 4.667 -0.046 25148 1743 1 3 . 1 1 73 73 LEU C C 73 175.946 175.946 174.943 1.003 25148 1744 1 3 . 1 1 73 73 LEU CA C 73 55.250 55.250 55.638 -0.388 25148 1745 1 3 . 1 1 73 73 LEU CB C 73 46.960 46.960 44.324 2.636 25148 1746 1 3 . 1 1 73 73 LEU H H 73 7.460 7.460 7.307 0.153 25148 1747 1 3 . 1 1 74 74 GLU N N 74 118.787 118.787 121.887 -3.100 25148 1748 1 3 . 1 1 74 74 GLU HA H 74 5.403 5.403 4.515 0.888 25148 1749 1 3 . 1 1 74 74 GLU C C 74 173.709 173.709 174.497 -0.788 25148 1750 1 3 . 1 1 74 74 GLU CA C 74 54.914 54.914 55.699 -0.785 25148 1751 1 3 . 1 1 74 74 GLU CB C 74 35.053 35.053 33.295 1.758 25148 1752 1 3 . 1 1 74 74 GLU H H 74 7.752 7.752 8.009 -0.257 25148 1753 1 3 . 1 1 75 75 ILE N N 75 119.803 119.803 121.084 -1.281 25148 1754 1 3 . 1 1 75 75 ILE HA H 75 4.507 4.507 4.329 0.178 25148 1755 1 3 . 1 1 75 75 ILE C C 75 172.126 172.126 173.789 -1.663 25148 1756 1 3 . 1 1 75 75 ILE CA C 75 58.664 58.664 60.634 -1.970 25148 1757 1 3 . 1 1 75 75 ILE CB C 75 42.560 42.560 42.036 0.524 25148 1758 1 3 . 1 1 75 75 ILE H H 75 8.975 8.975 8.302 0.673 25148 1759 1 3 . 1 1 76 76 SER N N 76 123.236 123.236 124.384 -1.148 25148 1760 1 3 . 1 1 76 76 SER HA H 76 4.505 4.505 4.805 -0.300 25148 1761 1 3 . 1 1 76 76 SER C C 76 176.145 176.145 175.889 0.256 25148 1762 1 3 . 1 1 76 76 SER CA C 76 58.108 58.108 59.062 -0.954 25148 1763 1 3 . 1 1 76 76 SER CB C 76 65.000 65.000 64.127 0.873 25148 1764 1 3 . 1 1 76 76 SER H H 76 8.810 8.810 8.439 0.371 25148 1765 1 3 . 1 1 77 77 ILE N N 77 120.629 120.629 126.139 -5.510 25148 1766 1 3 . 1 1 77 77 ILE HA H 77 3.935 3.935 3.726 0.209 25148 1767 1 3 . 1 1 77 77 ILE C C 77 175.806 175.806 176.864 -1.058 25148 1768 1 3 . 1 1 77 77 ILE CA C 77 61.928 61.928 63.822 -1.894 25148 1769 1 3 . 1 1 77 77 ILE CB C 77 38.031 38.031 38.252 -0.221 25148 1770 1 3 . 1 1 77 77 ILE H H 77 8.321 8.321 8.066 0.255 25148 1771 1 3 . 1 1 78 78 GLU N N 78 121.032 121.032 117.261 3.771 25148 1772 1 3 . 1 1 78 78 GLU HA H 78 4.082 4.082 3.997 0.085 25148 1773 1 3 . 1 1 78 78 GLU C C 78 179.829 179.829 178.245 1.584 25148 1774 1 3 . 1 1 78 78 GLU CA C 78 60.180 60.180 59.109 1.071 25148 1775 1 3 . 1 1 78 78 GLU CB C 78 28.988 28.988 28.672 0.316 25148 1776 1 3 . 1 1 78 78 GLU H H 78 8.222 8.222 8.514 -0.292 25148 1777 1 3 . 1 1 79 79 GLU N N 79 120.710 120.710 121.170 -0.460 25148 1778 1 3 . 1 1 79 79 GLU HA H 79 4.012 4.012 4.107 -0.095 25148 1779 1 3 . 1 1 79 79 GLU C C 79 180.339 180.339 179.032 1.307 25148 1780 1 3 . 1 1 79 79 GLU CA C 79 59.332 59.332 58.771 0.561 25148 1781 1 3 . 1 1 79 79 GLU CB C 79 29.317 29.317 29.533 -0.216 25148 1782 1 3 . 1 1 79 79 GLU H H 79 7.908 7.908 7.782 0.126 25148 1783 1 3 . 1 1 80 80 ALA N N 80 122.879 122.879 122.104 0.775 25148 1784 1 3 . 1 1 80 80 ALA HA H 80 3.966 3.966 4.127 -0.161 25148 1785 1 3 . 1 1 80 80 ALA C C 80 179.833 179.833 179.937 -0.104 25148 1786 1 3 . 1 1 80 80 ALA CA C 80 55.881 55.881 55.017 0.864 25148 1787 1 3 . 1 1 80 80 ALA CB C 80 18.870 18.870 18.083 0.787 25148 1788 1 3 . 1 1 80 80 ALA H H 80 9.132 9.132 7.994 1.138 25148 1789 1 3 . 1 1 81 81 GLN N N 81 115.829 115.829 116.805 -0.976 25148 1790 1 3 . 1 1 81 81 GLN HA H 81 4.749 4.749 4.307 0.442 25148 1791 1 3 . 1 1 81 81 GLN C C 81 178.126 178.126 178.003 0.123 25148 1792 1 3 . 1 1 81 81 GLN CA C 81 57.682 57.682 58.068 -0.386 25148 1793 1 3 . 1 1 81 81 GLN CB C 81 27.307 27.307 28.621 -1.314 25148 1794 1 3 . 1 1 81 81 GLN H H 81 8.709 8.709 7.764 0.945 25148 1795 1 3 . 1 1 82 82 GLY N N 82 105.531 105.531 106.669 -1.138 25148 1796 1 3 . 1 1 82 82 GLY C C 82 174.917 174.917 175.065 -0.148 25148 1797 1 3 . 1 1 82 82 GLY CA C 82 45.915 45.915 46.587 -0.672 25148 1798 1 3 . 1 1 82 82 GLY H H 82 7.479 7.479 7.916 -0.437 25148 1799 1 3 . 1 1 83 83 ILE N N 83 122.828 122.828 113.740 9.088 25148 1800 1 3 . 1 1 83 83 ILE HA H 83 3.970 3.970 4.437 -0.467 25148 1801 1 3 . 1 1 83 83 ILE C C 83 177.209 177.209 175.515 1.694 25148 1802 1 3 . 1 1 83 83 ILE CA C 83 64.305 64.305 61.631 2.674 25148 1803 1 3 . 1 1 83 83 ILE CB C 83 38.452 38.452 40.230 -1.778 25148 1804 1 3 . 1 1 83 83 ILE H H 83 7.634 7.634 7.561 0.073 25148 1805 1 3 . 1 1 84 84 HIS N N 84 118.927 118.927 120.067 -1.140 25148 1806 1 3 . 1 1 84 84 HIS HA H 84 4.713 4.713 4.935 -0.222 25148 1807 1 3 . 1 1 84 84 HIS CA C 84 55.487 55.487 54.424 1.063 25148 1808 1 3 . 1 1 84 84 HIS CB C 84 33.506 33.506 32.224 1.282 25148 1809 1 3 . 1 1 84 84 HIS H H 84 8.155 8.155 8.345 -0.190 25148 1810 1 3 . 1 1 85 85 PRO HA H 85 4.456 4.456 4.600 -0.144 25148 1811 1 3 . 1 1 85 85 PRO C C 85 177.357 177.357 177.201 0.156 25148 1812 1 3 . 1 1 85 85 PRO CA C 85 64.475 64.475 64.077 0.398 25148 1813 1 3 . 1 1 85 85 PRO CB C 85 32.489 32.489 32.098 0.391 25148 1814 1 3 . 1 1 86 86 GLU N N 86 116.314 116.314 116.796 -0.482 25148 1815 1 3 . 1 1 86 86 GLU HA H 86 4.286 4.286 4.177 0.109 25148 1816 1 3 . 1 1 86 86 GLU C C 86 177.624 177.624 177.199 0.425 25148 1817 1 3 . 1 1 86 86 GLU CA C 86 56.619 56.619 56.510 0.109 25148 1818 1 3 . 1 1 86 86 GLU CB C 86 29.389 29.389 29.323 0.066 25148 1819 1 3 . 1 1 86 86 GLU H H 86 8.938 8.938 7.840 1.098 25148 1820 1 3 . 1 1 87 87 TYR N N 87 119.773 119.773 120.304 -0.531 25148 1821 1 3 . 1 1 87 87 TYR HA H 87 4.744 4.744 4.172 0.572 25148 1822 1 3 . 1 1 87 87 TYR C C 87 174.533 174.533 176.224 -1.691 25148 1823 1 3 . 1 1 87 87 TYR CA C 87 59.117 59.117 59.364 -0.246 25148 1824 1 3 . 1 1 87 87 TYR CB C 87 38.859 38.859 38.698 0.161 25148 1825 1 3 . 1 1 87 87 TYR H H 87 7.447 7.447 7.351 0.096 25148 1826 1 3 . 1 1 88 88 MET N N 88 118.298 118.298 117.364 0.934 25148 1827 1 3 . 1 1 88 88 MET HA H 88 4.770 4.770 4.719 0.051 25148 1828 1 3 . 1 1 88 88 MET C C 88 175.638 175.638 173.865 1.773 25148 1829 1 3 . 1 1 88 88 MET CA C 88 53.133 53.133 54.620 -1.487 25148 1830 1 3 . 1 1 88 88 MET CB C 88 37.102 37.102 35.287 1.815 25148 1831 1 3 . 1 1 88 88 MET H H 88 9.023 9.023 8.394 0.629 25148 1832 1 3 . 1 1 89 89 VAL N N 89 120.157 120.157 124.497 -4.340 25148 1833 1 3 . 1 1 89 89 VAL HA H 89 3.330 3.330 3.701 -0.371 25148 1834 1 3 . 1 1 89 89 VAL C C 89 177.432 177.432 177.065 0.367 25148 1835 1 3 . 1 1 89 89 VAL CA C 89 65.675 65.675 64.975 0.700 25148 1836 1 3 . 1 1 89 89 VAL CB C 89 31.321 31.321 30.548 0.773 25148 1837 1 3 . 1 1 89 89 VAL H H 89 8.313 8.313 8.602 -0.289 25148 1838 1 3 . 1 1 90 90 GLY N N 90 116.935 116.935 116.603 0.332 25148 1839 1 3 . 1 1 90 90 GLY C C 90 175.196 175.196 174.201 0.995 25148 1840 1 3 . 1 1 90 90 GLY CA C 90 44.685 44.685 44.824 -0.139 25148 1841 1 3 . 1 1 90 90 GLY H H 90 8.551 8.551 9.103 -0.552 25148 1842 1 3 . 1 1 91 91 ASP N N 91 121.616 121.616 121.812 -0.196 25148 1843 1 3 . 1 1 91 91 ASP HA H 91 4.790 4.790 5.014 -0.224 25148 1844 1 3 . 1 1 91 91 ASP C C 91 174.431 174.431 175.016 -0.585 25148 1845 1 3 . 1 1 91 91 ASP CA C 91 55.011 55.011 53.506 1.505 25148 1846 1 3 . 1 1 91 91 ASP CB C 91 42.079 42.079 42.981 -0.902 25148 1847 1 3 . 1 1 91 91 ASP H H 91 8.073 8.073 7.913 0.160 25148 1848 1 3 . 1 1 92 92 VAL N N 92 118.919 118.919 113.967 4.952 25148 1849 1 3 . 1 1 92 92 VAL HA H 92 4.709 4.709 5.055 -0.346 25148 1850 1 3 . 1 1 92 92 VAL C C 92 175.602 175.602 174.223 1.379 25148 1851 1 3 . 1 1 92 92 VAL CA C 92 61.527 61.527 59.915 1.612 25148 1852 1 3 . 1 1 92 92 VAL CB C 92 34.110 34.110 35.444 -1.334 25148 1853 1 3 . 1 1 92 92 VAL H H 92 8.216 8.216 8.057 0.159 25148 1854 1 3 . 1 1 93 93 VAL N N 93 123.922 123.922 121.896 2.026 25148 1855 1 3 . 1 1 93 93 VAL HA H 93 4.231 4.231 4.226 0.005 25148 1856 1 3 . 1 1 93 93 VAL C C 93 174.105 174.105 174.221 -0.116 25148 1857 1 3 . 1 1 93 93 VAL CA C 93 59.644 59.644 59.601 0.043 25148 1858 1 3 . 1 1 93 93 VAL CB C 93 34.661 34.661 35.365 -0.704 25148 1859 1 3 . 1 1 93 93 VAL H H 93 8.812 8.812 7.984 0.828 25148 1860 1 3 . 1 1 94 94 GLU N N 94 123.605 123.605 129.256 -5.651 25148 1861 1 3 . 1 1 94 94 GLU HA H 94 5.347 5.347 5.079 0.268 25148 1862 1 3 . 1 1 94 94 GLU C C 94 175.708 175.708 175.657 0.051 25148 1863 1 3 . 1 1 94 94 GLU CA C 94 54.979 54.979 55.259 -0.280 25148 1864 1 3 . 1 1 94 94 GLU CB C 94 31.612 31.612 30.572 1.040 25148 1865 1 3 . 1 1 94 94 GLU H H 94 8.312 8.312 8.568 -0.256 25148 1866 1 3 . 1 1 95 95 ILE N N 95 123.581 123.581 124.580 -0.999 25148 1867 1 3 . 1 1 95 95 ILE HA H 95 4.601 4.601 4.457 0.144 25148 1868 1 3 . 1 1 95 95 ILE C C 95 175.081 175.081 176.012 -0.931 25148 1869 1 3 . 1 1 95 95 ILE CA C 95 58.601 58.601 59.663 -1.062 25148 1870 1 3 . 1 1 95 95 ILE CB C 95 41.727 41.727 40.880 0.847 25148 1871 1 3 . 1 1 95 95 ILE H H 95 9.045 9.045 7.891 1.154 25148 1872 1 3 . 1 1 96 96 GLU N N 96 128.094 128.094 127.797 0.297 25148 1873 1 3 . 1 1 96 96 GLU HA H 96 4.098 4.098 4.291 -0.193 25148 1874 1 3 . 1 1 96 96 GLU C C 96 176.845 176.845 175.729 1.116 25148 1875 1 3 . 1 1 96 96 GLU CA C 96 57.853 57.853 58.065 -0.212 25148 1876 1 3 . 1 1 96 96 GLU CB C 96 28.323 28.323 29.467 -1.144 25148 1877 1 3 . 1 1 96 96 GLU H H 96 9.256 9.256 8.905 0.351 25148 1878 1 3 . 1 1 97 97 VAL N N 97 118.446 118.446 124.008 -5.562 25148 1879 1 3 . 1 1 97 97 VAL HA H 97 4.568 4.568 4.242 0.326 25148 1880 1 3 . 1 1 97 97 VAL C C 97 175.051 175.051 175.149 -0.098 25148 1881 1 3 . 1 1 97 97 VAL CA C 97 59.796 59.796 61.138 -1.342 25148 1882 1 3 . 1 1 97 97 VAL CB C 97 32.399 32.399 33.761 -1.362 25148 1883 1 3 . 1 1 97 97 VAL H H 97 8.609 8.609 8.852 -0.243 25148 1884 1 3 . 1 1 98 98 THR N N 98 119.118 119.118 117.322 1.796 25148 1885 1 3 . 1 1 98 98 THR HA H 98 3.320 3.320 3.898 -0.578 25148 1886 1 3 . 1 1 98 98 THR CA C 98 61.628 61.628 59.159 2.469 25148 1887 1 3 . 1 1 98 98 THR CB C 98 70.031 70.031 69.055 0.976 25148 1888 1 3 . 1 1 98 98 THR H H 98 7.396 7.396 7.443 -0.047 25148 1889 1 3 . 1 1 99 99 PRO HA H 99 4.458 4.458 4.617 -0.159 25148 1890 1 3 . 1 1 99 99 PRO CA C 99 62.348 62.348 62.411 -0.063 25148 1891 1 3 . 1 1 99 99 PRO CB C 99 33.182 33.182 32.569 0.613 25148 1892 1 3 . 1 1 100 100 LYS HA H 100 4.126 4.126 4.217 -0.091 25148 1893 1 3 . 1 1 100 100 LYS CA C 100 58.773 58.773 57.715 1.058 25148 1894 1 3 . 1 1 100 100 LYS CB C 100 32.195 32.195 32.066 0.129 25148 1895 1 3 . 1 1 101 101 ASP HA H 101 4.924 4.924 4.793 0.131 25148 1896 1 3 . 1 1 101 101 ASP C C 101 176.884 176.884 176.573 0.311 25148 1897 1 3 . 1 1 101 101 ASP CA C 101 54.134 54.134 53.851 0.283 25148 1898 1 3 . 1 1 101 101 ASP CB C 101 40.272 40.272 40.527 -0.255 25148 1899 1 3 . 1 1 102 102 PHE N N 102 118.703 118.703 121.648 -2.945 25148 1900 1 3 . 1 1 102 102 PHE HA H 102 4.295 4.295 4.216 0.079 25148 1901 1 3 . 1 1 102 102 PHE C C 102 176.477 176.477 176.934 -0.457 25148 1902 1 3 . 1 1 102 102 PHE CA C 102 60.748 60.748 60.017 0.732 25148 1903 1 3 . 1 1 102 102 PHE CB C 102 39.667 39.667 39.116 0.551 25148 1904 1 3 . 1 1 102 102 PHE H H 102 7.862 7.862 7.695 0.167 25148 1905 1 3 . 1 1 103 103 GLY CA C 103 47.430 47.430 47.343 0.087 25148 1906 1 3 . 1 1 104 104 ARG N N 104 121.819 121.819 121.838 -0.019 25148 1907 1 3 . 1 1 104 104 ARG HA H 104 4.176 4.176 4.221 -0.045 25148 1908 1 3 . 1 1 104 104 ARG C C 104 178.912 178.912 178.341 0.571 25148 1909 1 3 . 1 1 104 104 ARG CA C 104 59.235 59.235 57.351 1.884 25148 1910 1 3 . 1 1 104 104 ARG CB C 104 30.000 30.000 29.999 0.001 25148 1911 1 3 . 1 1 104 104 ARG H H 104 7.809 7.809 7.474 0.335 25148 1912 1 3 . 1 1 105 105 ILE N N 105 120.331 120.331 120.659 -0.328 25148 1913 1 3 . 1 1 105 105 ILE HA H 105 3.836 3.836 3.817 0.019 25148 1914 1 3 . 1 1 105 105 ILE C C 105 179.206 179.206 177.615 1.591 25148 1915 1 3 . 1 1 105 105 ILE CA C 105 63.025 63.025 64.916 -1.891 25148 1916 1 3 . 1 1 105 105 ILE CB C 105 38.127 38.127 37.512 0.615 25148 1917 1 3 . 1 1 105 105 ILE H H 105 7.203 7.203 7.449 -0.246 25148 1918 1 3 . 1 1 106 106 ALA N N 106 124.867 124.867 122.333 2.534 25148 1919 1 3 . 1 1 106 106 ALA HA H 106 3.665 3.665 3.548 0.117 25148 1920 1 3 . 1 1 106 106 ALA C C 106 178.590 178.590 179.016 -0.426 25148 1921 1 3 . 1 1 106 106 ALA CA C 106 54.842 54.842 55.265 -0.423 25148 1922 1 3 . 1 1 106 106 ALA CB C 106 18.659 18.659 17.713 0.946 25148 1923 1 3 . 1 1 106 106 ALA H H 106 8.813 8.813 8.195 0.618 25148 1924 1 3 . 1 1 107 107 ALA N N 107 119.597 119.597 120.506 -0.909 25148 1925 1 3 . 1 1 107 107 ALA HA H 107 4.014 4.014 3.914 0.100 25148 1926 1 3 . 1 1 107 107 ALA C C 107 180.214 180.214 179.205 1.009 25148 1927 1 3 . 1 1 107 107 ALA CA C 107 55.454 55.454 54.580 0.874 25148 1928 1 3 . 1 1 107 107 ALA CB C 107 18.260 18.260 17.994 0.267 25148 1929 1 3 . 1 1 107 107 ALA H H 107 8.012 8.012 7.503 0.509 25148 1930 1 3 . 1 1 108 108 GLN N N 108 116.896 116.896 118.509 -1.613 25148 1931 1 3 . 1 1 108 108 GLN HA H 108 4.054 4.054 3.971 0.083 25148 1932 1 3 . 1 1 108 108 GLN C C 108 178.784 178.784 178.189 0.595 25148 1933 1 3 . 1 1 108 108 GLN CA C 108 58.705 58.705 59.124 -0.419 25148 1934 1 3 . 1 1 108 108 GLN CB C 108 28.647 28.647 28.456 0.191 25148 1935 1 3 . 1 1 108 108 GLN H H 108 7.498 7.498 8.471 -0.973 25148 1936 1 3 . 1 1 109 109 THR N N 109 117.495 117.495 115.019 2.476 25148 1937 1 3 . 1 1 109 109 THR HA H 109 3.917 3.917 4.434 -0.517 25148 1938 1 3 . 1 1 109 109 THR C C 109 175.732 175.732 175.630 0.102 25148 1939 1 3 . 1 1 109 109 THR CA C 109 66.989 66.989 65.244 1.745 25148 1940 1 3 . 1 1 109 109 THR CB C 109 68.766 68.766 68.580 0.186 25148 1941 1 3 . 1 1 109 109 THR H H 109 8.203 8.203 8.193 0.010 25148 1942 1 3 . 1 1 110 110 ALA N N 110 122.308 122.308 124.903 -2.595 25148 1943 1 3 . 1 1 110 110 ALA HA H 110 3.854 3.854 4.011 -0.157 25148 1944 1 3 . 1 1 110 110 ALA C C 110 178.380 178.380 178.759 -0.379 25148 1945 1 3 . 1 1 110 110 ALA CA C 110 55.903 55.903 54.877 1.026 25148 1946 1 3 . 1 1 110 110 ALA CB C 110 18.524 18.524 18.288 0.236 25148 1947 1 3 . 1 1 110 110 ALA H H 110 8.668 8.668 7.877 0.791 25148 1948 1 3 . 1 1 111 111 LYS N N 111 115.552 115.552 117.742 -2.190 25148 1949 1 3 . 1 1 111 111 LYS HA H 111 3.923 3.923 3.982 -0.059 25148 1950 1 3 . 1 1 111 111 LYS C C 111 179.111 179.111 178.612 0.499 25148 1951 1 3 . 1 1 111 111 LYS CA C 111 59.825 59.825 59.261 0.564 25148 1952 1 3 . 1 1 111 111 LYS CB C 111 32.251 32.251 31.889 0.362 25148 1953 1 3 . 1 1 111 111 LYS H H 111 7.642 7.642 8.583 -0.941 25148 1954 1 3 . 1 1 112 112 GLN N N 112 120.178 120.178 119.448 0.730 25148 1955 1 3 . 1 1 112 112 GLN HA H 112 4.060 4.060 4.132 -0.072 25148 1956 1 3 . 1 1 112 112 GLN C C 112 178.355 178.355 177.938 0.417 25148 1957 1 3 . 1 1 112 112 GLN CA C 112 59.240 59.240 58.401 0.839 25148 1958 1 3 . 1 1 112 112 GLN CB C 112 28.250 28.250 28.735 -0.485 25148 1959 1 3 . 1 1 112 112 GLN H H 112 7.798 7.798 7.630 0.168 25148 1960 1 3 . 1 1 113 113 VAL N N 113 119.799 119.799 120.324 -0.525 25148 1961 1 3 . 1 1 113 113 VAL HA H 113 3.705 3.705 4.021 -0.316 25148 1962 1 3 . 1 1 113 113 VAL C C 113 178.303 178.303 178.230 0.073 25148 1963 1 3 . 1 1 113 113 VAL CA C 113 66.277 66.277 66.167 0.110 25148 1964 1 3 . 1 1 113 113 VAL CB C 113 31.954 31.954 32.032 -0.078 25148 1965 1 3 . 1 1 113 113 VAL H H 113 8.105 8.105 7.401 0.704 25148 1966 1 3 . 1 1 114 114 VAL N N 114 118.265 118.265 116.773 1.492 25148 1967 1 3 . 1 1 114 114 VAL HA H 114 3.392 3.392 3.617 -0.225 25148 1968 1 3 . 1 1 114 114 VAL C C 114 177.360 177.360 177.925 -0.565 25148 1969 1 3 . 1 1 114 114 VAL CA C 114 67.832 67.832 66.838 0.994 25148 1970 1 3 . 1 1 114 114 VAL CB C 114 31.801 31.801 31.289 0.512 25148 1971 1 3 . 1 1 114 114 VAL H H 114 8.180 8.180 7.978 0.202 25148 1972 1 3 . 1 1 115 115 THR N N 115 113.460 113.460 114.456 -0.996 25148 1973 1 3 . 1 1 115 115 THR HA H 115 3.856 3.856 4.081 -0.225 25148 1974 1 3 . 1 1 115 115 THR C C 115 176.529 176.529 176.615 -0.086 25148 1975 1 3 . 1 1 115 115 THR CA C 115 66.706 66.706 65.702 1.004 25148 1976 1 3 . 1 1 115 115 THR CB C 115 69.008 69.008 68.328 0.680 25148 1977 1 3 . 1 1 115 115 THR H H 115 8.143 8.143 7.708 0.435 25148 1978 1 3 . 1 1 116 116 GLN N N 116 120.129 120.129 121.117 -0.988 25148 1979 1 3 . 1 1 116 116 GLN HA H 116 4.054 4.054 4.084 -0.030 25148 1980 1 3 . 1 1 116 116 GLN C C 116 178.100 178.100 178.341 -0.241 25148 1981 1 3 . 1 1 116 116 GLN CA C 116 58.950 58.950 59.373 -0.423 25148 1982 1 3 . 1 1 116 116 GLN CB C 116 28.244 28.244 28.549 -0.305 25148 1983 1 3 . 1 1 116 116 GLN H H 116 7.936 7.936 7.413 0.523 25148 1984 1 3 . 1 1 117 117 ARG N N 117 117.838 117.838 119.200 -1.362 25148 1985 1 3 . 1 1 117 117 ARG HA H 117 4.174 4.174 4.065 0.109 25148 1986 1 3 . 1 1 117 117 ARG C C 117 179.138 179.138 178.750 0.388 25148 1987 1 3 . 1 1 117 117 ARG CA C 117 57.461 57.461 58.239 -0.778 25148 1988 1 3 . 1 1 117 117 ARG CB C 117 29.548 29.548 29.355 0.193 25148 1989 1 3 . 1 1 117 117 ARG H H 117 8.240 8.240 8.284 -0.044 25148 1990 1 3 . 1 1 118 118 VAL N N 118 120.278 120.278 119.706 0.572 25148 1991 1 3 . 1 1 118 118 VAL HA H 118 3.709 3.709 3.595 0.114 25148 1992 1 3 . 1 1 118 118 VAL C C 118 177.597 177.597 178.003 -0.406 25148 1993 1 3 . 1 1 118 118 VAL CA C 118 66.246 66.246 66.579 -0.332 25148 1994 1 3 . 1 1 118 118 VAL CB C 118 31.785 31.785 31.334 0.451 25148 1995 1 3 . 1 1 118 118 VAL H H 118 8.480 8.480 7.562 0.918 25148 1996 1 3 . 1 1 119 119 ARG N N 119 120.197 120.197 118.347 1.850 25148 1997 1 3 . 1 1 119 119 ARG HA H 119 4.173 4.173 4.252 -0.079 25148 1998 1 3 . 1 1 119 119 ARG C C 119 178.864 178.864 177.612 1.252 25148 1999 1 3 . 1 1 119 119 ARG CA C 119 58.772 58.772 58.880 -0.108 25148 2000 1 3 . 1 1 119 119 ARG CB C 119 29.873 29.873 30.071 -0.198 25148 2001 1 3 . 1 1 119 119 ARG H H 119 7.899 7.899 7.579 0.320 25148 2002 1 3 . 1 1 120 120 GLU N N 120 118.768 118.768 117.297 1.471 25148 2003 1 3 . 1 1 120 120 GLU HA H 120 4.110 4.110 4.143 -0.033 25148 2004 1 3 . 1 1 120 120 GLU C C 120 177.823 177.823 179.001 -1.178 25148 2005 1 3 . 1 1 120 120 GLU CA C 120 58.223 58.223 58.909 -0.686 25148 2006 1 3 . 1 1 120 120 GLU CB C 120 29.854 29.854 29.969 -0.115 25148 2007 1 3 . 1 1 120 120 GLU H H 120 8.084 8.084 7.593 0.491 25148 2008 1 3 . 1 1 121 121 ALA N N 121 121.984 121.984 121.925 0.059 25148 2009 1 3 . 1 1 121 121 ALA HA H 121 4.296 4.296 4.057 0.239 25148 2010 1 3 . 1 1 121 121 ALA C C 121 178.586 178.586 179.008 -0.422 25148 2011 1 3 . 1 1 121 121 ALA CA C 121 53.475 53.475 55.112 -1.637 25148 2012 1 3 . 1 1 121 121 ALA CB C 121 18.856 18.856 18.642 0.214 25148 2013 1 3 . 1 1 121 121 ALA H H 121 7.810 7.810 8.404 -0.594 25148 2014 1 3 . 1 1 122 122 GLU N N 122 118.229 118.229 114.803 3.426 25148 2015 1 3 . 1 1 122 122 GLU HA H 122 4.241 4.241 4.305 -0.064 25148 2016 1 3 . 1 1 122 122 GLU C C 122 176.839 176.839 176.647 0.192 25148 2017 1 3 . 1 1 122 122 GLU CA C 122 57.118 57.118 56.044 1.073 25148 2018 1 3 . 1 1 122 122 GLU CB C 122 30.018 30.018 29.172 0.846 25148 2019 1 3 . 1 1 122 122 GLU H H 122 7.938 7.938 7.752 0.186 25148 2020 1 3 . 1 1 123 123 ARG N N 123 120.601 120.601 119.653 0.948 25148 2021 1 3 . 1 1 123 123 ARG HA H 123 4.348 4.348 4.208 0.140 25148 2022 1 3 . 1 1 123 123 ARG C C 123 176.071 176.071 176.119 -0.048 25148 2023 1 3 . 1 1 123 123 ARG CA C 123 56.510 56.510 56.998 -0.488 25148 2024 1 3 . 1 1 123 123 ARG CB C 123 30.765 30.765 31.011 -0.246 25148 2025 1 3 . 1 1 123 123 ARG H H 123 7.977 7.977 7.876 0.101 25148 2026 1 4 . 1 1 4 4 GLU HA H 4 4.138 4.138 3.994 0.144 25148 2027 1 4 . 1 1 4 4 GLU C C 4 179.152 179.152 178.010 1.142 25148 2028 1 4 . 1 1 4 4 GLU CA C 4 59.566 59.566 58.440 1.126 25148 2029 1 4 . 1 1 4 4 GLU CB C 4 29.407 29.407 29.674 -0.267 25148 2030 1 4 . 1 1 5 5 LEU N N 5 121.360 121.360 116.330 5.030 25148 2031 1 4 . 1 1 5 5 LEU HA H 5 4.195 4.195 4.065 0.130 25148 2032 1 4 . 1 1 5 5 LEU C C 5 178.179 178.179 178.141 0.038 25148 2033 1 4 . 1 1 5 5 LEU CA C 5 57.830 57.830 57.403 0.427 25148 2034 1 4 . 1 1 5 5 LEU CB C 5 41.630 41.630 41.444 0.186 25148 2035 1 4 . 1 1 5 5 LEU H H 5 7.877 7.877 7.918 -0.041 25148 2036 1 4 . 1 1 6 6 LEU N N 6 118.058 118.058 118.945 -0.887 25148 2037 1 4 . 1 1 6 6 LEU HA H 6 3.919 3.919 3.944 -0.025 25148 2038 1 4 . 1 1 6 6 LEU C C 6 180.274 180.274 179.098 1.176 25148 2039 1 4 . 1 1 6 6 LEU CA C 6 58.221 58.221 57.650 0.571 25148 2040 1 4 . 1 1 6 6 LEU CB C 6 40.684 40.684 41.062 -0.378 25148 2041 1 4 . 1 1 6 6 LEU H H 6 7.685 7.685 7.435 0.250 25148 2042 1 4 . 1 1 7 7 ASP N N 7 120.662 120.662 118.389 2.273 25148 2043 1 4 . 1 1 7 7 ASP HA H 7 4.416 4.416 4.392 0.024 25148 2044 1 4 . 1 1 7 7 ASP C C 7 178.738 178.738 177.963 0.775 25148 2045 1 4 . 1 1 7 7 ASP CA C 7 57.519 57.519 56.595 0.924 25148 2046 1 4 . 1 1 7 7 ASP CB C 7 40.167 40.167 40.829 -0.662 25148 2047 1 4 . 1 1 7 7 ASP H H 7 8.427 8.427 7.588 0.839 25148 2048 1 4 . 1 1 8 8 ALA N N 8 122.612 122.612 122.736 -0.124 25148 2049 1 4 . 1 1 8 8 ALA HA H 8 4.146 4.146 4.032 0.114 25148 2050 1 4 . 1 1 8 8 ALA C C 8 180.787 180.787 179.905 0.882 25148 2051 1 4 . 1 1 8 8 ALA CA C 8 55.165 55.165 55.139 0.026 25148 2052 1 4 . 1 1 8 8 ALA CB C 8 17.711 17.711 18.338 -0.627 25148 2053 1 4 . 1 1 8 8 ALA H H 8 7.847 7.847 8.001 -0.154 25148 2054 1 4 . 1 1 9 9 LEU N N 9 116.977 116.977 117.406 -0.429 25148 2055 1 4 . 1 1 9 9 LEU HA H 9 4.115 4.115 3.923 0.192 25148 2056 1 4 . 1 1 9 9 LEU C C 9 179.510 179.510 179.390 0.120 25148 2057 1 4 . 1 1 9 9 LEU CA C 9 57.468 57.468 57.716 -0.248 25148 2058 1 4 . 1 1 9 9 LEU CB C 9 41.203 41.203 41.616 -0.413 25148 2059 1 4 . 1 1 9 9 LEU H H 9 8.256 8.256 7.545 0.711 25148 2060 1 4 . 1 1 10 10 THR N N 10 118.764 118.764 115.640 3.124 25148 2061 1 4 . 1 1 10 10 THR HA H 10 4.487 4.487 3.949 0.538 25148 2062 1 4 . 1 1 10 10 THR C C 10 176.567 176.567 176.780 -0.213 25148 2063 1 4 . 1 1 10 10 THR CA C 10 68.768 68.768 66.751 2.017 25148 2064 1 4 . 1 1 10 10 THR CB C 10 66.961 66.961 68.560 -1.599 25148 2065 1 4 . 1 1 10 10 THR H H 10 8.218 8.218 7.383 0.835 25148 2066 1 4 . 1 1 11 11 ILE N N 11 122.555 122.555 120.124 2.431 25148 2067 1 4 . 1 1 11 11 ILE HA H 11 3.779 3.779 3.704 0.075 25148 2068 1 4 . 1 1 11 11 ILE C C 11 177.793 177.793 177.535 0.258 25148 2069 1 4 . 1 1 11 11 ILE CA C 11 64.695 64.695 64.948 -0.254 25148 2070 1 4 . 1 1 11 11 ILE CB C 11 37.856 37.856 37.705 0.151 25148 2071 1 4 . 1 1 11 11 ILE H H 11 7.632 7.632 7.873 -0.241 25148 2072 1 4 . 1 1 12 12 LEU N N 12 120.469 120.469 117.552 2.917 25148 2073 1 4 . 1 1 12 12 LEU HA H 12 4.065 4.065 4.085 -0.020 25148 2074 1 4 . 1 1 12 12 LEU C C 12 179.139 179.139 178.326 0.813 25148 2075 1 4 . 1 1 12 12 LEU CA C 12 57.944 57.944 56.913 1.031 25148 2076 1 4 . 1 1 12 12 LEU CB C 12 42.170 42.170 41.509 0.661 25148 2077 1 4 . 1 1 12 12 LEU H H 12 7.951 7.951 7.648 0.303 25148 2078 1 4 . 1 1 13 13 GLU N N 13 119.669 119.669 118.816 0.853 25148 2079 1 4 . 1 1 13 13 GLU HA H 13 4.183 4.183 4.001 0.182 25148 2080 1 4 . 1 1 13 13 GLU C C 13 179.007 179.007 177.542 1.465 25148 2081 1 4 . 1 1 13 13 GLU CA C 13 59.703 59.703 58.566 1.137 25148 2082 1 4 . 1 1 13 13 GLU CB C 13 30.110 30.110 29.594 0.516 25148 2083 1 4 . 1 1 13 13 GLU H H 13 8.003 8.003 7.940 0.063 25148 2084 1 4 . 1 1 14 14 LYS N N 14 118.935 118.935 118.508 0.427 25148 2085 1 4 . 1 1 14 14 LYS HA H 14 4.124 4.124 4.018 0.106 25148 2086 1 4 . 1 1 14 14 LYS CA C 14 58.847 58.847 58.050 0.797 25148 2087 1 4 . 1 1 14 14 LYS CB C 14 33.053 33.053 32.530 0.523 25148 2088 1 4 . 1 1 14 14 LYS H H 14 7.862 7.862 7.302 0.560 25148 2089 1 4 . 1 1 15 15 GLU HA H 15 3.693 3.693 4.222 -0.529 25148 2090 1 4 . 1 1 15 15 GLU CA C 15 56.688 56.688 56.644 0.044 25148 2091 1 4 . 1 1 15 15 GLU CB C 15 32.204 32.204 30.264 1.940 25148 2092 1 4 . 1 1 16 16 LYS HA H 16 4.678 4.678 4.201 0.477 25148 2093 1 4 . 1 1 16 16 LYS CA C 16 55.135 55.135 56.515 -1.380 25148 2094 1 4 . 1 1 16 16 LYS CB C 16 34.049 34.049 32.964 1.085 25148 2095 1 4 . 1 1 17 17 GLY CA C 17 46.541 46.541 45.321 1.220 25148 2096 1 4 . 1 1 18 18 ILE N N 18 115.364 115.364 118.542 -3.178 25148 2097 1 4 . 1 1 18 18 ILE HA H 18 4.079 4.079 4.240 -0.161 25148 2098 1 4 . 1 1 18 18 ILE C C 18 174.751 174.751 174.997 -0.246 25148 2099 1 4 . 1 1 18 18 ILE CA C 18 60.333 60.333 60.457 -0.124 25148 2100 1 4 . 1 1 18 18 ILE CB C 18 39.044 39.044 40.721 -1.677 25148 2101 1 4 . 1 1 18 18 ILE H H 18 8.203 8.203 7.700 0.503 25148 2102 1 4 . 1 1 19 19 SER N N 19 119.891 119.891 120.915 -1.024 25148 2103 1 4 . 1 1 19 19 SER HA H 19 4.362 4.362 4.798 -0.436 25148 2104 1 4 . 1 1 19 19 SER CA C 19 58.476 58.476 57.532 0.944 25148 2105 1 4 . 1 1 19 19 SER CB C 19 63.533 63.533 64.377 -0.844 25148 2106 1 4 . 1 1 19 19 SER H H 19 8.253 8.253 8.604 -0.351 25148 2107 1 4 . 1 1 20 20 LYS N N 20 124.782 124.782 126.734 -1.952 25148 2108 1 4 . 1 1 20 20 LYS HA H 20 4.137 4.137 4.165 -0.028 25148 2109 1 4 . 1 1 20 20 LYS C C 20 177.889 177.889 177.374 0.515 25148 2110 1 4 . 1 1 20 20 LYS CA C 20 59.485 59.485 58.683 0.802 25148 2111 1 4 . 1 1 20 20 LYS CB C 20 32.711 32.711 32.214 0.497 25148 2112 1 4 . 1 1 20 20 LYS H H 20 8.918 8.918 8.919 -0.001 25148 2113 1 4 . 1 1 21 21 GLU N N 21 117.831 117.831 118.095 -0.264 25148 2114 1 4 . 1 1 21 21 GLU HA H 21 3.957 3.957 4.048 -0.091 25148 2115 1 4 . 1 1 21 21 GLU C C 21 178.822 178.822 178.793 0.029 25148 2116 1 4 . 1 1 21 21 GLU CA C 21 59.529 59.529 59.116 0.413 25148 2117 1 4 . 1 1 21 21 GLU CB C 21 29.237 29.237 29.227 0.010 25148 2118 1 4 . 1 1 21 21 GLU H H 21 8.361 8.361 8.600 -0.239 25148 2119 1 4 . 1 1 22 22 ILE N N 22 118.690 118.690 117.915 0.775 25148 2120 1 4 . 1 1 22 22 ILE HA H 22 3.884 3.884 3.968 -0.084 25148 2121 1 4 . 1 1 22 22 ILE C C 22 179.247 179.247 177.722 1.525 25148 2122 1 4 . 1 1 22 22 ILE CA C 22 63.735 63.735 63.539 0.195 25148 2123 1 4 . 1 1 22 22 ILE CB C 22 37.415 37.415 38.085 -0.670 25148 2124 1 4 . 1 1 22 22 ILE H H 22 7.353 7.353 7.392 -0.039 25148 2125 1 4 . 1 1 23 23 ILE N N 23 120.880 120.880 120.958 -0.078 25148 2126 1 4 . 1 1 23 23 ILE HA H 23 3.733 3.733 3.707 0.026 25148 2127 1 4 . 1 1 23 23 ILE C C 23 177.817 177.817 178.007 -0.190 25148 2128 1 4 . 1 1 23 23 ILE CA C 23 64.172 64.172 63.969 0.203 25148 2129 1 4 . 1 1 23 23 ILE CB C 23 36.473 36.473 36.824 -0.351 25148 2130 1 4 . 1 1 23 23 ILE H H 23 7.571 7.571 7.163 0.408 25148 2131 1 4 . 1 1 24 24 ILE N N 24 121.460 121.460 119.051 2.409 25148 2132 1 4 . 1 1 24 24 ILE HA H 24 3.486 3.486 3.603 -0.117 25148 2133 1 4 . 1 1 24 24 ILE C C 24 177.759 177.759 177.828 -0.069 25148 2134 1 4 . 1 1 24 24 ILE CA C 24 66.641 66.641 66.202 0.439 25148 2135 1 4 . 1 1 24 24 ILE CB C 24 37.307 37.307 37.310 -0.004 25148 2136 1 4 . 1 1 24 24 ILE H H 24 8.709 8.709 7.675 1.034 25148 2137 1 4 . 1 1 25 25 GLU N N 25 119.323 119.323 118.124 1.199 25148 2138 1 4 . 1 1 25 25 GLU HA H 25 4.177 4.177 4.171 0.006 25148 2139 1 4 . 1 1 25 25 GLU C C 25 179.348 179.348 178.434 0.914 25148 2140 1 4 . 1 1 25 25 GLU CA C 25 59.951 59.951 59.109 0.841 25148 2141 1 4 . 1 1 25 25 GLU CB C 25 29.340 29.340 29.083 0.257 25148 2142 1 4 . 1 1 25 25 GLU H H 25 8.048 8.048 8.022 0.026 25148 2143 1 4 . 1 1 26 26 ALA N N 26 122.390 122.390 123.110 -0.720 25148 2144 1 4 . 1 1 26 26 ALA HA H 26 4.325 4.325 4.088 0.237 25148 2145 1 4 . 1 1 26 26 ALA C C 26 181.440 181.440 179.721 1.719 25148 2146 1 4 . 1 1 26 26 ALA CA C 26 54.935 54.935 54.965 -0.030 25148 2147 1 4 . 1 1 26 26 ALA CB C 26 17.834 17.834 18.225 -0.391 25148 2148 1 4 . 1 1 26 26 ALA H H 26 7.768 7.768 7.715 0.053 25148 2149 1 4 . 1 1 27 27 ILE N N 27 122.342 122.342 119.607 2.735 25148 2150 1 4 . 1 1 27 27 ILE HA H 27 3.575 3.575 3.614 -0.039 25148 2151 1 4 . 1 1 27 27 ILE C C 27 177.541 177.541 178.138 -0.597 25148 2152 1 4 . 1 1 27 27 ILE CA C 27 66.536 66.536 65.626 0.910 25148 2153 1 4 . 1 1 27 27 ILE CB C 27 37.886 37.886 37.722 0.164 25148 2154 1 4 . 1 1 27 27 ILE H H 27 8.805 8.805 7.648 1.157 25148 2155 1 4 . 1 1 28 28 GLU N N 28 120.188 120.188 119.268 0.920 25148 2156 1 4 . 1 1 28 28 GLU HA H 28 3.687 3.687 3.893 -0.206 25148 2157 1 4 . 1 1 28 28 GLU C C 28 178.707 178.707 178.998 -0.291 25148 2158 1 4 . 1 1 28 28 GLU CA C 28 61.458 61.458 59.880 1.579 25148 2159 1 4 . 1 1 28 28 GLU CB C 28 29.624 29.624 29.211 0.413 25148 2160 1 4 . 1 1 28 28 GLU H H 28 8.882 8.882 7.636 1.246 25148 2161 1 4 . 1 1 29 29 ALA N N 29 119.293 119.293 121.173 -1.880 25148 2162 1 4 . 1 1 29 29 ALA HA H 29 4.214 4.214 4.054 0.160 25148 2163 1 4 . 1 1 29 29 ALA C C 29 181.200 181.200 179.733 1.467 25148 2164 1 4 . 1 1 29 29 ALA CA C 29 55.435 55.435 54.896 0.539 25148 2165 1 4 . 1 1 29 29 ALA CB C 29 18.090 18.090 18.056 0.034 25148 2166 1 4 . 1 1 29 29 ALA H H 29 8.065 8.065 8.079 -0.014 25148 2167 1 4 . 1 1 30 30 ALA N N 30 121.729 121.729 121.852 -0.123 25148 2168 1 4 . 1 1 30 30 ALA HA H 30 4.307 4.307 4.135 0.172 25148 2169 1 4 . 1 1 30 30 ALA C C 30 181.315 181.315 179.504 1.811 25148 2170 1 4 . 1 1 30 30 ALA CA C 30 54.594 54.594 54.685 -0.091 25148 2171 1 4 . 1 1 30 30 ALA CB C 30 18.704 18.704 18.372 0.332 25148 2172 1 4 . 1 1 30 30 ALA H H 30 8.099 8.099 7.564 0.535 25148 2173 1 4 . 1 1 31 31 LEU N N 31 120.900 120.900 121.036 -0.136 25148 2174 1 4 . 1 1 31 31 LEU HA H 31 4.347 4.347 4.041 0.306 25148 2175 1 4 . 1 1 31 31 LEU C C 31 179.137 179.137 179.223 -0.086 25148 2176 1 4 . 1 1 31 31 LEU CA C 31 57.569 57.569 59.277 -1.708 25148 2177 1 4 . 1 1 31 31 LEU CB C 31 42.353 42.353 41.906 0.447 25148 2178 1 4 . 1 1 31 31 LEU H H 31 8.863 8.863 8.122 0.741 25148 2179 1 4 . 1 1 32 32 ILE N N 32 122.410 122.410 118.170 4.240 25148 2180 1 4 . 1 1 32 32 ILE HA H 32 3.699 3.699 3.696 0.003 25148 2181 1 4 . 1 1 32 32 ILE C C 32 178.303 178.303 177.697 0.606 25148 2182 1 4 . 1 1 32 32 ILE CA C 32 66.066 66.066 65.259 0.807 25148 2183 1 4 . 1 1 32 32 ILE CB C 32 37.882 37.882 37.907 -0.025 25148 2184 1 4 . 1 1 32 32 ILE H H 32 8.234 8.234 8.531 -0.297 25148 2185 1 4 . 1 1 33 33 SER N N 33 114.201 114.201 115.841 -1.640 25148 2186 1 4 . 1 1 33 33 SER HA H 33 4.311 4.311 4.171 0.140 25148 2187 1 4 . 1 1 33 33 SER C C 33 177.012 177.012 176.802 0.210 25148 2188 1 4 . 1 1 33 33 SER CA C 33 61.860 61.860 61.906 -0.046 25148 2189 1 4 . 1 1 33 33 SER CB C 33 62.508 62.508 63.272 -0.764 25148 2190 1 4 . 1 1 33 33 SER H H 33 7.558 7.558 7.745 -0.187 25148 2191 1 4 . 1 1 34 34 ALA N N 34 122.893 122.893 124.841 -1.948 25148 2192 1 4 . 1 1 34 34 ALA HA H 34 4.215 4.215 4.082 0.133 25148 2193 1 4 . 1 1 34 34 ALA C C 34 180.814 180.814 179.386 1.428 25148 2194 1 4 . 1 1 34 34 ALA CA C 34 55.283 55.283 55.035 0.248 25148 2195 1 4 . 1 1 34 34 ALA CB C 34 18.273 18.273 18.203 0.070 25148 2196 1 4 . 1 1 34 34 ALA H H 34 8.409 8.409 8.403 0.006 25148 2197 1 4 . 1 1 35 35 TYR N N 35 120.259 120.259 118.928 1.331 25148 2198 1 4 . 1 1 35 35 TYR HA H 35 4.393 4.393 4.289 0.104 25148 2199 1 4 . 1 1 35 35 TYR C C 35 177.892 177.892 177.556 0.336 25148 2200 1 4 . 1 1 35 35 TYR CA C 35 63.071 63.071 61.032 2.039 25148 2201 1 4 . 1 1 35 35 TYR CB C 35 38.021 38.021 38.752 -0.731 25148 2202 1 4 . 1 1 35 35 TYR H H 35 8.975 8.975 8.139 0.836 25148 2203 1 4 . 1 1 36 36 LYS N N 36 120.942 120.942 118.366 2.576 25148 2204 1 4 . 1 1 36 36 LYS HA H 36 4.032 4.032 4.052 -0.020 25148 2205 1 4 . 1 1 36 36 LYS C C 36 177.797 177.797 177.973 -0.176 25148 2206 1 4 . 1 1 36 36 LYS CA C 36 59.900 59.900 59.145 0.755 25148 2207 1 4 . 1 1 36 36 LYS CB C 36 32.429 32.429 32.245 0.185 25148 2208 1 4 . 1 1 36 36 LYS H H 36 8.654 8.654 7.936 0.718 25148 2209 1 4 . 1 1 37 37 ARG N N 37 115.139 115.139 116.092 -0.953 25148 2210 1 4 . 1 1 37 37 ARG HA H 37 4.101 4.101 4.116 -0.015 25148 2211 1 4 . 1 1 37 37 ARG C C 37 177.517 177.517 177.987 -0.470 25148 2212 1 4 . 1 1 37 37 ARG CA C 37 58.276 58.276 58.010 0.266 25148 2213 1 4 . 1 1 37 37 ARG CB C 37 31.014 31.014 29.914 1.100 25148 2214 1 4 . 1 1 37 37 ARG H H 37 8.138 8.138 7.695 0.443 25148 2215 1 4 . 1 1 38 38 ASN N N 38 112.555 112.555 116.373 -3.818 25148 2216 1 4 . 1 1 38 38 ASN HA H 38 4.540 4.540 4.335 0.205 25148 2217 1 4 . 1 1 38 38 ASN C C 38 173.994 173.994 175.397 -1.403 25148 2218 1 4 . 1 1 38 38 ASN CA C 38 54.722 54.722 55.295 -0.574 25148 2219 1 4 . 1 1 38 38 ASN CB C 38 42.077 42.077 39.300 2.777 25148 2220 1 4 . 1 1 38 38 ASN H H 38 7.426 7.426 7.426 -0.000 25148 2221 1 4 . 1 1 39 39 PHE N N 39 116.711 116.711 117.681 -0.970 25148 2222 1 4 . 1 1 39 39 PHE HA H 39 4.569 4.569 4.801 -0.232 25148 2223 1 4 . 1 1 39 39 PHE CA C 39 58.913 58.913 55.809 3.104 25148 2224 1 4 . 1 1 39 39 PHE CB C 39 39.781 39.781 38.636 1.145 25148 2225 1 4 . 1 1 39 39 PHE H H 39 7.959 7.959 7.396 0.563 25148 2226 1 4 . 1 1 40 40 ASN HA H 40 4.018 4.018 4.550 -0.532 25148 2227 1 4 . 1 1 40 40 ASN CA C 40 58.944 58.944 55.222 3.722 25148 2228 1 4 . 1 1 41 41 GLN HA H 41 4.298 4.298 4.519 -0.221 25148 2229 1 4 . 1 1 41 41 GLN C C 41 175.237 175.237 175.766 -0.529 25148 2230 1 4 . 1 1 41 41 GLN CA C 41 57.360 57.360 56.525 0.835 25148 2231 1 4 . 1 1 41 41 GLN CB C 41 28.724 28.724 27.961 0.763 25148 2232 1 4 . 1 1 42 42 ALA N N 42 120.514 120.514 121.136 -0.622 25148 2233 1 4 . 1 1 42 42 ALA HA H 42 4.622 4.622 4.449 0.173 25148 2234 1 4 . 1 1 42 42 ALA C C 42 175.922 175.922 176.329 -0.407 25148 2235 1 4 . 1 1 42 42 ALA CA C 42 51.841 51.841 52.104 -0.263 25148 2236 1 4 . 1 1 42 42 ALA CB C 42 21.576 21.576 20.410 1.166 25148 2237 1 4 . 1 1 42 42 ALA H H 42 7.817 7.817 8.032 -0.215 25148 2238 1 4 . 1 1 43 43 GLN N N 43 117.594 117.594 116.151 1.443 25148 2239 1 4 . 1 1 43 43 GLN HA H 43 4.265 4.265 4.514 -0.249 25148 2240 1 4 . 1 1 43 43 GLN C C 43 174.942 174.942 173.604 1.338 25148 2241 1 4 . 1 1 43 43 GLN CA C 43 57.047 57.047 55.585 1.462 25148 2242 1 4 . 1 1 43 43 GLN CB C 43 30.863 30.863 31.788 -0.925 25148 2243 1 4 . 1 1 43 43 GLN H H 43 7.400 7.400 7.520 -0.120 25148 2244 1 4 . 1 1 44 44 ASN N N 44 120.467 120.467 121.349 -0.882 25148 2245 1 4 . 1 1 44 44 ASN HA H 44 5.005 5.005 4.615 0.390 25148 2246 1 4 . 1 1 44 44 ASN C C 44 174.365 174.365 173.915 0.450 25148 2247 1 4 . 1 1 44 44 ASN CA C 44 52.381 52.381 53.460 -1.079 25148 2248 1 4 . 1 1 44 44 ASN CB C 44 38.177 38.177 39.255 -1.078 25148 2249 1 4 . 1 1 44 44 ASN H H 44 9.123 9.123 8.546 0.577 25148 2250 1 4 . 1 1 45 45 VAL N N 45 115.479 115.479 117.385 -1.906 25148 2251 1 4 . 1 1 45 45 VAL HA H 45 5.376 5.376 4.238 1.138 25148 2252 1 4 . 1 1 45 45 VAL C C 45 174.908 174.908 173.635 1.273 25148 2253 1 4 . 1 1 45 45 VAL CA C 45 59.022 59.022 61.727 -2.705 25148 2254 1 4 . 1 1 45 45 VAL CB C 45 35.776 35.776 35.117 0.659 25148 2255 1 4 . 1 1 45 45 VAL H H 45 7.732 7.732 8.177 -0.445 25148 2256 1 4 . 1 1 46 46 ARG N N 46 121.146 121.146 125.043 -3.897 25148 2257 1 4 . 1 1 46 46 ARG HA H 46 4.566 4.566 4.828 -0.262 25148 2258 1 4 . 1 1 46 46 ARG C C 46 173.790 173.790 174.961 -1.171 25148 2259 1 4 . 1 1 46 46 ARG CA C 46 54.762 54.762 53.632 1.130 25148 2260 1 4 . 1 1 46 46 ARG CB C 46 33.946 33.946 31.673 2.273 25148 2261 1 4 . 1 1 46 46 ARG H H 46 8.850 8.850 9.061 -0.211 25148 2262 1 4 . 1 1 47 47 VAL N N 47 122.339 122.339 125.031 -2.692 25148 2263 1 4 . 1 1 47 47 VAL HA H 47 4.741 4.741 4.246 0.495 25148 2264 1 4 . 1 1 47 47 VAL C C 47 173.541 173.541 175.593 -2.052 25148 2265 1 4 . 1 1 47 47 VAL CA C 47 60.893 60.893 62.563 -1.670 25148 2266 1 4 . 1 1 47 47 VAL CB C 47 33.563 33.563 32.857 0.706 25148 2267 1 4 . 1 1 47 47 VAL H H 47 8.444 8.444 8.550 -0.106 25148 2268 1 4 . 1 1 48 48 ASP N N 48 127.701 127.701 126.205 1.496 25148 2269 1 4 . 1 1 48 48 ASP HA H 48 4.946 4.946 4.952 -0.006 25148 2270 1 4 . 1 1 48 48 ASP C C 48 173.744 173.744 174.456 -0.712 25148 2271 1 4 . 1 1 48 48 ASP CA C 48 52.651 52.651 52.655 -0.004 25148 2272 1 4 . 1 1 48 48 ASP CB C 48 45.225 45.225 44.026 1.199 25148 2273 1 4 . 1 1 48 48 ASP H H 48 9.068 9.068 8.425 0.643 25148 2274 1 4 . 1 1 49 49 LEU N N 49 130.945 130.945 126.076 4.869 25148 2275 1 4 . 1 1 49 49 LEU HA H 49 4.774 4.774 4.647 0.127 25148 2276 1 4 . 1 1 49 49 LEU C C 49 174.531 174.531 175.644 -1.113 25148 2277 1 4 . 1 1 49 49 LEU CA C 49 54.337 54.337 54.433 -0.096 25148 2278 1 4 . 1 1 49 49 LEU CB C 49 43.192 43.192 44.203 -1.011 25148 2279 1 4 . 1 1 49 49 LEU H H 49 9.369 9.369 8.579 0.790 25148 2280 1 4 . 1 1 50 50 ASN N N 50 126.268 126.268 124.567 1.701 25148 2281 1 4 . 1 1 50 50 ASN HA H 50 4.629 4.629 5.046 -0.417 25148 2282 1 4 . 1 1 50 50 ASN C C 50 176.602 176.602 175.417 1.185 25148 2283 1 4 . 1 1 50 50 ASN CA C 50 54.048 54.048 52.376 1.672 25148 2284 1 4 . 1 1 50 50 ASN CB C 50 39.891 39.891 39.207 0.684 25148 2285 1 4 . 1 1 50 50 ASN H H 50 8.672 8.672 8.876 -0.204 25148 2286 1 4 . 1 1 51 51 ARG N N 51 125.897 125.897 123.603 2.294 25148 2287 1 4 . 1 1 51 51 ARG HA H 51 3.789 3.789 4.242 -0.453 25148 2288 1 4 . 1 1 51 51 ARG C C 51 175.681 175.681 176.199 -0.518 25148 2289 1 4 . 1 1 51 51 ARG CA C 51 58.162 58.162 58.453 -0.291 25148 2290 1 4 . 1 1 51 51 ARG CB C 51 29.944 29.944 29.796 0.148 25148 2291 1 4 . 1 1 51 51 ARG H H 51 8.984 8.984 8.700 0.284 25148 2292 1 4 . 1 1 52 52 GLU N N 52 116.733 116.733 118.569 -1.836 25148 2293 1 4 . 1 1 52 52 GLU HA H 52 4.368 4.368 4.149 0.219 25148 2294 1 4 . 1 1 52 52 GLU C C 52 178.049 178.049 177.118 0.931 25148 2295 1 4 . 1 1 52 52 GLU CA C 52 58.048 58.048 58.100 -0.052 25148 2296 1 4 . 1 1 52 52 GLU CB C 52 30.716 30.716 29.457 1.259 25148 2297 1 4 . 1 1 52 52 GLU H H 52 8.541 8.541 8.418 0.123 25148 2298 1 4 . 1 1 53 53 THR N N 53 106.556 106.556 108.093 -1.537 25148 2299 1 4 . 1 1 53 53 THR HA H 53 4.424 4.424 4.573 -0.149 25148 2300 1 4 . 1 1 53 53 THR C C 53 176.352 176.352 175.305 1.047 25148 2301 1 4 . 1 1 53 53 THR CA C 53 61.320 61.320 60.972 0.348 25148 2302 1 4 . 1 1 53 53 THR CB C 53 71.220 71.220 70.188 1.032 25148 2303 1 4 . 1 1 53 53 THR H H 53 8.085 8.085 7.580 0.505 25148 2304 1 4 . 1 1 54 54 GLY N N 54 111.843 111.843 110.348 1.495 25148 2305 1 4 . 1 1 54 54 GLY C C 54 172.690 172.690 174.564 -1.874 25148 2306 1 4 . 1 1 54 54 GLY CA C 54 45.417 45.417 46.208 -0.791 25148 2307 1 4 . 1 1 54 54 GLY H H 54 8.330 8.330 7.859 0.471 25148 2308 1 4 . 1 1 55 55 SER N N 55 113.844 113.844 113.766 0.078 25148 2309 1 4 . 1 1 55 55 SER HA H 55 4.279 4.279 4.686 -0.407 25148 2310 1 4 . 1 1 55 55 SER C C 55 174.127 174.127 173.060 1.067 25148 2311 1 4 . 1 1 55 55 SER CA C 55 59.229 59.229 57.485 1.744 25148 2312 1 4 . 1 1 55 55 SER CB C 55 63.939 63.939 65.679 -1.740 25148 2313 1 4 . 1 1 55 55 SER H H 55 7.653 7.653 7.537 0.116 25148 2314 1 4 . 1 1 56 56 ILE N N 56 125.286 125.286 120.339 4.947 25148 2315 1 4 . 1 1 56 56 ILE HA H 56 5.082 5.082 4.749 0.333 25148 2316 1 4 . 1 1 56 56 ILE C C 56 175.346 175.346 174.400 0.946 25148 2317 1 4 . 1 1 56 56 ILE CA C 56 59.967 59.967 60.442 -0.475 25148 2318 1 4 . 1 1 56 56 ILE CB C 56 40.165 40.165 42.095 -1.930 25148 2319 1 4 . 1 1 56 56 ILE H H 56 8.478 8.478 8.416 0.062 25148 2320 1 4 . 1 1 57 57 ARG N N 57 126.332 126.332 127.068 -0.736 25148 2321 1 4 . 1 1 57 57 ARG HA H 57 4.740 4.740 4.577 0.163 25148 2322 1 4 . 1 1 57 57 ARG C C 57 173.921 173.921 173.596 0.325 25148 2323 1 4 . 1 1 57 57 ARG CA C 57 54.311 54.311 53.843 0.468 25148 2324 1 4 . 1 1 57 57 ARG CB C 57 35.805 35.805 33.268 2.537 25148 2325 1 4 . 1 1 57 57 ARG H H 57 8.590 8.590 8.479 0.111 25148 2326 1 4 . 1 1 58 58 VAL N N 58 120.987 120.987 123.225 -2.238 25148 2327 1 4 . 1 1 58 58 VAL HA H 58 4.334 4.334 4.037 0.297 25148 2328 1 4 . 1 1 58 58 VAL C C 58 174.204 174.204 174.095 0.109 25148 2329 1 4 . 1 1 58 58 VAL CA C 58 60.861 60.861 60.612 0.249 25148 2330 1 4 . 1 1 58 58 VAL CB C 58 33.383 33.383 31.307 2.076 25148 2331 1 4 . 1 1 58 58 VAL H H 58 8.585 8.585 8.254 0.331 25148 2332 1 4 . 1 1 59 59 PHE N N 59 124.913 124.913 126.440 -1.527 25148 2333 1 4 . 1 1 59 59 PHE HA H 59 5.046 5.046 5.313 -0.267 25148 2334 1 4 . 1 1 59 59 PHE C C 59 174.446 174.446 174.371 0.075 25148 2335 1 4 . 1 1 59 59 PHE CA C 59 56.695 56.695 55.624 1.071 25148 2336 1 4 . 1 1 59 59 PHE CB C 59 42.779 42.779 43.301 -0.522 25148 2337 1 4 . 1 1 59 59 PHE H H 59 8.920 8.920 8.235 0.685 25148 2338 1 4 . 1 1 60 60 ALA N N 60 124.035 124.035 124.275 -0.240 25148 2339 1 4 . 1 1 60 60 ALA HA H 60 5.102 5.102 4.802 0.300 25148 2340 1 4 . 1 1 60 60 ALA C C 60 176.017 176.017 176.443 -0.426 25148 2341 1 4 . 1 1 60 60 ALA CA C 60 50.083 50.083 50.781 -0.698 25148 2342 1 4 . 1 1 60 60 ALA CB C 60 22.400 22.400 20.576 1.824 25148 2343 1 4 . 1 1 60 60 ALA H H 60 9.457 9.457 8.727 0.730 25148 2344 1 4 . 1 1 61 61 ARG N N 61 121.530 121.530 124.529 -2.999 25148 2345 1 4 . 1 1 61 61 ARG HA H 61 4.958 4.958 4.652 0.306 25148 2346 1 4 . 1 1 61 61 ARG C C 61 176.737 176.737 175.693 1.044 25148 2347 1 4 . 1 1 61 61 ARG CA C 61 55.375 55.375 55.896 -0.521 25148 2348 1 4 . 1 1 61 61 ARG CB C 61 31.230 31.230 30.262 0.968 25148 2349 1 4 . 1 1 61 61 ARG H H 61 8.447 8.447 8.735 -0.288 25148 2350 1 4 . 1 1 62 62 LYS N N 62 124.784 124.784 125.779 -0.995 25148 2351 1 4 . 1 1 62 62 LYS HA H 62 4.709 4.709 4.394 0.315 25148 2352 1 4 . 1 1 62 62 LYS C C 62 173.899 173.899 175.140 -1.241 25148 2353 1 4 . 1 1 62 62 LYS CA C 62 54.812 54.812 55.506 -0.694 25148 2354 1 4 . 1 1 62 62 LYS CB C 62 37.147 37.147 34.283 2.864 25148 2355 1 4 . 1 1 62 62 LYS H H 62 9.137 9.137 8.109 1.028 25148 2356 1 4 . 1 1 63 63 ASP N N 63 122.552 122.552 125.536 -2.984 25148 2357 1 4 . 1 1 63 63 ASP HA H 63 4.877 4.877 4.612 0.265 25148 2358 1 4 . 1 1 63 63 ASP C C 63 175.560 175.560 176.250 -0.690 25148 2359 1 4 . 1 1 63 63 ASP CA C 63 54.576 54.576 54.486 0.090 25148 2360 1 4 . 1 1 63 63 ASP CB C 63 42.841 42.841 41.329 1.512 25148 2361 1 4 . 1 1 63 63 ASP H H 63 8.334 8.334 8.776 -0.442 25148 2362 1 4 . 1 1 64 64 VAL N N 64 123.109 123.109 126.879 -3.770 25148 2363 1 4 . 1 1 64 64 VAL HA H 64 4.557 4.557 4.540 0.017 25148 2364 1 4 . 1 1 64 64 VAL C C 64 177.260 177.260 175.508 1.752 25148 2365 1 4 . 1 1 64 64 VAL CA C 64 62.268 62.268 62.903 -0.635 25148 2366 1 4 . 1 1 64 64 VAL CB C 64 30.348 30.348 30.390 -0.042 25148 2367 1 4 . 1 1 64 64 VAL H H 64 8.693 8.693 8.250 0.443 25148 2368 1 4 . 1 1 65 65 VAL N N 65 122.320 122.320 122.903 -0.583 25148 2369 1 4 . 1 1 65 65 VAL HA H 65 4.939 4.939 4.627 0.312 25148 2370 1 4 . 1 1 65 65 VAL C C 65 174.754 174.754 174.687 0.067 25148 2371 1 4 . 1 1 65 65 VAL CA C 65 59.173 59.173 59.779 -0.606 25148 2372 1 4 . 1 1 65 65 VAL CB C 65 36.289 36.289 35.806 0.483 25148 2373 1 4 . 1 1 65 65 VAL H H 65 8.656 8.656 8.566 0.090 25148 2374 1 4 . 1 1 66 66 ASP N N 66 119.805 119.805 121.959 -2.154 25148 2375 1 4 . 1 1 66 66 ASP HA H 66 4.499 4.499 4.385 0.114 25148 2376 1 4 . 1 1 66 66 ASP C C 66 176.565 176.565 175.905 0.660 25148 2377 1 4 . 1 1 66 66 ASP CA C 66 57.236 57.236 56.511 0.725 25148 2378 1 4 . 1 1 66 66 ASP CB C 66 41.662 41.662 41.166 0.496 25148 2379 1 4 . 1 1 66 66 ASP H H 66 8.628 8.628 8.822 -0.194 25148 2380 1 4 . 1 1 67 67 GLU N N 67 117.604 117.604 117.686 -0.082 25148 2381 1 4 . 1 1 67 67 GLU HA H 67 4.350 4.350 4.453 -0.103 25148 2382 1 4 . 1 1 67 67 GLU C C 67 173.736 173.736 175.789 -2.053 25148 2383 1 4 . 1 1 67 67 GLU CA C 67 55.203 55.203 54.720 0.483 25148 2384 1 4 . 1 1 67 67 GLU CB C 67 32.240 32.240 32.592 -0.352 25148 2385 1 4 . 1 1 67 67 GLU H H 67 7.525 7.525 7.899 -0.374 25148 2386 1 4 . 1 1 68 68 VAL N N 68 125.774 125.774 123.194 2.580 25148 2387 1 4 . 1 1 68 68 VAL HA H 68 3.578 3.578 3.872 -0.294 25148 2388 1 4 . 1 1 68 68 VAL C C 68 175.885 175.885 175.362 0.523 25148 2389 1 4 . 1 1 68 68 VAL CA C 68 63.397 63.397 63.929 -0.532 25148 2390 1 4 . 1 1 68 68 VAL CB C 68 32.452 32.452 31.258 1.194 25148 2391 1 4 . 1 1 68 68 VAL H H 68 8.573 8.573 8.425 0.148 25148 2392 1 4 . 1 1 69 69 TYR N N 69 129.859 129.859 126.424 3.435 25148 2393 1 4 . 1 1 69 69 TYR HA H 69 4.642 4.642 4.607 0.035 25148 2394 1 4 . 1 1 69 69 TYR C C 69 176.100 176.100 175.503 0.597 25148 2395 1 4 . 1 1 69 69 TYR CA C 69 59.092 59.092 59.095 -0.003 25148 2396 1 4 . 1 1 69 69 TYR CB C 69 39.830 39.830 40.537 -0.707 25148 2397 1 4 . 1 1 69 69 TYR H H 69 9.801 9.801 8.499 1.302 25148 2398 1 4 . 1 1 70 70 ASP N N 70 120.204 120.204 120.337 -0.133 25148 2399 1 4 . 1 1 70 70 ASP HA H 70 4.772 4.772 4.924 -0.152 25148 2400 1 4 . 1 1 70 70 ASP C C 70 176.622 176.622 176.443 0.179 25148 2401 1 4 . 1 1 70 70 ASP CA C 70 52.885 52.885 53.122 -0.237 25148 2402 1 4 . 1 1 70 70 ASP CB C 70 41.878 41.878 41.487 0.390 25148 2403 1 4 . 1 1 70 70 ASP H H 70 8.348 8.348 7.889 0.459 25148 2404 1 4 . 1 1 71 71 GLN N N 71 125.440 125.440 123.154 2.286 25148 2405 1 4 . 1 1 71 71 GLN HA H 71 4.315 4.315 4.060 0.255 25148 2406 1 4 . 1 1 71 71 GLN C C 71 175.819 175.819 176.890 -1.071 25148 2407 1 4 . 1 1 71 71 GLN CA C 71 57.914 57.914 58.217 -0.303 25148 2408 1 4 . 1 1 71 71 GLN CB C 71 28.307 28.307 28.344 -0.037 25148 2409 1 4 . 1 1 71 71 GLN H H 71 9.097 9.097 8.915 0.182 25148 2410 1 4 . 1 1 72 72 ARG N N 72 116.306 116.306 115.431 0.875 25148 2411 1 4 . 1 1 72 72 ARG HA H 72 4.252 4.252 4.172 0.080 25148 2412 1 4 . 1 1 72 72 ARG C C 72 178.087 178.087 176.040 2.047 25148 2413 1 4 . 1 1 72 72 ARG CA C 72 58.532 58.532 57.440 1.092 25148 2414 1 4 . 1 1 72 72 ARG CB C 72 30.143 30.143 30.915 -0.772 25148 2415 1 4 . 1 1 72 72 ARG H H 72 8.534 8.534 8.201 0.333 25148 2416 1 4 . 1 1 73 73 LEU N N 73 116.734 116.734 114.139 2.595 25148 2417 1 4 . 1 1 73 73 LEU HA H 73 4.621 4.621 4.656 -0.035 25148 2418 1 4 . 1 1 73 73 LEU C C 73 175.946 175.946 175.068 0.878 25148 2419 1 4 . 1 1 73 73 LEU CA C 73 55.250 55.250 55.405 -0.155 25148 2420 1 4 . 1 1 73 73 LEU CB C 73 46.960 46.960 44.382 2.578 25148 2421 1 4 . 1 1 73 73 LEU H H 73 7.460 7.460 7.437 0.023 25148 2422 1 4 . 1 1 74 74 GLU N N 74 118.787 118.787 121.666 -2.879 25148 2423 1 4 . 1 1 74 74 GLU HA H 74 5.403 5.403 4.658 0.745 25148 2424 1 4 . 1 1 74 74 GLU C C 74 173.709 173.709 173.940 -0.231 25148 2425 1 4 . 1 1 74 74 GLU CA C 74 54.914 54.914 56.082 -1.168 25148 2426 1 4 . 1 1 74 74 GLU CB C 74 35.053 35.053 33.792 1.261 25148 2427 1 4 . 1 1 74 74 GLU H H 74 7.752 7.752 8.008 -0.256 25148 2428 1 4 . 1 1 75 75 ILE N N 75 119.803 119.803 120.236 -0.433 25148 2429 1 4 . 1 1 75 75 ILE HA H 75 4.507 4.507 4.556 -0.049 25148 2430 1 4 . 1 1 75 75 ILE C C 75 172.126 172.126 173.437 -1.311 25148 2431 1 4 . 1 1 75 75 ILE CA C 75 58.664 58.664 60.008 -1.344 25148 2432 1 4 . 1 1 75 75 ILE CB C 75 42.560 42.560 41.693 0.867 25148 2433 1 4 . 1 1 75 75 ILE H H 75 8.975 8.975 8.407 0.568 25148 2434 1 4 . 1 1 76 76 SER N N 76 123.236 123.236 124.202 -0.966 25148 2435 1 4 . 1 1 76 76 SER HA H 76 4.505 4.505 4.904 -0.399 25148 2436 1 4 . 1 1 76 76 SER C C 76 176.145 176.145 175.797 0.348 25148 2437 1 4 . 1 1 76 76 SER CA C 76 58.108 58.108 57.991 0.117 25148 2438 1 4 . 1 1 76 76 SER CB C 76 65.000 65.000 64.214 0.786 25148 2439 1 4 . 1 1 76 76 SER H H 76 8.810 8.810 8.481 0.329 25148 2440 1 4 . 1 1 77 77 ILE N N 77 120.629 120.629 124.805 -4.176 25148 2441 1 4 . 1 1 77 77 ILE HA H 77 3.935 3.935 3.721 0.214 25148 2442 1 4 . 1 1 77 77 ILE C C 77 175.806 175.806 176.959 -1.153 25148 2443 1 4 . 1 1 77 77 ILE CA C 77 61.928 61.928 63.716 -1.788 25148 2444 1 4 . 1 1 77 77 ILE CB C 77 38.031 38.031 38.104 -0.073 25148 2445 1 4 . 1 1 77 77 ILE H H 77 8.321 8.321 8.072 0.249 25148 2446 1 4 . 1 1 78 78 GLU N N 78 121.032 121.032 117.518 3.514 25148 2447 1 4 . 1 1 78 78 GLU HA H 78 4.082 4.082 3.981 0.101 25148 2448 1 4 . 1 1 78 78 GLU C C 78 179.829 179.829 178.394 1.435 25148 2449 1 4 . 1 1 78 78 GLU CA C 78 60.180 60.180 59.087 1.093 25148 2450 1 4 . 1 1 78 78 GLU CB C 78 28.988 28.988 28.665 0.323 25148 2451 1 4 . 1 1 78 78 GLU H H 78 8.222 8.222 8.325 -0.103 25148 2452 1 4 . 1 1 79 79 GLU N N 79 120.710 120.710 121.304 -0.594 25148 2453 1 4 . 1 1 79 79 GLU HA H 79 4.012 4.012 4.096 -0.084 25148 2454 1 4 . 1 1 79 79 GLU C C 79 180.339 180.339 179.111 1.228 25148 2455 1 4 . 1 1 79 79 GLU CA C 79 59.332 59.332 58.752 0.580 25148 2456 1 4 . 1 1 79 79 GLU CB C 79 29.317 29.317 29.297 0.020 25148 2457 1 4 . 1 1 79 79 GLU H H 79 7.908 7.908 7.806 0.102 25148 2458 1 4 . 1 1 80 80 ALA N N 80 122.879 122.879 121.982 0.897 25148 2459 1 4 . 1 1 80 80 ALA HA H 80 3.966 3.966 4.178 -0.212 25148 2460 1 4 . 1 1 80 80 ALA C C 80 179.833 179.833 179.962 -0.129 25148 2461 1 4 . 1 1 80 80 ALA CA C 80 55.881 55.881 55.007 0.874 25148 2462 1 4 . 1 1 80 80 ALA CB C 80 18.870 18.870 18.136 0.734 25148 2463 1 4 . 1 1 80 80 ALA H H 80 9.132 9.132 8.040 1.092 25148 2464 1 4 . 1 1 81 81 GLN N N 81 115.829 115.829 116.504 -0.675 25148 2465 1 4 . 1 1 81 81 GLN HA H 81 4.749 4.749 4.348 0.401 25148 2466 1 4 . 1 1 81 81 GLN C C 81 178.126 178.126 177.920 0.206 25148 2467 1 4 . 1 1 81 81 GLN CA C 81 57.682 57.682 57.982 -0.300 25148 2468 1 4 . 1 1 81 81 GLN CB C 81 27.307 27.307 28.686 -1.379 25148 2469 1 4 . 1 1 81 81 GLN H H 81 8.709 8.709 7.773 0.936 25148 2470 1 4 . 1 1 82 82 GLY N N 82 105.531 105.531 106.730 -1.199 25148 2471 1 4 . 1 1 82 82 GLY C C 82 174.917 174.917 175.011 -0.094 25148 2472 1 4 . 1 1 82 82 GLY CA C 82 45.915 45.915 46.501 -0.586 25148 2473 1 4 . 1 1 82 82 GLY H H 82 7.479 7.479 7.947 -0.468 25148 2474 1 4 . 1 1 83 83 ILE N N 83 122.828 122.828 113.983 8.845 25148 2475 1 4 . 1 1 83 83 ILE HA H 83 3.970 3.970 4.383 -0.413 25148 2476 1 4 . 1 1 83 83 ILE C C 83 177.209 177.209 175.706 1.503 25148 2477 1 4 . 1 1 83 83 ILE CA C 83 64.305 64.305 61.395 2.910 25148 2478 1 4 . 1 1 83 83 ILE CB C 83 38.452 38.452 40.232 -1.780 25148 2479 1 4 . 1 1 83 83 ILE H H 83 7.634 7.634 7.382 0.252 25148 2480 1 4 . 1 1 84 84 HIS N N 84 118.927 118.927 120.179 -1.252 25148 2481 1 4 . 1 1 84 84 HIS HA H 84 4.713 4.713 4.907 -0.194 25148 2482 1 4 . 1 1 84 84 HIS CA C 84 55.487 55.487 54.633 0.854 25148 2483 1 4 . 1 1 84 84 HIS CB C 84 33.506 33.506 32.090 1.416 25148 2484 1 4 . 1 1 84 84 HIS H H 84 8.155 8.155 8.349 -0.194 25148 2485 1 4 . 1 1 85 85 PRO HA H 85 4.456 4.456 4.611 -0.154 25148 2486 1 4 . 1 1 85 85 PRO C C 85 177.357 177.357 177.231 0.126 25148 2487 1 4 . 1 1 85 85 PRO CA C 85 64.475 64.475 64.090 0.385 25148 2488 1 4 . 1 1 85 85 PRO CB C 85 32.489 32.489 32.110 0.379 25148 2489 1 4 . 1 1 86 86 GLU N N 86 116.314 116.314 116.800 -0.486 25148 2490 1 4 . 1 1 86 86 GLU HA H 86 4.286 4.286 4.178 0.108 25148 2491 1 4 . 1 1 86 86 GLU C C 86 177.624 177.624 177.204 0.420 25148 2492 1 4 . 1 1 86 86 GLU CA C 86 56.619 56.619 56.700 -0.081 25148 2493 1 4 . 1 1 86 86 GLU CB C 86 29.389 29.389 29.423 -0.034 25148 2494 1 4 . 1 1 86 86 GLU H H 86 8.938 8.938 7.845 1.093 25148 2495 1 4 . 1 1 87 87 TYR N N 87 119.773 119.773 120.303 -0.530 25148 2496 1 4 . 1 1 87 87 TYR HA H 87 4.744 4.744 4.185 0.559 25148 2497 1 4 . 1 1 87 87 TYR C C 87 174.533 174.533 176.219 -1.686 25148 2498 1 4 . 1 1 87 87 TYR CA C 87 59.117 59.117 59.316 -0.199 25148 2499 1 4 . 1 1 87 87 TYR CB C 87 38.859 38.859 38.719 0.140 25148 2500 1 4 . 1 1 87 87 TYR H H 87 7.447 7.447 7.361 0.086 25148 2501 1 4 . 1 1 88 88 MET N N 88 118.298 118.298 117.326 0.972 25148 2502 1 4 . 1 1 88 88 MET HA H 88 4.770 4.770 4.733 0.037 25148 2503 1 4 . 1 1 88 88 MET C C 88 175.638 175.638 173.866 1.772 25148 2504 1 4 . 1 1 88 88 MET CA C 88 53.133 53.133 54.611 -1.478 25148 2505 1 4 . 1 1 88 88 MET CB C 88 37.102 37.102 35.494 1.608 25148 2506 1 4 . 1 1 88 88 MET H H 88 9.023 9.023 8.313 0.710 25148 2507 1 4 . 1 1 89 89 VAL N N 89 120.157 120.157 124.974 -4.817 25148 2508 1 4 . 1 1 89 89 VAL HA H 89 3.330 3.330 3.677 -0.347 25148 2509 1 4 . 1 1 89 89 VAL C C 89 177.432 177.432 176.768 0.664 25148 2510 1 4 . 1 1 89 89 VAL CA C 89 65.675 65.675 64.758 0.917 25148 2511 1 4 . 1 1 89 89 VAL CB C 89 31.321 31.321 31.001 0.320 25148 2512 1 4 . 1 1 89 89 VAL H H 89 8.313 8.313 8.634 -0.321 25148 2513 1 4 . 1 1 90 90 GLY N N 90 116.935 116.935 115.603 1.332 25148 2514 1 4 . 1 1 90 90 GLY C C 90 175.196 175.196 174.283 0.913 25148 2515 1 4 . 1 1 90 90 GLY CA C 90 44.685 44.685 44.728 -0.043 25148 2516 1 4 . 1 1 90 90 GLY H H 90 8.551 8.551 8.910 -0.359 25148 2517 1 4 . 1 1 91 91 ASP N N 91 121.616 121.616 121.989 -0.373 25148 2518 1 4 . 1 1 91 91 ASP HA H 91 4.790 4.790 4.934 -0.144 25148 2519 1 4 . 1 1 91 91 ASP C C 91 174.431 174.431 174.921 -0.490 25148 2520 1 4 . 1 1 91 91 ASP CA C 91 55.011 55.011 53.810 1.201 25148 2521 1 4 . 1 1 91 91 ASP CB C 91 42.079 42.079 42.654 -0.576 25148 2522 1 4 . 1 1 91 91 ASP H H 91 8.073 8.073 8.012 0.061 25148 2523 1 4 . 1 1 92 92 VAL N N 92 118.919 118.919 114.628 4.291 25148 2524 1 4 . 1 1 92 92 VAL HA H 92 4.709 4.709 4.950 -0.241 25148 2525 1 4 . 1 1 92 92 VAL C C 92 175.602 175.602 174.355 1.247 25148 2526 1 4 . 1 1 92 92 VAL CA C 92 61.527 61.527 60.029 1.498 25148 2527 1 4 . 1 1 92 92 VAL CB C 92 34.110 34.110 35.424 -1.314 25148 2528 1 4 . 1 1 92 92 VAL H H 92 8.216 8.216 8.098 0.118 25148 2529 1 4 . 1 1 93 93 VAL N N 93 123.922 123.922 123.717 0.205 25148 2530 1 4 . 1 1 93 93 VAL HA H 93 4.231 4.231 4.192 0.039 25148 2531 1 4 . 1 1 93 93 VAL C C 93 174.105 174.105 174.197 -0.092 25148 2532 1 4 . 1 1 93 93 VAL CA C 93 59.644 59.644 59.514 0.130 25148 2533 1 4 . 1 1 93 93 VAL CB C 93 34.661 34.661 34.175 0.486 25148 2534 1 4 . 1 1 93 93 VAL H H 93 8.812 8.812 8.041 0.771 25148 2535 1 4 . 1 1 94 94 GLU N N 94 123.605 123.605 128.862 -5.257 25148 2536 1 4 . 1 1 94 94 GLU HA H 94 5.347 5.347 5.181 0.166 25148 2537 1 4 . 1 1 94 94 GLU C C 94 175.708 175.708 175.671 0.037 25148 2538 1 4 . 1 1 94 94 GLU CA C 94 54.979 54.979 55.271 -0.292 25148 2539 1 4 . 1 1 94 94 GLU CB C 94 31.612 31.612 30.802 0.810 25148 2540 1 4 . 1 1 94 94 GLU H H 94 8.312 8.312 8.512 -0.200 25148 2541 1 4 . 1 1 95 95 ILE N N 95 123.581 123.581 124.518 -0.937 25148 2542 1 4 . 1 1 95 95 ILE HA H 95 4.601 4.601 4.529 0.072 25148 2543 1 4 . 1 1 95 95 ILE C C 95 175.081 175.081 175.916 -0.835 25148 2544 1 4 . 1 1 95 95 ILE CA C 95 58.601 58.601 59.603 -1.002 25148 2545 1 4 . 1 1 95 95 ILE CB C 95 41.727 41.727 41.210 0.517 25148 2546 1 4 . 1 1 95 95 ILE H H 95 9.045 9.045 7.929 1.116 25148 2547 1 4 . 1 1 96 96 GLU N N 96 128.094 128.094 128.322 -0.228 25148 2548 1 4 . 1 1 96 96 GLU HA H 96 4.098 4.098 4.125 -0.027 25148 2549 1 4 . 1 1 96 96 GLU C C 96 176.845 176.845 175.597 1.248 25148 2550 1 4 . 1 1 96 96 GLU CA C 96 57.853 57.853 57.879 -0.026 25148 2551 1 4 . 1 1 96 96 GLU CB C 96 28.323 28.323 29.387 -1.064 25148 2552 1 4 . 1 1 96 96 GLU H H 96 9.256 9.256 8.918 0.338 25148 2553 1 4 . 1 1 97 97 VAL N N 97 118.446 118.446 125.196 -6.750 25148 2554 1 4 . 1 1 97 97 VAL HA H 97 4.568 4.568 4.244 0.324 25148 2555 1 4 . 1 1 97 97 VAL C C 97 175.051 175.051 175.110 -0.059 25148 2556 1 4 . 1 1 97 97 VAL CA C 97 59.796 59.796 60.746 -0.950 25148 2557 1 4 . 1 1 97 97 VAL CB C 97 32.399 32.399 32.656 -0.257 25148 2558 1 4 . 1 1 97 97 VAL H H 97 8.609 8.609 8.719 -0.110 25148 2559 1 4 . 1 1 98 98 THR N N 98 119.118 119.118 118.372 0.746 25148 2560 1 4 . 1 1 98 98 THR HA H 98 3.320 3.320 3.877 -0.557 25148 2561 1 4 . 1 1 98 98 THR CA C 98 61.628 61.628 60.737 0.891 25148 2562 1 4 . 1 1 98 98 THR CB C 98 70.031 70.031 69.698 0.333 25148 2563 1 4 . 1 1 98 98 THR H H 98 7.396 7.396 7.263 0.133 25148 2564 1 4 . 1 1 99 99 PRO HA H 99 4.458 4.458 4.538 -0.080 25148 2565 1 4 . 1 1 99 99 PRO CA C 99 62.348 62.348 62.319 0.029 25148 2566 1 4 . 1 1 99 99 PRO CB C 99 33.182 33.182 32.580 0.602 25148 2567 1 4 . 1 1 100 100 LYS HA H 100 4.126 4.126 4.146 -0.020 25148 2568 1 4 . 1 1 100 100 LYS CA C 100 58.773 58.773 57.751 1.022 25148 2569 1 4 . 1 1 100 100 LYS CB C 100 32.195 32.195 32.014 0.181 25148 2570 1 4 . 1 1 101 101 ASP HA H 101 4.924 4.924 4.678 0.246 25148 2571 1 4 . 1 1 101 101 ASP C C 101 176.884 176.884 176.805 0.079 25148 2572 1 4 . 1 1 101 101 ASP CA C 101 54.134 54.134 53.819 0.315 25148 2573 1 4 . 1 1 101 101 ASP CB C 101 40.272 40.272 40.398 -0.126 25148 2574 1 4 . 1 1 102 102 PHE N N 102 118.703 118.703 122.123 -3.420 25148 2575 1 4 . 1 1 102 102 PHE HA H 102 4.295 4.295 4.286 0.009 25148 2576 1 4 . 1 1 102 102 PHE C C 102 176.477 176.477 177.026 -0.549 25148 2577 1 4 . 1 1 102 102 PHE CA C 102 60.748 60.748 60.059 0.689 25148 2578 1 4 . 1 1 102 102 PHE CB C 102 39.667 39.667 39.273 0.394 25148 2579 1 4 . 1 1 102 102 PHE H H 102 7.862 7.862 7.641 0.221 25148 2580 1 4 . 1 1 103 103 GLY CA C 103 47.430 47.430 47.247 0.183 25148 2581 1 4 . 1 1 104 104 ARG N N 104 121.819 121.819 121.484 0.335 25148 2582 1 4 . 1 1 104 104 ARG HA H 104 4.176 4.176 4.201 -0.025 25148 2583 1 4 . 1 1 104 104 ARG C C 104 178.912 178.912 178.411 0.501 25148 2584 1 4 . 1 1 104 104 ARG CA C 104 59.235 59.235 57.961 1.274 25148 2585 1 4 . 1 1 104 104 ARG CB C 104 30.000 30.000 30.213 -0.213 25148 2586 1 4 . 1 1 104 104 ARG H H 104 7.809 7.809 7.665 0.144 25148 2587 1 4 . 1 1 105 105 ILE N N 105 120.331 120.331 120.451 -0.120 25148 2588 1 4 . 1 1 105 105 ILE HA H 105 3.836 3.836 3.661 0.175 25148 2589 1 4 . 1 1 105 105 ILE C C 105 179.206 179.206 177.506 1.700 25148 2590 1 4 . 1 1 105 105 ILE CA C 105 63.025 63.025 64.646 -1.621 25148 2591 1 4 . 1 1 105 105 ILE CB C 105 38.127 38.127 37.551 0.576 25148 2592 1 4 . 1 1 105 105 ILE H H 105 7.203 7.203 7.438 -0.235 25148 2593 1 4 . 1 1 106 106 ALA N N 106 124.867 124.867 121.460 3.407 25148 2594 1 4 . 1 1 106 106 ALA HA H 106 3.665 3.665 3.676 -0.011 25148 2595 1 4 . 1 1 106 106 ALA C C 106 178.590 178.590 179.242 -0.652 25148 2596 1 4 . 1 1 106 106 ALA CA C 106 54.842 54.842 55.270 -0.428 25148 2597 1 4 . 1 1 106 106 ALA CB C 106 18.659 18.659 17.636 1.023 25148 2598 1 4 . 1 1 106 106 ALA H H 106 8.813 8.813 8.226 0.587 25148 2599 1 4 . 1 1 107 107 ALA N N 107 119.597 119.597 120.388 -0.791 25148 2600 1 4 . 1 1 107 107 ALA HA H 107 4.014 4.014 4.026 -0.012 25148 2601 1 4 . 1 1 107 107 ALA C C 107 180.214 180.214 179.528 0.686 25148 2602 1 4 . 1 1 107 107 ALA CA C 107 55.454 55.454 54.631 0.823 25148 2603 1 4 . 1 1 107 107 ALA CB C 107 18.260 18.260 18.175 0.085 25148 2604 1 4 . 1 1 107 107 ALA H H 107 8.012 8.012 7.612 0.400 25148 2605 1 4 . 1 1 108 108 GLN N N 108 116.896 116.896 118.378 -1.482 25148 2606 1 4 . 1 1 108 108 GLN HA H 108 4.054 4.054 4.018 0.036 25148 2607 1 4 . 1 1 108 108 GLN C C 108 178.784 178.784 178.365 0.419 25148 2608 1 4 . 1 1 108 108 GLN CA C 108 58.705 58.705 58.982 -0.277 25148 2609 1 4 . 1 1 108 108 GLN CB C 108 28.647 28.647 28.745 -0.099 25148 2610 1 4 . 1 1 108 108 GLN H H 108 7.498 7.498 7.977 -0.479 25148 2611 1 4 . 1 1 109 109 THR N N 109 117.495 117.495 116.006 1.489 25148 2612 1 4 . 1 1 109 109 THR HA H 109 3.917 3.917 4.285 -0.368 25148 2613 1 4 . 1 1 109 109 THR C C 109 175.732 175.732 175.874 -0.142 25148 2614 1 4 . 1 1 109 109 THR CA C 109 66.989 66.989 65.567 1.421 25148 2615 1 4 . 1 1 109 109 THR CB C 109 68.766 68.766 68.452 0.314 25148 2616 1 4 . 1 1 109 109 THR H H 109 8.203 8.203 8.187 0.016 25148 2617 1 4 . 1 1 110 110 ALA N N 110 122.308 122.308 124.872 -2.564 25148 2618 1 4 . 1 1 110 110 ALA HA H 110 3.854 3.854 4.057 -0.203 25148 2619 1 4 . 1 1 110 110 ALA C C 110 178.380 178.380 178.794 -0.414 25148 2620 1 4 . 1 1 110 110 ALA CA C 110 55.903 55.903 54.864 1.039 25148 2621 1 4 . 1 1 110 110 ALA CB C 110 18.524 18.524 18.344 0.180 25148 2622 1 4 . 1 1 110 110 ALA H H 110 8.668 8.668 7.781 0.887 25148 2623 1 4 . 1 1 111 111 LYS N N 111 115.552 115.552 117.918 -2.366 25148 2624 1 4 . 1 1 111 111 LYS HA H 111 3.923 3.923 3.999 -0.076 25148 2625 1 4 . 1 1 111 111 LYS C C 111 179.111 179.111 178.803 0.308 25148 2626 1 4 . 1 1 111 111 LYS CA C 111 59.825 59.825 59.278 0.547 25148 2627 1 4 . 1 1 111 111 LYS CB C 111 32.251 32.251 31.896 0.355 25148 2628 1 4 . 1 1 111 111 LYS H H 111 7.642 7.642 8.433 -0.791 25148 2629 1 4 . 1 1 112 112 GLN N N 112 120.178 120.178 118.778 1.400 25148 2630 1 4 . 1 1 112 112 GLN HA H 112 4.060 4.060 4.131 -0.071 25148 2631 1 4 . 1 1 112 112 GLN C C 112 178.355 178.355 178.148 0.207 25148 2632 1 4 . 1 1 112 112 GLN CA C 112 59.240 59.240 58.211 1.029 25148 2633 1 4 . 1 1 112 112 GLN CB C 112 28.250 28.250 28.551 -0.301 25148 2634 1 4 . 1 1 112 112 GLN H H 112 7.798 7.798 7.672 0.126 25148 2635 1 4 . 1 1 113 113 VAL N N 113 119.799 119.799 121.282 -1.483 25148 2636 1 4 . 1 1 113 113 VAL HA H 113 3.705 3.705 4.094 -0.389 25148 2637 1 4 . 1 1 113 113 VAL C C 113 178.303 178.303 178.256 0.047 25148 2638 1 4 . 1 1 113 113 VAL CA C 113 66.277 66.277 64.502 1.774 25148 2639 1 4 . 1 1 113 113 VAL CB C 113 31.954 31.954 31.669 0.285 25148 2640 1 4 . 1 1 113 113 VAL H H 113 8.105 8.105 7.542 0.563 25148 2641 1 4 . 1 1 114 114 VAL N N 114 118.265 118.265 117.099 1.166 25148 2642 1 4 . 1 1 114 114 VAL HA H 114 3.392 3.392 3.698 -0.306 25148 2643 1 4 . 1 1 114 114 VAL C C 114 177.360 177.360 178.238 -0.878 25148 2644 1 4 . 1 1 114 114 VAL CA C 114 67.832 67.832 67.044 0.788 25148 2645 1 4 . 1 1 114 114 VAL CB C 114 31.801 31.801 30.467 1.334 25148 2646 1 4 . 1 1 114 114 VAL H H 114 8.180 8.180 8.136 0.044 25148 2647 1 4 . 1 1 115 115 THR N N 115 113.460 113.460 114.932 -1.472 25148 2648 1 4 . 1 1 115 115 THR HA H 115 3.856 3.856 4.061 -0.205 25148 2649 1 4 . 1 1 115 115 THR C C 115 176.529 176.529 176.659 -0.130 25148 2650 1 4 . 1 1 115 115 THR CA C 115 66.706 66.706 66.579 0.127 25148 2651 1 4 . 1 1 115 115 THR CB C 115 69.008 69.008 68.604 0.404 25148 2652 1 4 . 1 1 115 115 THR H H 115 8.143 8.143 7.677 0.466 25148 2653 1 4 . 1 1 116 116 GLN N N 116 120.129 120.129 121.323 -1.194 25148 2654 1 4 . 1 1 116 116 GLN HA H 116 4.054 4.054 4.093 -0.039 25148 2655 1 4 . 1 1 116 116 GLN C C 116 178.100 178.100 178.420 -0.320 25148 2656 1 4 . 1 1 116 116 GLN CA C 116 58.950 58.950 59.331 -0.381 25148 2657 1 4 . 1 1 116 116 GLN CB C 116 28.244 28.244 28.517 -0.273 25148 2658 1 4 . 1 1 116 116 GLN H H 116 7.936 7.936 7.340 0.596 25148 2659 1 4 . 1 1 117 117 ARG N N 117 117.838 117.838 119.039 -1.201 25148 2660 1 4 . 1 1 117 117 ARG HA H 117 4.174 4.174 4.050 0.124 25148 2661 1 4 . 1 1 117 117 ARG C C 117 179.138 179.138 178.696 0.442 25148 2662 1 4 . 1 1 117 117 ARG CA C 117 57.461 57.461 58.503 -1.042 25148 2663 1 4 . 1 1 117 117 ARG CB C 117 29.548 29.548 29.447 0.101 25148 2664 1 4 . 1 1 117 117 ARG H H 117 8.240 8.240 8.238 0.002 25148 2665 1 4 . 1 1 118 118 VAL N N 118 120.278 120.278 119.923 0.355 25148 2666 1 4 . 1 1 118 118 VAL HA H 118 3.709 3.709 3.664 0.045 25148 2667 1 4 . 1 1 118 118 VAL C C 118 177.597 177.597 177.912 -0.315 25148 2668 1 4 . 1 1 118 118 VAL CA C 118 66.246 66.246 66.106 0.141 25148 2669 1 4 . 1 1 118 118 VAL CB C 118 31.785 31.785 30.930 0.855 25148 2670 1 4 . 1 1 118 118 VAL H H 118 8.480 8.480 7.610 0.870 25148 2671 1 4 . 1 1 119 119 ARG N N 119 120.197 120.197 119.595 0.602 25148 2672 1 4 . 1 1 119 119 ARG HA H 119 4.173 4.173 3.931 0.242 25148 2673 1 4 . 1 1 119 119 ARG C C 119 178.864 178.864 178.979 -0.115 25148 2674 1 4 . 1 1 119 119 ARG CA C 119 58.772 58.772 59.810 -1.038 25148 2675 1 4 . 1 1 119 119 ARG CB C 119 29.873 29.873 29.724 0.149 25148 2676 1 4 . 1 1 119 119 ARG H H 119 7.899 7.899 7.668 0.231 25148 2677 1 4 . 1 1 120 120 GLU N N 120 118.768 118.768 118.981 -0.213 25148 2678 1 4 . 1 1 120 120 GLU HA H 120 4.110 4.110 4.057 0.053 25148 2679 1 4 . 1 1 120 120 GLU C C 120 177.823 177.823 178.805 -0.982 25148 2680 1 4 . 1 1 120 120 GLU CA C 120 58.223 58.223 59.323 -1.100 25148 2681 1 4 . 1 1 120 120 GLU CB C 120 29.854 29.854 29.504 0.350 25148 2682 1 4 . 1 1 120 120 GLU H H 120 8.084 8.084 7.604 0.480 25148 2683 1 4 . 1 1 121 121 ALA N N 121 121.984 121.984 121.675 0.309 25148 2684 1 4 . 1 1 121 121 ALA HA H 121 4.296 4.296 4.058 0.238 25148 2685 1 4 . 1 1 121 121 ALA C C 121 178.586 178.586 179.870 -1.284 25148 2686 1 4 . 1 1 121 121 ALA CA C 121 53.475 53.475 55.115 -1.640 25148 2687 1 4 . 1 1 121 121 ALA CB C 121 18.856 18.856 18.512 0.344 25148 2688 1 4 . 1 1 121 121 ALA H H 121 7.810 7.810 8.346 -0.536 25148 2689 1 4 . 1 1 122 122 GLU N N 122 118.229 118.229 116.560 1.669 25148 2690 1 4 . 1 1 122 122 GLU HA H 122 4.241 4.241 4.007 0.234 25148 2691 1 4 . 1 1 122 122 GLU C C 122 176.839 176.839 178.890 -2.051 25148 2692 1 4 . 1 1 122 122 GLU CA C 122 57.118 57.118 58.087 -0.969 25148 2693 1 4 . 1 1 122 122 GLU CB C 122 30.018 30.018 29.539 0.479 25148 2694 1 4 . 1 1 122 122 GLU H H 122 7.938 7.938 8.263 -0.325 25148 2695 1 4 . 1 1 123 123 ARG N N 123 120.601 120.601 120.270 0.331 25148 2696 1 4 . 1 1 123 123 ARG HA H 123 4.348 4.348 4.139 0.209 25148 2697 1 4 . 1 1 123 123 ARG C C 123 176.071 176.071 176.844 -0.773 25148 2698 1 4 . 1 1 123 123 ARG CA C 123 56.510 56.510 57.748 -1.238 25148 2699 1 4 . 1 1 123 123 ARG CB C 123 30.765 30.765 30.810 -0.045 25148 2700 1 4 . 1 1 123 123 ARG H H 123 7.977 7.977 8.118 -0.141 25148 2701 1 5 . 1 1 4 4 GLU HA H 4 4.138 4.138 3.935 0.203 25148 2702 1 5 . 1 1 4 4 GLU C C 4 179.152 179.152 178.201 0.951 25148 2703 1 5 . 1 1 4 4 GLU CA C 4 59.566 59.566 58.842 0.724 25148 2704 1 5 . 1 1 4 4 GLU CB C 4 29.407 29.407 29.686 -0.279 25148 2705 1 5 . 1 1 5 5 LEU N N 5 121.360 121.360 117.032 4.328 25148 2706 1 5 . 1 1 5 5 LEU HA H 5 4.195 4.195 4.070 0.125 25148 2707 1 5 . 1 1 5 5 LEU C C 5 178.179 178.179 178.132 0.047 25148 2708 1 5 . 1 1 5 5 LEU CA C 5 57.830 57.830 57.459 0.372 25148 2709 1 5 . 1 1 5 5 LEU CB C 5 41.630 41.630 41.289 0.341 25148 2710 1 5 . 1 1 5 5 LEU H H 5 7.877 7.877 7.856 0.021 25148 2711 1 5 . 1 1 6 6 LEU N N 6 118.058 118.058 120.339 -2.281 25148 2712 1 5 . 1 1 6 6 LEU HA H 6 3.919 3.919 3.858 0.061 25148 2713 1 5 . 1 1 6 6 LEU C C 6 180.274 180.274 179.221 1.053 25148 2714 1 5 . 1 1 6 6 LEU CA C 6 58.221 58.221 57.785 0.436 25148 2715 1 5 . 1 1 6 6 LEU CB C 6 40.684 40.684 41.336 -0.652 25148 2716 1 5 . 1 1 6 6 LEU H H 6 7.685 7.685 7.400 0.285 25148 2717 1 5 . 1 1 7 7 ASP N N 7 120.662 120.662 117.885 2.777 25148 2718 1 5 . 1 1 7 7 ASP HA H 7 4.416 4.416 4.331 0.085 25148 2719 1 5 . 1 1 7 7 ASP C C 7 178.738 178.738 177.999 0.739 25148 2720 1 5 . 1 1 7 7 ASP CA C 7 57.519 57.519 57.305 0.214 25148 2721 1 5 . 1 1 7 7 ASP CB C 7 40.167 40.167 41.025 -0.858 25148 2722 1 5 . 1 1 7 7 ASP H H 7 8.427 8.427 7.823 0.604 25148 2723 1 5 . 1 1 8 8 ALA N N 8 122.612 122.612 122.746 -0.134 25148 2724 1 5 . 1 1 8 8 ALA HA H 8 4.146 4.146 4.033 0.113 25148 2725 1 5 . 1 1 8 8 ALA C C 8 180.787 180.787 179.690 1.097 25148 2726 1 5 . 1 1 8 8 ALA CA C 8 55.165 55.165 55.214 -0.049 25148 2727 1 5 . 1 1 8 8 ALA CB C 8 17.711 17.711 18.372 -0.661 25148 2728 1 5 . 1 1 8 8 ALA H H 8 7.847 7.847 7.732 0.115 25148 2729 1 5 . 1 1 9 9 LEU N N 9 116.977 116.977 117.647 -0.670 25148 2730 1 5 . 1 1 9 9 LEU HA H 9 4.115 4.115 3.858 0.257 25148 2731 1 5 . 1 1 9 9 LEU C C 9 179.510 179.510 179.398 0.112 25148 2732 1 5 . 1 1 9 9 LEU CA C 9 57.468 57.468 57.925 -0.457 25148 2733 1 5 . 1 1 9 9 LEU CB C 9 41.203 41.203 41.688 -0.485 25148 2734 1 5 . 1 1 9 9 LEU H H 9 8.256 8.256 7.793 0.463 25148 2735 1 5 . 1 1 10 10 THR N N 10 118.764 118.764 115.540 3.224 25148 2736 1 5 . 1 1 10 10 THR HA H 10 4.487 4.487 3.961 0.526 25148 2737 1 5 . 1 1 10 10 THR C C 10 176.567 176.567 177.170 -0.603 25148 2738 1 5 . 1 1 10 10 THR CA C 10 68.768 68.768 67.061 1.707 25148 2739 1 5 . 1 1 10 10 THR CB C 10 66.961 66.961 68.716 -1.755 25148 2740 1 5 . 1 1 10 10 THR H H 10 8.218 8.218 7.345 0.873 25148 2741 1 5 . 1 1 11 11 ILE N N 11 122.555 122.555 122.063 0.492 25148 2742 1 5 . 1 1 11 11 ILE HA H 11 3.779 3.779 3.710 0.069 25148 2743 1 5 . 1 1 11 11 ILE C C 11 177.793 177.793 177.755 0.038 25148 2744 1 5 . 1 1 11 11 ILE CA C 11 64.695 64.695 65.004 -0.309 25148 2745 1 5 . 1 1 11 11 ILE CB C 11 37.856 37.856 37.676 0.180 25148 2746 1 5 . 1 1 11 11 ILE H H 11 7.632 7.632 7.722 -0.090 25148 2747 1 5 . 1 1 12 12 LEU N N 12 120.469 120.469 118.260 2.209 25148 2748 1 5 . 1 1 12 12 LEU HA H 12 4.065 4.065 4.046 0.019 25148 2749 1 5 . 1 1 12 12 LEU C C 12 179.139 179.139 179.097 0.042 25148 2750 1 5 . 1 1 12 12 LEU CA C 12 57.944 57.944 57.157 0.786 25148 2751 1 5 . 1 1 12 12 LEU CB C 12 42.170 42.170 40.805 1.365 25148 2752 1 5 . 1 1 12 12 LEU H H 12 7.951 7.951 7.607 0.344 25148 2753 1 5 . 1 1 13 13 GLU N N 13 119.669 119.669 117.953 1.716 25148 2754 1 5 . 1 1 13 13 GLU HA H 13 4.183 4.183 3.997 0.186 25148 2755 1 5 . 1 1 13 13 GLU C C 13 179.007 179.007 177.597 1.410 25148 2756 1 5 . 1 1 13 13 GLU CA C 13 59.703 59.703 58.840 0.863 25148 2757 1 5 . 1 1 13 13 GLU CB C 13 30.110 30.110 28.904 1.206 25148 2758 1 5 . 1 1 13 13 GLU H H 13 8.003 8.003 7.758 0.245 25148 2759 1 5 . 1 1 14 14 LYS N N 14 118.935 118.935 118.596 0.339 25148 2760 1 5 . 1 1 14 14 LYS HA H 14 4.124 4.124 4.088 0.036 25148 2761 1 5 . 1 1 14 14 LYS CA C 14 58.847 58.847 57.124 1.723 25148 2762 1 5 . 1 1 14 14 LYS CB C 14 33.053 33.053 32.768 0.285 25148 2763 1 5 . 1 1 14 14 LYS H H 14 7.862 7.862 7.395 0.467 25148 2764 1 5 . 1 1 15 15 GLU HA H 15 3.693 3.693 4.346 -0.653 25148 2765 1 5 . 1 1 15 15 GLU CA C 15 56.688 56.688 55.753 0.935 25148 2766 1 5 . 1 1 15 15 GLU CB C 15 32.204 32.204 31.110 1.094 25148 2767 1 5 . 1 1 16 16 LYS HA H 16 4.678 4.678 4.326 0.352 25148 2768 1 5 . 1 1 16 16 LYS CA C 16 55.135 55.135 56.850 -1.715 25148 2769 1 5 . 1 1 16 16 LYS CB C 16 34.049 34.049 32.804 1.245 25148 2770 1 5 . 1 1 17 17 GLY CA C 17 46.541 46.541 45.188 1.353 25148 2771 1 5 . 1 1 18 18 ILE N N 18 115.364 115.364 122.833 -7.469 25148 2772 1 5 . 1 1 18 18 ILE HA H 18 4.079 4.079 4.252 -0.173 25148 2773 1 5 . 1 1 18 18 ILE C C 18 174.751 174.751 174.759 -0.008 25148 2774 1 5 . 1 1 18 18 ILE CA C 18 60.333 60.333 60.035 0.298 25148 2775 1 5 . 1 1 18 18 ILE CB C 18 39.044 39.044 38.359 0.684 25148 2776 1 5 . 1 1 18 18 ILE H H 18 8.203 8.203 7.505 0.698 25148 2777 1 5 . 1 1 19 19 SER N N 19 119.891 119.891 122.419 -2.528 25148 2778 1 5 . 1 1 19 19 SER HA H 19 4.362 4.362 4.618 -0.256 25148 2779 1 5 . 1 1 19 19 SER CA C 19 58.476 58.476 58.012 0.464 25148 2780 1 5 . 1 1 19 19 SER CB C 19 63.533 63.533 63.947 -0.414 25148 2781 1 5 . 1 1 19 19 SER H H 19 8.253 8.253 8.562 -0.309 25148 2782 1 5 . 1 1 20 20 LYS N N 20 124.782 124.782 126.554 -1.772 25148 2783 1 5 . 1 1 20 20 LYS HA H 20 4.137 4.137 4.042 0.095 25148 2784 1 5 . 1 1 20 20 LYS C C 20 177.889 177.889 177.312 0.577 25148 2785 1 5 . 1 1 20 20 LYS CA C 20 59.485 59.485 59.058 0.427 25148 2786 1 5 . 1 1 20 20 LYS CB C 20 32.711 32.711 32.069 0.642 25148 2787 1 5 . 1 1 20 20 LYS H H 20 8.918 8.918 8.749 0.169 25148 2788 1 5 . 1 1 21 21 GLU N N 21 117.831 117.831 119.893 -2.062 25148 2789 1 5 . 1 1 21 21 GLU HA H 21 3.957 3.957 4.082 -0.125 25148 2790 1 5 . 1 1 21 21 GLU C C 21 178.822 178.822 178.499 0.323 25148 2791 1 5 . 1 1 21 21 GLU CA C 21 59.529 59.529 58.578 0.951 25148 2792 1 5 . 1 1 21 21 GLU CB C 21 29.237 29.237 28.686 0.551 25148 2793 1 5 . 1 1 21 21 GLU H H 21 8.361 8.361 8.494 -0.133 25148 2794 1 5 . 1 1 22 22 ILE N N 22 118.690 118.690 119.089 -0.399 25148 2795 1 5 . 1 1 22 22 ILE HA H 22 3.884 3.884 3.906 -0.022 25148 2796 1 5 . 1 1 22 22 ILE C C 22 179.247 179.247 177.526 1.721 25148 2797 1 5 . 1 1 22 22 ILE CA C 22 63.735 63.735 64.068 -0.333 25148 2798 1 5 . 1 1 22 22 ILE CB C 22 37.415 37.415 38.146 -0.731 25148 2799 1 5 . 1 1 22 22 ILE H H 22 7.353 7.353 7.393 -0.040 25148 2800 1 5 . 1 1 23 23 ILE N N 23 120.880 120.880 120.999 -0.119 25148 2801 1 5 . 1 1 23 23 ILE HA H 23 3.733 3.733 3.718 0.015 25148 2802 1 5 . 1 1 23 23 ILE C C 23 177.817 177.817 177.900 -0.083 25148 2803 1 5 . 1 1 23 23 ILE CA C 23 64.172 64.172 63.510 0.662 25148 2804 1 5 . 1 1 23 23 ILE CB C 23 36.473 36.473 36.783 -0.310 25148 2805 1 5 . 1 1 23 23 ILE H H 23 7.571 7.571 7.284 0.287 25148 2806 1 5 . 1 1 24 24 ILE N N 24 121.460 121.460 119.175 2.285 25148 2807 1 5 . 1 1 24 24 ILE HA H 24 3.486 3.486 3.626 -0.140 25148 2808 1 5 . 1 1 24 24 ILE C C 24 177.759 177.759 177.878 -0.119 25148 2809 1 5 . 1 1 24 24 ILE CA C 24 66.641 66.641 66.139 0.502 25148 2810 1 5 . 1 1 24 24 ILE CB C 24 37.307 37.307 37.313 -0.006 25148 2811 1 5 . 1 1 24 24 ILE H H 24 8.709 8.709 7.684 1.025 25148 2812 1 5 . 1 1 25 25 GLU N N 25 119.323 119.323 118.409 0.914 25148 2813 1 5 . 1 1 25 25 GLU HA H 25 4.177 4.177 4.063 0.114 25148 2814 1 5 . 1 1 25 25 GLU C C 25 179.348 179.348 178.562 0.786 25148 2815 1 5 . 1 1 25 25 GLU CA C 25 59.951 59.951 59.200 0.750 25148 2816 1 5 . 1 1 25 25 GLU CB C 25 29.340 29.340 28.948 0.392 25148 2817 1 5 . 1 1 25 25 GLU H H 25 8.048 8.048 7.805 0.243 25148 2818 1 5 . 1 1 26 26 ALA N N 26 122.390 122.390 122.836 -0.446 25148 2819 1 5 . 1 1 26 26 ALA HA H 26 4.325 4.325 4.092 0.233 25148 2820 1 5 . 1 1 26 26 ALA C C 26 181.440 181.440 179.934 1.506 25148 2821 1 5 . 1 1 26 26 ALA CA C 26 54.935 54.935 54.979 -0.044 25148 2822 1 5 . 1 1 26 26 ALA CB C 26 17.834 17.834 18.215 -0.381 25148 2823 1 5 . 1 1 26 26 ALA H H 26 7.768 7.768 7.806 -0.038 25148 2824 1 5 . 1 1 27 27 ILE N N 27 122.342 122.342 119.239 3.103 25148 2825 1 5 . 1 1 27 27 ILE HA H 27 3.575 3.575 3.604 -0.029 25148 2826 1 5 . 1 1 27 27 ILE C C 27 177.541 177.541 178.035 -0.494 25148 2827 1 5 . 1 1 27 27 ILE CA C 27 66.536 66.536 65.656 0.880 25148 2828 1 5 . 1 1 27 27 ILE CB C 27 37.886 37.886 37.673 0.213 25148 2829 1 5 . 1 1 27 27 ILE H H 27 8.805 8.805 7.566 1.239 25148 2830 1 5 . 1 1 28 28 GLU N N 28 120.188 120.188 119.586 0.602 25148 2831 1 5 . 1 1 28 28 GLU HA H 28 3.687 3.687 3.874 -0.187 25148 2832 1 5 . 1 1 28 28 GLU C C 28 178.707 178.707 178.939 -0.232 25148 2833 1 5 . 1 1 28 28 GLU CA C 28 61.458 61.458 59.835 1.623 25148 2834 1 5 . 1 1 28 28 GLU CB C 28 29.624 29.624 29.356 0.268 25148 2835 1 5 . 1 1 28 28 GLU H H 28 8.882 8.882 7.667 1.215 25148 2836 1 5 . 1 1 29 29 ALA N N 29 119.293 119.293 121.177 -1.884 25148 2837 1 5 . 1 1 29 29 ALA HA H 29 4.214 4.214 4.041 0.173 25148 2838 1 5 . 1 1 29 29 ALA C C 29 181.200 181.200 179.570 1.630 25148 2839 1 5 . 1 1 29 29 ALA CA C 29 55.435 55.435 55.149 0.286 25148 2840 1 5 . 1 1 29 29 ALA CB C 29 18.090 18.090 18.190 -0.100 25148 2841 1 5 . 1 1 29 29 ALA H H 29 8.065 8.065 8.079 -0.014 25148 2842 1 5 . 1 1 30 30 ALA N N 30 121.729 121.729 121.511 0.218 25148 2843 1 5 . 1 1 30 30 ALA HA H 30 4.307 4.307 4.179 0.128 25148 2844 1 5 . 1 1 30 30 ALA C C 30 181.315 181.315 179.794 1.521 25148 2845 1 5 . 1 1 30 30 ALA CA C 30 54.594 54.594 54.740 -0.146 25148 2846 1 5 . 1 1 30 30 ALA CB C 30 18.704 18.704 18.253 0.451 25148 2847 1 5 . 1 1 30 30 ALA H H 30 8.099 8.099 7.196 0.903 25148 2848 1 5 . 1 1 31 31 LEU N N 31 120.900 120.900 120.240 0.660 25148 2849 1 5 . 1 1 31 31 LEU HA H 31 4.347 4.347 4.111 0.236 25148 2850 1 5 . 1 1 31 31 LEU C C 31 179.137 179.137 179.327 -0.190 25148 2851 1 5 . 1 1 31 31 LEU CA C 31 57.569 57.569 58.082 -0.513 25148 2852 1 5 . 1 1 31 31 LEU CB C 31 42.353 42.353 41.112 1.241 25148 2853 1 5 . 1 1 31 31 LEU H H 31 8.863 8.863 8.172 0.691 25148 2854 1 5 . 1 1 32 32 ILE N N 32 122.410 122.410 119.161 3.249 25148 2855 1 5 . 1 1 32 32 ILE HA H 32 3.699 3.699 3.707 -0.008 25148 2856 1 5 . 1 1 32 32 ILE C C 32 178.303 178.303 177.826 0.477 25148 2857 1 5 . 1 1 32 32 ILE CA C 32 66.066 66.066 65.517 0.549 25148 2858 1 5 . 1 1 32 32 ILE CB C 32 37.882 37.882 37.923 -0.041 25148 2859 1 5 . 1 1 32 32 ILE H H 32 8.234 8.234 8.387 -0.153 25148 2860 1 5 . 1 1 33 33 SER N N 33 114.201 114.201 115.479 -1.278 25148 2861 1 5 . 1 1 33 33 SER HA H 33 4.311 4.311 4.188 0.123 25148 2862 1 5 . 1 1 33 33 SER C C 33 177.012 177.012 176.632 0.380 25148 2863 1 5 . 1 1 33 33 SER CA C 33 61.860 61.860 61.743 0.117 25148 2864 1 5 . 1 1 33 33 SER CB C 33 62.508 62.508 63.081 -0.573 25148 2865 1 5 . 1 1 33 33 SER H H 33 7.558 7.558 7.914 -0.356 25148 2866 1 5 . 1 1 34 34 ALA N N 34 122.893 122.893 124.659 -1.766 25148 2867 1 5 . 1 1 34 34 ALA HA H 34 4.215 4.215 4.186 0.029 25148 2868 1 5 . 1 1 34 34 ALA C C 34 180.814 180.814 179.000 1.814 25148 2869 1 5 . 1 1 34 34 ALA CA C 34 55.283 55.283 54.775 0.508 25148 2870 1 5 . 1 1 34 34 ALA CB C 34 18.273 18.273 18.412 -0.139 25148 2871 1 5 . 1 1 34 34 ALA H H 34 8.409 8.409 7.887 0.522 25148 2872 1 5 . 1 1 35 35 TYR N N 35 120.259 120.259 118.997 1.262 25148 2873 1 5 . 1 1 35 35 TYR HA H 35 4.393 4.393 4.465 -0.072 25148 2874 1 5 . 1 1 35 35 TYR C C 35 177.892 177.892 177.099 0.793 25148 2875 1 5 . 1 1 35 35 TYR CA C 35 63.071 63.071 60.374 2.697 25148 2876 1 5 . 1 1 35 35 TYR CB C 35 38.021 38.021 39.269 -1.248 25148 2877 1 5 . 1 1 35 35 TYR H H 35 8.975 8.975 8.092 0.883 25148 2878 1 5 . 1 1 36 36 LYS N N 36 120.942 120.942 119.645 1.297 25148 2879 1 5 . 1 1 36 36 LYS HA H 36 4.032 4.032 4.076 -0.044 25148 2880 1 5 . 1 1 36 36 LYS C C 36 177.797 177.797 177.948 -0.151 25148 2881 1 5 . 1 1 36 36 LYS CA C 36 59.900 59.900 58.950 0.950 25148 2882 1 5 . 1 1 36 36 LYS CB C 36 32.429 32.429 32.282 0.147 25148 2883 1 5 . 1 1 36 36 LYS H H 36 8.654 8.654 8.119 0.535 25148 2884 1 5 . 1 1 37 37 ARG N N 37 115.139 115.139 116.204 -1.065 25148 2885 1 5 . 1 1 37 37 ARG HA H 37 4.101 4.101 4.105 -0.004 25148 2886 1 5 . 1 1 37 37 ARG C C 37 177.517 177.517 177.925 -0.408 25148 2887 1 5 . 1 1 37 37 ARG CA C 37 58.276 58.276 58.262 0.014 25148 2888 1 5 . 1 1 37 37 ARG CB C 37 31.014 31.014 30.049 0.965 25148 2889 1 5 . 1 1 37 37 ARG H H 37 8.138 8.138 7.542 0.596 25148 2890 1 5 . 1 1 38 38 ASN N N 38 112.555 112.555 116.450 -3.895 25148 2891 1 5 . 1 1 38 38 ASN HA H 38 4.540 4.540 4.320 0.220 25148 2892 1 5 . 1 1 38 38 ASN C C 38 173.994 173.994 175.374 -1.380 25148 2893 1 5 . 1 1 38 38 ASN CA C 38 54.722 54.722 55.317 -0.595 25148 2894 1 5 . 1 1 38 38 ASN CB C 38 42.077 42.077 39.262 2.815 25148 2895 1 5 . 1 1 38 38 ASN H H 38 7.426 7.426 7.403 0.023 25148 2896 1 5 . 1 1 39 39 PHE N N 39 116.711 116.711 117.690 -0.979 25148 2897 1 5 . 1 1 39 39 PHE HA H 39 4.569 4.569 4.811 -0.242 25148 2898 1 5 . 1 1 39 39 PHE CA C 39 58.913 58.913 55.865 3.047 25148 2899 1 5 . 1 1 39 39 PHE CB C 39 39.781 39.781 38.592 1.189 25148 2900 1 5 . 1 1 39 39 PHE H H 39 7.959 7.959 7.391 0.568 25148 2901 1 5 . 1 1 40 40 ASN HA H 40 4.018 4.018 4.557 -0.539 25148 2902 1 5 . 1 1 40 40 ASN CA C 40 58.944 58.944 55.130 3.814 25148 2903 1 5 . 1 1 41 41 GLN HA H 41 4.298 4.298 4.524 -0.226 25148 2904 1 5 . 1 1 41 41 GLN C C 41 175.237 175.237 175.665 -0.428 25148 2905 1 5 . 1 1 41 41 GLN CA C 41 57.360 57.360 56.393 0.967 25148 2906 1 5 . 1 1 41 41 GLN CB C 41 28.724 28.724 28.058 0.666 25148 2907 1 5 . 1 1 42 42 ALA N N 42 120.514 120.514 121.099 -0.585 25148 2908 1 5 . 1 1 42 42 ALA HA H 42 4.622 4.622 4.454 0.168 25148 2909 1 5 . 1 1 42 42 ALA C C 42 175.922 175.922 176.328 -0.406 25148 2910 1 5 . 1 1 42 42 ALA CA C 42 51.841 51.841 52.206 -0.365 25148 2911 1 5 . 1 1 42 42 ALA CB C 42 21.576 21.576 20.386 1.190 25148 2912 1 5 . 1 1 42 42 ALA H H 42 7.817 7.817 8.073 -0.256 25148 2913 1 5 . 1 1 43 43 GLN N N 43 117.594 117.594 116.293 1.301 25148 2914 1 5 . 1 1 43 43 GLN HA H 43 4.265 4.265 4.392 -0.127 25148 2915 1 5 . 1 1 43 43 GLN C C 43 174.942 174.942 173.865 1.077 25148 2916 1 5 . 1 1 43 43 GLN CA C 43 57.047 57.047 55.298 1.749 25148 2917 1 5 . 1 1 43 43 GLN CB C 43 30.863 30.863 31.153 -0.290 25148 2918 1 5 . 1 1 43 43 GLN H H 43 7.400 7.400 7.497 -0.097 25148 2919 1 5 . 1 1 44 44 ASN N N 44 120.467 120.467 121.642 -1.175 25148 2920 1 5 . 1 1 44 44 ASN HA H 44 5.005 5.005 4.688 0.317 25148 2921 1 5 . 1 1 44 44 ASN C C 44 174.365 174.365 174.002 0.363 25148 2922 1 5 . 1 1 44 44 ASN CA C 44 52.381 52.381 52.913 -0.532 25148 2923 1 5 . 1 1 44 44 ASN CB C 44 38.177 38.177 38.989 -0.812 25148 2924 1 5 . 1 1 44 44 ASN H H 44 9.123 9.123 8.628 0.495 25148 2925 1 5 . 1 1 45 45 VAL N N 45 115.479 115.479 116.996 -1.517 25148 2926 1 5 . 1 1 45 45 VAL HA H 45 5.376 5.376 4.231 1.145 25148 2927 1 5 . 1 1 45 45 VAL C C 45 174.908 174.908 173.808 1.100 25148 2928 1 5 . 1 1 45 45 VAL CA C 45 59.022 59.022 61.682 -2.660 25148 2929 1 5 . 1 1 45 45 VAL CB C 45 35.776 35.776 35.021 0.755 25148 2930 1 5 . 1 1 45 45 VAL H H 45 7.732 7.732 8.105 -0.373 25148 2931 1 5 . 1 1 46 46 ARG N N 46 121.146 121.146 124.956 -3.810 25148 2932 1 5 . 1 1 46 46 ARG HA H 46 4.566 4.566 4.810 -0.244 25148 2933 1 5 . 1 1 46 46 ARG C C 46 173.790 173.790 174.548 -0.758 25148 2934 1 5 . 1 1 46 46 ARG CA C 46 54.762 54.762 53.708 1.054 25148 2935 1 5 . 1 1 46 46 ARG CB C 46 33.946 33.946 32.029 1.917 25148 2936 1 5 . 1 1 46 46 ARG H H 46 8.850 8.850 9.012 -0.162 25148 2937 1 5 . 1 1 47 47 VAL N N 47 122.339 122.339 124.812 -2.473 25148 2938 1 5 . 1 1 47 47 VAL HA H 47 4.741 4.741 4.449 0.292 25148 2939 1 5 . 1 1 47 47 VAL C C 47 173.541 173.541 175.615 -2.074 25148 2940 1 5 . 1 1 47 47 VAL CA C 47 60.893 60.893 61.597 -0.704 25148 2941 1 5 . 1 1 47 47 VAL CB C 47 33.563 33.563 32.831 0.732 25148 2942 1 5 . 1 1 47 47 VAL H H 47 8.444 8.444 8.522 -0.078 25148 2943 1 5 . 1 1 48 48 ASP N N 48 127.701 127.701 125.973 1.728 25148 2944 1 5 . 1 1 48 48 ASP HA H 48 4.946 4.946 4.909 0.037 25148 2945 1 5 . 1 1 48 48 ASP C C 48 173.744 173.744 174.291 -0.547 25148 2946 1 5 . 1 1 48 48 ASP CA C 48 52.651 52.651 52.856 -0.205 25148 2947 1 5 . 1 1 48 48 ASP CB C 48 45.225 45.225 43.947 1.278 25148 2948 1 5 . 1 1 48 48 ASP H H 48 9.068 9.068 8.498 0.570 25148 2949 1 5 . 1 1 49 49 LEU N N 49 130.945 130.945 126.391 4.554 25148 2950 1 5 . 1 1 49 49 LEU HA H 49 4.774 4.774 4.593 0.181 25148 2951 1 5 . 1 1 49 49 LEU C C 49 174.531 174.531 175.668 -1.137 25148 2952 1 5 . 1 1 49 49 LEU CA C 49 54.337 54.337 54.349 -0.012 25148 2953 1 5 . 1 1 49 49 LEU CB C 49 43.192 43.192 44.225 -1.033 25148 2954 1 5 . 1 1 49 49 LEU H H 49 9.369 9.369 8.778 0.591 25148 2955 1 5 . 1 1 50 50 ASN N N 50 126.268 126.268 124.526 1.742 25148 2956 1 5 . 1 1 50 50 ASN HA H 50 4.629 4.629 5.044 -0.415 25148 2957 1 5 . 1 1 50 50 ASN C C 50 176.602 176.602 175.316 1.286 25148 2958 1 5 . 1 1 50 50 ASN CA C 50 54.048 54.048 52.380 1.668 25148 2959 1 5 . 1 1 50 50 ASN CB C 50 39.891 39.891 39.006 0.885 25148 2960 1 5 . 1 1 50 50 ASN H H 50 8.672 8.672 9.051 -0.379 25148 2961 1 5 . 1 1 51 51 ARG N N 51 125.897 125.897 124.654 1.243 25148 2962 1 5 . 1 1 51 51 ARG HA H 51 3.789 3.789 4.113 -0.324 25148 2963 1 5 . 1 1 51 51 ARG C C 51 175.681 175.681 176.219 -0.538 25148 2964 1 5 . 1 1 51 51 ARG CA C 51 58.162 58.162 58.583 -0.421 25148 2965 1 5 . 1 1 51 51 ARG CB C 51 29.944 29.944 29.863 0.081 25148 2966 1 5 . 1 1 51 51 ARG H H 51 8.984 8.984 8.658 0.326 25148 2967 1 5 . 1 1 52 52 GLU N N 52 116.733 116.733 118.510 -1.777 25148 2968 1 5 . 1 1 52 52 GLU HA H 52 4.368 4.368 4.194 0.174 25148 2969 1 5 . 1 1 52 52 GLU C C 52 178.049 178.049 177.571 0.478 25148 2970 1 5 . 1 1 52 52 GLU CA C 52 58.048 58.048 58.183 -0.135 25148 2971 1 5 . 1 1 52 52 GLU CB C 52 30.716 30.716 29.305 1.411 25148 2972 1 5 . 1 1 52 52 GLU H H 52 8.541 8.541 8.492 0.049 25148 2973 1 5 . 1 1 53 53 THR N N 53 106.556 106.556 108.105 -1.549 25148 2974 1 5 . 1 1 53 53 THR HA H 53 4.424 4.424 4.566 -0.142 25148 2975 1 5 . 1 1 53 53 THR C C 53 176.352 176.352 175.281 1.071 25148 2976 1 5 . 1 1 53 53 THR CA C 53 61.320 61.320 61.337 -0.017 25148 2977 1 5 . 1 1 53 53 THR CB C 53 71.220 71.220 70.155 1.065 25148 2978 1 5 . 1 1 53 53 THR H H 53 8.085 8.085 7.557 0.528 25148 2979 1 5 . 1 1 54 54 GLY N N 54 111.843 111.843 111.163 0.680 25148 2980 1 5 . 1 1 54 54 GLY C C 54 172.690 172.690 174.335 -1.645 25148 2981 1 5 . 1 1 54 54 GLY CA C 54 45.417 45.417 46.239 -0.822 25148 2982 1 5 . 1 1 54 54 GLY H H 54 8.330 8.330 7.863 0.467 25148 2983 1 5 . 1 1 55 55 SER N N 55 113.844 113.844 114.204 -0.360 25148 2984 1 5 . 1 1 55 55 SER HA H 55 4.279 4.279 4.682 -0.403 25148 2985 1 5 . 1 1 55 55 SER C C 55 174.127 174.127 173.064 1.063 25148 2986 1 5 . 1 1 55 55 SER CA C 55 59.229 59.229 57.814 1.415 25148 2987 1 5 . 1 1 55 55 SER CB C 55 63.939 63.939 65.812 -1.873 25148 2988 1 5 . 1 1 55 55 SER H H 55 7.653 7.653 7.546 0.107 25148 2989 1 5 . 1 1 56 56 ILE N N 56 125.286 125.286 120.673 4.613 25148 2990 1 5 . 1 1 56 56 ILE HA H 56 5.082 5.082 4.707 0.374 25148 2991 1 5 . 1 1 56 56 ILE C C 56 175.346 175.346 174.431 0.915 25148 2992 1 5 . 1 1 56 56 ILE CA C 56 59.967 59.967 60.441 -0.475 25148 2993 1 5 . 1 1 56 56 ILE CB C 56 40.165 40.165 42.122 -1.957 25148 2994 1 5 . 1 1 56 56 ILE H H 56 8.478 8.478 8.407 0.071 25148 2995 1 5 . 1 1 57 57 ARG N N 57 126.332 126.332 127.979 -1.647 25148 2996 1 5 . 1 1 57 57 ARG HA H 57 4.740 4.740 4.634 0.106 25148 2997 1 5 . 1 1 57 57 ARG C C 57 173.921 173.921 173.694 0.227 25148 2998 1 5 . 1 1 57 57 ARG CA C 57 54.311 54.311 53.843 0.468 25148 2999 1 5 . 1 1 57 57 ARG CB C 57 35.805 35.805 33.256 2.549 25148 3000 1 5 . 1 1 57 57 ARG H H 57 8.590 8.590 8.517 0.073 25148 3001 1 5 . 1 1 58 58 VAL N N 58 120.987 120.987 123.117 -2.130 25148 3002 1 5 . 1 1 58 58 VAL HA H 58 4.334 4.334 4.028 0.306 25148 3003 1 5 . 1 1 58 58 VAL C C 58 174.204 174.204 174.045 0.159 25148 3004 1 5 . 1 1 58 58 VAL CA C 58 60.861 60.861 61.402 -0.541 25148 3005 1 5 . 1 1 58 58 VAL CB C 58 33.383 33.383 32.289 1.094 25148 3006 1 5 . 1 1 58 58 VAL H H 58 8.585 8.585 8.220 0.365 25148 3007 1 5 . 1 1 59 59 PHE N N 59 124.913 124.913 126.383 -1.470 25148 3008 1 5 . 1 1 59 59 PHE HA H 59 5.046 5.046 5.393 -0.347 25148 3009 1 5 . 1 1 59 59 PHE C C 59 174.446 174.446 174.369 0.077 25148 3010 1 5 . 1 1 59 59 PHE CA C 59 56.695 56.695 55.117 1.578 25148 3011 1 5 . 1 1 59 59 PHE CB C 59 42.779 42.779 43.227 -0.448 25148 3012 1 5 . 1 1 59 59 PHE H H 59 8.920 8.920 8.595 0.325 25148 3013 1 5 . 1 1 60 60 ALA N N 60 124.035 124.035 123.522 0.513 25148 3014 1 5 . 1 1 60 60 ALA HA H 60 5.102 5.102 4.785 0.317 25148 3015 1 5 . 1 1 60 60 ALA C C 60 176.017 176.017 176.430 -0.413 25148 3016 1 5 . 1 1 60 60 ALA CA C 60 50.083 50.083 50.598 -0.515 25148 3017 1 5 . 1 1 60 60 ALA CB C 60 22.400 22.400 20.402 1.998 25148 3018 1 5 . 1 1 60 60 ALA H H 60 9.457 9.457 8.718 0.739 25148 3019 1 5 . 1 1 61 61 ARG N N 61 121.530 121.530 125.857 -4.327 25148 3020 1 5 . 1 1 61 61 ARG HA H 61 4.958 4.958 4.852 0.106 25148 3021 1 5 . 1 1 61 61 ARG C C 61 176.737 176.737 175.686 1.051 25148 3022 1 5 . 1 1 61 61 ARG CA C 61 55.375 55.375 55.922 -0.547 25148 3023 1 5 . 1 1 61 61 ARG CB C 61 31.230 31.230 30.772 0.458 25148 3024 1 5 . 1 1 61 61 ARG H H 61 8.447 8.447 8.737 -0.290 25148 3025 1 5 . 1 1 62 62 LYS N N 62 124.784 124.784 126.489 -1.705 25148 3026 1 5 . 1 1 62 62 LYS HA H 62 4.709 4.709 4.454 0.255 25148 3027 1 5 . 1 1 62 62 LYS C C 62 173.899 173.899 174.868 -0.969 25148 3028 1 5 . 1 1 62 62 LYS CA C 62 54.812 54.812 55.028 -0.216 25148 3029 1 5 . 1 1 62 62 LYS CB C 62 37.147 37.147 35.112 2.035 25148 3030 1 5 . 1 1 62 62 LYS H H 62 9.137 9.137 8.470 0.667 25148 3031 1 5 . 1 1 63 63 ASP N N 63 122.552 122.552 124.572 -2.020 25148 3032 1 5 . 1 1 63 63 ASP HA H 63 4.877 4.877 4.674 0.203 25148 3033 1 5 . 1 1 63 63 ASP C C 63 175.560 175.560 176.365 -0.805 25148 3034 1 5 . 1 1 63 63 ASP CA C 63 54.576 54.576 54.681 -0.105 25148 3035 1 5 . 1 1 63 63 ASP CB C 63 42.841 42.841 41.314 1.527 25148 3036 1 5 . 1 1 63 63 ASP H H 63 8.334 8.334 8.648 -0.314 25148 3037 1 5 . 1 1 64 64 VAL N N 64 123.109 123.109 127.230 -4.121 25148 3038 1 5 . 1 1 64 64 VAL HA H 64 4.557 4.557 4.509 0.048 25148 3039 1 5 . 1 1 64 64 VAL C C 64 177.260 177.260 175.612 1.648 25148 3040 1 5 . 1 1 64 64 VAL CA C 64 62.268 62.268 63.544 -1.276 25148 3041 1 5 . 1 1 64 64 VAL CB C 64 30.348 30.348 31.345 -0.997 25148 3042 1 5 . 1 1 64 64 VAL H H 64 8.693 8.693 8.188 0.505 25148 3043 1 5 . 1 1 65 65 VAL N N 65 122.320 122.320 124.191 -1.871 25148 3044 1 5 . 1 1 65 65 VAL HA H 65 4.939 4.939 4.669 0.270 25148 3045 1 5 . 1 1 65 65 VAL C C 65 174.754 174.754 174.991 -0.237 25148 3046 1 5 . 1 1 65 65 VAL CA C 65 59.173 59.173 59.941 -0.768 25148 3047 1 5 . 1 1 65 65 VAL CB C 65 36.289 36.289 35.508 0.781 25148 3048 1 5 . 1 1 65 65 VAL H H 65 8.656 8.656 8.550 0.106 25148 3049 1 5 . 1 1 66 66 ASP N N 66 119.805 119.805 120.957 -1.152 25148 3050 1 5 . 1 1 66 66 ASP HA H 66 4.499 4.499 4.443 0.056 25148 3051 1 5 . 1 1 66 66 ASP C C 66 176.565 176.565 176.049 0.516 25148 3052 1 5 . 1 1 66 66 ASP CA C 66 57.236 57.236 56.515 0.721 25148 3053 1 5 . 1 1 66 66 ASP CB C 66 41.662 41.662 41.231 0.430 25148 3054 1 5 . 1 1 66 66 ASP H H 66 8.628 8.628 8.750 -0.122 25148 3055 1 5 . 1 1 67 67 GLU N N 67 117.604 117.604 118.044 -0.440 25148 3056 1 5 . 1 1 67 67 GLU HA H 67 4.350 4.350 4.448 -0.098 25148 3057 1 5 . 1 1 67 67 GLU C C 67 173.736 173.736 175.322 -1.586 25148 3058 1 5 . 1 1 67 67 GLU CA C 67 55.203 55.203 54.664 0.539 25148 3059 1 5 . 1 1 67 67 GLU CB C 67 32.240 32.240 32.245 -0.004 25148 3060 1 5 . 1 1 67 67 GLU H H 67 7.525 7.525 8.019 -0.494 25148 3061 1 5 . 1 1 68 68 VAL N N 68 125.774 125.774 122.873 2.901 25148 3062 1 5 . 1 1 68 68 VAL HA H 68 3.578 3.578 3.868 -0.290 25148 3063 1 5 . 1 1 68 68 VAL C C 68 175.885 175.885 175.477 0.408 25148 3064 1 5 . 1 1 68 68 VAL CA C 68 63.397 63.397 64.188 -0.791 25148 3065 1 5 . 1 1 68 68 VAL CB C 68 32.452 32.452 31.386 1.066 25148 3066 1 5 . 1 1 68 68 VAL H H 68 8.573 8.573 8.453 0.120 25148 3067 1 5 . 1 1 69 69 TYR N N 69 129.859 129.859 126.422 3.437 25148 3068 1 5 . 1 1 69 69 TYR HA H 69 4.642 4.642 4.630 0.012 25148 3069 1 5 . 1 1 69 69 TYR C C 69 176.100 176.100 175.509 0.591 25148 3070 1 5 . 1 1 69 69 TYR CA C 69 59.092 59.092 59.065 0.027 25148 3071 1 5 . 1 1 69 69 TYR CB C 69 39.830 39.830 40.574 -0.744 25148 3072 1 5 . 1 1 69 69 TYR H H 69 9.801 9.801 8.971 0.830 25148 3073 1 5 . 1 1 70 70 ASP N N 70 120.204 120.204 120.726 -0.522 25148 3074 1 5 . 1 1 70 70 ASP HA H 70 4.772 4.772 4.950 -0.178 25148 3075 1 5 . 1 1 70 70 ASP C C 70 176.622 176.622 175.943 0.679 25148 3076 1 5 . 1 1 70 70 ASP CA C 70 52.885 52.885 53.688 -0.803 25148 3077 1 5 . 1 1 70 70 ASP CB C 70 41.878 41.878 41.055 0.823 25148 3078 1 5 . 1 1 70 70 ASP H H 70 8.348 8.348 8.151 0.197 25148 3079 1 5 . 1 1 71 71 GLN N N 71 125.440 125.440 124.149 1.291 25148 3080 1 5 . 1 1 71 71 GLN HA H 71 4.315 4.315 3.985 0.330 25148 3081 1 5 . 1 1 71 71 GLN C C 71 175.819 175.819 176.593 -0.774 25148 3082 1 5 . 1 1 71 71 GLN CA C 71 57.914 57.914 58.714 -0.800 25148 3083 1 5 . 1 1 71 71 GLN CB C 71 28.307 28.307 28.802 -0.495 25148 3084 1 5 . 1 1 71 71 GLN H H 71 9.097 9.097 8.707 0.390 25148 3085 1 5 . 1 1 72 72 ARG N N 72 116.306 116.306 115.449 0.857 25148 3086 1 5 . 1 1 72 72 ARG HA H 72 4.252 4.252 4.143 0.109 25148 3087 1 5 . 1 1 72 72 ARG C C 72 178.087 178.087 175.973 2.114 25148 3088 1 5 . 1 1 72 72 ARG CA C 72 58.532 58.532 57.122 1.410 25148 3089 1 5 . 1 1 72 72 ARG CB C 72 30.143 30.143 30.793 -0.650 25148 3090 1 5 . 1 1 72 72 ARG H H 72 8.534 8.534 8.193 0.341 25148 3091 1 5 . 1 1 73 73 LEU N N 73 116.734 116.734 114.501 2.233 25148 3092 1 5 . 1 1 73 73 LEU HA H 73 4.621 4.621 4.647 -0.026 25148 3093 1 5 . 1 1 73 73 LEU C C 73 175.946 175.946 174.989 0.957 25148 3094 1 5 . 1 1 73 73 LEU CA C 73 55.250 55.250 55.259 -0.009 25148 3095 1 5 . 1 1 73 73 LEU CB C 73 46.960 46.960 44.351 2.609 25148 3096 1 5 . 1 1 73 73 LEU H H 73 7.460 7.460 7.440 0.020 25148 3097 1 5 . 1 1 74 74 GLU N N 74 118.787 118.787 122.054 -3.267 25148 3098 1 5 . 1 1 74 74 GLU HA H 74 5.403 5.403 4.663 0.740 25148 3099 1 5 . 1 1 74 74 GLU C C 74 173.709 173.709 174.025 -0.316 25148 3100 1 5 . 1 1 74 74 GLU CA C 74 54.914 54.914 56.161 -1.247 25148 3101 1 5 . 1 1 74 74 GLU CB C 74 35.053 35.053 33.593 1.460 25148 3102 1 5 . 1 1 74 74 GLU H H 74 7.752 7.752 7.977 -0.225 25148 3103 1 5 . 1 1 75 75 ILE N N 75 119.803 119.803 121.366 -1.563 25148 3104 1 5 . 1 1 75 75 ILE HA H 75 4.507 4.507 4.619 -0.112 25148 3105 1 5 . 1 1 75 75 ILE C C 75 172.126 172.126 173.527 -1.401 25148 3106 1 5 . 1 1 75 75 ILE CA C 75 58.664 58.664 59.658 -0.994 25148 3107 1 5 . 1 1 75 75 ILE CB C 75 42.560 42.560 41.794 0.766 25148 3108 1 5 . 1 1 75 75 ILE H H 75 8.975 8.975 8.626 0.349 25148 3109 1 5 . 1 1 76 76 SER N N 76 123.236 123.236 124.239 -1.003 25148 3110 1 5 . 1 1 76 76 SER HA H 76 4.505 4.505 4.902 -0.397 25148 3111 1 5 . 1 1 76 76 SER C C 76 176.145 176.145 175.805 0.340 25148 3112 1 5 . 1 1 76 76 SER CA C 76 58.108 58.108 57.652 0.456 25148 3113 1 5 . 1 1 76 76 SER CB C 76 65.000 65.000 64.130 0.869 25148 3114 1 5 . 1 1 76 76 SER H H 76 8.810 8.810 8.516 0.294 25148 3115 1 5 . 1 1 77 77 ILE N N 77 120.629 120.629 125.025 -4.396 25148 3116 1 5 . 1 1 77 77 ILE HA H 77 3.935 3.935 3.708 0.227 25148 3117 1 5 . 1 1 77 77 ILE C C 77 175.806 175.806 177.085 -1.279 25148 3118 1 5 . 1 1 77 77 ILE CA C 77 61.928 61.928 63.453 -1.525 25148 3119 1 5 . 1 1 77 77 ILE CB C 77 38.031 38.031 38.089 -0.058 25148 3120 1 5 . 1 1 77 77 ILE H H 77 8.321 8.321 8.427 -0.106 25148 3121 1 5 . 1 1 78 78 GLU N N 78 121.032 121.032 117.869 3.163 25148 3122 1 5 . 1 1 78 78 GLU HA H 78 4.082 4.082 3.979 0.103 25148 3123 1 5 . 1 1 78 78 GLU C C 78 179.829 179.829 178.562 1.267 25148 3124 1 5 . 1 1 78 78 GLU CA C 78 60.180 60.180 59.321 0.859 25148 3125 1 5 . 1 1 78 78 GLU CB C 78 28.988 28.988 29.008 -0.020 25148 3126 1 5 . 1 1 78 78 GLU H H 78 8.222 8.222 8.300 -0.078 25148 3127 1 5 . 1 1 79 79 GLU N N 79 120.710 120.710 120.483 0.227 25148 3128 1 5 . 1 1 79 79 GLU HA H 79 4.012 4.012 4.063 -0.051 25148 3129 1 5 . 1 1 79 79 GLU C C 79 180.339 180.339 178.560 1.779 25148 3130 1 5 . 1 1 79 79 GLU CA C 79 59.332 59.332 58.881 0.451 25148 3131 1 5 . 1 1 79 79 GLU CB C 79 29.317 29.317 29.340 -0.024 25148 3132 1 5 . 1 1 79 79 GLU H H 79 7.908 7.908 7.838 0.070 25148 3133 1 5 . 1 1 80 80 ALA N N 80 122.879 122.879 120.312 2.567 25148 3134 1 5 . 1 1 80 80 ALA HA H 80 3.966 3.966 4.261 -0.295 25148 3135 1 5 . 1 1 80 80 ALA C C 80 179.833 179.833 180.014 -0.181 25148 3136 1 5 . 1 1 80 80 ALA CA C 80 55.881 55.881 54.867 1.014 25148 3137 1 5 . 1 1 80 80 ALA CB C 80 18.870 18.870 18.418 0.452 25148 3138 1 5 . 1 1 80 80 ALA H H 80 9.132 9.132 8.017 1.115 25148 3139 1 5 . 1 1 81 81 GLN N N 81 115.829 115.829 116.925 -1.096 25148 3140 1 5 . 1 1 81 81 GLN HA H 81 4.749 4.749 4.383 0.366 25148 3141 1 5 . 1 1 81 81 GLN C C 81 178.126 178.126 177.743 0.383 25148 3142 1 5 . 1 1 81 81 GLN CA C 81 57.682 57.682 57.907 -0.225 25148 3143 1 5 . 1 1 81 81 GLN CB C 81 27.307 27.307 28.715 -1.409 25148 3144 1 5 . 1 1 81 81 GLN H H 81 8.709 8.709 7.786 0.923 25148 3145 1 5 . 1 1 82 82 GLY N N 82 105.531 105.531 106.727 -1.196 25148 3146 1 5 . 1 1 82 82 GLY C C 82 174.917 174.917 174.928 -0.011 25148 3147 1 5 . 1 1 82 82 GLY CA C 82 45.915 45.915 46.413 -0.498 25148 3148 1 5 . 1 1 82 82 GLY H H 82 7.479 7.479 7.738 -0.259 25148 3149 1 5 . 1 1 83 83 ILE N N 83 122.828 122.828 114.139 8.689 25148 3150 1 5 . 1 1 83 83 ILE HA H 83 3.970 3.970 4.384 -0.414 25148 3151 1 5 . 1 1 83 83 ILE C C 83 177.209 177.209 175.705 1.504 25148 3152 1 5 . 1 1 83 83 ILE CA C 83 64.305 64.305 61.378 2.927 25148 3153 1 5 . 1 1 83 83 ILE CB C 83 38.452 38.452 40.265 -1.813 25148 3154 1 5 . 1 1 83 83 ILE H H 83 7.634 7.634 7.356 0.278 25148 3155 1 5 . 1 1 84 84 HIS N N 84 118.927 118.927 120.024 -1.097 25148 3156 1 5 . 1 1 84 84 HIS HA H 84 4.713 4.713 4.900 -0.187 25148 3157 1 5 . 1 1 84 84 HIS CA C 84 55.487 55.487 54.633 0.854 25148 3158 1 5 . 1 1 84 84 HIS CB C 84 33.506 33.506 32.122 1.384 25148 3159 1 5 . 1 1 84 84 HIS H H 84 8.155 8.155 8.233 -0.078 25148 3160 1 5 . 1 1 85 85 PRO HA H 85 4.456 4.456 4.639 -0.183 25148 3161 1 5 . 1 1 85 85 PRO C C 85 177.357 177.357 177.275 0.082 25148 3162 1 5 . 1 1 85 85 PRO CA C 85 64.475 64.475 64.105 0.370 25148 3163 1 5 . 1 1 85 85 PRO CB C 85 32.489 32.489 32.133 0.356 25148 3164 1 5 . 1 1 86 86 GLU N N 86 116.314 116.314 117.675 -1.361 25148 3165 1 5 . 1 1 86 86 GLU HA H 86 4.286 4.286 4.111 0.175 25148 3166 1 5 . 1 1 86 86 GLU C C 86 177.624 177.624 177.382 0.242 25148 3167 1 5 . 1 1 86 86 GLU CA C 86 56.619 56.619 57.315 -0.696 25148 3168 1 5 . 1 1 86 86 GLU CB C 86 29.389 29.389 29.688 -0.299 25148 3169 1 5 . 1 1 86 86 GLU H H 86 8.938 8.938 7.729 1.209 25148 3170 1 5 . 1 1 87 87 TYR N N 87 119.773 119.773 119.952 -0.179 25148 3171 1 5 . 1 1 87 87 TYR HA H 87 4.744 4.744 4.211 0.533 25148 3172 1 5 . 1 1 87 87 TYR C C 87 174.533 174.533 176.090 -1.557 25148 3173 1 5 . 1 1 87 87 TYR CA C 87 59.117 59.117 59.666 -0.549 25148 3174 1 5 . 1 1 87 87 TYR CB C 87 38.859 38.859 38.717 0.142 25148 3175 1 5 . 1 1 87 87 TYR H H 87 7.447 7.447 7.349 0.098 25148 3176 1 5 . 1 1 88 88 MET N N 88 118.298 118.298 117.143 1.155 25148 3177 1 5 . 1 1 88 88 MET HA H 88 4.770 4.770 4.672 0.098 25148 3178 1 5 . 1 1 88 88 MET C C 88 175.638 175.638 173.878 1.760 25148 3179 1 5 . 1 1 88 88 MET CA C 88 53.133 53.133 54.512 -1.379 25148 3180 1 5 . 1 1 88 88 MET CB C 88 37.102 37.102 35.588 1.514 25148 3181 1 5 . 1 1 88 88 MET H H 88 9.023 9.023 8.327 0.696 25148 3182 1 5 . 1 1 89 89 VAL N N 89 120.157 120.157 123.967 -3.810 25148 3183 1 5 . 1 1 89 89 VAL HA H 89 3.330 3.330 3.783 -0.453 25148 3184 1 5 . 1 1 89 89 VAL C C 89 177.432 177.432 177.310 0.122 25148 3185 1 5 . 1 1 89 89 VAL CA C 89 65.675 65.675 63.422 2.253 25148 3186 1 5 . 1 1 89 89 VAL CB C 89 31.321 31.321 30.163 1.157 25148 3187 1 5 . 1 1 89 89 VAL H H 89 8.313 8.313 8.598 -0.285 25148 3188 1 5 . 1 1 90 90 GLY N N 90 116.935 116.935 116.343 0.592 25148 3189 1 5 . 1 1 90 90 GLY C C 90 175.196 175.196 174.324 0.872 25148 3190 1 5 . 1 1 90 90 GLY CA C 90 44.685 44.685 44.838 -0.153 25148 3191 1 5 . 1 1 90 90 GLY H H 90 8.551 8.551 9.036 -0.485 25148 3192 1 5 . 1 1 91 91 ASP N N 91 121.616 121.616 121.918 -0.302 25148 3193 1 5 . 1 1 91 91 ASP HA H 91 4.790 4.790 4.893 -0.103 25148 3194 1 5 . 1 1 91 91 ASP C C 91 174.431 174.431 175.150 -0.719 25148 3195 1 5 . 1 1 91 91 ASP CA C 91 55.011 55.011 54.560 0.451 25148 3196 1 5 . 1 1 91 91 ASP CB C 91 42.079 42.079 42.541 -0.462 25148 3197 1 5 . 1 1 91 91 ASP H H 91 8.073 8.073 8.139 -0.066 25148 3198 1 5 . 1 1 92 92 VAL N N 92 118.919 118.919 114.109 4.810 25148 3199 1 5 . 1 1 92 92 VAL HA H 92 4.709 4.709 5.073 -0.364 25148 3200 1 5 . 1 1 92 92 VAL C C 92 175.602 175.602 174.307 1.295 25148 3201 1 5 . 1 1 92 92 VAL CA C 92 61.527 61.527 59.871 1.656 25148 3202 1 5 . 1 1 92 92 VAL CB C 92 34.110 34.110 35.644 -1.534 25148 3203 1 5 . 1 1 92 92 VAL H H 92 8.216 8.216 8.100 0.116 25148 3204 1 5 . 1 1 93 93 VAL N N 93 123.922 123.922 123.005 0.917 25148 3205 1 5 . 1 1 93 93 VAL HA H 93 4.231 4.231 4.259 -0.028 25148 3206 1 5 . 1 1 93 93 VAL C C 93 174.105 174.105 174.101 0.004 25148 3207 1 5 . 1 1 93 93 VAL CA C 93 59.644 59.644 59.229 0.415 25148 3208 1 5 . 1 1 93 93 VAL CB C 93 34.661 34.661 34.532 0.129 25148 3209 1 5 . 1 1 93 93 VAL H H 93 8.812 8.812 8.078 0.734 25148 3210 1 5 . 1 1 94 94 GLU N N 94 123.605 123.605 127.769 -4.164 25148 3211 1 5 . 1 1 94 94 GLU HA H 94 5.347 5.347 5.181 0.166 25148 3212 1 5 . 1 1 94 94 GLU C C 94 175.708 175.708 175.447 0.261 25148 3213 1 5 . 1 1 94 94 GLU CA C 94 54.979 54.979 54.979 0.000 25148 3214 1 5 . 1 1 94 94 GLU CB C 94 31.612 31.612 32.103 -0.491 25148 3215 1 5 . 1 1 94 94 GLU H H 94 8.312 8.312 8.369 -0.057 25148 3216 1 5 . 1 1 95 95 ILE N N 95 123.581 123.581 123.616 -0.035 25148 3217 1 5 . 1 1 95 95 ILE HA H 95 4.601 4.601 4.483 0.118 25148 3218 1 5 . 1 1 95 95 ILE C C 95 175.081 175.081 175.167 -0.086 25148 3219 1 5 . 1 1 95 95 ILE CA C 95 58.601 58.601 59.593 -0.992 25148 3220 1 5 . 1 1 95 95 ILE CB C 95 41.727 41.727 42.184 -0.457 25148 3221 1 5 . 1 1 95 95 ILE H H 95 9.045 9.045 8.195 0.850 25148 3222 1 5 . 1 1 96 96 GLU N N 96 128.094 128.094 128.019 0.075 25148 3223 1 5 . 1 1 96 96 GLU HA H 96 4.098 4.098 4.344 -0.246 25148 3224 1 5 . 1 1 96 96 GLU C C 96 176.845 176.845 175.721 1.124 25148 3225 1 5 . 1 1 96 96 GLU CA C 96 57.853 57.853 58.083 -0.230 25148 3226 1 5 . 1 1 96 96 GLU CB C 96 28.323 28.323 29.142 -0.819 25148 3227 1 5 . 1 1 96 96 GLU H H 96 9.256 9.256 8.942 0.314 25148 3228 1 5 . 1 1 97 97 VAL N N 97 118.446 118.446 123.786 -5.340 25148 3229 1 5 . 1 1 97 97 VAL HA H 97 4.568 4.568 4.209 0.359 25148 3230 1 5 . 1 1 97 97 VAL C C 97 175.051 175.051 174.912 0.139 25148 3231 1 5 . 1 1 97 97 VAL CA C 97 59.796 59.796 61.301 -1.505 25148 3232 1 5 . 1 1 97 97 VAL CB C 97 32.399 32.399 32.949 -0.550 25148 3233 1 5 . 1 1 97 97 VAL H H 97 8.609 8.609 8.955 -0.346 25148 3234 1 5 . 1 1 98 98 THR N N 98 119.118 119.118 118.278 0.840 25148 3235 1 5 . 1 1 98 98 THR HA H 98 3.320 3.320 4.021 -0.701 25148 3236 1 5 . 1 1 98 98 THR CA C 98 61.628 61.628 59.202 2.426 25148 3237 1 5 . 1 1 98 98 THR CB C 98 70.031 70.031 69.311 0.720 25148 3238 1 5 . 1 1 98 98 THR H H 98 7.396 7.396 7.537 -0.141 25148 3239 1 5 . 1 1 99 99 PRO HA H 99 4.458 4.458 4.627 -0.169 25148 3240 1 5 . 1 1 99 99 PRO CA C 99 62.348 62.348 62.412 -0.064 25148 3241 1 5 . 1 1 99 99 PRO CB C 99 33.182 33.182 32.596 0.586 25148 3242 1 5 . 1 1 100 100 LYS HA H 100 4.126 4.126 4.215 -0.089 25148 3243 1 5 . 1 1 100 100 LYS CA C 100 58.773 58.773 57.837 0.936 25148 3244 1 5 . 1 1 100 100 LYS CB C 100 32.195 32.195 32.151 0.044 25148 3245 1 5 . 1 1 101 101 ASP HA H 101 4.924 4.924 4.797 0.127 25148 3246 1 5 . 1 1 101 101 ASP C C 101 176.884 176.884 176.568 0.316 25148 3247 1 5 . 1 1 101 101 ASP CA C 101 54.134 54.134 54.014 0.120 25148 3248 1 5 . 1 1 101 101 ASP CB C 101 40.272 40.272 40.648 -0.376 25148 3249 1 5 . 1 1 102 102 PHE N N 102 118.703 118.703 121.819 -3.116 25148 3250 1 5 . 1 1 102 102 PHE HA H 102 4.295 4.295 4.222 0.073 25148 3251 1 5 . 1 1 102 102 PHE C C 102 176.477 176.477 177.051 -0.574 25148 3252 1 5 . 1 1 102 102 PHE CA C 102 60.748 60.748 60.257 0.491 25148 3253 1 5 . 1 1 102 102 PHE CB C 102 39.667 39.667 39.125 0.542 25148 3254 1 5 . 1 1 102 102 PHE H H 102 7.862 7.862 7.723 0.139 25148 3255 1 5 . 1 1 103 103 GLY CA C 103 47.430 47.430 47.318 0.112 25148 3256 1 5 . 1 1 104 104 ARG N N 104 121.819 121.819 121.800 0.019 25148 3257 1 5 . 1 1 104 104 ARG HA H 104 4.176 4.176 4.210 -0.034 25148 3258 1 5 . 1 1 104 104 ARG C C 104 178.912 178.912 178.401 0.511 25148 3259 1 5 . 1 1 104 104 ARG CA C 104 59.235 59.235 57.548 1.687 25148 3260 1 5 . 1 1 104 104 ARG CB C 104 30.000 30.000 30.117 -0.117 25148 3261 1 5 . 1 1 104 104 ARG H H 104 7.809 7.809 7.497 0.312 25148 3262 1 5 . 1 1 105 105 ILE N N 105 120.331 120.331 120.438 -0.107 25148 3263 1 5 . 1 1 105 105 ILE HA H 105 3.836 3.836 3.508 0.328 25148 3264 1 5 . 1 1 105 105 ILE C C 105 179.206 179.206 177.365 1.841 25148 3265 1 5 . 1 1 105 105 ILE CA C 105 63.025 63.025 65.233 -2.208 25148 3266 1 5 . 1 1 105 105 ILE CB C 105 38.127 38.127 37.617 0.510 25148 3267 1 5 . 1 1 105 105 ILE H H 105 7.203 7.203 7.467 -0.264 25148 3268 1 5 . 1 1 106 106 ALA N N 106 124.867 124.867 121.007 3.860 25148 3269 1 5 . 1 1 106 106 ALA HA H 106 3.665 3.665 3.568 0.097 25148 3270 1 5 . 1 1 106 106 ALA C C 106 178.590 178.590 178.968 -0.378 25148 3271 1 5 . 1 1 106 106 ALA CA C 106 54.842 54.842 55.019 -0.177 25148 3272 1 5 . 1 1 106 106 ALA CB C 106 18.659 18.659 17.802 0.857 25148 3273 1 5 . 1 1 106 106 ALA H H 106 8.813 8.813 8.257 0.556 25148 3274 1 5 . 1 1 107 107 ALA N N 107 119.597 119.597 120.908 -1.311 25148 3275 1 5 . 1 1 107 107 ALA HA H 107 4.014 4.014 4.013 0.001 25148 3276 1 5 . 1 1 107 107 ALA C C 107 180.214 180.214 179.577 0.637 25148 3277 1 5 . 1 1 107 107 ALA CA C 107 55.454 55.454 54.727 0.727 25148 3278 1 5 . 1 1 107 107 ALA CB C 107 18.260 18.260 18.211 0.049 25148 3279 1 5 . 1 1 107 107 ALA H H 107 8.012 8.012 7.523 0.489 25148 3280 1 5 . 1 1 108 108 GLN N N 108 116.896 116.896 118.749 -1.853 25148 3281 1 5 . 1 1 108 108 GLN HA H 108 4.054 4.054 4.023 0.031 25148 3282 1 5 . 1 1 108 108 GLN C C 108 178.784 178.784 178.497 0.287 25148 3283 1 5 . 1 1 108 108 GLN CA C 108 58.705 58.705 58.956 -0.251 25148 3284 1 5 . 1 1 108 108 GLN CB C 108 28.647 28.647 28.840 -0.193 25148 3285 1 5 . 1 1 108 108 GLN H H 108 7.498 7.498 8.115 -0.617 25148 3286 1 5 . 1 1 109 109 THR N N 109 117.495 117.495 116.276 1.219 25148 3287 1 5 . 1 1 109 109 THR HA H 109 3.917 3.917 4.091 -0.174 25148 3288 1 5 . 1 1 109 109 THR C C 109 175.732 175.732 176.155 -0.423 25148 3289 1 5 . 1 1 109 109 THR CA C 109 66.989 66.989 65.450 1.539 25148 3290 1 5 . 1 1 109 109 THR CB C 109 68.766 68.766 68.883 -0.117 25148 3291 1 5 . 1 1 109 109 THR H H 109 8.203 8.203 8.354 -0.151 25148 3292 1 5 . 1 1 110 110 ALA N N 110 122.308 122.308 124.234 -1.926 25148 3293 1 5 . 1 1 110 110 ALA HA H 110 3.854 3.854 4.049 -0.195 25148 3294 1 5 . 1 1 110 110 ALA C C 110 178.380 178.380 178.812 -0.432 25148 3295 1 5 . 1 1 110 110 ALA CA C 110 55.903 55.903 54.907 0.996 25148 3296 1 5 . 1 1 110 110 ALA CB C 110 18.524 18.524 18.450 0.074 25148 3297 1 5 . 1 1 110 110 ALA H H 110 8.668 8.668 8.184 0.484 25148 3298 1 5 . 1 1 111 111 LYS N N 111 115.552 115.552 118.224 -2.672 25148 3299 1 5 . 1 1 111 111 LYS HA H 111 3.923 3.923 3.989 -0.066 25148 3300 1 5 . 1 1 111 111 LYS C C 111 179.111 179.111 178.535 0.576 25148 3301 1 5 . 1 1 111 111 LYS CA C 111 59.825 59.825 59.009 0.816 25148 3302 1 5 . 1 1 111 111 LYS CB C 111 32.251 32.251 31.793 0.458 25148 3303 1 5 . 1 1 111 111 LYS H H 111 7.642 7.642 8.357 -0.715 25148 3304 1 5 . 1 1 112 112 GLN N N 112 120.178 120.178 119.500 0.678 25148 3305 1 5 . 1 1 112 112 GLN HA H 112 4.060 4.060 4.130 -0.070 25148 3306 1 5 . 1 1 112 112 GLN C C 112 178.355 178.355 178.128 0.227 25148 3307 1 5 . 1 1 112 112 GLN CA C 112 59.240 59.240 58.350 0.890 25148 3308 1 5 . 1 1 112 112 GLN CB C 112 28.250 28.250 27.872 0.378 25148 3309 1 5 . 1 1 112 112 GLN H H 112 7.798 7.798 7.667 0.131 25148 3310 1 5 . 1 1 113 113 VAL N N 113 119.799 119.799 120.086 -0.287 25148 3311 1 5 . 1 1 113 113 VAL HA H 113 3.705 3.705 4.148 -0.443 25148 3312 1 5 . 1 1 113 113 VAL C C 113 178.303 178.303 178.198 0.105 25148 3313 1 5 . 1 1 113 113 VAL CA C 113 66.277 66.277 66.385 -0.108 25148 3314 1 5 . 1 1 113 113 VAL CB C 113 31.954 31.954 32.065 -0.111 25148 3315 1 5 . 1 1 113 113 VAL H H 113 8.105 8.105 7.314 0.791 25148 3316 1 5 . 1 1 114 114 VAL N N 114 118.265 118.265 117.461 0.804 25148 3317 1 5 . 1 1 114 114 VAL HA H 114 3.392 3.392 3.641 -0.249 25148 3318 1 5 . 1 1 114 114 VAL C C 114 177.360 177.360 177.709 -0.349 25148 3319 1 5 . 1 1 114 114 VAL CA C 114 67.832 67.832 66.219 1.613 25148 3320 1 5 . 1 1 114 114 VAL CB C 114 31.801 31.801 30.482 1.319 25148 3321 1 5 . 1 1 114 114 VAL H H 114 8.180 8.180 7.683 0.497 25148 3322 1 5 . 1 1 115 115 THR N N 115 113.460 113.460 115.492 -2.032 25148 3323 1 5 . 1 1 115 115 THR HA H 115 3.856 3.856 3.880 -0.024 25148 3324 1 5 . 1 1 115 115 THR C C 115 176.529 176.529 176.911 -0.382 25148 3325 1 5 . 1 1 115 115 THR CA C 115 66.706 66.706 66.830 -0.124 25148 3326 1 5 . 1 1 115 115 THR CB C 115 69.008 69.008 68.215 0.793 25148 3327 1 5 . 1 1 115 115 THR H H 115 8.143 8.143 7.990 0.153 25148 3328 1 5 . 1 1 116 116 GLN N N 116 120.129 120.129 119.924 0.205 25148 3329 1 5 . 1 1 116 116 GLN HA H 116 4.054 4.054 3.954 0.100 25148 3330 1 5 . 1 1 116 116 GLN C C 116 178.100 178.100 178.178 -0.078 25148 3331 1 5 . 1 1 116 116 GLN CA C 116 58.950 58.950 59.365 -0.415 25148 3332 1 5 . 1 1 116 116 GLN CB C 116 28.244 28.244 28.489 -0.245 25148 3333 1 5 . 1 1 116 116 GLN H H 116 7.936 7.936 7.608 0.328 25148 3334 1 5 . 1 1 117 117 ARG N N 117 117.838 117.838 119.638 -1.800 25148 3335 1 5 . 1 1 117 117 ARG HA H 117 4.174 4.174 4.051 0.123 25148 3336 1 5 . 1 1 117 117 ARG C C 117 179.138 179.138 178.855 0.283 25148 3337 1 5 . 1 1 117 117 ARG CA C 117 57.461 57.461 58.165 -0.704 25148 3338 1 5 . 1 1 117 117 ARG CB C 117 29.548 29.548 29.153 0.395 25148 3339 1 5 . 1 1 117 117 ARG H H 117 8.240 8.240 7.762 0.478 25148 3340 1 5 . 1 1 118 118 VAL N N 118 120.278 120.278 118.624 1.654 25148 3341 1 5 . 1 1 118 118 VAL HA H 118 3.709 3.709 3.665 0.044 25148 3342 1 5 . 1 1 118 118 VAL C C 118 177.597 177.597 177.893 -0.296 25148 3343 1 5 . 1 1 118 118 VAL CA C 118 66.246 66.246 66.922 -0.676 25148 3344 1 5 . 1 1 118 118 VAL CB C 118 31.785 31.785 31.229 0.556 25148 3345 1 5 . 1 1 118 118 VAL H H 118 8.480 8.480 8.272 0.208 25148 3346 1 5 . 1 1 119 119 ARG N N 119 120.197 120.197 119.541 0.656 25148 3347 1 5 . 1 1 119 119 ARG HA H 119 4.173 4.173 4.230 -0.057 25148 3348 1 5 . 1 1 119 119 ARG C C 119 178.864 178.864 178.898 -0.034 25148 3349 1 5 . 1 1 119 119 ARG CA C 119 58.772 58.772 59.279 -0.507 25148 3350 1 5 . 1 1 119 119 ARG CB C 119 29.873 29.873 29.993 -0.120 25148 3351 1 5 . 1 1 119 119 ARG H H 119 7.899 7.899 7.498 0.401 25148 3352 1 5 . 1 1 120 120 GLU N N 120 118.768 118.768 119.374 -0.606 25148 3353 1 5 . 1 1 120 120 GLU HA H 120 4.110 4.110 3.993 0.117 25148 3354 1 5 . 1 1 120 120 GLU C C 120 177.823 177.823 178.887 -1.064 25148 3355 1 5 . 1 1 120 120 GLU CA C 120 58.223 58.223 59.057 -0.834 25148 3356 1 5 . 1 1 120 120 GLU CB C 120 29.854 29.854 28.963 0.891 25148 3357 1 5 . 1 1 120 120 GLU H H 120 8.084 8.084 8.020 0.064 25148 3358 1 5 . 1 1 121 121 ALA N N 121 121.984 121.984 121.848 0.136 25148 3359 1 5 . 1 1 121 121 ALA HA H 121 4.296 4.296 4.005 0.291 25148 3360 1 5 . 1 1 121 121 ALA C C 121 178.586 178.586 180.028 -1.442 25148 3361 1 5 . 1 1 121 121 ALA CA C 121 53.475 53.475 55.252 -1.777 25148 3362 1 5 . 1 1 121 121 ALA CB C 121 18.856 18.856 18.338 0.518 25148 3363 1 5 . 1 1 121 121 ALA H H 121 7.810 7.810 8.462 -0.652 25148 3364 1 5 . 1 1 122 122 GLU N N 122 118.229 118.229 117.160 1.069 25148 3365 1 5 . 1 1 122 122 GLU HA H 122 4.241 4.241 4.327 -0.086 25148 3366 1 5 . 1 1 122 122 GLU C C 122 176.839 176.839 178.496 -1.657 25148 3367 1 5 . 1 1 122 122 GLU CA C 122 57.118 57.118 58.248 -1.130 25148 3368 1 5 . 1 1 122 122 GLU CB C 122 30.018 30.018 29.387 0.631 25148 3369 1 5 . 1 1 122 122 GLU H H 122 7.938 7.938 7.782 0.156 25148 3370 1 5 . 1 1 123 123 ARG N N 123 120.601 120.601 119.309 1.292 25148 3371 1 5 . 1 1 123 123 ARG HA H 123 4.348 4.348 4.267 0.081 25148 3372 1 5 . 1 1 123 123 ARG C C 123 176.071 176.071 176.630 -0.559 25148 3373 1 5 . 1 1 123 123 ARG CA C 123 56.510 56.510 56.715 -0.205 25148 3374 1 5 . 1 1 123 123 ARG CB C 123 30.765 30.765 31.350 -0.585 25148 3375 1 5 . 1 1 123 123 ARG H H 123 7.977 7.977 8.118 -0.141 25148 3376 1 6 . 1 1 4 4 GLU HA H 4 4.138 4.138 3.974 0.164 25148 3377 1 6 . 1 1 4 4 GLU C C 4 179.152 179.152 177.765 1.387 25148 3378 1 6 . 1 1 4 4 GLU CA C 4 59.566 59.566 58.705 0.861 25148 3379 1 6 . 1 1 4 4 GLU CB C 4 29.407 29.407 29.481 -0.074 25148 3380 1 6 . 1 1 5 5 LEU N N 5 121.360 121.360 116.693 4.667 25148 3381 1 6 . 1 1 5 5 LEU HA H 5 4.195 4.195 4.001 0.194 25148 3382 1 6 . 1 1 5 5 LEU C C 5 178.179 178.179 178.225 -0.046 25148 3383 1 6 . 1 1 5 5 LEU CA C 5 57.830 57.830 57.431 0.399 25148 3384 1 6 . 1 1 5 5 LEU CB C 5 41.630 41.630 41.437 0.193 25148 3385 1 6 . 1 1 5 5 LEU H H 5 7.877 7.877 7.811 0.066 25148 3386 1 6 . 1 1 6 6 LEU N N 6 118.058 118.058 119.386 -1.328 25148 3387 1 6 . 1 1 6 6 LEU HA H 6 3.919 3.919 3.945 -0.026 25148 3388 1 6 . 1 1 6 6 LEU C C 6 180.274 180.274 179.086 1.188 25148 3389 1 6 . 1 1 6 6 LEU CA C 6 58.221 58.221 57.617 0.604 25148 3390 1 6 . 1 1 6 6 LEU CB C 6 40.684 40.684 41.114 -0.430 25148 3391 1 6 . 1 1 6 6 LEU H H 6 7.685 7.685 7.530 0.155 25148 3392 1 6 . 1 1 7 7 ASP N N 7 120.662 120.662 118.011 2.651 25148 3393 1 6 . 1 1 7 7 ASP HA H 7 4.416 4.416 4.395 0.021 25148 3394 1 6 . 1 1 7 7 ASP C C 7 178.738 178.738 177.912 0.826 25148 3395 1 6 . 1 1 7 7 ASP CA C 7 57.519 57.519 56.434 1.085 25148 3396 1 6 . 1 1 7 7 ASP CB C 7 40.167 40.167 40.579 -0.412 25148 3397 1 6 . 1 1 7 7 ASP H H 7 8.427 8.427 7.607 0.820 25148 3398 1 6 . 1 1 8 8 ALA N N 8 122.612 122.612 123.227 -0.615 25148 3399 1 6 . 1 1 8 8 ALA HA H 8 4.146 4.146 3.981 0.165 25148 3400 1 6 . 1 1 8 8 ALA C C 8 180.787 180.787 179.502 1.285 25148 3401 1 6 . 1 1 8 8 ALA CA C 8 55.165 55.165 55.224 -0.059 25148 3402 1 6 . 1 1 8 8 ALA CB C 8 17.711 17.711 18.575 -0.864 25148 3403 1 6 . 1 1 8 8 ALA H H 8 7.847 7.847 7.944 -0.097 25148 3404 1 6 . 1 1 9 9 LEU N N 9 116.977 116.977 117.769 -0.792 25148 3405 1 6 . 1 1 9 9 LEU HA H 9 4.115 4.115 3.865 0.250 25148 3406 1 6 . 1 1 9 9 LEU C C 9 179.510 179.510 179.451 0.059 25148 3407 1 6 . 1 1 9 9 LEU CA C 9 57.468 57.468 58.046 -0.578 25148 3408 1 6 . 1 1 9 9 LEU CB C 9 41.203 41.203 41.567 -0.364 25148 3409 1 6 . 1 1 9 9 LEU H H 9 8.256 8.256 7.571 0.685 25148 3410 1 6 . 1 1 10 10 THR N N 10 118.764 118.764 115.397 3.367 25148 3411 1 6 . 1 1 10 10 THR HA H 10 4.487 4.487 3.922 0.565 25148 3412 1 6 . 1 1 10 10 THR C C 10 176.567 176.567 177.226 -0.659 25148 3413 1 6 . 1 1 10 10 THR CA C 10 68.768 68.768 66.961 1.807 25148 3414 1 6 . 1 1 10 10 THR CB C 10 66.961 66.961 68.691 -1.730 25148 3415 1 6 . 1 1 10 10 THR H H 10 8.218 8.218 7.416 0.802 25148 3416 1 6 . 1 1 11 11 ILE N N 11 122.555 122.555 121.064 1.491 25148 3417 1 6 . 1 1 11 11 ILE HA H 11 3.779 3.779 3.730 0.049 25148 3418 1 6 . 1 1 11 11 ILE C C 11 177.793 177.793 177.574 0.219 25148 3419 1 6 . 1 1 11 11 ILE CA C 11 64.695 64.695 64.897 -0.202 25148 3420 1 6 . 1 1 11 11 ILE CB C 11 37.856 37.856 37.694 0.162 25148 3421 1 6 . 1 1 11 11 ILE H H 11 7.632 7.632 7.785 -0.153 25148 3422 1 6 . 1 1 12 12 LEU N N 12 120.469 120.469 118.337 2.132 25148 3423 1 6 . 1 1 12 12 LEU HA H 12 4.065 4.065 4.079 -0.014 25148 3424 1 6 . 1 1 12 12 LEU C C 12 179.139 179.139 178.835 0.304 25148 3425 1 6 . 1 1 12 12 LEU CA C 12 57.944 57.944 57.143 0.801 25148 3426 1 6 . 1 1 12 12 LEU CB C 12 42.170 42.170 41.056 1.114 25148 3427 1 6 . 1 1 12 12 LEU H H 12 7.951 7.951 7.640 0.311 25148 3428 1 6 . 1 1 13 13 GLU N N 13 119.669 119.669 118.070 1.599 25148 3429 1 6 . 1 1 13 13 GLU HA H 13 4.183 4.183 4.046 0.137 25148 3430 1 6 . 1 1 13 13 GLU C C 13 179.007 179.007 177.459 1.548 25148 3431 1 6 . 1 1 13 13 GLU CA C 13 59.703 59.703 58.508 1.195 25148 3432 1 6 . 1 1 13 13 GLU CB C 13 30.110 30.110 28.781 1.329 25148 3433 1 6 . 1 1 13 13 GLU H H 13 8.003 8.003 7.807 0.196 25148 3434 1 6 . 1 1 14 14 LYS N N 14 118.935 118.935 117.332 1.603 25148 3435 1 6 . 1 1 14 14 LYS HA H 14 4.124 4.124 4.048 0.076 25148 3436 1 6 . 1 1 14 14 LYS CA C 14 58.847 58.847 58.087 0.760 25148 3437 1 6 . 1 1 14 14 LYS CB C 14 33.053 33.053 32.717 0.336 25148 3438 1 6 . 1 1 14 14 LYS H H 14 7.862 7.862 7.471 0.391 25148 3439 1 6 . 1 1 15 15 GLU HA H 15 3.693 3.693 4.458 -0.765 25148 3440 1 6 . 1 1 15 15 GLU CA C 15 56.688 56.688 55.389 1.300 25148 3441 1 6 . 1 1 15 15 GLU CB C 15 32.204 32.204 30.674 1.530 25148 3442 1 6 . 1 1 16 16 LYS HA H 16 4.678 4.678 4.267 0.411 25148 3443 1 6 . 1 1 16 16 LYS CA C 16 55.135 55.135 56.161 -1.026 25148 3444 1 6 . 1 1 16 16 LYS CB C 16 34.049 34.049 33.112 0.937 25148 3445 1 6 . 1 1 17 17 GLY CA C 17 46.541 46.541 45.715 0.826 25148 3446 1 6 . 1 1 18 18 ILE N N 18 115.364 115.364 113.785 1.579 25148 3447 1 6 . 1 1 18 18 ILE HA H 18 4.079 4.079 4.511 -0.432 25148 3448 1 6 . 1 1 18 18 ILE C C 18 174.751 174.751 173.883 0.868 25148 3449 1 6 . 1 1 18 18 ILE CA C 18 60.333 60.333 59.092 1.241 25148 3450 1 6 . 1 1 18 18 ILE CB C 18 39.044 39.044 41.050 -2.006 25148 3451 1 6 . 1 1 18 18 ILE H H 18 8.203 8.203 7.376 0.827 25148 3452 1 6 . 1 1 19 19 SER N N 19 119.891 119.891 117.598 2.293 25148 3453 1 6 . 1 1 19 19 SER HA H 19 4.362 4.362 4.958 -0.596 25148 3454 1 6 . 1 1 19 19 SER CA C 19 58.476 58.476 57.596 0.880 25148 3455 1 6 . 1 1 19 19 SER CB C 19 63.533 63.533 65.050 -1.517 25148 3456 1 6 . 1 1 19 19 SER H H 19 8.253 8.253 8.232 0.021 25148 3457 1 6 . 1 1 20 20 LYS N N 20 124.782 124.782 125.685 -0.903 25148 3458 1 6 . 1 1 20 20 LYS HA H 20 4.137 4.137 4.036 0.101 25148 3459 1 6 . 1 1 20 20 LYS C C 20 177.889 177.889 177.582 0.307 25148 3460 1 6 . 1 1 20 20 LYS CA C 20 59.485 59.485 58.972 0.513 25148 3461 1 6 . 1 1 20 20 LYS CB C 20 32.711 32.711 32.096 0.615 25148 3462 1 6 . 1 1 20 20 LYS H H 20 8.918 8.918 8.842 0.076 25148 3463 1 6 . 1 1 21 21 GLU N N 21 117.831 117.831 118.566 -0.735 25148 3464 1 6 . 1 1 21 21 GLU HA H 21 3.957 3.957 4.055 -0.098 25148 3465 1 6 . 1 1 21 21 GLU C C 21 178.822 178.822 178.844 -0.022 25148 3466 1 6 . 1 1 21 21 GLU CA C 21 59.529 59.529 59.098 0.431 25148 3467 1 6 . 1 1 21 21 GLU CB C 21 29.237 29.237 29.225 0.012 25148 3468 1 6 . 1 1 21 21 GLU H H 21 8.361 8.361 8.513 -0.152 25148 3469 1 6 . 1 1 22 22 ILE N N 22 118.690 118.690 117.866 0.824 25148 3470 1 6 . 1 1 22 22 ILE HA H 22 3.884 3.884 3.946 -0.062 25148 3471 1 6 . 1 1 22 22 ILE C C 22 179.247 179.247 177.705 1.542 25148 3472 1 6 . 1 1 22 22 ILE CA C 22 63.735 63.735 64.120 -0.385 25148 3473 1 6 . 1 1 22 22 ILE CB C 22 37.415 37.415 38.250 -0.835 25148 3474 1 6 . 1 1 22 22 ILE H H 22 7.353 7.353 7.640 -0.287 25148 3475 1 6 . 1 1 23 23 ILE N N 23 120.880 120.880 121.094 -0.214 25148 3476 1 6 . 1 1 23 23 ILE HA H 23 3.733 3.733 3.703 0.030 25148 3477 1 6 . 1 1 23 23 ILE C C 23 177.817 177.817 177.863 -0.046 25148 3478 1 6 . 1 1 23 23 ILE CA C 23 64.172 64.172 63.738 0.434 25148 3479 1 6 . 1 1 23 23 ILE CB C 23 36.473 36.473 36.797 -0.324 25148 3480 1 6 . 1 1 23 23 ILE H H 23 7.571 7.571 7.372 0.199 25148 3481 1 6 . 1 1 24 24 ILE N N 24 121.460 121.460 119.224 2.236 25148 3482 1 6 . 1 1 24 24 ILE HA H 24 3.486 3.486 3.571 -0.085 25148 3483 1 6 . 1 1 24 24 ILE C C 24 177.759 177.759 177.996 -0.237 25148 3484 1 6 . 1 1 24 24 ILE CA C 24 66.641 66.641 66.106 0.535 25148 3485 1 6 . 1 1 24 24 ILE CB C 24 37.307 37.307 37.411 -0.104 25148 3486 1 6 . 1 1 24 24 ILE H H 24 8.709 8.709 7.734 0.975 25148 3487 1 6 . 1 1 25 25 GLU N N 25 119.323 119.323 118.279 1.044 25148 3488 1 6 . 1 1 25 25 GLU HA H 25 4.177 4.177 4.042 0.135 25148 3489 1 6 . 1 1 25 25 GLU C C 25 179.348 179.348 178.602 0.746 25148 3490 1 6 . 1 1 25 25 GLU CA C 25 59.951 59.951 59.017 0.934 25148 3491 1 6 . 1 1 25 25 GLU CB C 25 29.340 29.340 29.136 0.204 25148 3492 1 6 . 1 1 25 25 GLU H H 25 8.048 8.048 8.132 -0.084 25148 3493 1 6 . 1 1 26 26 ALA N N 26 122.390 122.390 123.045 -0.655 25148 3494 1 6 . 1 1 26 26 ALA HA H 26 4.325 4.325 4.098 0.228 25148 3495 1 6 . 1 1 26 26 ALA C C 26 181.440 181.440 179.738 1.702 25148 3496 1 6 . 1 1 26 26 ALA CA C 26 54.935 54.935 54.936 -0.001 25148 3497 1 6 . 1 1 26 26 ALA CB C 26 17.834 17.834 18.290 -0.456 25148 3498 1 6 . 1 1 26 26 ALA H H 26 7.768 7.768 7.703 0.065 25148 3499 1 6 . 1 1 27 27 ILE N N 27 122.342 122.342 119.364 2.978 25148 3500 1 6 . 1 1 27 27 ILE HA H 27 3.575 3.575 3.596 -0.021 25148 3501 1 6 . 1 1 27 27 ILE C C 27 177.541 177.541 178.036 -0.495 25148 3502 1 6 . 1 1 27 27 ILE CA C 27 66.536 66.536 65.722 0.814 25148 3503 1 6 . 1 1 27 27 ILE CB C 27 37.886 37.886 37.647 0.239 25148 3504 1 6 . 1 1 27 27 ILE H H 27 8.805 8.805 7.661 1.144 25148 3505 1 6 . 1 1 28 28 GLU N N 28 120.188 120.188 119.488 0.700 25148 3506 1 6 . 1 1 28 28 GLU HA H 28 3.687 3.687 3.889 -0.202 25148 3507 1 6 . 1 1 28 28 GLU C C 28 178.707 178.707 179.032 -0.325 25148 3508 1 6 . 1 1 28 28 GLU CA C 28 61.458 61.458 59.862 1.596 25148 3509 1 6 . 1 1 28 28 GLU CB C 28 29.624 29.624 29.356 0.268 25148 3510 1 6 . 1 1 28 28 GLU H H 28 8.882 8.882 7.768 1.114 25148 3511 1 6 . 1 1 29 29 ALA N N 29 119.293 119.293 120.872 -1.579 25148 3512 1 6 . 1 1 29 29 ALA HA H 29 4.214 4.214 4.210 0.004 25148 3513 1 6 . 1 1 29 29 ALA C C 29 181.200 181.200 179.566 1.634 25148 3514 1 6 . 1 1 29 29 ALA CA C 29 55.435 55.435 54.737 0.698 25148 3515 1 6 . 1 1 29 29 ALA CB C 29 18.090 18.090 18.178 -0.088 25148 3516 1 6 . 1 1 29 29 ALA H H 29 8.065 8.065 7.804 0.261 25148 3517 1 6 . 1 1 30 30 ALA N N 30 121.729 121.729 122.706 -0.977 25148 3518 1 6 . 1 1 30 30 ALA HA H 30 4.307 4.307 4.147 0.160 25148 3519 1 6 . 1 1 30 30 ALA C C 30 181.315 181.315 179.579 1.736 25148 3520 1 6 . 1 1 30 30 ALA CA C 30 54.594 54.594 54.963 -0.369 25148 3521 1 6 . 1 1 30 30 ALA CB C 30 18.704 18.704 18.317 0.387 25148 3522 1 6 . 1 1 30 30 ALA H H 30 8.099 8.099 7.642 0.457 25148 3523 1 6 . 1 1 31 31 LEU N N 31 120.900 120.900 120.190 0.710 25148 3524 1 6 . 1 1 31 31 LEU HA H 31 4.347 4.347 4.142 0.205 25148 3525 1 6 . 1 1 31 31 LEU C C 31 179.137 179.137 179.273 -0.136 25148 3526 1 6 . 1 1 31 31 LEU CA C 31 57.569 57.569 58.160 -0.591 25148 3527 1 6 . 1 1 31 31 LEU CB C 31 42.353 42.353 41.035 1.318 25148 3528 1 6 . 1 1 31 31 LEU H H 31 8.863 8.863 8.483 0.380 25148 3529 1 6 . 1 1 32 32 ILE N N 32 122.410 122.410 119.081 3.329 25148 3530 1 6 . 1 1 32 32 ILE HA H 32 3.699 3.699 3.697 0.002 25148 3531 1 6 . 1 1 32 32 ILE C C 32 178.303 178.303 177.825 0.478 25148 3532 1 6 . 1 1 32 32 ILE CA C 32 66.066 66.066 65.345 0.721 25148 3533 1 6 . 1 1 32 32 ILE CB C 32 37.882 37.882 37.907 -0.025 25148 3534 1 6 . 1 1 32 32 ILE H H 32 8.234 8.234 7.912 0.322 25148 3535 1 6 . 1 1 33 33 SER N N 33 114.201 114.201 115.715 -1.514 25148 3536 1 6 . 1 1 33 33 SER HA H 33 4.311 4.311 4.129 0.182 25148 3537 1 6 . 1 1 33 33 SER C C 33 177.012 177.012 176.693 0.319 25148 3538 1 6 . 1 1 33 33 SER CA C 33 61.860 61.860 61.899 -0.039 25148 3539 1 6 . 1 1 33 33 SER CB C 33 62.508 62.508 63.156 -0.648 25148 3540 1 6 . 1 1 33 33 SER H H 33 7.558 7.558 7.938 -0.380 25148 3541 1 6 . 1 1 34 34 ALA N N 34 122.893 122.893 124.609 -1.716 25148 3542 1 6 . 1 1 34 34 ALA HA H 34 4.215 4.215 4.078 0.137 25148 3543 1 6 . 1 1 34 34 ALA C C 34 180.814 180.814 179.305 1.509 25148 3544 1 6 . 1 1 34 34 ALA CA C 34 55.283 55.283 54.984 0.299 25148 3545 1 6 . 1 1 34 34 ALA CB C 34 18.273 18.273 18.234 0.039 25148 3546 1 6 . 1 1 34 34 ALA H H 34 8.409 8.409 8.178 0.231 25148 3547 1 6 . 1 1 35 35 TYR N N 35 120.259 120.259 118.824 1.435 25148 3548 1 6 . 1 1 35 35 TYR HA H 35 4.393 4.393 4.325 0.068 25148 3549 1 6 . 1 1 35 35 TYR C C 35 177.892 177.892 177.587 0.305 25148 3550 1 6 . 1 1 35 35 TYR CA C 35 63.071 63.071 61.017 2.054 25148 3551 1 6 . 1 1 35 35 TYR CB C 35 38.021 38.021 38.865 -0.844 25148 3552 1 6 . 1 1 35 35 TYR H H 35 8.975 8.975 8.087 0.888 25148 3553 1 6 . 1 1 36 36 LYS N N 36 120.942 120.942 118.335 2.607 25148 3554 1 6 . 1 1 36 36 LYS HA H 36 4.032 4.032 4.060 -0.028 25148 3555 1 6 . 1 1 36 36 LYS C C 36 177.797 177.797 178.011 -0.214 25148 3556 1 6 . 1 1 36 36 LYS CA C 36 59.900 59.900 59.195 0.705 25148 3557 1 6 . 1 1 36 36 LYS CB C 36 32.429 32.429 32.250 0.179 25148 3558 1 6 . 1 1 36 36 LYS H H 36 8.654 8.654 7.999 0.655 25148 3559 1 6 . 1 1 37 37 ARG N N 37 115.139 115.139 115.894 -0.755 25148 3560 1 6 . 1 1 37 37 ARG HA H 37 4.101 4.101 4.126 -0.025 25148 3561 1 6 . 1 1 37 37 ARG C C 37 177.517 177.517 178.007 -0.490 25148 3562 1 6 . 1 1 37 37 ARG CA C 37 58.276 58.276 57.969 0.307 25148 3563 1 6 . 1 1 37 37 ARG CB C 37 31.014 31.014 29.909 1.105 25148 3564 1 6 . 1 1 37 37 ARG H H 37 8.138 8.138 7.757 0.381 25148 3565 1 6 . 1 1 38 38 ASN N N 38 112.555 112.555 116.540 -3.985 25148 3566 1 6 . 1 1 38 38 ASN HA H 38 4.540 4.540 4.386 0.154 25148 3567 1 6 . 1 1 38 38 ASN C C 38 173.994 173.994 175.663 -1.669 25148 3568 1 6 . 1 1 38 38 ASN CA C 38 54.722 54.722 55.012 -0.290 25148 3569 1 6 . 1 1 38 38 ASN CB C 38 42.077 42.077 39.359 2.717 25148 3570 1 6 . 1 1 38 38 ASN H H 38 7.426 7.426 7.490 -0.064 25148 3571 1 6 . 1 1 39 39 PHE N N 39 116.711 116.711 118.551 -1.840 25148 3572 1 6 . 1 1 39 39 PHE HA H 39 4.569 4.569 4.717 -0.148 25148 3573 1 6 . 1 1 39 39 PHE CA C 39 58.913 58.913 55.906 3.007 25148 3574 1 6 . 1 1 39 39 PHE CB C 39 39.781 39.781 38.919 0.862 25148 3575 1 6 . 1 1 39 39 PHE H H 39 7.959 7.959 7.296 0.663 25148 3576 1 6 . 1 1 40 40 ASN HA H 40 4.018 4.018 4.570 -0.552 25148 3577 1 6 . 1 1 40 40 ASN CA C 40 58.944 58.944 55.060 3.884 25148 3578 1 6 . 1 1 41 41 GLN HA H 41 4.298 4.298 4.539 -0.241 25148 3579 1 6 . 1 1 41 41 GLN C C 41 175.237 175.237 175.776 -0.539 25148 3580 1 6 . 1 1 41 41 GLN CA C 41 57.360 57.360 56.331 1.028 25148 3581 1 6 . 1 1 41 41 GLN CB C 41 28.724 28.724 28.115 0.609 25148 3582 1 6 . 1 1 42 42 ALA N N 42 120.514 120.514 121.719 -1.205 25148 3583 1 6 . 1 1 42 42 ALA HA H 42 4.622 4.622 4.396 0.226 25148 3584 1 6 . 1 1 42 42 ALA C C 42 175.922 175.922 176.960 -1.038 25148 3585 1 6 . 1 1 42 42 ALA CA C 42 51.841 51.841 52.170 -0.329 25148 3586 1 6 . 1 1 42 42 ALA CB C 42 21.576 21.576 19.836 1.740 25148 3587 1 6 . 1 1 42 42 ALA H H 42 7.817 7.817 8.130 -0.313 25148 3588 1 6 . 1 1 43 43 GLN N N 43 117.594 117.594 114.652 2.942 25148 3589 1 6 . 1 1 43 43 GLN HA H 43 4.265 4.265 4.575 -0.310 25148 3590 1 6 . 1 1 43 43 GLN C C 43 174.942 174.942 173.524 1.418 25148 3591 1 6 . 1 1 43 43 GLN CA C 43 57.047 57.047 55.219 1.828 25148 3592 1 6 . 1 1 43 43 GLN CB C 43 30.863 30.863 31.496 -0.633 25148 3593 1 6 . 1 1 43 43 GLN H H 43 7.400 7.400 7.526 -0.126 25148 3594 1 6 . 1 1 44 44 ASN N N 44 120.467 120.467 118.749 1.718 25148 3595 1 6 . 1 1 44 44 ASN HA H 44 5.005 5.005 4.781 0.224 25148 3596 1 6 . 1 1 44 44 ASN C C 44 174.365 174.365 174.387 -0.022 25148 3597 1 6 . 1 1 44 44 ASN CA C 44 52.381 52.381 53.797 -1.416 25148 3598 1 6 . 1 1 44 44 ASN CB C 44 38.177 38.177 39.504 -1.327 25148 3599 1 6 . 1 1 44 44 ASN H H 44 9.123 9.123 8.484 0.639 25148 3600 1 6 . 1 1 45 45 VAL N N 45 115.479 115.479 118.897 -3.418 25148 3601 1 6 . 1 1 45 45 VAL HA H 45 5.376 5.376 4.421 0.955 25148 3602 1 6 . 1 1 45 45 VAL C C 45 174.908 174.908 174.050 0.858 25148 3603 1 6 . 1 1 45 45 VAL CA C 45 59.022 59.022 61.304 -2.282 25148 3604 1 6 . 1 1 45 45 VAL CB C 45 35.776 35.776 35.354 0.422 25148 3605 1 6 . 1 1 45 45 VAL H H 45 7.732 7.732 8.226 -0.494 25148 3606 1 6 . 1 1 46 46 ARG N N 46 121.146 121.146 125.521 -4.375 25148 3607 1 6 . 1 1 46 46 ARG HA H 46 4.566 4.566 4.778 -0.212 25148 3608 1 6 . 1 1 46 46 ARG C C 46 173.790 173.790 174.367 -0.577 25148 3609 1 6 . 1 1 46 46 ARG CA C 46 54.762 54.762 54.386 0.376 25148 3610 1 6 . 1 1 46 46 ARG CB C 46 33.946 33.946 32.051 1.895 25148 3611 1 6 . 1 1 46 46 ARG H H 46 8.850 8.850 9.204 -0.354 25148 3612 1 6 . 1 1 47 47 VAL N N 47 122.339 122.339 124.952 -2.613 25148 3613 1 6 . 1 1 47 47 VAL HA H 47 4.741 4.741 4.398 0.343 25148 3614 1 6 . 1 1 47 47 VAL C C 47 173.541 173.541 175.349 -1.808 25148 3615 1 6 . 1 1 47 47 VAL CA C 47 60.893 60.893 61.863 -0.970 25148 3616 1 6 . 1 1 47 47 VAL CB C 47 33.563 33.563 33.226 0.337 25148 3617 1 6 . 1 1 47 47 VAL H H 47 8.444 8.444 8.552 -0.108 25148 3618 1 6 . 1 1 48 48 ASP N N 48 127.701 127.701 126.649 1.052 25148 3619 1 6 . 1 1 48 48 ASP HA H 48 4.946 4.946 5.144 -0.198 25148 3620 1 6 . 1 1 48 48 ASP C C 48 173.744 173.744 174.556 -0.812 25148 3621 1 6 . 1 1 48 48 ASP CA C 48 52.651 52.651 52.635 0.016 25148 3622 1 6 . 1 1 48 48 ASP CB C 48 45.225 45.225 43.799 1.426 25148 3623 1 6 . 1 1 48 48 ASP H H 48 9.068 9.068 8.379 0.689 25148 3624 1 6 . 1 1 49 49 LEU N N 49 130.945 130.945 125.994 4.951 25148 3625 1 6 . 1 1 49 49 LEU HA H 49 4.774 4.774 4.624 0.150 25148 3626 1 6 . 1 1 49 49 LEU C C 49 174.531 174.531 175.723 -1.192 25148 3627 1 6 . 1 1 49 49 LEU CA C 49 54.337 54.337 54.360 -0.023 25148 3628 1 6 . 1 1 49 49 LEU CB C 49 43.192 43.192 44.391 -1.199 25148 3629 1 6 . 1 1 49 49 LEU H H 49 9.369 9.369 8.753 0.616 25148 3630 1 6 . 1 1 50 50 ASN N N 50 126.268 126.268 122.915 3.353 25148 3631 1 6 . 1 1 50 50 ASN HA H 50 4.629 4.629 5.050 -0.421 25148 3632 1 6 . 1 1 50 50 ASN C C 50 176.602 176.602 175.170 1.432 25148 3633 1 6 . 1 1 50 50 ASN CA C 50 54.048 54.048 52.924 1.124 25148 3634 1 6 . 1 1 50 50 ASN CB C 50 39.891 39.891 39.800 0.091 25148 3635 1 6 . 1 1 50 50 ASN H H 50 8.672 8.672 8.777 -0.105 25148 3636 1 6 . 1 1 51 51 ARG N N 51 125.897 125.897 124.093 1.804 25148 3637 1 6 . 1 1 51 51 ARG HA H 51 3.789 3.789 4.225 -0.436 25148 3638 1 6 . 1 1 51 51 ARG C C 51 175.681 175.681 176.235 -0.554 25148 3639 1 6 . 1 1 51 51 ARG CA C 51 58.162 58.162 58.482 -0.320 25148 3640 1 6 . 1 1 51 51 ARG CB C 51 29.944 29.944 29.829 0.115 25148 3641 1 6 . 1 1 51 51 ARG H H 51 8.984 8.984 8.819 0.165 25148 3642 1 6 . 1 1 52 52 GLU N N 52 116.733 116.733 119.025 -2.292 25148 3643 1 6 . 1 1 52 52 GLU HA H 52 4.368 4.368 4.167 0.201 25148 3644 1 6 . 1 1 52 52 GLU C C 52 178.049 178.049 177.484 0.565 25148 3645 1 6 . 1 1 52 52 GLU CA C 52 58.048 58.048 57.991 0.057 25148 3646 1 6 . 1 1 52 52 GLU CB C 52 30.716 30.716 29.320 1.396 25148 3647 1 6 . 1 1 52 52 GLU H H 52 8.541 8.541 8.313 0.228 25148 3648 1 6 . 1 1 53 53 THR N N 53 106.556 106.556 112.011 -5.455 25148 3649 1 6 . 1 1 53 53 THR HA H 53 4.424 4.424 4.473 -0.049 25148 3650 1 6 . 1 1 53 53 THR C C 53 176.352 176.352 174.761 1.591 25148 3651 1 6 . 1 1 53 53 THR CA C 53 61.320 61.320 61.410 -0.090 25148 3652 1 6 . 1 1 53 53 THR CB C 53 71.220 71.220 69.735 1.485 25148 3653 1 6 . 1 1 53 53 THR H H 53 8.085 8.085 7.544 0.541 25148 3654 1 6 . 1 1 54 54 GLY N N 54 111.843 111.843 110.421 1.422 25148 3655 1 6 . 1 1 54 54 GLY C C 54 172.690 172.690 174.117 -1.427 25148 3656 1 6 . 1 1 54 54 GLY CA C 54 45.417 45.417 46.245 -0.828 25148 3657 1 6 . 1 1 54 54 GLY H H 54 8.330 8.330 7.740 0.590 25148 3658 1 6 . 1 1 55 55 SER N N 55 113.844 113.844 113.826 0.018 25148 3659 1 6 . 1 1 55 55 SER HA H 55 4.279 4.279 4.685 -0.406 25148 3660 1 6 . 1 1 55 55 SER C C 55 174.127 174.127 172.984 1.143 25148 3661 1 6 . 1 1 55 55 SER CA C 55 59.229 59.229 57.622 1.607 25148 3662 1 6 . 1 1 55 55 SER CB C 55 63.939 63.939 65.074 -1.135 25148 3663 1 6 . 1 1 55 55 SER H H 55 7.653 7.653 7.527 0.126 25148 3664 1 6 . 1 1 56 56 ILE N N 56 125.286 125.286 120.118 5.168 25148 3665 1 6 . 1 1 56 56 ILE HA H 56 5.082 5.082 4.654 0.428 25148 3666 1 6 . 1 1 56 56 ILE C C 56 175.346 175.346 174.331 1.015 25148 3667 1 6 . 1 1 56 56 ILE CA C 56 59.967 59.967 60.371 -0.404 25148 3668 1 6 . 1 1 56 56 ILE CB C 56 40.165 40.165 42.337 -2.172 25148 3669 1 6 . 1 1 56 56 ILE H H 56 8.478 8.478 8.444 0.034 25148 3670 1 6 . 1 1 57 57 ARG N N 57 126.332 126.332 127.037 -0.705 25148 3671 1 6 . 1 1 57 57 ARG HA H 57 4.740 4.740 4.541 0.199 25148 3672 1 6 . 1 1 57 57 ARG C C 57 173.921 173.921 173.574 0.347 25148 3673 1 6 . 1 1 57 57 ARG CA C 57 54.311 54.311 53.738 0.573 25148 3674 1 6 . 1 1 57 57 ARG CB C 57 35.805 35.805 33.092 2.713 25148 3675 1 6 . 1 1 57 57 ARG H H 57 8.590 8.590 8.404 0.186 25148 3676 1 6 . 1 1 58 58 VAL N N 58 120.987 120.987 123.340 -2.353 25148 3677 1 6 . 1 1 58 58 VAL HA H 58 4.334 4.334 4.141 0.193 25148 3678 1 6 . 1 1 58 58 VAL C C 58 174.204 174.204 174.340 -0.136 25148 3679 1 6 . 1 1 58 58 VAL CA C 58 60.861 60.861 60.744 0.117 25148 3680 1 6 . 1 1 58 58 VAL CB C 58 33.383 33.383 31.620 1.762 25148 3681 1 6 . 1 1 58 58 VAL H H 58 8.585 8.585 8.225 0.360 25148 3682 1 6 . 1 1 59 59 PHE N N 59 124.913 124.913 126.378 -1.465 25148 3683 1 6 . 1 1 59 59 PHE HA H 59 5.046 5.046 5.356 -0.310 25148 3684 1 6 . 1 1 59 59 PHE C C 59 174.446 174.446 174.285 0.161 25148 3685 1 6 . 1 1 59 59 PHE CA C 59 56.695 56.695 55.291 1.404 25148 3686 1 6 . 1 1 59 59 PHE CB C 59 42.779 42.779 43.123 -0.344 25148 3687 1 6 . 1 1 59 59 PHE H H 59 8.920 8.920 8.640 0.280 25148 3688 1 6 . 1 1 60 60 ALA N N 60 124.035 124.035 123.895 0.140 25148 3689 1 6 . 1 1 60 60 ALA HA H 60 5.102 5.102 4.855 0.247 25148 3690 1 6 . 1 1 60 60 ALA C C 60 176.017 176.017 176.488 -0.471 25148 3691 1 6 . 1 1 60 60 ALA CA C 60 50.083 50.083 50.695 -0.612 25148 3692 1 6 . 1 1 60 60 ALA CB C 60 22.400 22.400 20.339 2.061 25148 3693 1 6 . 1 1 60 60 ALA H H 60 9.457 9.457 8.797 0.660 25148 3694 1 6 . 1 1 61 61 ARG N N 61 121.530 121.530 125.707 -4.177 25148 3695 1 6 . 1 1 61 61 ARG HA H 61 4.958 4.958 4.679 0.279 25148 3696 1 6 . 1 1 61 61 ARG C C 61 176.737 176.737 175.840 0.897 25148 3697 1 6 . 1 1 61 61 ARG CA C 61 55.375 55.375 56.296 -0.921 25148 3698 1 6 . 1 1 61 61 ARG CB C 61 31.230 31.230 31.010 0.220 25148 3699 1 6 . 1 1 61 61 ARG H H 61 8.447 8.447 8.756 -0.309 25148 3700 1 6 . 1 1 62 62 LYS N N 62 124.784 124.784 126.495 -1.711 25148 3701 1 6 . 1 1 62 62 LYS HA H 62 4.709 4.709 4.522 0.187 25148 3702 1 6 . 1 1 62 62 LYS C C 62 173.899 173.899 174.669 -0.770 25148 3703 1 6 . 1 1 62 62 LYS CA C 62 54.812 54.812 54.893 -0.081 25148 3704 1 6 . 1 1 62 62 LYS CB C 62 37.147 37.147 35.578 1.569 25148 3705 1 6 . 1 1 62 62 LYS H H 62 9.137 9.137 8.248 0.889 25148 3706 1 6 . 1 1 63 63 ASP N N 63 122.552 122.552 123.561 -1.009 25148 3707 1 6 . 1 1 63 63 ASP HA H 63 4.877 4.877 4.737 0.141 25148 3708 1 6 . 1 1 63 63 ASP C C 63 175.560 175.560 176.287 -0.727 25148 3709 1 6 . 1 1 63 63 ASP CA C 63 54.576 54.576 55.080 -0.504 25148 3710 1 6 . 1 1 63 63 ASP CB C 63 42.841 42.841 41.705 1.136 25148 3711 1 6 . 1 1 63 63 ASP H H 63 8.334 8.334 8.552 -0.218 25148 3712 1 6 . 1 1 64 64 VAL N N 64 123.109 123.109 127.329 -4.220 25148 3713 1 6 . 1 1 64 64 VAL HA H 64 4.557 4.557 4.658 -0.101 25148 3714 1 6 . 1 1 64 64 VAL C C 64 177.260 177.260 175.117 2.143 25148 3715 1 6 . 1 1 64 64 VAL CA C 64 62.268 62.268 62.887 -0.619 25148 3716 1 6 . 1 1 64 64 VAL CB C 64 30.348 30.348 31.607 -1.259 25148 3717 1 6 . 1 1 64 64 VAL H H 64 8.693 8.693 8.016 0.677 25148 3718 1 6 . 1 1 65 65 VAL N N 65 122.320 122.320 122.280 0.040 25148 3719 1 6 . 1 1 65 65 VAL HA H 65 4.939 4.939 4.542 0.397 25148 3720 1 6 . 1 1 65 65 VAL C C 65 174.754 174.754 175.249 -0.495 25148 3721 1 6 . 1 1 65 65 VAL CA C 65 59.173 59.173 59.666 -0.493 25148 3722 1 6 . 1 1 65 65 VAL CB C 65 36.289 36.289 35.632 0.657 25148 3723 1 6 . 1 1 65 65 VAL H H 65 8.656 8.656 7.807 0.849 25148 3724 1 6 . 1 1 66 66 ASP N N 66 119.805 119.805 121.679 -1.874 25148 3725 1 6 . 1 1 66 66 ASP HA H 66 4.499 4.499 4.500 -0.001 25148 3726 1 6 . 1 1 66 66 ASP C C 66 176.565 176.565 176.117 0.448 25148 3727 1 6 . 1 1 66 66 ASP CA C 66 57.236 57.236 56.382 0.854 25148 3728 1 6 . 1 1 66 66 ASP CB C 66 41.662 41.662 41.282 0.380 25148 3729 1 6 . 1 1 66 66 ASP H H 66 8.628 8.628 8.757 -0.129 25148 3730 1 6 . 1 1 67 67 GLU N N 67 117.604 117.604 117.915 -0.311 25148 3731 1 6 . 1 1 67 67 GLU HA H 67 4.350 4.350 4.326 0.024 25148 3732 1 6 . 1 1 67 67 GLU C C 67 173.736 173.736 174.973 -1.237 25148 3733 1 6 . 1 1 67 67 GLU CA C 67 55.203 55.203 55.149 0.054 25148 3734 1 6 . 1 1 67 67 GLU CB C 67 32.240 32.240 32.529 -0.289 25148 3735 1 6 . 1 1 67 67 GLU H H 67 7.525 7.525 7.815 -0.290 25148 3736 1 6 . 1 1 68 68 VAL N N 68 125.774 125.774 123.886 1.888 25148 3737 1 6 . 1 1 68 68 VAL HA H 68 3.578 3.578 4.083 -0.505 25148 3738 1 6 . 1 1 68 68 VAL C C 68 175.885 175.885 175.764 0.121 25148 3739 1 6 . 1 1 68 68 VAL CA C 68 63.397 63.397 63.835 -0.438 25148 3740 1 6 . 1 1 68 68 VAL CB C 68 32.452 32.452 31.401 1.051 25148 3741 1 6 . 1 1 68 68 VAL H H 68 8.573 8.573 8.447 0.126 25148 3742 1 6 . 1 1 69 69 TYR N N 69 129.859 129.859 125.244 4.615 25148 3743 1 6 . 1 1 69 69 TYR HA H 69 4.642 4.642 4.562 0.080 25148 3744 1 6 . 1 1 69 69 TYR C C 69 176.100 176.100 175.802 0.298 25148 3745 1 6 . 1 1 69 69 TYR CA C 69 59.092 59.092 58.404 0.688 25148 3746 1 6 . 1 1 69 69 TYR CB C 69 39.830 39.830 40.322 -0.492 25148 3747 1 6 . 1 1 69 69 TYR H H 69 9.801 9.801 8.358 1.443 25148 3748 1 6 . 1 1 70 70 ASP N N 70 120.204 120.204 120.380 -0.176 25148 3749 1 6 . 1 1 70 70 ASP HA H 70 4.772 4.772 4.938 -0.166 25148 3750 1 6 . 1 1 70 70 ASP C C 70 176.622 176.622 176.537 0.085 25148 3751 1 6 . 1 1 70 70 ASP CA C 70 52.885 52.885 53.326 -0.441 25148 3752 1 6 . 1 1 70 70 ASP CB C 70 41.878 41.878 40.517 1.361 25148 3753 1 6 . 1 1 70 70 ASP H H 70 8.348 8.348 8.157 0.191 25148 3754 1 6 . 1 1 71 71 GLN N N 71 125.440 125.440 123.313 2.127 25148 3755 1 6 . 1 1 71 71 GLN HA H 71 4.315 4.315 3.848 0.467 25148 3756 1 6 . 1 1 71 71 GLN C C 71 175.819 175.819 176.939 -1.120 25148 3757 1 6 . 1 1 71 71 GLN CA C 71 57.914 57.914 58.687 -0.773 25148 3758 1 6 . 1 1 71 71 GLN CB C 71 28.307 28.307 28.460 -0.153 25148 3759 1 6 . 1 1 71 71 GLN H H 71 9.097 9.097 8.670 0.427 25148 3760 1 6 . 1 1 72 72 ARG N N 72 116.306 116.306 116.851 -0.545 25148 3761 1 6 . 1 1 72 72 ARG HA H 72 4.252 4.252 4.095 0.157 25148 3762 1 6 . 1 1 72 72 ARG C C 72 178.087 178.087 175.627 2.460 25148 3763 1 6 . 1 1 72 72 ARG CA C 72 58.532 58.532 57.483 1.049 25148 3764 1 6 . 1 1 72 72 ARG CB C 72 30.143 30.143 30.369 -0.226 25148 3765 1 6 . 1 1 72 72 ARG H H 72 8.534 8.534 8.253 0.281 25148 3766 1 6 . 1 1 73 73 LEU N N 73 116.734 116.734 113.245 3.489 25148 3767 1 6 . 1 1 73 73 LEU HA H 73 4.621 4.621 4.606 0.015 25148 3768 1 6 . 1 1 73 73 LEU C C 73 175.946 175.946 175.081 0.865 25148 3769 1 6 . 1 1 73 73 LEU CA C 73 55.250 55.250 55.339 -0.089 25148 3770 1 6 . 1 1 73 73 LEU CB C 73 46.960 46.960 44.967 1.993 25148 3771 1 6 . 1 1 73 73 LEU H H 73 7.460 7.460 7.465 -0.005 25148 3772 1 6 . 1 1 74 74 GLU N N 74 118.787 118.787 123.083 -4.296 25148 3773 1 6 . 1 1 74 74 GLU HA H 74 5.403 5.403 4.744 0.659 25148 3774 1 6 . 1 1 74 74 GLU C C 74 173.709 173.709 173.728 -0.019 25148 3775 1 6 . 1 1 74 74 GLU CA C 74 54.914 54.914 55.765 -0.851 25148 3776 1 6 . 1 1 74 74 GLU CB C 74 35.053 35.053 33.645 1.408 25148 3777 1 6 . 1 1 74 74 GLU H H 74 7.752 7.752 8.128 -0.376 25148 3778 1 6 . 1 1 75 75 ILE N N 75 119.803 119.803 121.693 -1.890 25148 3779 1 6 . 1 1 75 75 ILE HA H 75 4.507 4.507 4.499 0.008 25148 3780 1 6 . 1 1 75 75 ILE C C 75 172.126 172.126 174.017 -1.891 25148 3781 1 6 . 1 1 75 75 ILE CA C 75 58.664 58.664 60.125 -1.461 25148 3782 1 6 . 1 1 75 75 ILE CB C 75 42.560 42.560 41.570 0.990 25148 3783 1 6 . 1 1 75 75 ILE H H 75 8.975 8.975 8.821 0.154 25148 3784 1 6 . 1 1 76 76 SER N N 76 123.236 123.236 123.521 -0.285 25148 3785 1 6 . 1 1 76 76 SER HA H 76 4.505 4.505 4.403 0.102 25148 3786 1 6 . 1 1 76 76 SER C C 76 176.145 176.145 175.697 0.448 25148 3787 1 6 . 1 1 76 76 SER CA C 76 58.108 58.108 59.136 -1.028 25148 3788 1 6 . 1 1 76 76 SER CB C 76 65.000 65.000 63.858 1.142 25148 3789 1 6 . 1 1 76 76 SER H H 76 8.810 8.810 8.752 0.058 25148 3790 1 6 . 1 1 77 77 ILE N N 77 120.629 120.629 127.406 -6.777 25148 3791 1 6 . 1 1 77 77 ILE HA H 77 3.935 3.935 3.779 0.156 25148 3792 1 6 . 1 1 77 77 ILE C C 77 175.806 175.806 176.866 -1.060 25148 3793 1 6 . 1 1 77 77 ILE CA C 77 61.928 61.928 64.065 -2.137 25148 3794 1 6 . 1 1 77 77 ILE CB C 77 38.031 38.031 38.347 -0.316 25148 3795 1 6 . 1 1 77 77 ILE H H 77 8.321 8.321 8.082 0.239 25148 3796 1 6 . 1 1 78 78 GLU N N 78 121.032 121.032 117.297 3.735 25148 3797 1 6 . 1 1 78 78 GLU HA H 78 4.082 4.082 4.161 -0.079 25148 3798 1 6 . 1 1 78 78 GLU C C 78 179.829 179.829 178.405 1.424 25148 3799 1 6 . 1 1 78 78 GLU CA C 78 60.180 60.180 59.075 1.105 25148 3800 1 6 . 1 1 78 78 GLU CB C 78 28.988 28.988 28.804 0.184 25148 3801 1 6 . 1 1 78 78 GLU H H 78 8.222 8.222 8.504 -0.282 25148 3802 1 6 . 1 1 79 79 GLU N N 79 120.710 120.710 121.398 -0.688 25148 3803 1 6 . 1 1 79 79 GLU HA H 79 4.012 4.012 4.090 -0.078 25148 3804 1 6 . 1 1 79 79 GLU C C 79 180.339 180.339 178.962 1.377 25148 3805 1 6 . 1 1 79 79 GLU CA C 79 59.332 59.332 58.785 0.547 25148 3806 1 6 . 1 1 79 79 GLU CB C 79 29.317 29.317 29.136 0.181 25148 3807 1 6 . 1 1 79 79 GLU H H 79 7.908 7.908 7.543 0.365 25148 3808 1 6 . 1 1 80 80 ALA N N 80 122.879 122.879 121.665 1.214 25148 3809 1 6 . 1 1 80 80 ALA HA H 80 3.966 3.966 4.104 -0.138 25148 3810 1 6 . 1 1 80 80 ALA C C 80 179.833 179.833 179.972 -0.139 25148 3811 1 6 . 1 1 80 80 ALA CA C 80 55.881 55.881 55.047 0.834 25148 3812 1 6 . 1 1 80 80 ALA CB C 80 18.870 18.870 18.150 0.720 25148 3813 1 6 . 1 1 80 80 ALA H H 80 9.132 9.132 7.888 1.244 25148 3814 1 6 . 1 1 81 81 GLN N N 81 115.829 115.829 116.884 -1.055 25148 3815 1 6 . 1 1 81 81 GLN HA H 81 4.749 4.749 4.332 0.417 25148 3816 1 6 . 1 1 81 81 GLN C C 81 178.126 178.126 177.983 0.143 25148 3817 1 6 . 1 1 81 81 GLN CA C 81 57.682 57.682 57.561 0.121 25148 3818 1 6 . 1 1 81 81 GLN CB C 81 27.307 27.307 28.787 -1.480 25148 3819 1 6 . 1 1 81 81 GLN H H 81 8.709 8.709 7.849 0.860 25148 3820 1 6 . 1 1 82 82 GLY N N 82 105.531 105.531 106.888 -1.357 25148 3821 1 6 . 1 1 82 82 GLY C C 82 174.917 174.917 174.966 -0.049 25148 3822 1 6 . 1 1 82 82 GLY CA C 82 45.915 45.915 46.676 -0.761 25148 3823 1 6 . 1 1 82 82 GLY H H 82 7.479 7.479 8.002 -0.523 25148 3824 1 6 . 1 1 83 83 ILE N N 83 122.828 122.828 113.793 9.035 25148 3825 1 6 . 1 1 83 83 ILE HA H 83 3.970 3.970 4.442 -0.472 25148 3826 1 6 . 1 1 83 83 ILE C C 83 177.209 177.209 175.538 1.671 25148 3827 1 6 . 1 1 83 83 ILE CA C 83 64.305 64.305 61.632 2.673 25148 3828 1 6 . 1 1 83 83 ILE CB C 83 38.452 38.452 40.172 -1.720 25148 3829 1 6 . 1 1 83 83 ILE H H 83 7.634 7.634 7.524 0.110 25148 3830 1 6 . 1 1 84 84 HIS N N 84 118.927 118.927 120.041 -1.114 25148 3831 1 6 . 1 1 84 84 HIS HA H 84 4.713 4.713 4.943 -0.230 25148 3832 1 6 . 1 1 84 84 HIS CA C 84 55.487 55.487 54.431 1.056 25148 3833 1 6 . 1 1 84 84 HIS CB C 84 33.506 33.506 32.285 1.221 25148 3834 1 6 . 1 1 84 84 HIS H H 84 8.155 8.155 8.324 -0.169 25148 3835 1 6 . 1 1 85 85 PRO HA H 85 4.456 4.456 4.509 -0.053 25148 3836 1 6 . 1 1 85 85 PRO C C 85 177.357 177.357 177.264 0.093 25148 3837 1 6 . 1 1 85 85 PRO CA C 85 64.475 64.475 64.054 0.421 25148 3838 1 6 . 1 1 85 85 PRO CB C 85 32.489 32.489 32.079 0.410 25148 3839 1 6 . 1 1 86 86 GLU N N 86 116.314 116.314 117.462 -1.148 25148 3840 1 6 . 1 1 86 86 GLU HA H 86 4.286 4.286 4.166 0.120 25148 3841 1 6 . 1 1 86 86 GLU C C 86 177.624 177.624 177.186 0.438 25148 3842 1 6 . 1 1 86 86 GLU CA C 86 56.619 56.619 56.760 -0.141 25148 3843 1 6 . 1 1 86 86 GLU CB C 86 29.389 29.389 29.508 -0.119 25148 3844 1 6 . 1 1 86 86 GLU H H 86 8.938 8.938 7.813 1.125 25148 3845 1 6 . 1 1 87 87 TYR N N 87 119.773 119.773 120.180 -0.407 25148 3846 1 6 . 1 1 87 87 TYR HA H 87 4.744 4.744 4.222 0.522 25148 3847 1 6 . 1 1 87 87 TYR C C 87 174.533 174.533 176.036 -1.503 25148 3848 1 6 . 1 1 87 87 TYR CA C 87 59.117 59.117 59.535 -0.418 25148 3849 1 6 . 1 1 87 87 TYR CB C 87 38.859 38.859 38.761 0.098 25148 3850 1 6 . 1 1 87 87 TYR H H 87 7.447 7.447 7.374 0.073 25148 3851 1 6 . 1 1 88 88 MET N N 88 118.298 118.298 116.589 1.709 25148 3852 1 6 . 1 1 88 88 MET HA H 88 4.770 4.770 4.650 0.120 25148 3853 1 6 . 1 1 88 88 MET C C 88 175.638 175.638 174.175 1.463 25148 3854 1 6 . 1 1 88 88 MET CA C 88 53.133 53.133 54.792 -1.659 25148 3855 1 6 . 1 1 88 88 MET CB C 88 37.102 37.102 35.818 1.284 25148 3856 1 6 . 1 1 88 88 MET H H 88 9.023 9.023 8.324 0.699 25148 3857 1 6 . 1 1 89 89 VAL N N 89 120.157 120.157 124.549 -4.392 25148 3858 1 6 . 1 1 89 89 VAL HA H 89 3.330 3.330 3.756 -0.426 25148 3859 1 6 . 1 1 89 89 VAL C C 89 177.432 177.432 177.059 0.373 25148 3860 1 6 . 1 1 89 89 VAL CA C 89 65.675 65.675 64.531 1.145 25148 3861 1 6 . 1 1 89 89 VAL CB C 89 31.321 31.321 31.134 0.187 25148 3862 1 6 . 1 1 89 89 VAL H H 89 8.313 8.313 8.572 -0.259 25148 3863 1 6 . 1 1 90 90 GLY N N 90 116.935 116.935 115.622 1.313 25148 3864 1 6 . 1 1 90 90 GLY C C 90 175.196 175.196 174.261 0.935 25148 3865 1 6 . 1 1 90 90 GLY CA C 90 44.685 44.685 44.721 -0.036 25148 3866 1 6 . 1 1 90 90 GLY H H 90 8.551 8.551 9.039 -0.488 25148 3867 1 6 . 1 1 91 91 ASP N N 91 121.616 121.616 121.709 -0.093 25148 3868 1 6 . 1 1 91 91 ASP HA H 91 4.790 4.790 4.975 -0.185 25148 3869 1 6 . 1 1 91 91 ASP C C 91 174.431 174.431 175.004 -0.573 25148 3870 1 6 . 1 1 91 91 ASP CA C 91 55.011 55.011 53.821 1.190 25148 3871 1 6 . 1 1 91 91 ASP CB C 91 42.079 42.079 42.837 -0.758 25148 3872 1 6 . 1 1 91 91 ASP H H 91 8.073 8.073 7.930 0.143 25148 3873 1 6 . 1 1 92 92 VAL N N 92 118.919 118.919 114.488 4.431 25148 3874 1 6 . 1 1 92 92 VAL HA H 92 4.709 4.709 5.009 -0.300 25148 3875 1 6 . 1 1 92 92 VAL C C 92 175.602 175.602 174.244 1.358 25148 3876 1 6 . 1 1 92 92 VAL CA C 92 61.527 61.527 60.062 1.465 25148 3877 1 6 . 1 1 92 92 VAL CB C 92 34.110 34.110 35.440 -1.330 25148 3878 1 6 . 1 1 92 92 VAL H H 92 8.216 8.216 8.058 0.158 25148 3879 1 6 . 1 1 93 93 VAL N N 93 123.922 123.922 122.972 0.950 25148 3880 1 6 . 1 1 93 93 VAL HA H 93 4.231 4.231 4.260 -0.029 25148 3881 1 6 . 1 1 93 93 VAL C C 93 174.105 174.105 174.155 -0.050 25148 3882 1 6 . 1 1 93 93 VAL CA C 93 59.644 59.644 59.525 0.119 25148 3883 1 6 . 1 1 93 93 VAL CB C 93 34.661 34.661 34.890 -0.229 25148 3884 1 6 . 1 1 93 93 VAL H H 93 8.812 8.812 7.954 0.858 25148 3885 1 6 . 1 1 94 94 GLU N N 94 123.605 123.605 128.431 -4.826 25148 3886 1 6 . 1 1 94 94 GLU HA H 94 5.347 5.347 5.092 0.255 25148 3887 1 6 . 1 1 94 94 GLU C C 94 175.708 175.708 175.613 0.095 25148 3888 1 6 . 1 1 94 94 GLU CA C 94 54.979 54.979 55.233 -0.254 25148 3889 1 6 . 1 1 94 94 GLU CB C 94 31.612 31.612 31.767 -0.155 25148 3890 1 6 . 1 1 94 94 GLU H H 94 8.312 8.312 8.622 -0.310 25148 3891 1 6 . 1 1 95 95 ILE N N 95 123.581 123.581 123.398 0.183 25148 3892 1 6 . 1 1 95 95 ILE HA H 95 4.601 4.601 4.517 0.084 25148 3893 1 6 . 1 1 95 95 ILE C C 95 175.081 175.081 175.082 -0.001 25148 3894 1 6 . 1 1 95 95 ILE CA C 95 58.601 58.601 59.567 -0.966 25148 3895 1 6 . 1 1 95 95 ILE CB C 95 41.727 41.727 42.534 -0.807 25148 3896 1 6 . 1 1 95 95 ILE H H 95 9.045 9.045 8.119 0.926 25148 3897 1 6 . 1 1 96 96 GLU N N 96 128.094 128.094 127.611 0.483 25148 3898 1 6 . 1 1 96 96 GLU HA H 96 4.098 4.098 4.247 -0.149 25148 3899 1 6 . 1 1 96 96 GLU C C 96 176.845 176.845 175.680 1.165 25148 3900 1 6 . 1 1 96 96 GLU CA C 96 57.853 57.853 58.072 -0.219 25148 3901 1 6 . 1 1 96 96 GLU CB C 96 28.323 28.323 29.220 -0.897 25148 3902 1 6 . 1 1 96 96 GLU H H 96 9.256 9.256 8.928 0.328 25148 3903 1 6 . 1 1 97 97 VAL N N 97 118.446 118.446 123.609 -5.163 25148 3904 1 6 . 1 1 97 97 VAL HA H 97 4.568 4.568 4.188 0.380 25148 3905 1 6 . 1 1 97 97 VAL C C 97 175.051 175.051 174.909 0.142 25148 3906 1 6 . 1 1 97 97 VAL CA C 97 59.796 59.796 61.335 -1.539 25148 3907 1 6 . 1 1 97 97 VAL CB C 97 32.399 32.399 33.012 -0.613 25148 3908 1 6 . 1 1 97 97 VAL H H 97 8.609 8.609 8.895 -0.286 25148 3909 1 6 . 1 1 98 98 THR N N 98 119.118 119.118 118.186 0.932 25148 3910 1 6 . 1 1 98 98 THR HA H 98 3.320 3.320 3.989 -0.669 25148 3911 1 6 . 1 1 98 98 THR CA C 98 61.628 61.628 59.446 2.182 25148 3912 1 6 . 1 1 98 98 THR CB C 98 70.031 70.031 69.324 0.707 25148 3913 1 6 . 1 1 98 98 THR H H 98 7.396 7.396 7.528 -0.132 25148 3914 1 6 . 1 1 99 99 PRO HA H 99 4.458 4.458 4.617 -0.159 25148 3915 1 6 . 1 1 99 99 PRO CA C 99 62.348 62.348 62.541 -0.193 25148 3916 1 6 . 1 1 99 99 PRO CB C 99 33.182 33.182 32.468 0.715 25148 3917 1 6 . 1 1 100 100 LYS HA H 100 4.126 4.126 4.149 -0.023 25148 3918 1 6 . 1 1 100 100 LYS CA C 100 58.773 58.773 58.221 0.552 25148 3919 1 6 . 1 1 100 100 LYS CB C 100 32.195 32.195 32.200 -0.005 25148 3920 1 6 . 1 1 101 101 ASP HA H 101 4.924 4.924 4.822 0.102 25148 3921 1 6 . 1 1 101 101 ASP C C 101 176.884 176.884 176.249 0.635 25148 3922 1 6 . 1 1 101 101 ASP CA C 101 54.134 54.134 54.051 0.083 25148 3923 1 6 . 1 1 101 101 ASP CB C 101 40.272 40.272 40.833 -0.561 25148 3924 1 6 . 1 1 102 102 PHE N N 102 118.703 118.703 121.475 -2.772 25148 3925 1 6 . 1 1 102 102 PHE HA H 102 4.295 4.295 4.200 0.095 25148 3926 1 6 . 1 1 102 102 PHE C C 102 176.477 176.477 177.010 -0.533 25148 3927 1 6 . 1 1 102 102 PHE CA C 102 60.748 60.748 60.147 0.602 25148 3928 1 6 . 1 1 102 102 PHE CB C 102 39.667 39.667 39.119 0.548 25148 3929 1 6 . 1 1 102 102 PHE H H 102 7.862 7.862 7.720 0.142 25148 3930 1 6 . 1 1 103 103 GLY CA C 103 47.430 47.430 47.281 0.149 25148 3931 1 6 . 1 1 104 104 ARG N N 104 121.819 121.819 120.551 1.268 25148 3932 1 6 . 1 1 104 104 ARG HA H 104 4.176 4.176 4.132 0.044 25148 3933 1 6 . 1 1 104 104 ARG C C 104 178.912 178.912 178.401 0.511 25148 3934 1 6 . 1 1 104 104 ARG CA C 104 59.235 59.235 58.483 0.752 25148 3935 1 6 . 1 1 104 104 ARG CB C 104 30.000 30.000 30.348 -0.347 25148 3936 1 6 . 1 1 104 104 ARG H H 104 7.809 7.809 7.451 0.358 25148 3937 1 6 . 1 1 105 105 ILE N N 105 120.331 120.331 121.304 -0.973 25148 3938 1 6 . 1 1 105 105 ILE HA H 105 3.836 3.836 3.688 0.148 25148 3939 1 6 . 1 1 105 105 ILE C C 105 179.206 179.206 177.734 1.472 25148 3940 1 6 . 1 1 105 105 ILE CA C 105 63.025 63.025 64.865 -1.840 25148 3941 1 6 . 1 1 105 105 ILE CB C 105 38.127 38.127 37.602 0.525 25148 3942 1 6 . 1 1 105 105 ILE H H 105 7.203 7.203 7.419 -0.216 25148 3943 1 6 . 1 1 106 106 ALA N N 106 124.867 124.867 121.974 2.893 25148 3944 1 6 . 1 1 106 106 ALA HA H 106 3.665 3.665 3.552 0.113 25148 3945 1 6 . 1 1 106 106 ALA C C 106 178.590 178.590 179.045 -0.455 25148 3946 1 6 . 1 1 106 106 ALA CA C 106 54.842 54.842 55.229 -0.387 25148 3947 1 6 . 1 1 106 106 ALA CB C 106 18.659 18.659 17.822 0.838 25148 3948 1 6 . 1 1 106 106 ALA H H 106 8.813 8.813 8.181 0.632 25148 3949 1 6 . 1 1 107 107 ALA N N 107 119.597 119.597 120.554 -0.957 25148 3950 1 6 . 1 1 107 107 ALA HA H 107 4.014 4.014 4.020 -0.006 25148 3951 1 6 . 1 1 107 107 ALA C C 107 180.214 180.214 179.489 0.725 25148 3952 1 6 . 1 1 107 107 ALA CA C 107 55.454 55.454 54.662 0.792 25148 3953 1 6 . 1 1 107 107 ALA CB C 107 18.260 18.260 18.026 0.234 25148 3954 1 6 . 1 1 107 107 ALA H H 107 8.012 8.012 7.422 0.590 25148 3955 1 6 . 1 1 108 108 GLN N N 108 116.896 116.896 118.737 -1.841 25148 3956 1 6 . 1 1 108 108 GLN HA H 108 4.054 4.054 3.953 0.101 25148 3957 1 6 . 1 1 108 108 GLN C C 108 178.784 178.784 178.489 0.295 25148 3958 1 6 . 1 1 108 108 GLN CA C 108 58.705 58.705 59.089 -0.383 25148 3959 1 6 . 1 1 108 108 GLN CB C 108 28.647 28.647 28.759 -0.112 25148 3960 1 6 . 1 1 108 108 GLN H H 108 7.498 7.498 8.384 -0.886 25148 3961 1 6 . 1 1 109 109 THR N N 109 117.495 117.495 114.999 2.496 25148 3962 1 6 . 1 1 109 109 THR HA H 109 3.917 3.917 4.159 -0.242 25148 3963 1 6 . 1 1 109 109 THR C C 109 175.732 175.732 175.755 -0.023 25148 3964 1 6 . 1 1 109 109 THR CA C 109 66.989 66.989 65.052 1.937 25148 3965 1 6 . 1 1 109 109 THR CB C 109 68.766 68.766 68.716 0.050 25148 3966 1 6 . 1 1 109 109 THR H H 109 8.203 8.203 8.223 -0.020 25148 3967 1 6 . 1 1 110 110 ALA N N 110 122.308 122.308 124.887 -2.579 25148 3968 1 6 . 1 1 110 110 ALA HA H 110 3.854 3.854 4.067 -0.213 25148 3969 1 6 . 1 1 110 110 ALA C C 110 178.380 178.380 178.937 -0.557 25148 3970 1 6 . 1 1 110 110 ALA CA C 110 55.903 55.903 54.785 1.118 25148 3971 1 6 . 1 1 110 110 ALA CB C 110 18.524 18.524 18.314 0.210 25148 3972 1 6 . 1 1 110 110 ALA H H 110 8.668 8.668 7.369 1.299 25148 3973 1 6 . 1 1 111 111 LYS N N 111 115.552 115.552 117.722 -2.170 25148 3974 1 6 . 1 1 111 111 LYS HA H 111 3.923 3.923 3.944 -0.021 25148 3975 1 6 . 1 1 111 111 LYS C C 111 179.111 179.111 178.428 0.683 25148 3976 1 6 . 1 1 111 111 LYS CA C 111 59.825 59.825 59.347 0.478 25148 3977 1 6 . 1 1 111 111 LYS CB C 111 32.251 32.251 31.979 0.272 25148 3978 1 6 . 1 1 111 111 LYS H H 111 7.642 7.642 8.539 -0.897 25148 3979 1 6 . 1 1 112 112 GLN N N 112 120.178 120.178 117.992 2.186 25148 3980 1 6 . 1 1 112 112 GLN HA H 112 4.060 4.060 4.131 -0.071 25148 3981 1 6 . 1 1 112 112 GLN C C 112 178.355 178.355 178.388 -0.033 25148 3982 1 6 . 1 1 112 112 GLN CA C 112 59.240 59.240 58.147 1.093 25148 3983 1 6 . 1 1 112 112 GLN CB C 112 28.250 28.250 28.537 -0.287 25148 3984 1 6 . 1 1 112 112 GLN H H 112 7.798 7.798 7.599 0.199 25148 3985 1 6 . 1 1 113 113 VAL N N 113 119.799 119.799 120.797 -0.998 25148 3986 1 6 . 1 1 113 113 VAL HA H 113 3.705 3.705 3.811 -0.106 25148 3987 1 6 . 1 1 113 113 VAL C C 113 178.303 178.303 177.992 0.311 25148 3988 1 6 . 1 1 113 113 VAL CA C 113 66.277 66.277 64.944 1.333 25148 3989 1 6 . 1 1 113 113 VAL CB C 113 31.954 31.954 31.683 0.271 25148 3990 1 6 . 1 1 113 113 VAL H H 113 8.105 8.105 7.537 0.568 25148 3991 1 6 . 1 1 114 114 VAL N N 114 118.265 118.265 116.420 1.845 25148 3992 1 6 . 1 1 114 114 VAL HA H 114 3.392 3.392 3.629 -0.237 25148 3993 1 6 . 1 1 114 114 VAL C C 114 177.360 177.360 177.793 -0.433 25148 3994 1 6 . 1 1 114 114 VAL CA C 114 67.832 67.832 66.962 0.870 25148 3995 1 6 . 1 1 114 114 VAL CB C 114 31.801 31.801 31.272 0.529 25148 3996 1 6 . 1 1 114 114 VAL H H 114 8.180 8.180 8.112 0.068 25148 3997 1 6 . 1 1 115 115 THR N N 115 113.460 113.460 114.294 -0.834 25148 3998 1 6 . 1 1 115 115 THR HA H 115 3.856 3.856 4.055 -0.199 25148 3999 1 6 . 1 1 115 115 THR C C 115 176.529 176.529 176.506 0.023 25148 4000 1 6 . 1 1 115 115 THR CA C 115 66.706 66.706 66.134 0.572 25148 4001 1 6 . 1 1 115 115 THR CB C 115 69.008 69.008 68.430 0.578 25148 4002 1 6 . 1 1 115 115 THR H H 115 8.143 8.143 7.673 0.470 25148 4003 1 6 . 1 1 116 116 GLN N N 116 120.129 120.129 120.648 -0.519 25148 4004 1 6 . 1 1 116 116 GLN HA H 116 4.054 4.054 4.087 -0.033 25148 4005 1 6 . 1 1 116 116 GLN C C 116 178.100 178.100 178.660 -0.560 25148 4006 1 6 . 1 1 116 116 GLN CA C 116 58.950 58.950 59.088 -0.138 25148 4007 1 6 . 1 1 116 116 GLN CB C 116 28.244 28.244 28.617 -0.373 25148 4008 1 6 . 1 1 116 116 GLN H H 116 7.936 7.936 7.499 0.437 25148 4009 1 6 . 1 1 117 117 ARG N N 117 117.838 117.838 119.863 -2.025 25148 4010 1 6 . 1 1 117 117 ARG HA H 117 4.174 4.174 4.072 0.102 25148 4011 1 6 . 1 1 117 117 ARG C C 117 179.138 179.138 178.517 0.621 25148 4012 1 6 . 1 1 117 117 ARG CA C 117 57.461 57.461 58.367 -0.906 25148 4013 1 6 . 1 1 117 117 ARG CB C 117 29.548 29.548 29.328 0.220 25148 4014 1 6 . 1 1 117 117 ARG H H 117 8.240 8.240 8.207 0.033 25148 4015 1 6 . 1 1 118 118 VAL N N 118 120.278 120.278 119.498 0.780 25148 4016 1 6 . 1 1 118 118 VAL HA H 118 3.709 3.709 3.691 0.018 25148 4017 1 6 . 1 1 118 118 VAL C C 118 177.597 177.597 178.143 -0.546 25148 4018 1 6 . 1 1 118 118 VAL CA C 118 66.246 66.246 66.138 0.109 25148 4019 1 6 . 1 1 118 118 VAL CB C 118 31.785 31.785 30.926 0.859 25148 4020 1 6 . 1 1 118 118 VAL H H 118 8.480 8.480 7.581 0.899 25148 4021 1 6 . 1 1 119 119 ARG N N 119 120.197 120.197 119.870 0.327 25148 4022 1 6 . 1 1 119 119 ARG HA H 119 4.173 4.173 4.030 0.143 25148 4023 1 6 . 1 1 119 119 ARG C C 119 178.864 178.864 178.862 0.002 25148 4024 1 6 . 1 1 119 119 ARG CA C 119 58.772 58.772 59.342 -0.570 25148 4025 1 6 . 1 1 119 119 ARG CB C 119 29.873 29.873 29.535 0.338 25148 4026 1 6 . 1 1 119 119 ARG H H 119 7.899 7.899 7.866 0.033 25148 4027 1 6 . 1 1 120 120 GLU N N 120 118.768 118.768 118.989 -0.221 25148 4028 1 6 . 1 1 120 120 GLU HA H 120 4.110 4.110 4.100 0.010 25148 4029 1 6 . 1 1 120 120 GLU C C 120 177.823 177.823 178.807 -0.984 25148 4030 1 6 . 1 1 120 120 GLU CA C 120 58.223 58.223 58.918 -0.695 25148 4031 1 6 . 1 1 120 120 GLU CB C 120 29.854 29.854 29.171 0.683 25148 4032 1 6 . 1 1 120 120 GLU H H 120 8.084 8.084 7.718 0.366 25148 4033 1 6 . 1 1 121 121 ALA N N 121 121.984 121.984 122.513 -0.529 25148 4034 1 6 . 1 1 121 121 ALA HA H 121 4.296 4.296 4.073 0.223 25148 4035 1 6 . 1 1 121 121 ALA C C 121 178.586 178.586 178.792 -0.206 25148 4036 1 6 . 1 1 121 121 ALA CA C 121 53.475 53.475 54.936 -1.461 25148 4037 1 6 . 1 1 121 121 ALA CB C 121 18.856 18.856 18.491 0.364 25148 4038 1 6 . 1 1 121 121 ALA H H 121 7.810 7.810 8.138 -0.328 25148 4039 1 6 . 1 1 122 122 GLU N N 122 118.229 118.229 117.796 0.433 25148 4040 1 6 . 1 1 122 122 GLU HA H 122 4.241 4.241 4.024 0.217 25148 4041 1 6 . 1 1 122 122 GLU C C 122 176.839 176.839 178.603 -1.764 25148 4042 1 6 . 1 1 122 122 GLU CA C 122 57.118 57.118 58.476 -1.358 25148 4043 1 6 . 1 1 122 122 GLU CB C 122 30.018 30.018 29.494 0.524 25148 4044 1 6 . 1 1 122 122 GLU H H 122 7.938 7.938 8.212 -0.274 25148 4045 1 6 . 1 1 123 123 ARG N N 123 120.601 120.601 120.002 0.599 25148 4046 1 6 . 1 1 123 123 ARG HA H 123 4.348 4.348 4.230 0.118 25148 4047 1 6 . 1 1 123 123 ARG C C 123 176.071 176.071 176.990 -0.919 25148 4048 1 6 . 1 1 123 123 ARG CA C 123 56.510 56.510 57.626 -1.116 25148 4049 1 6 . 1 1 123 123 ARG CB C 123 30.765 30.765 31.362 -0.597 25148 4050 1 6 . 1 1 123 123 ARG H H 123 7.977 7.977 7.734 0.243 25148 4051 1 7 . 1 1 4 4 GLU HA H 4 4.138 4.138 4.015 0.123 25148 4052 1 7 . 1 1 4 4 GLU C C 4 179.152 179.152 177.699 1.453 25148 4053 1 7 . 1 1 4 4 GLU CA C 4 59.566 59.566 59.122 0.444 25148 4054 1 7 . 1 1 4 4 GLU CB C 4 29.407 29.407 29.637 -0.230 25148 4055 1 7 . 1 1 5 5 LEU N N 5 121.360 121.360 116.702 4.658 25148 4056 1 7 . 1 1 5 5 LEU HA H 5 4.195 4.195 4.000 0.195 25148 4057 1 7 . 1 1 5 5 LEU C C 5 178.179 178.179 178.225 -0.046 25148 4058 1 7 . 1 1 5 5 LEU CA C 5 57.830 57.830 57.455 0.375 25148 4059 1 7 . 1 1 5 5 LEU CB C 5 41.630 41.630 41.481 0.149 25148 4060 1 7 . 1 1 5 5 LEU H H 5 7.877 7.877 7.934 -0.057 25148 4061 1 7 . 1 1 6 6 LEU N N 6 118.058 118.058 118.985 -0.927 25148 4062 1 7 . 1 1 6 6 LEU HA H 6 3.919 3.919 3.901 0.018 25148 4063 1 7 . 1 1 6 6 LEU C C 6 180.274 180.274 178.953 1.321 25148 4064 1 7 . 1 1 6 6 LEU CA C 6 58.221 58.221 57.659 0.562 25148 4065 1 7 . 1 1 6 6 LEU CB C 6 40.684 40.684 41.294 -0.610 25148 4066 1 7 . 1 1 6 6 LEU H H 6 7.685 7.685 7.602 0.083 25148 4067 1 7 . 1 1 7 7 ASP N N 7 120.662 120.662 118.205 2.457 25148 4068 1 7 . 1 1 7 7 ASP HA H 7 4.416 4.416 4.444 -0.028 25148 4069 1 7 . 1 1 7 7 ASP C C 7 178.738 178.738 177.892 0.846 25148 4070 1 7 . 1 1 7 7 ASP CA C 7 57.519 57.519 56.104 1.415 25148 4071 1 7 . 1 1 7 7 ASP CB C 7 40.167 40.167 40.757 -0.590 25148 4072 1 7 . 1 1 7 7 ASP H H 7 8.427 8.427 7.668 0.759 25148 4073 1 7 . 1 1 8 8 ALA N N 8 122.612 122.612 123.490 -0.878 25148 4074 1 7 . 1 1 8 8 ALA HA H 8 4.146 4.146 3.943 0.203 25148 4075 1 7 . 1 1 8 8 ALA C C 8 180.787 180.787 179.431 1.356 25148 4076 1 7 . 1 1 8 8 ALA CA C 8 55.165 55.165 55.371 -0.206 25148 4077 1 7 . 1 1 8 8 ALA CB C 8 17.711 17.711 18.520 -0.809 25148 4078 1 7 . 1 1 8 8 ALA H H 8 7.847 7.847 7.765 0.082 25148 4079 1 7 . 1 1 9 9 LEU N N 9 116.977 116.977 116.905 0.072 25148 4080 1 7 . 1 1 9 9 LEU HA H 9 4.115 4.115 3.902 0.213 25148 4081 1 7 . 1 1 9 9 LEU C C 9 179.510 179.510 179.428 0.082 25148 4082 1 7 . 1 1 9 9 LEU CA C 9 57.468 57.468 57.692 -0.224 25148 4083 1 7 . 1 1 9 9 LEU CB C 9 41.203 41.203 41.541 -0.338 25148 4084 1 7 . 1 1 9 9 LEU H H 9 8.256 8.256 7.735 0.521 25148 4085 1 7 . 1 1 10 10 THR N N 10 118.764 118.764 115.236 3.528 25148 4086 1 7 . 1 1 10 10 THR HA H 10 4.487 4.487 4.050 0.437 25148 4087 1 7 . 1 1 10 10 THR C C 10 176.567 176.567 177.105 -0.538 25148 4088 1 7 . 1 1 10 10 THR CA C 10 68.768 68.768 65.966 2.802 25148 4089 1 7 . 1 1 10 10 THR CB C 10 66.961 66.961 68.442 -1.481 25148 4090 1 7 . 1 1 10 10 THR H H 10 8.218 8.218 7.352 0.866 25148 4091 1 7 . 1 1 11 11 ILE N N 11 122.555 122.555 122.338 0.217 25148 4092 1 7 . 1 1 11 11 ILE HA H 11 3.779 3.779 3.706 0.073 25148 4093 1 7 . 1 1 11 11 ILE C C 11 177.793 177.793 177.884 -0.091 25148 4094 1 7 . 1 1 11 11 ILE CA C 11 64.695 64.695 65.088 -0.393 25148 4095 1 7 . 1 1 11 11 ILE CB C 11 37.856 37.856 37.678 0.178 25148 4096 1 7 . 1 1 11 11 ILE H H 11 7.632 7.632 7.937 -0.305 25148 4097 1 7 . 1 1 12 12 LEU N N 12 120.469 120.469 119.093 1.376 25148 4098 1 7 . 1 1 12 12 LEU HA H 12 4.065 4.065 4.010 0.055 25148 4099 1 7 . 1 1 12 12 LEU C C 12 179.139 179.139 179.143 -0.004 25148 4100 1 7 . 1 1 12 12 LEU CA C 12 57.944 57.944 57.296 0.648 25148 4101 1 7 . 1 1 12 12 LEU CB C 12 42.170 42.170 40.807 1.363 25148 4102 1 7 . 1 1 12 12 LEU H H 12 7.951 7.951 7.683 0.268 25148 4103 1 7 . 1 1 13 13 GLU N N 13 119.669 119.669 117.889 1.780 25148 4104 1 7 . 1 1 13 13 GLU HA H 13 4.183 4.183 3.994 0.189 25148 4105 1 7 . 1 1 13 13 GLU C C 13 179.007 179.007 177.478 1.529 25148 4106 1 7 . 1 1 13 13 GLU CA C 13 59.703 59.703 58.662 1.041 25148 4107 1 7 . 1 1 13 13 GLU CB C 13 30.110 30.110 28.887 1.224 25148 4108 1 7 . 1 1 13 13 GLU H H 13 8.003 8.003 7.724 0.279 25148 4109 1 7 . 1 1 14 14 LYS N N 14 118.935 118.935 118.190 0.745 25148 4110 1 7 . 1 1 14 14 LYS HA H 14 4.124 4.124 4.037 0.087 25148 4111 1 7 . 1 1 14 14 LYS CA C 14 58.847 58.847 57.907 0.940 25148 4112 1 7 . 1 1 14 14 LYS CB C 14 33.053 33.053 32.877 0.177 25148 4113 1 7 . 1 1 14 14 LYS H H 14 7.862 7.862 7.527 0.335 25148 4114 1 7 . 1 1 15 15 GLU HA H 15 3.693 3.693 4.382 -0.689 25148 4115 1 7 . 1 1 15 15 GLU CA C 15 56.688 56.688 55.743 0.945 25148 4116 1 7 . 1 1 15 15 GLU CB C 15 32.204 32.204 30.786 1.418 25148 4117 1 7 . 1 1 16 16 LYS HA H 16 4.678 4.678 4.295 0.383 25148 4118 1 7 . 1 1 16 16 LYS CA C 16 55.135 55.135 56.141 -1.006 25148 4119 1 7 . 1 1 16 16 LYS CB C 16 34.049 34.049 33.435 0.614 25148 4120 1 7 . 1 1 17 17 GLY CA C 17 46.541 46.541 45.976 0.565 25148 4121 1 7 . 1 1 18 18 ILE N N 18 115.364 115.364 113.636 1.728 25148 4122 1 7 . 1 1 18 18 ILE HA H 18 4.079 4.079 4.450 -0.371 25148 4123 1 7 . 1 1 18 18 ILE C C 18 174.751 174.751 174.003 0.748 25148 4124 1 7 . 1 1 18 18 ILE CA C 18 60.333 60.333 59.424 0.909 25148 4125 1 7 . 1 1 18 18 ILE CB C 18 39.044 39.044 40.765 -1.721 25148 4126 1 7 . 1 1 18 18 ILE H H 18 8.203 8.203 7.346 0.857 25148 4127 1 7 . 1 1 19 19 SER N N 19 119.891 119.891 117.205 2.686 25148 4128 1 7 . 1 1 19 19 SER HA H 19 4.362 4.362 4.898 -0.536 25148 4129 1 7 . 1 1 19 19 SER CA C 19 58.476 58.476 57.501 0.975 25148 4130 1 7 . 1 1 19 19 SER CB C 19 63.533 63.533 65.437 -1.904 25148 4131 1 7 . 1 1 19 19 SER H H 19 8.253 8.253 8.267 -0.014 25148 4132 1 7 . 1 1 20 20 LYS N N 20 124.782 124.782 125.400 -0.618 25148 4133 1 7 . 1 1 20 20 LYS HA H 20 4.137 4.137 4.056 0.081 25148 4134 1 7 . 1 1 20 20 LYS C C 20 177.889 177.889 177.634 0.255 25148 4135 1 7 . 1 1 20 20 LYS CA C 20 59.485 59.485 59.036 0.449 25148 4136 1 7 . 1 1 20 20 LYS CB C 20 32.711 32.711 32.515 0.196 25148 4137 1 7 . 1 1 20 20 LYS H H 20 8.918 8.918 8.811 0.107 25148 4138 1 7 . 1 1 21 21 GLU N N 21 117.831 117.831 120.050 -2.219 25148 4139 1 7 . 1 1 21 21 GLU HA H 21 3.957 3.957 4.077 -0.120 25148 4140 1 7 . 1 1 21 21 GLU C C 21 178.822 178.822 178.772 0.050 25148 4141 1 7 . 1 1 21 21 GLU CA C 21 59.529 59.529 59.028 0.501 25148 4142 1 7 . 1 1 21 21 GLU CB C 21 29.237 29.237 29.128 0.109 25148 4143 1 7 . 1 1 21 21 GLU H H 21 8.361 8.361 8.566 -0.205 25148 4144 1 7 . 1 1 22 22 ILE N N 22 118.690 118.690 117.555 1.135 25148 4145 1 7 . 1 1 22 22 ILE HA H 22 3.884 3.884 3.940 -0.056 25148 4146 1 7 . 1 1 22 22 ILE C C 22 179.247 179.247 177.546 1.701 25148 4147 1 7 . 1 1 22 22 ILE CA C 22 63.735 63.735 63.718 0.017 25148 4148 1 7 . 1 1 22 22 ILE CB C 22 37.415 37.415 37.979 -0.564 25148 4149 1 7 . 1 1 22 22 ILE H H 22 7.353 7.353 7.386 -0.033 25148 4150 1 7 . 1 1 23 23 ILE N N 23 120.880 120.880 120.923 -0.043 25148 4151 1 7 . 1 1 23 23 ILE HA H 23 3.733 3.733 3.730 0.003 25148 4152 1 7 . 1 1 23 23 ILE C C 23 177.817 177.817 177.925 -0.108 25148 4153 1 7 . 1 1 23 23 ILE CA C 23 64.172 64.172 63.365 0.807 25148 4154 1 7 . 1 1 23 23 ILE CB C 23 36.473 36.473 36.809 -0.336 25148 4155 1 7 . 1 1 23 23 ILE H H 23 7.571 7.571 7.140 0.431 25148 4156 1 7 . 1 1 24 24 ILE N N 24 121.460 121.460 119.380 2.080 25148 4157 1 7 . 1 1 24 24 ILE HA H 24 3.486 3.486 3.574 -0.088 25148 4158 1 7 . 1 1 24 24 ILE C C 24 177.759 177.759 177.813 -0.054 25148 4159 1 7 . 1 1 24 24 ILE CA C 24 66.641 66.641 66.125 0.516 25148 4160 1 7 . 1 1 24 24 ILE CB C 24 37.307 37.307 37.411 -0.104 25148 4161 1 7 . 1 1 24 24 ILE H H 24 8.709 8.709 8.284 0.425 25148 4162 1 7 . 1 1 25 25 GLU N N 25 119.323 119.323 118.500 0.823 25148 4163 1 7 . 1 1 25 25 GLU HA H 25 4.177 4.177 4.294 -0.117 25148 4164 1 7 . 1 1 25 25 GLU C C 25 179.348 179.348 178.593 0.755 25148 4165 1 7 . 1 1 25 25 GLU CA C 25 59.951 59.951 58.797 1.154 25148 4166 1 7 . 1 1 25 25 GLU CB C 25 29.340 29.340 29.314 0.026 25148 4167 1 7 . 1 1 25 25 GLU H H 25 8.048 8.048 8.038 0.010 25148 4168 1 7 . 1 1 26 26 ALA N N 26 122.390 122.390 122.667 -0.277 25148 4169 1 7 . 1 1 26 26 ALA HA H 26 4.325 4.325 4.144 0.181 25148 4170 1 7 . 1 1 26 26 ALA C C 26 181.440 181.440 179.665 1.775 25148 4171 1 7 . 1 1 26 26 ALA CA C 26 54.935 54.935 54.753 0.182 25148 4172 1 7 . 1 1 26 26 ALA CB C 26 17.834 17.834 18.309 -0.475 25148 4173 1 7 . 1 1 26 26 ALA H H 26 7.768 7.768 7.834 -0.066 25148 4174 1 7 . 1 1 27 27 ILE N N 27 122.342 122.342 119.773 2.569 25148 4175 1 7 . 1 1 27 27 ILE HA H 27 3.575 3.575 3.655 -0.080 25148 4176 1 7 . 1 1 27 27 ILE C C 27 177.541 177.541 177.815 -0.274 25148 4177 1 7 . 1 1 27 27 ILE CA C 27 66.536 66.536 65.522 1.014 25148 4178 1 7 . 1 1 27 27 ILE CB C 27 37.886 37.886 37.995 -0.109 25148 4179 1 7 . 1 1 27 27 ILE H H 27 8.805 8.805 7.672 1.133 25148 4180 1 7 . 1 1 28 28 GLU N N 28 120.188 120.188 119.437 0.751 25148 4181 1 7 . 1 1 28 28 GLU HA H 28 3.687 3.687 3.965 -0.278 25148 4182 1 7 . 1 1 28 28 GLU C C 28 178.707 178.707 178.834 -0.127 25148 4183 1 7 . 1 1 28 28 GLU CA C 28 61.458 61.458 59.484 1.974 25148 4184 1 7 . 1 1 28 28 GLU CB C 28 29.624 29.624 28.912 0.712 25148 4185 1 7 . 1 1 28 28 GLU H H 28 8.882 8.882 7.672 1.210 25148 4186 1 7 . 1 1 29 29 ALA N N 29 119.293 119.293 122.074 -2.781 25148 4187 1 7 . 1 1 29 29 ALA HA H 29 4.214 4.214 3.973 0.241 25148 4188 1 7 . 1 1 29 29 ALA C C 29 181.200 181.200 179.552 1.648 25148 4189 1 7 . 1 1 29 29 ALA CA C 29 55.435 55.435 54.917 0.518 25148 4190 1 7 . 1 1 29 29 ALA CB C 29 18.090 18.090 18.204 -0.114 25148 4191 1 7 . 1 1 29 29 ALA H H 29 8.065 8.065 7.863 0.202 25148 4192 1 7 . 1 1 30 30 ALA N N 30 121.729 121.729 121.353 0.376 25148 4193 1 7 . 1 1 30 30 ALA HA H 30 4.307 4.307 4.150 0.157 25148 4194 1 7 . 1 1 30 30 ALA C C 30 181.315 181.315 179.565 1.750 25148 4195 1 7 . 1 1 30 30 ALA CA C 30 54.594 54.594 54.653 -0.059 25148 4196 1 7 . 1 1 30 30 ALA CB C 30 18.704 18.704 18.366 0.338 25148 4197 1 7 . 1 1 30 30 ALA H H 30 8.099 8.099 7.517 0.582 25148 4198 1 7 . 1 1 31 31 LEU N N 31 120.900 120.900 121.124 -0.224 25148 4199 1 7 . 1 1 31 31 LEU HA H 31 4.347 4.347 4.074 0.273 25148 4200 1 7 . 1 1 31 31 LEU C C 31 179.137 179.137 179.059 0.078 25148 4201 1 7 . 1 1 31 31 LEU CA C 31 57.569 57.569 59.125 -1.556 25148 4202 1 7 . 1 1 31 31 LEU CB C 31 42.353 42.353 42.024 0.329 25148 4203 1 7 . 1 1 31 31 LEU H H 31 8.863 8.863 7.518 1.345 25148 4204 1 7 . 1 1 32 32 ILE N N 32 122.410 122.410 118.708 3.702 25148 4205 1 7 . 1 1 32 32 ILE HA H 32 3.699 3.699 3.662 0.037 25148 4206 1 7 . 1 1 32 32 ILE C C 32 178.303 178.303 177.742 0.561 25148 4207 1 7 . 1 1 32 32 ILE CA C 32 66.066 66.066 65.388 0.678 25148 4208 1 7 . 1 1 32 32 ILE CB C 32 37.882 37.882 37.967 -0.085 25148 4209 1 7 . 1 1 32 32 ILE H H 32 8.234 8.234 8.392 -0.158 25148 4210 1 7 . 1 1 33 33 SER N N 33 114.201 114.201 115.729 -1.528 25148 4211 1 7 . 1 1 33 33 SER HA H 33 4.311 4.311 4.240 0.071 25148 4212 1 7 . 1 1 33 33 SER C C 33 177.012 177.012 176.536 0.476 25148 4213 1 7 . 1 1 33 33 SER CA C 33 61.860 61.860 61.382 0.478 25148 4214 1 7 . 1 1 33 33 SER CB C 33 62.508 62.508 62.945 -0.437 25148 4215 1 7 . 1 1 33 33 SER H H 33 7.558 7.558 7.749 -0.191 25148 4216 1 7 . 1 1 34 34 ALA N N 34 122.893 122.893 124.784 -1.891 25148 4217 1 7 . 1 1 34 34 ALA HA H 34 4.215 4.215 4.145 0.070 25148 4218 1 7 . 1 1 34 34 ALA C C 34 180.814 180.814 179.273 1.541 25148 4219 1 7 . 1 1 34 34 ALA CA C 34 55.283 55.283 54.924 0.359 25148 4220 1 7 . 1 1 34 34 ALA CB C 34 18.273 18.273 18.342 -0.069 25148 4221 1 7 . 1 1 34 34 ALA H H 34 8.409 8.409 8.100 0.310 25148 4222 1 7 . 1 1 35 35 TYR N N 35 120.259 120.259 118.926 1.333 25148 4223 1 7 . 1 1 35 35 TYR HA H 35 4.393 4.393 4.432 -0.039 25148 4224 1 7 . 1 1 35 35 TYR C C 35 177.892 177.892 177.978 -0.086 25148 4225 1 7 . 1 1 35 35 TYR CA C 35 63.071 63.071 60.590 2.481 25148 4226 1 7 . 1 1 35 35 TYR CB C 35 38.021 38.021 39.127 -1.106 25148 4227 1 7 . 1 1 35 35 TYR H H 35 8.975 8.975 8.339 0.636 25148 4228 1 7 . 1 1 36 36 LYS N N 36 120.942 120.942 120.543 0.399 25148 4229 1 7 . 1 1 36 36 LYS HA H 36 4.032 4.032 4.033 -0.001 25148 4230 1 7 . 1 1 36 36 LYS C C 36 177.797 177.797 177.948 -0.151 25148 4231 1 7 . 1 1 36 36 LYS CA C 36 59.900 59.900 59.108 0.792 25148 4232 1 7 . 1 1 36 36 LYS CB C 36 32.429 32.429 32.210 0.219 25148 4233 1 7 . 1 1 36 36 LYS H H 36 8.654 8.654 7.954 0.700 25148 4234 1 7 . 1 1 37 37 ARG N N 37 115.139 115.139 115.858 -0.719 25148 4235 1 7 . 1 1 37 37 ARG HA H 37 4.101 4.101 4.109 -0.008 25148 4236 1 7 . 1 1 37 37 ARG C C 37 177.517 177.517 178.095 -0.578 25148 4237 1 7 . 1 1 37 37 ARG CA C 37 58.276 58.276 58.011 0.265 25148 4238 1 7 . 1 1 37 37 ARG CB C 37 31.014 31.014 29.935 1.079 25148 4239 1 7 . 1 1 37 37 ARG H H 37 8.138 8.138 7.756 0.382 25148 4240 1 7 . 1 1 38 38 ASN N N 38 112.555 112.555 117.678 -5.123 25148 4241 1 7 . 1 1 38 38 ASN HA H 38 4.540 4.540 4.271 0.269 25148 4242 1 7 . 1 1 38 38 ASN C C 38 173.994 173.994 175.285 -1.291 25148 4243 1 7 . 1 1 38 38 ASN CA C 38 54.722 54.722 55.311 -0.589 25148 4244 1 7 . 1 1 38 38 ASN CB C 38 42.077 42.077 38.799 3.278 25148 4245 1 7 . 1 1 38 38 ASN H H 38 7.426 7.426 7.648 -0.222 25148 4246 1 7 . 1 1 39 39 PHE N N 39 116.711 116.711 117.699 -0.988 25148 4247 1 7 . 1 1 39 39 PHE HA H 39 4.569 4.569 4.799 -0.230 25148 4248 1 7 . 1 1 39 39 PHE CA C 39 58.913 58.913 55.742 3.171 25148 4249 1 7 . 1 1 39 39 PHE CB C 39 39.781 39.781 38.493 1.288 25148 4250 1 7 . 1 1 39 39 PHE H H 39 7.959 7.959 7.322 0.637 25148 4251 1 7 . 1 1 40 40 ASN HA H 40 4.018 4.018 4.543 -0.525 25148 4252 1 7 . 1 1 40 40 ASN CA C 40 58.944 58.944 55.164 3.780 25148 4253 1 7 . 1 1 41 41 GLN HA H 41 4.298 4.298 4.515 -0.217 25148 4254 1 7 . 1 1 41 41 GLN C C 41 175.237 175.237 175.566 -0.329 25148 4255 1 7 . 1 1 41 41 GLN CA C 41 57.360 57.360 56.408 0.952 25148 4256 1 7 . 1 1 41 41 GLN CB C 41 28.724 28.724 28.092 0.632 25148 4257 1 7 . 1 1 42 42 ALA N N 42 120.514 120.514 121.506 -0.992 25148 4258 1 7 . 1 1 42 42 ALA HA H 42 4.622 4.622 4.507 0.115 25148 4259 1 7 . 1 1 42 42 ALA C C 42 175.922 175.922 176.465 -0.543 25148 4260 1 7 . 1 1 42 42 ALA CA C 42 51.841 51.841 52.072 -0.231 25148 4261 1 7 . 1 1 42 42 ALA CB C 42 21.576 21.576 20.624 0.952 25148 4262 1 7 . 1 1 42 42 ALA H H 42 7.817 7.817 8.058 -0.241 25148 4263 1 7 . 1 1 43 43 GLN N N 43 117.594 117.594 115.703 1.891 25148 4264 1 7 . 1 1 43 43 GLN HA H 43 4.265 4.265 4.537 -0.272 25148 4265 1 7 . 1 1 43 43 GLN C C 43 174.942 174.942 173.662 1.280 25148 4266 1 7 . 1 1 43 43 GLN CA C 43 57.047 57.047 55.468 1.579 25148 4267 1 7 . 1 1 43 43 GLN CB C 43 30.863 30.863 31.888 -1.025 25148 4268 1 7 . 1 1 43 43 GLN H H 43 7.400 7.400 7.584 -0.184 25148 4269 1 7 . 1 1 44 44 ASN N N 44 120.467 120.467 120.089 0.378 25148 4270 1 7 . 1 1 44 44 ASN HA H 44 5.005 5.005 4.632 0.373 25148 4271 1 7 . 1 1 44 44 ASN C C 44 174.365 174.365 174.192 0.173 25148 4272 1 7 . 1 1 44 44 ASN CA C 44 52.381 52.381 53.331 -0.950 25148 4273 1 7 . 1 1 44 44 ASN CB C 44 38.177 38.177 39.269 -1.092 25148 4274 1 7 . 1 1 44 44 ASN H H 44 9.123 9.123 8.533 0.590 25148 4275 1 7 . 1 1 45 45 VAL N N 45 115.479 115.479 117.687 -2.208 25148 4276 1 7 . 1 1 45 45 VAL HA H 45 5.376 5.376 4.289 1.087 25148 4277 1 7 . 1 1 45 45 VAL C C 45 174.908 174.908 173.694 1.214 25148 4278 1 7 . 1 1 45 45 VAL CA C 45 59.022 59.022 61.486 -2.464 25148 4279 1 7 . 1 1 45 45 VAL CB C 45 35.776 35.776 35.293 0.483 25148 4280 1 7 . 1 1 45 45 VAL H H 45 7.732 7.732 8.135 -0.403 25148 4281 1 7 . 1 1 46 46 ARG N N 46 121.146 121.146 123.742 -2.596 25148 4282 1 7 . 1 1 46 46 ARG HA H 46 4.566 4.566 4.730 -0.164 25148 4283 1 7 . 1 1 46 46 ARG C C 46 173.790 173.790 174.405 -0.615 25148 4284 1 7 . 1 1 46 46 ARG CA C 46 54.762 54.762 55.327 -0.565 25148 4285 1 7 . 1 1 46 46 ARG CB C 46 33.946 33.946 32.986 0.960 25148 4286 1 7 . 1 1 46 46 ARG H H 46 8.850 8.850 8.758 0.092 25148 4287 1 7 . 1 1 47 47 VAL N N 47 122.339 122.339 124.824 -2.485 25148 4288 1 7 . 1 1 47 47 VAL HA H 47 4.741 4.741 4.570 0.171 25148 4289 1 7 . 1 1 47 47 VAL C C 47 173.541 173.541 175.697 -2.156 25148 4290 1 7 . 1 1 47 47 VAL CA C 47 60.893 60.893 61.263 -0.370 25148 4291 1 7 . 1 1 47 47 VAL CB C 47 33.563 33.563 33.152 0.411 25148 4292 1 7 . 1 1 47 47 VAL H H 47 8.444 8.444 8.439 0.005 25148 4293 1 7 . 1 1 48 48 ASP N N 48 127.701 127.701 125.818 1.883 25148 4294 1 7 . 1 1 48 48 ASP HA H 48 4.946 4.946 4.885 0.061 25148 4295 1 7 . 1 1 48 48 ASP C C 48 173.744 173.744 174.678 -0.934 25148 4296 1 7 . 1 1 48 48 ASP CA C 48 52.651 52.651 53.100 -0.449 25148 4297 1 7 . 1 1 48 48 ASP CB C 48 45.225 45.225 43.737 1.488 25148 4298 1 7 . 1 1 48 48 ASP H H 48 9.068 9.068 8.293 0.775 25148 4299 1 7 . 1 1 49 49 LEU N N 49 130.945 130.945 126.479 4.466 25148 4300 1 7 . 1 1 49 49 LEU HA H 49 4.774 4.774 4.573 0.201 25148 4301 1 7 . 1 1 49 49 LEU C C 49 174.531 174.531 175.689 -1.158 25148 4302 1 7 . 1 1 49 49 LEU CA C 49 54.337 54.337 54.847 -0.510 25148 4303 1 7 . 1 1 49 49 LEU CB C 49 43.192 43.192 43.414 -0.222 25148 4304 1 7 . 1 1 49 49 LEU H H 49 9.369 9.369 8.552 0.817 25148 4305 1 7 . 1 1 50 50 ASN N N 50 126.268 126.268 125.001 1.267 25148 4306 1 7 . 1 1 50 50 ASN HA H 50 4.629 4.629 5.014 -0.385 25148 4307 1 7 . 1 1 50 50 ASN C C 50 176.602 176.602 175.367 1.235 25148 4308 1 7 . 1 1 50 50 ASN CA C 50 54.048 54.048 52.447 1.601 25148 4309 1 7 . 1 1 50 50 ASN CB C 50 39.891 39.891 39.050 0.841 25148 4310 1 7 . 1 1 50 50 ASN H H 50 8.672 8.672 8.921 -0.249 25148 4311 1 7 . 1 1 51 51 ARG N N 51 125.897 125.897 124.655 1.242 25148 4312 1 7 . 1 1 51 51 ARG HA H 51 3.789 3.789 4.110 -0.321 25148 4313 1 7 . 1 1 51 51 ARG C C 51 175.681 175.681 176.376 -0.695 25148 4314 1 7 . 1 1 51 51 ARG CA C 51 58.162 58.162 58.443 -0.281 25148 4315 1 7 . 1 1 51 51 ARG CB C 51 29.944 29.944 29.896 0.048 25148 4316 1 7 . 1 1 51 51 ARG H H 51 8.984 8.984 8.632 0.352 25148 4317 1 7 . 1 1 52 52 GLU N N 52 116.733 116.733 118.636 -1.903 25148 4318 1 7 . 1 1 52 52 GLU HA H 52 4.368 4.368 4.241 0.127 25148 4319 1 7 . 1 1 52 52 GLU C C 52 178.049 178.049 177.365 0.684 25148 4320 1 7 . 1 1 52 52 GLU CA C 52 58.048 58.048 58.456 -0.408 25148 4321 1 7 . 1 1 52 52 GLU CB C 52 30.716 30.716 29.389 1.327 25148 4322 1 7 . 1 1 52 52 GLU H H 52 8.541 8.541 8.442 0.099 25148 4323 1 7 . 1 1 53 53 THR N N 53 106.556 106.556 109.040 -2.484 25148 4324 1 7 . 1 1 53 53 THR HA H 53 4.424 4.424 4.539 -0.115 25148 4325 1 7 . 1 1 53 53 THR C C 53 176.352 176.352 175.087 1.265 25148 4326 1 7 . 1 1 53 53 THR CA C 53 61.320 61.320 60.520 0.800 25148 4327 1 7 . 1 1 53 53 THR CB C 53 71.220 71.220 69.794 1.426 25148 4328 1 7 . 1 1 53 53 THR H H 53 8.085 8.085 7.530 0.555 25148 4329 1 7 . 1 1 54 54 GLY N N 54 111.843 111.843 110.645 1.198 25148 4330 1 7 . 1 1 54 54 GLY C C 54 172.690 172.690 174.254 -1.564 25148 4331 1 7 . 1 1 54 54 GLY CA C 54 45.417 45.417 46.287 -0.870 25148 4332 1 7 . 1 1 54 54 GLY H H 54 8.330 8.330 7.859 0.471 25148 4333 1 7 . 1 1 55 55 SER N N 55 113.844 113.844 113.770 0.074 25148 4334 1 7 . 1 1 55 55 SER HA H 55 4.279 4.279 4.660 -0.381 25148 4335 1 7 . 1 1 55 55 SER C C 55 174.127 174.127 173.003 1.124 25148 4336 1 7 . 1 1 55 55 SER CA C 55 59.229 59.229 57.790 1.439 25148 4337 1 7 . 1 1 55 55 SER CB C 55 63.939 63.939 65.221 -1.282 25148 4338 1 7 . 1 1 55 55 SER H H 55 7.653 7.653 7.526 0.127 25148 4339 1 7 . 1 1 56 56 ILE N N 56 125.286 125.286 120.150 5.136 25148 4340 1 7 . 1 1 56 56 ILE HA H 56 5.082 5.082 4.578 0.504 25148 4341 1 7 . 1 1 56 56 ILE C C 56 175.346 175.346 174.333 1.013 25148 4342 1 7 . 1 1 56 56 ILE CA C 56 59.967 59.967 60.392 -0.426 25148 4343 1 7 . 1 1 56 56 ILE CB C 56 40.165 40.165 42.238 -2.073 25148 4344 1 7 . 1 1 56 56 ILE H H 56 8.478 8.478 8.437 0.041 25148 4345 1 7 . 1 1 57 57 ARG N N 57 126.332 126.332 127.802 -1.470 25148 4346 1 7 . 1 1 57 57 ARG HA H 57 4.740 4.740 4.592 0.148 25148 4347 1 7 . 1 1 57 57 ARG C C 57 173.921 173.921 173.686 0.235 25148 4348 1 7 . 1 1 57 57 ARG CA C 57 54.311 54.311 53.817 0.494 25148 4349 1 7 . 1 1 57 57 ARG CB C 57 35.805 35.805 33.112 2.693 25148 4350 1 7 . 1 1 57 57 ARG H H 57 8.590 8.590 8.132 0.458 25148 4351 1 7 . 1 1 58 58 VAL N N 58 120.987 120.987 123.141 -2.154 25148 4352 1 7 . 1 1 58 58 VAL HA H 58 4.334 4.334 3.948 0.386 25148 4353 1 7 . 1 1 58 58 VAL C C 58 174.204 174.204 174.108 0.096 25148 4354 1 7 . 1 1 58 58 VAL CA C 58 60.861 60.861 61.763 -0.902 25148 4355 1 7 . 1 1 58 58 VAL CB C 58 33.383 33.383 31.944 1.439 25148 4356 1 7 . 1 1 58 58 VAL H H 58 8.585 8.585 8.220 0.365 25148 4357 1 7 . 1 1 59 59 PHE N N 59 124.913 124.913 126.840 -1.927 25148 4358 1 7 . 1 1 59 59 PHE HA H 59 5.046 5.046 5.432 -0.386 25148 4359 1 7 . 1 1 59 59 PHE C C 59 174.446 174.446 174.510 -0.064 25148 4360 1 7 . 1 1 59 59 PHE CA C 59 56.695 56.695 55.096 1.599 25148 4361 1 7 . 1 1 59 59 PHE CB C 59 42.779 42.779 43.071 -0.292 25148 4362 1 7 . 1 1 59 59 PHE H H 59 8.920 8.920 8.583 0.337 25148 4363 1 7 . 1 1 60 60 ALA N N 60 124.035 124.035 124.241 -0.206 25148 4364 1 7 . 1 1 60 60 ALA HA H 60 5.102 5.102 4.839 0.263 25148 4365 1 7 . 1 1 60 60 ALA C C 60 176.017 176.017 176.233 -0.216 25148 4366 1 7 . 1 1 60 60 ALA CA C 60 50.083 50.083 50.511 -0.428 25148 4367 1 7 . 1 1 60 60 ALA CB C 60 22.400 22.400 20.414 1.986 25148 4368 1 7 . 1 1 60 60 ALA H H 60 9.457 9.457 8.724 0.733 25148 4369 1 7 . 1 1 61 61 ARG N N 61 121.530 121.530 124.921 -3.391 25148 4370 1 7 . 1 1 61 61 ARG HA H 61 4.958 4.958 4.759 0.199 25148 4371 1 7 . 1 1 61 61 ARG C C 61 176.737 176.737 175.640 1.097 25148 4372 1 7 . 1 1 61 61 ARG CA C 61 55.375 55.375 55.736 -0.361 25148 4373 1 7 . 1 1 61 61 ARG CB C 61 31.230 31.230 30.412 0.818 25148 4374 1 7 . 1 1 61 61 ARG H H 61 8.447 8.447 8.840 -0.393 25148 4375 1 7 . 1 1 62 62 LYS N N 62 124.784 124.784 125.789 -1.005 25148 4376 1 7 . 1 1 62 62 LYS HA H 62 4.709 4.709 4.409 0.300 25148 4377 1 7 . 1 1 62 62 LYS C C 62 173.899 173.899 175.138 -1.239 25148 4378 1 7 . 1 1 62 62 LYS CA C 62 54.812 54.812 55.361 -0.549 25148 4379 1 7 . 1 1 62 62 LYS CB C 62 37.147 37.147 34.617 2.530 25148 4380 1 7 . 1 1 62 62 LYS H H 62 9.137 9.137 8.034 1.103 25148 4381 1 7 . 1 1 63 63 ASP N N 63 122.552 122.552 124.922 -2.370 25148 4382 1 7 . 1 1 63 63 ASP HA H 63 4.877 4.877 4.601 0.276 25148 4383 1 7 . 1 1 63 63 ASP C C 63 175.560 175.560 176.111 -0.551 25148 4384 1 7 . 1 1 63 63 ASP CA C 63 54.576 54.576 54.602 -0.026 25148 4385 1 7 . 1 1 63 63 ASP CB C 63 42.841 42.841 41.575 1.266 25148 4386 1 7 . 1 1 63 63 ASP H H 63 8.334 8.334 8.794 -0.460 25148 4387 1 7 . 1 1 64 64 VAL N N 64 123.109 123.109 126.872 -3.763 25148 4388 1 7 . 1 1 64 64 VAL HA H 64 4.557 4.557 4.583 -0.026 25148 4389 1 7 . 1 1 64 64 VAL C C 64 177.260 177.260 175.754 1.506 25148 4390 1 7 . 1 1 64 64 VAL CA C 64 62.268 62.268 62.815 -0.547 25148 4391 1 7 . 1 1 64 64 VAL CB C 64 30.348 30.348 30.892 -0.544 25148 4392 1 7 . 1 1 64 64 VAL H H 64 8.693 8.693 8.204 0.489 25148 4393 1 7 . 1 1 65 65 VAL N N 65 122.320 122.320 123.265 -0.945 25148 4394 1 7 . 1 1 65 65 VAL HA H 65 4.939 4.939 4.487 0.452 25148 4395 1 7 . 1 1 65 65 VAL C C 65 174.754 174.754 174.862 -0.108 25148 4396 1 7 . 1 1 65 65 VAL CA C 65 59.173 59.173 59.888 -0.715 25148 4397 1 7 . 1 1 65 65 VAL CB C 65 36.289 36.289 35.797 0.492 25148 4398 1 7 . 1 1 65 65 VAL H H 65 8.656 8.656 8.495 0.161 25148 4399 1 7 . 1 1 66 66 ASP N N 66 119.805 119.805 121.575 -1.770 25148 4400 1 7 . 1 1 66 66 ASP HA H 66 4.499 4.499 4.321 0.178 25148 4401 1 7 . 1 1 66 66 ASP C C 66 176.565 176.565 176.194 0.371 25148 4402 1 7 . 1 1 66 66 ASP CA C 66 57.236 57.236 56.807 0.429 25148 4403 1 7 . 1 1 66 66 ASP CB C 66 41.662 41.662 41.192 0.470 25148 4404 1 7 . 1 1 66 66 ASP H H 66 8.628 8.628 8.622 0.006 25148 4405 1 7 . 1 1 67 67 GLU N N 67 117.604 117.604 116.958 0.646 25148 4406 1 7 . 1 1 67 67 GLU HA H 67 4.350 4.350 4.562 -0.212 25148 4407 1 7 . 1 1 67 67 GLU C C 67 173.736 173.736 175.800 -2.064 25148 4408 1 7 . 1 1 67 67 GLU CA C 67 55.203 55.203 55.085 0.118 25148 4409 1 7 . 1 1 67 67 GLU CB C 67 32.240 32.240 33.032 -0.792 25148 4410 1 7 . 1 1 67 67 GLU H H 67 7.525 7.525 7.690 -0.165 25148 4411 1 7 . 1 1 68 68 VAL N N 68 125.774 125.774 123.598 2.176 25148 4412 1 7 . 1 1 68 68 VAL HA H 68 3.578 3.578 3.932 -0.354 25148 4413 1 7 . 1 1 68 68 VAL C C 68 175.885 175.885 175.575 0.310 25148 4414 1 7 . 1 1 68 68 VAL CA C 68 63.397 63.397 64.091 -0.694 25148 4415 1 7 . 1 1 68 68 VAL CB C 68 32.452 32.452 31.535 0.916 25148 4416 1 7 . 1 1 68 68 VAL H H 68 8.573 8.573 8.551 0.022 25148 4417 1 7 . 1 1 69 69 TYR N N 69 129.859 129.859 127.169 2.690 25148 4418 1 7 . 1 1 69 69 TYR HA H 69 4.642 4.642 4.620 0.022 25148 4419 1 7 . 1 1 69 69 TYR C C 69 176.100 176.100 175.511 0.589 25148 4420 1 7 . 1 1 69 69 TYR CA C 69 59.092 59.092 58.085 1.007 25148 4421 1 7 . 1 1 69 69 TYR CB C 69 39.830 39.830 40.459 -0.629 25148 4422 1 7 . 1 1 69 69 TYR H H 69 9.801 9.801 8.528 1.273 25148 4423 1 7 . 1 1 70 70 ASP N N 70 120.204 120.204 120.181 0.023 25148 4424 1 7 . 1 1 70 70 ASP HA H 70 4.772 4.772 4.943 -0.171 25148 4425 1 7 . 1 1 70 70 ASP C C 70 176.622 176.622 176.078 0.544 25148 4426 1 7 . 1 1 70 70 ASP CA C 70 52.885 52.885 53.049 -0.164 25148 4427 1 7 . 1 1 70 70 ASP CB C 70 41.878 41.878 41.067 0.811 25148 4428 1 7 . 1 1 70 70 ASP H H 70 8.348 8.348 7.783 0.565 25148 4429 1 7 . 1 1 71 71 GLN N N 71 125.440 125.440 124.158 1.282 25148 4430 1 7 . 1 1 71 71 GLN HA H 71 4.315 4.315 3.957 0.358 25148 4431 1 7 . 1 1 71 71 GLN C C 71 175.819 175.819 176.919 -1.100 25148 4432 1 7 . 1 1 71 71 GLN CA C 71 57.914 57.914 58.619 -0.705 25148 4433 1 7 . 1 1 71 71 GLN CB C 71 28.307 28.307 29.027 -0.720 25148 4434 1 7 . 1 1 71 71 GLN H H 71 9.097 9.097 8.720 0.377 25148 4435 1 7 . 1 1 72 72 ARG N N 72 116.306 116.306 114.958 1.348 25148 4436 1 7 . 1 1 72 72 ARG HA H 72 4.252 4.252 4.139 0.113 25148 4437 1 7 . 1 1 72 72 ARG C C 72 178.087 178.087 175.885 2.202 25148 4438 1 7 . 1 1 72 72 ARG CA C 72 58.532 58.532 57.757 0.775 25148 4439 1 7 . 1 1 72 72 ARG CB C 72 30.143 30.143 30.655 -0.512 25148 4440 1 7 . 1 1 72 72 ARG H H 72 8.534 8.534 7.972 0.562 25148 4441 1 7 . 1 1 73 73 LEU N N 73 116.734 116.734 113.817 2.917 25148 4442 1 7 . 1 1 73 73 LEU HA H 73 4.621 4.621 4.670 -0.049 25148 4443 1 7 . 1 1 73 73 LEU C C 73 175.946 175.946 175.051 0.895 25148 4444 1 7 . 1 1 73 73 LEU CA C 73 55.250 55.250 55.513 -0.263 25148 4445 1 7 . 1 1 73 73 LEU CB C 73 46.960 46.960 44.463 2.497 25148 4446 1 7 . 1 1 73 73 LEU H H 73 7.460 7.460 7.471 -0.011 25148 4447 1 7 . 1 1 74 74 GLU N N 74 118.787 118.787 122.045 -3.258 25148 4448 1 7 . 1 1 74 74 GLU HA H 74 5.403 5.403 4.736 0.667 25148 4449 1 7 . 1 1 74 74 GLU C C 74 173.709 173.709 174.546 -0.837 25148 4450 1 7 . 1 1 74 74 GLU CA C 74 54.914 54.914 55.727 -0.813 25148 4451 1 7 . 1 1 74 74 GLU CB C 74 35.053 35.053 33.501 1.552 25148 4452 1 7 . 1 1 74 74 GLU H H 74 7.752 7.752 8.081 -0.329 25148 4453 1 7 . 1 1 75 75 ILE N N 75 119.803 119.803 121.486 -1.683 25148 4454 1 7 . 1 1 75 75 ILE HA H 75 4.507 4.507 4.430 0.077 25148 4455 1 7 . 1 1 75 75 ILE C C 75 172.126 172.126 173.759 -1.633 25148 4456 1 7 . 1 1 75 75 ILE CA C 75 58.664 58.664 60.614 -1.950 25148 4457 1 7 . 1 1 75 75 ILE CB C 75 42.560 42.560 42.269 0.291 25148 4458 1 7 . 1 1 75 75 ILE H H 75 8.975 8.975 8.643 0.332 25148 4459 1 7 . 1 1 76 76 SER N N 76 123.236 123.236 123.883 -0.647 25148 4460 1 7 . 1 1 76 76 SER HA H 76 4.505 4.505 4.921 -0.416 25148 4461 1 7 . 1 1 76 76 SER C C 76 176.145 176.145 175.895 0.250 25148 4462 1 7 . 1 1 76 76 SER CA C 76 58.108 58.108 58.275 -0.167 25148 4463 1 7 . 1 1 76 76 SER CB C 76 65.000 65.000 64.196 0.804 25148 4464 1 7 . 1 1 76 76 SER H H 76 8.810 8.810 8.637 0.173 25148 4465 1 7 . 1 1 77 77 ILE N N 77 120.629 120.629 127.402 -6.773 25148 4466 1 7 . 1 1 77 77 ILE HA H 77 3.935 3.935 3.776 0.159 25148 4467 1 7 . 1 1 77 77 ILE C C 77 175.806 175.806 176.760 -0.954 25148 4468 1 7 . 1 1 77 77 ILE CA C 77 61.928 61.928 63.926 -1.998 25148 4469 1 7 . 1 1 77 77 ILE CB C 77 38.031 38.031 38.341 -0.310 25148 4470 1 7 . 1 1 77 77 ILE H H 77 8.321 8.321 8.170 0.151 25148 4471 1 7 . 1 1 78 78 GLU N N 78 121.032 121.032 117.362 3.670 25148 4472 1 7 . 1 1 78 78 GLU HA H 78 4.082 4.082 4.021 0.061 25148 4473 1 7 . 1 1 78 78 GLU C C 78 179.829 179.829 178.441 1.388 25148 4474 1 7 . 1 1 78 78 GLU CA C 78 60.180 60.180 58.867 1.313 25148 4475 1 7 . 1 1 78 78 GLU CB C 78 28.988 28.988 28.908 0.080 25148 4476 1 7 . 1 1 78 78 GLU H H 78 8.222 8.222 8.260 -0.038 25148 4477 1 7 . 1 1 79 79 GLU N N 79 120.710 120.710 121.180 -0.470 25148 4478 1 7 . 1 1 79 79 GLU HA H 79 4.012 4.012 4.107 -0.095 25148 4479 1 7 . 1 1 79 79 GLU C C 79 180.339 180.339 179.014 1.325 25148 4480 1 7 . 1 1 79 79 GLU CA C 79 59.332 59.332 58.800 0.532 25148 4481 1 7 . 1 1 79 79 GLU CB C 79 29.317 29.317 29.522 -0.205 25148 4482 1 7 . 1 1 79 79 GLU H H 79 7.908 7.908 7.611 0.297 25148 4483 1 7 . 1 1 80 80 ALA N N 80 122.879 122.879 122.005 0.874 25148 4484 1 7 . 1 1 80 80 ALA HA H 80 3.966 3.966 4.117 -0.151 25148 4485 1 7 . 1 1 80 80 ALA C C 80 179.833 179.833 179.945 -0.112 25148 4486 1 7 . 1 1 80 80 ALA CA C 80 55.881 55.881 55.050 0.831 25148 4487 1 7 . 1 1 80 80 ALA CB C 80 18.870 18.870 18.050 0.820 25148 4488 1 7 . 1 1 80 80 ALA H H 80 9.132 9.132 7.971 1.161 25148 4489 1 7 . 1 1 81 81 GLN N N 81 115.829 115.829 116.893 -1.064 25148 4490 1 7 . 1 1 81 81 GLN HA H 81 4.749 4.749 4.299 0.450 25148 4491 1 7 . 1 1 81 81 GLN C C 81 178.126 178.126 178.024 0.102 25148 4492 1 7 . 1 1 81 81 GLN CA C 81 57.682 57.682 58.096 -0.414 25148 4493 1 7 . 1 1 81 81 GLN CB C 81 27.307 27.307 28.607 -1.300 25148 4494 1 7 . 1 1 81 81 GLN H H 81 8.709 8.709 7.781 0.928 25148 4495 1 7 . 1 1 82 82 GLY N N 82 105.531 105.531 106.633 -1.102 25148 4496 1 7 . 1 1 82 82 GLY C C 82 174.917 174.917 175.064 -0.147 25148 4497 1 7 . 1 1 82 82 GLY CA C 82 45.915 45.915 46.542 -0.627 25148 4498 1 7 . 1 1 82 82 GLY H H 82 7.479 7.479 7.962 -0.483 25148 4499 1 7 . 1 1 83 83 ILE N N 83 122.828 122.828 113.725 9.103 25148 4500 1 7 . 1 1 83 83 ILE HA H 83 3.970 3.970 4.432 -0.462 25148 4501 1 7 . 1 1 83 83 ILE C C 83 177.209 177.209 175.521 1.688 25148 4502 1 7 . 1 1 83 83 ILE CA C 83 64.305 64.305 61.638 2.667 25148 4503 1 7 . 1 1 83 83 ILE CB C 83 38.452 38.452 40.235 -1.783 25148 4504 1 7 . 1 1 83 83 ILE H H 83 7.634 7.634 7.589 0.045 25148 4505 1 7 . 1 1 84 84 HIS N N 84 118.927 118.927 120.080 -1.153 25148 4506 1 7 . 1 1 84 84 HIS HA H 84 4.713 4.713 4.933 -0.220 25148 4507 1 7 . 1 1 84 84 HIS CA C 84 55.487 55.487 54.406 1.081 25148 4508 1 7 . 1 1 84 84 HIS CB C 84 33.506 33.506 32.239 1.267 25148 4509 1 7 . 1 1 84 84 HIS H H 84 8.155 8.155 8.410 -0.255 25148 4510 1 7 . 1 1 85 85 PRO HA H 85 4.456 4.456 4.607 -0.151 25148 4511 1 7 . 1 1 85 85 PRO C C 85 177.357 177.357 177.222 0.135 25148 4512 1 7 . 1 1 85 85 PRO CA C 85 64.475 64.475 64.076 0.399 25148 4513 1 7 . 1 1 85 85 PRO CB C 85 32.489 32.489 32.112 0.377 25148 4514 1 7 . 1 1 86 86 GLU N N 86 116.314 116.314 117.455 -1.141 25148 4515 1 7 . 1 1 86 86 GLU HA H 86 4.286 4.286 4.171 0.115 25148 4516 1 7 . 1 1 86 86 GLU C C 86 177.624 177.624 177.241 0.383 25148 4517 1 7 . 1 1 86 86 GLU CA C 86 56.619 56.619 56.761 -0.142 25148 4518 1 7 . 1 1 86 86 GLU CB C 86 29.389 29.389 29.540 -0.151 25148 4519 1 7 . 1 1 86 86 GLU H H 86 8.938 8.938 7.786 1.152 25148 4520 1 7 . 1 1 87 87 TYR N N 87 119.773 119.773 120.278 -0.505 25148 4521 1 7 . 1 1 87 87 TYR HA H 87 4.744 4.744 4.176 0.568 25148 4522 1 7 . 1 1 87 87 TYR C C 87 174.533 174.533 176.101 -1.568 25148 4523 1 7 . 1 1 87 87 TYR CA C 87 59.117 59.117 59.635 -0.518 25148 4524 1 7 . 1 1 87 87 TYR CB C 87 38.859 38.859 38.680 0.179 25148 4525 1 7 . 1 1 87 87 TYR H H 87 7.447 7.447 7.371 0.076 25148 4526 1 7 . 1 1 88 88 MET N N 88 118.298 118.298 117.323 0.975 25148 4527 1 7 . 1 1 88 88 MET HA H 88 4.770 4.770 4.710 0.060 25148 4528 1 7 . 1 1 88 88 MET C C 88 175.638 175.638 173.936 1.702 25148 4529 1 7 . 1 1 88 88 MET CA C 88 53.133 53.133 54.687 -1.554 25148 4530 1 7 . 1 1 88 88 MET CB C 88 37.102 37.102 35.353 1.749 25148 4531 1 7 . 1 1 88 88 MET H H 88 9.023 9.023 8.372 0.651 25148 4532 1 7 . 1 1 89 89 VAL N N 89 120.157 120.157 124.469 -4.312 25148 4533 1 7 . 1 1 89 89 VAL HA H 89 3.330 3.330 3.584 -0.254 25148 4534 1 7 . 1 1 89 89 VAL C C 89 177.432 177.432 176.803 0.629 25148 4535 1 7 . 1 1 89 89 VAL CA C 89 65.675 65.675 65.095 0.580 25148 4536 1 7 . 1 1 89 89 VAL CB C 89 31.321 31.321 30.660 0.661 25148 4537 1 7 . 1 1 89 89 VAL H H 89 8.313 8.313 8.607 -0.294 25148 4538 1 7 . 1 1 90 90 GLY N N 90 116.935 116.935 116.476 0.459 25148 4539 1 7 . 1 1 90 90 GLY C C 90 175.196 175.196 174.199 0.997 25148 4540 1 7 . 1 1 90 90 GLY CA C 90 44.685 44.685 44.737 -0.052 25148 4541 1 7 . 1 1 90 90 GLY H H 90 8.551 8.551 8.831 -0.280 25148 4542 1 7 . 1 1 91 91 ASP N N 91 121.616 121.616 121.697 -0.081 25148 4543 1 7 . 1 1 91 91 ASP HA H 91 4.790 4.790 4.903 -0.113 25148 4544 1 7 . 1 1 91 91 ASP C C 91 174.431 174.431 175.089 -0.658 25148 4545 1 7 . 1 1 91 91 ASP CA C 91 55.011 55.011 53.757 1.254 25148 4546 1 7 . 1 1 91 91 ASP CB C 91 42.079 42.079 42.290 -0.211 25148 4547 1 7 . 1 1 91 91 ASP H H 91 8.073 8.073 7.994 0.079 25148 4548 1 7 . 1 1 92 92 VAL N N 92 118.919 118.919 115.538 3.381 25148 4549 1 7 . 1 1 92 92 VAL HA H 92 4.709 4.709 4.946 -0.237 25148 4550 1 7 . 1 1 92 92 VAL C C 92 175.602 175.602 173.894 1.708 25148 4551 1 7 . 1 1 92 92 VAL CA C 92 61.527 61.527 60.005 1.522 25148 4552 1 7 . 1 1 92 92 VAL CB C 92 34.110 34.110 34.863 -0.753 25148 4553 1 7 . 1 1 92 92 VAL H H 92 8.216 8.216 7.991 0.225 25148 4554 1 7 . 1 1 93 93 VAL N N 93 123.922 123.922 122.102 1.820 25148 4555 1 7 . 1 1 93 93 VAL HA H 93 4.231 4.231 4.240 -0.009 25148 4556 1 7 . 1 1 93 93 VAL C C 93 174.105 174.105 173.957 0.148 25148 4557 1 7 . 1 1 93 93 VAL CA C 93 59.644 59.644 59.010 0.635 25148 4558 1 7 . 1 1 93 93 VAL CB C 93 34.661 34.661 35.212 -0.551 25148 4559 1 7 . 1 1 93 93 VAL H H 93 8.812 8.812 7.839 0.973 25148 4560 1 7 . 1 1 94 94 GLU N N 94 123.605 123.605 128.466 -4.861 25148 4561 1 7 . 1 1 94 94 GLU HA H 94 5.347 5.347 5.143 0.204 25148 4562 1 7 . 1 1 94 94 GLU C C 94 175.708 175.708 175.621 0.087 25148 4563 1 7 . 1 1 94 94 GLU CA C 94 54.979 54.979 55.125 -0.146 25148 4564 1 7 . 1 1 94 94 GLU CB C 94 31.612 31.612 30.904 0.708 25148 4565 1 7 . 1 1 94 94 GLU H H 94 8.312 8.312 8.276 0.036 25148 4566 1 7 . 1 1 95 95 ILE N N 95 123.581 123.581 124.776 -1.195 25148 4567 1 7 . 1 1 95 95 ILE HA H 95 4.601 4.601 4.426 0.175 25148 4568 1 7 . 1 1 95 95 ILE C C 95 175.081 175.081 175.491 -0.410 25148 4569 1 7 . 1 1 95 95 ILE CA C 95 58.601 58.601 59.587 -0.986 25148 4570 1 7 . 1 1 95 95 ILE CB C 95 41.727 41.727 41.099 0.628 25148 4571 1 7 . 1 1 95 95 ILE H H 95 9.045 9.045 8.008 1.037 25148 4572 1 7 . 1 1 96 96 GLU N N 96 128.094 128.094 128.005 0.089 25148 4573 1 7 . 1 1 96 96 GLU HA H 96 4.098 4.098 4.412 -0.314 25148 4574 1 7 . 1 1 96 96 GLU C C 96 176.845 176.845 175.777 1.068 25148 4575 1 7 . 1 1 96 96 GLU CA C 96 57.853 57.853 58.022 -0.169 25148 4576 1 7 . 1 1 96 96 GLU CB C 96 28.323 28.323 29.384 -1.061 25148 4577 1 7 . 1 1 96 96 GLU H H 96 9.256 9.256 8.892 0.364 25148 4578 1 7 . 1 1 97 97 VAL N N 97 118.446 118.446 124.360 -5.914 25148 4579 1 7 . 1 1 97 97 VAL HA H 97 4.568 4.568 4.228 0.340 25148 4580 1 7 . 1 1 97 97 VAL C C 97 175.051 175.051 174.809 0.242 25148 4581 1 7 . 1 1 97 97 VAL CA C 97 59.796 59.796 61.220 -1.424 25148 4582 1 7 . 1 1 97 97 VAL CB C 97 32.399 32.399 33.040 -0.641 25148 4583 1 7 . 1 1 97 97 VAL H H 97 8.609 8.609 8.883 -0.274 25148 4584 1 7 . 1 1 98 98 THR N N 98 119.118 119.118 119.087 0.031 25148 4585 1 7 . 1 1 98 98 THR HA H 98 3.320 3.320 3.955 -0.635 25148 4586 1 7 . 1 1 98 98 THR CA C 98 61.628 61.628 59.586 2.042 25148 4587 1 7 . 1 1 98 98 THR CB C 98 70.031 70.031 69.311 0.720 25148 4588 1 7 . 1 1 98 98 THR H H 98 7.396 7.396 7.474 -0.078 25148 4589 1 7 . 1 1 99 99 PRO HA H 99 4.458 4.458 4.647 -0.189 25148 4590 1 7 . 1 1 99 99 PRO CA C 99 62.348 62.348 62.517 -0.169 25148 4591 1 7 . 1 1 99 99 PRO CB C 99 33.182 33.182 32.622 0.560 25148 4592 1 7 . 1 1 100 100 LYS HA H 100 4.126 4.126 4.200 -0.074 25148 4593 1 7 . 1 1 100 100 LYS CA C 100 58.773 58.773 57.983 0.790 25148 4594 1 7 . 1 1 100 100 LYS CB C 100 32.195 32.195 32.352 -0.157 25148 4595 1 7 . 1 1 101 101 ASP HA H 101 4.924 4.924 4.807 0.117 25148 4596 1 7 . 1 1 101 101 ASP C C 101 176.884 176.884 176.567 0.317 25148 4597 1 7 . 1 1 101 101 ASP CA C 101 54.134 54.134 54.089 0.045 25148 4598 1 7 . 1 1 101 101 ASP CB C 101 40.272 40.272 40.708 -0.436 25148 4599 1 7 . 1 1 102 102 PHE N N 102 118.703 118.703 121.664 -2.961 25148 4600 1 7 . 1 1 102 102 PHE HA H 102 4.295 4.295 4.250 0.045 25148 4601 1 7 . 1 1 102 102 PHE C C 102 176.477 176.477 177.018 -0.541 25148 4602 1 7 . 1 1 102 102 PHE CA C 102 60.748 60.748 60.139 0.609 25148 4603 1 7 . 1 1 102 102 PHE CB C 102 39.667 39.667 39.158 0.509 25148 4604 1 7 . 1 1 102 102 PHE H H 102 7.862 7.862 7.712 0.150 25148 4605 1 7 . 1 1 103 103 GLY CA C 103 47.430 47.430 47.295 0.135 25148 4606 1 7 . 1 1 104 104 ARG N N 104 121.819 121.819 120.544 1.275 25148 4607 1 7 . 1 1 104 104 ARG HA H 104 4.176 4.176 4.191 -0.015 25148 4608 1 7 . 1 1 104 104 ARG C C 104 178.912 178.912 178.492 0.420 25148 4609 1 7 . 1 1 104 104 ARG CA C 104 59.235 59.235 57.772 1.463 25148 4610 1 7 . 1 1 104 104 ARG CB C 104 30.000 30.000 30.196 -0.196 25148 4611 1 7 . 1 1 104 104 ARG H H 104 7.809 7.809 7.528 0.281 25148 4612 1 7 . 1 1 105 105 ILE N N 105 120.331 120.331 120.633 -0.302 25148 4613 1 7 . 1 1 105 105 ILE HA H 105 3.836 3.836 3.667 0.169 25148 4614 1 7 . 1 1 105 105 ILE C C 105 179.206 179.206 177.732 1.474 25148 4615 1 7 . 1 1 105 105 ILE CA C 105 63.025 63.025 64.749 -1.724 25148 4616 1 7 . 1 1 105 105 ILE CB C 105 38.127 38.127 37.352 0.775 25148 4617 1 7 . 1 1 105 105 ILE H H 105 7.203 7.203 7.448 -0.245 25148 4618 1 7 . 1 1 106 106 ALA N N 106 124.867 124.867 121.961 2.906 25148 4619 1 7 . 1 1 106 106 ALA HA H 106 3.665 3.665 3.551 0.114 25148 4620 1 7 . 1 1 106 106 ALA C C 106 178.590 178.590 178.954 -0.364 25148 4621 1 7 . 1 1 106 106 ALA CA C 106 54.842 54.842 55.255 -0.414 25148 4622 1 7 . 1 1 106 106 ALA CB C 106 18.659 18.659 17.676 0.983 25148 4623 1 7 . 1 1 106 106 ALA H H 106 8.813 8.813 8.203 0.610 25148 4624 1 7 . 1 1 107 107 ALA N N 107 119.597 119.597 120.832 -1.235 25148 4625 1 7 . 1 1 107 107 ALA HA H 107 4.014 4.014 3.958 0.056 25148 4626 1 7 . 1 1 107 107 ALA C C 107 180.214 180.214 179.615 0.599 25148 4627 1 7 . 1 1 107 107 ALA CA C 107 55.454 55.454 54.872 0.582 25148 4628 1 7 . 1 1 107 107 ALA CB C 107 18.260 18.260 17.969 0.291 25148 4629 1 7 . 1 1 107 107 ALA H H 107 8.012 8.012 7.617 0.395 25148 4630 1 7 . 1 1 108 108 GLN N N 108 116.896 116.896 118.364 -1.468 25148 4631 1 7 . 1 1 108 108 GLN HA H 108 4.054 4.054 3.981 0.073 25148 4632 1 7 . 1 1 108 108 GLN C C 108 178.784 178.784 178.580 0.204 25148 4633 1 7 . 1 1 108 108 GLN CA C 108 58.705 58.705 59.042 -0.337 25148 4634 1 7 . 1 1 108 108 GLN CB C 108 28.647 28.647 28.737 -0.090 25148 4635 1 7 . 1 1 108 108 GLN H H 108 7.498 7.498 8.046 -0.548 25148 4636 1 7 . 1 1 109 109 THR N N 109 117.495 117.495 116.052 1.443 25148 4637 1 7 . 1 1 109 109 THR HA H 109 3.917 3.917 4.082 -0.165 25148 4638 1 7 . 1 1 109 109 THR C C 109 175.732 175.732 176.113 -0.381 25148 4639 1 7 . 1 1 109 109 THR CA C 109 66.989 66.989 65.390 1.599 25148 4640 1 7 . 1 1 109 109 THR CB C 109 68.766 68.766 68.809 -0.043 25148 4641 1 7 . 1 1 109 109 THR H H 109 8.203 8.203 8.103 0.100 25148 4642 1 7 . 1 1 110 110 ALA N N 110 122.308 122.308 124.579 -2.271 25148 4643 1 7 . 1 1 110 110 ALA HA H 110 3.854 3.854 4.039 -0.185 25148 4644 1 7 . 1 1 110 110 ALA C C 110 178.380 178.380 178.855 -0.475 25148 4645 1 7 . 1 1 110 110 ALA CA C 110 55.903 55.903 55.025 0.878 25148 4646 1 7 . 1 1 110 110 ALA CB C 110 18.524 18.524 18.446 0.078 25148 4647 1 7 . 1 1 110 110 ALA H H 110 8.668 8.668 8.108 0.560 25148 4648 1 7 . 1 1 111 111 LYS N N 111 115.552 115.552 118.244 -2.692 25148 4649 1 7 . 1 1 111 111 LYS HA H 111 3.923 3.923 3.977 -0.054 25148 4650 1 7 . 1 1 111 111 LYS C C 111 179.111 179.111 178.546 0.565 25148 4651 1 7 . 1 1 111 111 LYS CA C 111 59.825 59.825 59.100 0.725 25148 4652 1 7 . 1 1 111 111 LYS CB C 111 32.251 32.251 31.743 0.508 25148 4653 1 7 . 1 1 111 111 LYS H H 111 7.642 7.642 8.469 -0.827 25148 4654 1 7 . 1 1 112 112 GLN N N 112 120.178 120.178 119.348 0.830 25148 4655 1 7 . 1 1 112 112 GLN HA H 112 4.060 4.060 4.099 -0.039 25148 4656 1 7 . 1 1 112 112 GLN C C 112 178.355 178.355 178.098 0.257 25148 4657 1 7 . 1 1 112 112 GLN CA C 112 59.240 59.240 58.476 0.764 25148 4658 1 7 . 1 1 112 112 GLN CB C 112 28.250 28.250 27.898 0.352 25148 4659 1 7 . 1 1 112 112 GLN H H 112 7.798 7.798 7.689 0.109 25148 4660 1 7 . 1 1 113 113 VAL N N 113 119.799 119.799 119.800 -0.001 25148 4661 1 7 . 1 1 113 113 VAL HA H 113 3.705 3.705 4.091 -0.386 25148 4662 1 7 . 1 1 113 113 VAL C C 113 178.303 178.303 178.260 0.043 25148 4663 1 7 . 1 1 113 113 VAL CA C 113 66.277 66.277 65.162 1.115 25148 4664 1 7 . 1 1 113 113 VAL CB C 113 31.954 31.954 31.745 0.209 25148 4665 1 7 . 1 1 113 113 VAL H H 113 8.105 8.105 7.354 0.751 25148 4666 1 7 . 1 1 114 114 VAL N N 114 118.265 118.265 117.004 1.261 25148 4667 1 7 . 1 1 114 114 VAL HA H 114 3.392 3.392 3.553 -0.161 25148 4668 1 7 . 1 1 114 114 VAL C C 114 177.360 177.360 178.033 -0.673 25148 4669 1 7 . 1 1 114 114 VAL CA C 114 67.832 67.832 66.582 1.250 25148 4670 1 7 . 1 1 114 114 VAL CB C 114 31.801 31.801 31.024 0.777 25148 4671 1 7 . 1 1 114 114 VAL H H 114 8.180 8.180 7.749 0.431 25148 4672 1 7 . 1 1 115 115 THR N N 115 113.460 113.460 115.340 -1.880 25148 4673 1 7 . 1 1 115 115 THR HA H 115 3.856 3.856 3.877 -0.021 25148 4674 1 7 . 1 1 115 115 THR C C 115 176.529 176.529 177.011 -0.482 25148 4675 1 7 . 1 1 115 115 THR CA C 115 66.706 66.706 66.981 -0.275 25148 4676 1 7 . 1 1 115 115 THR CB C 115 69.008 69.008 68.350 0.658 25148 4677 1 7 . 1 1 115 115 THR H H 115 8.143 8.143 8.358 -0.215 25148 4678 1 7 . 1 1 116 116 GLN N N 116 120.129 120.129 120.133 -0.004 25148 4679 1 7 . 1 1 116 116 GLN HA H 116 4.054 4.054 4.027 0.027 25148 4680 1 7 . 1 1 116 116 GLN C C 116 178.100 178.100 178.492 -0.392 25148 4681 1 7 . 1 1 116 116 GLN CA C 116 58.950 58.950 58.963 -0.013 25148 4682 1 7 . 1 1 116 116 GLN CB C 116 28.244 28.244 28.387 -0.144 25148 4683 1 7 . 1 1 116 116 GLN H H 116 7.936 7.936 7.533 0.403 25148 4684 1 7 . 1 1 117 117 ARG N N 117 117.838 117.838 118.721 -0.883 25148 4685 1 7 . 1 1 117 117 ARG HA H 117 4.174 4.174 4.093 0.081 25148 4686 1 7 . 1 1 117 117 ARG C C 117 179.138 179.138 178.905 0.233 25148 4687 1 7 . 1 1 117 117 ARG CA C 117 57.461 57.461 58.136 -0.675 25148 4688 1 7 . 1 1 117 117 ARG CB C 117 29.548 29.548 29.365 0.183 25148 4689 1 7 . 1 1 117 117 ARG H H 117 8.240 8.240 7.667 0.573 25148 4690 1 7 . 1 1 118 118 VAL N N 118 120.278 120.278 118.706 1.572 25148 4691 1 7 . 1 1 118 118 VAL HA H 118 3.709 3.709 3.770 -0.061 25148 4692 1 7 . 1 1 118 118 VAL C C 118 177.597 177.597 177.825 -0.228 25148 4693 1 7 . 1 1 118 118 VAL CA C 118 66.246 66.246 66.064 0.182 25148 4694 1 7 . 1 1 118 118 VAL CB C 118 31.785 31.785 31.223 0.562 25148 4695 1 7 . 1 1 118 118 VAL H H 118 8.480 8.480 7.896 0.584 25148 4696 1 7 . 1 1 119 119 ARG N N 119 120.197 120.197 119.315 0.882 25148 4697 1 7 . 1 1 119 119 ARG HA H 119 4.173 4.173 4.090 0.083 25148 4698 1 7 . 1 1 119 119 ARG C C 119 178.864 178.864 178.291 0.573 25148 4699 1 7 . 1 1 119 119 ARG CA C 119 58.772 58.772 57.902 0.870 25148 4700 1 7 . 1 1 119 119 ARG CB C 119 29.873 29.873 29.460 0.413 25148 4701 1 7 . 1 1 119 119 ARG H H 119 7.899 7.899 7.917 -0.018 25148 4702 1 7 . 1 1 120 120 GLU N N 120 118.768 118.768 119.226 -0.458 25148 4703 1 7 . 1 1 120 120 GLU HA H 120 4.110 4.110 4.172 -0.062 25148 4704 1 7 . 1 1 120 120 GLU C C 120 177.823 177.823 179.647 -1.824 25148 4705 1 7 . 1 1 120 120 GLU CA C 120 58.223 58.223 58.811 -0.588 25148 4706 1 7 . 1 1 120 120 GLU CB C 120 29.854 29.854 29.454 0.400 25148 4707 1 7 . 1 1 120 120 GLU H H 120 8.084 8.084 7.794 0.290 25148 4708 1 7 . 1 1 121 121 ALA N N 121 121.984 121.984 122.393 -0.409 25148 4709 1 7 . 1 1 121 121 ALA HA H 121 4.296 4.296 4.076 0.220 25148 4710 1 7 . 1 1 121 121 ALA C C 121 178.586 178.586 178.690 -0.104 25148 4711 1 7 . 1 1 121 121 ALA CA C 121 53.475 53.475 54.795 -1.320 25148 4712 1 7 . 1 1 121 121 ALA CB C 121 18.856 18.856 18.648 0.208 25148 4713 1 7 . 1 1 121 121 ALA H H 121 7.810 7.810 8.171 -0.361 25148 4714 1 7 . 1 1 122 122 GLU N N 122 118.229 118.229 114.533 3.696 25148 4715 1 7 . 1 1 122 122 GLU HA H 122 4.241 4.241 4.398 -0.157 25148 4716 1 7 . 1 1 122 122 GLU C C 122 176.839 176.839 176.794 0.045 25148 4717 1 7 . 1 1 122 122 GLU CA C 122 57.118 57.118 55.667 1.450 25148 4718 1 7 . 1 1 122 122 GLU CB C 122 30.018 30.018 29.532 0.486 25148 4719 1 7 . 1 1 122 122 GLU H H 122 7.938 7.938 7.799 0.139 25148 4720 1 7 . 1 1 123 123 ARG N N 123 120.601 120.601 120.932 -0.331 25148 4721 1 7 . 1 1 123 123 ARG HA H 123 4.348 4.348 4.148 0.200 25148 4722 1 7 . 1 1 123 123 ARG C C 123 176.071 176.071 176.396 -0.325 25148 4723 1 7 . 1 1 123 123 ARG CA C 123 56.510 56.510 57.890 -1.380 25148 4724 1 7 . 1 1 123 123 ARG CB C 123 30.765 30.765 30.750 0.015 25148 4725 1 7 . 1 1 123 123 ARG H H 123 7.977 7.977 7.777 0.200 25148 4726 1 8 . 1 1 4 4 GLU HA H 4 4.138 4.138 4.121 0.017 25148 4727 1 8 . 1 1 4 4 GLU C C 4 179.152 179.152 177.695 1.457 25148 4728 1 8 . 1 1 4 4 GLU CA C 4 59.566 59.566 59.019 0.547 25148 4729 1 8 . 1 1 4 4 GLU CB C 4 29.407 29.407 29.325 0.082 25148 4730 1 8 . 1 1 5 5 LEU N N 5 121.360 121.360 116.866 4.494 25148 4731 1 8 . 1 1 5 5 LEU HA H 5 4.195 4.195 4.080 0.115 25148 4732 1 8 . 1 1 5 5 LEU C C 5 178.179 178.179 178.253 -0.074 25148 4733 1 8 . 1 1 5 5 LEU CA C 5 57.830 57.830 57.574 0.256 25148 4734 1 8 . 1 1 5 5 LEU CB C 5 41.630 41.630 41.202 0.428 25148 4735 1 8 . 1 1 5 5 LEU H H 5 7.877 7.877 7.933 -0.056 25148 4736 1 8 . 1 1 6 6 LEU N N 6 118.058 118.058 119.317 -1.259 25148 4737 1 8 . 1 1 6 6 LEU HA H 6 3.919 3.919 3.859 0.060 25148 4738 1 8 . 1 1 6 6 LEU C C 6 180.274 180.274 179.142 1.132 25148 4739 1 8 . 1 1 6 6 LEU CA C 6 58.221 58.221 57.690 0.531 25148 4740 1 8 . 1 1 6 6 LEU CB C 6 40.684 40.684 41.171 -0.487 25148 4741 1 8 . 1 1 6 6 LEU H H 6 7.685 7.685 7.552 0.133 25148 4742 1 8 . 1 1 7 7 ASP N N 7 120.662 120.662 118.217 2.445 25148 4743 1 8 . 1 1 7 7 ASP HA H 7 4.416 4.416 4.413 0.003 25148 4744 1 8 . 1 1 7 7 ASP C C 7 178.738 178.738 177.843 0.895 25148 4745 1 8 . 1 1 7 7 ASP CA C 7 57.519 57.519 56.480 1.039 25148 4746 1 8 . 1 1 7 7 ASP CB C 7 40.167 40.167 40.885 -0.718 25148 4747 1 8 . 1 1 7 7 ASP H H 7 8.427 8.427 7.697 0.730 25148 4748 1 8 . 1 1 8 8 ALA N N 8 122.612 122.612 123.027 -0.415 25148 4749 1 8 . 1 1 8 8 ALA HA H 8 4.146 4.146 4.020 0.126 25148 4750 1 8 . 1 1 8 8 ALA C C 8 180.787 180.787 179.844 0.943 25148 4751 1 8 . 1 1 8 8 ALA CA C 8 55.165 55.165 55.160 0.005 25148 4752 1 8 . 1 1 8 8 ALA CB C 8 17.711 17.711 18.329 -0.619 25148 4753 1 8 . 1 1 8 8 ALA H H 8 7.847 7.847 7.356 0.491 25148 4754 1 8 . 1 1 9 9 LEU N N 9 116.977 116.977 117.653 -0.676 25148 4755 1 8 . 1 1 9 9 LEU HA H 9 4.115 4.115 3.857 0.258 25148 4756 1 8 . 1 1 9 9 LEU C C 9 179.510 179.510 179.438 0.072 25148 4757 1 8 . 1 1 9 9 LEU CA C 9 57.468 57.468 58.152 -0.684 25148 4758 1 8 . 1 1 9 9 LEU CB C 9 41.203 41.203 41.434 -0.231 25148 4759 1 8 . 1 1 9 9 LEU H H 9 8.256 8.256 7.856 0.400 25148 4760 1 8 . 1 1 10 10 THR N N 10 118.764 118.764 116.013 2.751 25148 4761 1 8 . 1 1 10 10 THR HA H 10 4.487 4.487 3.878 0.609 25148 4762 1 8 . 1 1 10 10 THR C C 10 176.567 176.567 176.885 -0.318 25148 4763 1 8 . 1 1 10 10 THR CA C 10 68.768 68.768 66.634 2.134 25148 4764 1 8 . 1 1 10 10 THR CB C 10 66.961 66.961 68.458 -1.497 25148 4765 1 8 . 1 1 10 10 THR H H 10 8.218 8.218 7.394 0.824 25148 4766 1 8 . 1 1 11 11 ILE N N 11 122.555 122.555 119.698 2.857 25148 4767 1 8 . 1 1 11 11 ILE HA H 11 3.779 3.779 3.745 0.034 25148 4768 1 8 . 1 1 11 11 ILE C C 11 177.793 177.793 177.203 0.590 25148 4769 1 8 . 1 1 11 11 ILE CA C 11 64.695 64.695 64.823 -0.128 25148 4770 1 8 . 1 1 11 11 ILE CB C 11 37.856 37.856 37.687 0.169 25148 4771 1 8 . 1 1 11 11 ILE H H 11 7.632 7.632 7.739 -0.107 25148 4772 1 8 . 1 1 12 12 LEU N N 12 120.469 120.469 117.890 2.579 25148 4773 1 8 . 1 1 12 12 LEU HA H 12 4.065 4.065 4.035 0.030 25148 4774 1 8 . 1 1 12 12 LEU C C 12 179.139 179.139 179.010 0.129 25148 4775 1 8 . 1 1 12 12 LEU CA C 12 57.944 57.944 56.817 1.127 25148 4776 1 8 . 1 1 12 12 LEU CB C 12 42.170 42.170 41.485 0.685 25148 4777 1 8 . 1 1 12 12 LEU H H 12 7.951 7.951 7.453 0.498 25148 4778 1 8 . 1 1 13 13 GLU N N 13 119.669 119.669 120.087 -0.418 25148 4779 1 8 . 1 1 13 13 GLU HA H 13 4.183 4.183 3.997 0.186 25148 4780 1 8 . 1 1 13 13 GLU C C 13 179.007 179.007 177.910 1.097 25148 4781 1 8 . 1 1 13 13 GLU CA C 13 59.703 59.703 58.933 0.770 25148 4782 1 8 . 1 1 13 13 GLU CB C 13 30.110 30.110 29.417 0.693 25148 4783 1 8 . 1 1 13 13 GLU H H 13 8.003 8.003 8.045 -0.042 25148 4784 1 8 . 1 1 14 14 LYS N N 14 118.935 118.935 116.776 2.159 25148 4785 1 8 . 1 1 14 14 LYS HA H 14 4.124 4.124 4.081 0.043 25148 4786 1 8 . 1 1 14 14 LYS CA C 14 58.847 58.847 57.615 1.232 25148 4787 1 8 . 1 1 14 14 LYS CB C 14 33.053 33.053 32.200 0.853 25148 4788 1 8 . 1 1 14 14 LYS H H 14 7.862 7.862 7.352 0.510 25148 4789 1 8 . 1 1 15 15 GLU HA H 15 3.693 3.693 4.324 -0.631 25148 4790 1 8 . 1 1 15 15 GLU CA C 15 56.688 56.688 55.681 1.007 25148 4791 1 8 . 1 1 15 15 GLU CB C 15 32.204 32.204 30.202 2.002 25148 4792 1 8 . 1 1 16 16 LYS HA H 16 4.678 4.678 4.392 0.286 25148 4793 1 8 . 1 1 16 16 LYS CA C 16 55.135 55.135 55.728 -0.594 25148 4794 1 8 . 1 1 16 16 LYS CB C 16 34.049 34.049 33.305 0.744 25148 4795 1 8 . 1 1 17 17 GLY CA C 17 46.541 46.541 45.306 1.235 25148 4796 1 8 . 1 1 18 18 ILE N N 18 115.364 115.364 122.275 -6.911 25148 4797 1 8 . 1 1 18 18 ILE HA H 18 4.079 4.079 4.213 -0.134 25148 4798 1 8 . 1 1 18 18 ILE C C 18 174.751 174.751 175.104 -0.353 25148 4799 1 8 . 1 1 18 18 ILE CA C 18 60.333 60.333 59.556 0.777 25148 4800 1 8 . 1 1 18 18 ILE CB C 18 39.044 39.044 36.755 2.288 25148 4801 1 8 . 1 1 18 18 ILE H H 18 8.203 8.203 7.801 0.402 25148 4802 1 8 . 1 1 19 19 SER N N 19 119.891 119.891 119.583 0.308 25148 4803 1 8 . 1 1 19 19 SER HA H 19 4.362 4.362 4.394 -0.032 25148 4804 1 8 . 1 1 19 19 SER CA C 19 58.476 58.476 58.967 -0.491 25148 4805 1 8 . 1 1 19 19 SER CB C 19 63.533 63.533 63.601 -0.068 25148 4806 1 8 . 1 1 19 19 SER H H 19 8.253 8.253 8.258 -0.005 25148 4807 1 8 . 1 1 20 20 LYS N N 20 124.782 124.782 126.626 -1.844 25148 4808 1 8 . 1 1 20 20 LYS HA H 20 4.137 4.137 4.036 0.101 25148 4809 1 8 . 1 1 20 20 LYS C C 20 177.889 177.889 178.023 -0.134 25148 4810 1 8 . 1 1 20 20 LYS CA C 20 59.485 59.485 58.865 0.620 25148 4811 1 8 . 1 1 20 20 LYS CB C 20 32.711 32.711 32.042 0.669 25148 4812 1 8 . 1 1 20 20 LYS H H 20 8.918 8.918 8.945 -0.027 25148 4813 1 8 . 1 1 21 21 GLU N N 21 117.831 117.831 118.472 -0.641 25148 4814 1 8 . 1 1 21 21 GLU HA H 21 3.957 3.957 4.059 -0.102 25148 4815 1 8 . 1 1 21 21 GLU C C 21 178.822 178.822 178.766 0.056 25148 4816 1 8 . 1 1 21 21 GLU CA C 21 59.529 59.529 59.270 0.259 25148 4817 1 8 . 1 1 21 21 GLU CB C 21 29.237 29.237 29.257 -0.020 25148 4818 1 8 . 1 1 21 21 GLU H H 21 8.361 8.361 8.566 -0.205 25148 4819 1 8 . 1 1 22 22 ILE N N 22 118.690 118.690 118.075 0.615 25148 4820 1 8 . 1 1 22 22 ILE HA H 22 3.884 3.884 3.906 -0.022 25148 4821 1 8 . 1 1 22 22 ILE C C 22 179.247 179.247 177.834 1.413 25148 4822 1 8 . 1 1 22 22 ILE CA C 22 63.735 63.735 64.016 -0.281 25148 4823 1 8 . 1 1 22 22 ILE CB C 22 37.415 37.415 38.077 -0.662 25148 4824 1 8 . 1 1 22 22 ILE H H 22 7.353 7.353 7.427 -0.074 25148 4825 1 8 . 1 1 23 23 ILE N N 23 120.880 120.880 121.433 -0.553 25148 4826 1 8 . 1 1 23 23 ILE HA H 23 3.733 3.733 3.662 0.071 25148 4827 1 8 . 1 1 23 23 ILE C C 23 177.817 177.817 177.709 0.108 25148 4828 1 8 . 1 1 23 23 ILE CA C 23 64.172 64.172 63.247 0.925 25148 4829 1 8 . 1 1 23 23 ILE CB C 23 36.473 36.473 36.954 -0.481 25148 4830 1 8 . 1 1 23 23 ILE H H 23 7.571 7.571 7.562 0.009 25148 4831 1 8 . 1 1 24 24 ILE N N 24 121.460 121.460 119.636 1.824 25148 4832 1 8 . 1 1 24 24 ILE HA H 24 3.486 3.486 3.557 -0.071 25148 4833 1 8 . 1 1 24 24 ILE C C 24 177.759 177.759 177.932 -0.173 25148 4834 1 8 . 1 1 24 24 ILE CA C 24 66.641 66.641 66.175 0.466 25148 4835 1 8 . 1 1 24 24 ILE CB C 24 37.307 37.307 37.478 -0.171 25148 4836 1 8 . 1 1 24 24 ILE H H 24 8.709 8.709 7.764 0.945 25148 4837 1 8 . 1 1 25 25 GLU N N 25 119.323 119.323 118.553 0.770 25148 4838 1 8 . 1 1 25 25 GLU HA H 25 4.177 4.177 4.208 -0.031 25148 4839 1 8 . 1 1 25 25 GLU C C 25 179.348 179.348 178.536 0.812 25148 4840 1 8 . 1 1 25 25 GLU CA C 25 59.951 59.951 58.998 0.953 25148 4841 1 8 . 1 1 25 25 GLU CB C 25 29.340 29.340 29.232 0.108 25148 4842 1 8 . 1 1 25 25 GLU H H 25 8.048 8.048 8.113 -0.065 25148 4843 1 8 . 1 1 26 26 ALA N N 26 122.390 122.390 122.752 -0.362 25148 4844 1 8 . 1 1 26 26 ALA HA H 26 4.325 4.325 4.097 0.228 25148 4845 1 8 . 1 1 26 26 ALA C C 26 181.440 181.440 179.747 1.693 25148 4846 1 8 . 1 1 26 26 ALA CA C 26 54.935 54.935 54.931 0.004 25148 4847 1 8 . 1 1 26 26 ALA CB C 26 17.834 17.834 18.296 -0.462 25148 4848 1 8 . 1 1 26 26 ALA H H 26 7.768 7.768 7.703 0.065 25148 4849 1 8 . 1 1 27 27 ILE N N 27 122.342 122.342 119.129 3.213 25148 4850 1 8 . 1 1 27 27 ILE HA H 27 3.575 3.575 3.606 -0.031 25148 4851 1 8 . 1 1 27 27 ILE C C 27 177.541 177.541 178.073 -0.532 25148 4852 1 8 . 1 1 27 27 ILE CA C 27 66.536 66.536 65.579 0.957 25148 4853 1 8 . 1 1 27 27 ILE CB C 27 37.886 37.886 37.677 0.209 25148 4854 1 8 . 1 1 27 27 ILE H H 27 8.805 8.805 7.570 1.235 25148 4855 1 8 . 1 1 28 28 GLU N N 28 120.188 120.188 119.576 0.612 25148 4856 1 8 . 1 1 28 28 GLU HA H 28 3.687 3.687 3.871 -0.184 25148 4857 1 8 . 1 1 28 28 GLU C C 28 178.707 178.707 178.908 -0.201 25148 4858 1 8 . 1 1 28 28 GLU CA C 28 61.458 61.458 59.838 1.620 25148 4859 1 8 . 1 1 28 28 GLU CB C 28 29.624 29.624 29.245 0.379 25148 4860 1 8 . 1 1 28 28 GLU H H 28 8.882 8.882 7.739 1.143 25148 4861 1 8 . 1 1 29 29 ALA N N 29 119.293 119.293 120.701 -1.408 25148 4862 1 8 . 1 1 29 29 ALA HA H 29 4.214 4.214 4.059 0.155 25148 4863 1 8 . 1 1 29 29 ALA C C 29 181.200 181.200 179.556 1.644 25148 4864 1 8 . 1 1 29 29 ALA CA C 29 55.435 55.435 54.994 0.441 25148 4865 1 8 . 1 1 29 29 ALA CB C 29 18.090 18.090 18.159 -0.069 25148 4866 1 8 . 1 1 29 29 ALA H H 29 8.065 8.065 7.920 0.145 25148 4867 1 8 . 1 1 30 30 ALA N N 30 121.729 121.729 121.763 -0.034 25148 4868 1 8 . 1 1 30 30 ALA HA H 30 4.307 4.307 4.182 0.125 25148 4869 1 8 . 1 1 30 30 ALA C C 30 181.315 181.315 179.674 1.641 25148 4870 1 8 . 1 1 30 30 ALA CA C 30 54.594 54.594 54.716 -0.122 25148 4871 1 8 . 1 1 30 30 ALA CB C 30 18.704 18.704 18.269 0.435 25148 4872 1 8 . 1 1 30 30 ALA H H 30 8.099 8.099 7.260 0.839 25148 4873 1 8 . 1 1 31 31 LEU N N 31 120.900 120.900 120.518 0.382 25148 4874 1 8 . 1 1 31 31 LEU HA H 31 4.347 4.347 4.132 0.215 25148 4875 1 8 . 1 1 31 31 LEU C C 31 179.137 179.137 179.281 -0.144 25148 4876 1 8 . 1 1 31 31 LEU CA C 31 57.569 57.569 57.994 -0.425 25148 4877 1 8 . 1 1 31 31 LEU CB C 31 42.353 42.353 41.150 1.203 25148 4878 1 8 . 1 1 31 31 LEU H H 31 8.863 8.863 8.011 0.852 25148 4879 1 8 . 1 1 32 32 ILE N N 32 122.410 122.410 119.138 3.272 25148 4880 1 8 . 1 1 32 32 ILE HA H 32 3.699 3.699 3.641 0.058 25148 4881 1 8 . 1 1 32 32 ILE C C 32 178.303 178.303 177.879 0.424 25148 4882 1 8 . 1 1 32 32 ILE CA C 32 66.066 66.066 65.306 0.759 25148 4883 1 8 . 1 1 32 32 ILE CB C 32 37.882 37.882 37.897 -0.015 25148 4884 1 8 . 1 1 32 32 ILE H H 32 8.234 8.234 8.386 -0.152 25148 4885 1 8 . 1 1 33 33 SER N N 33 114.201 114.201 115.360 -1.159 25148 4886 1 8 . 1 1 33 33 SER HA H 33 4.311 4.311 4.114 0.197 25148 4887 1 8 . 1 1 33 33 SER C C 33 177.012 177.012 176.586 0.426 25148 4888 1 8 . 1 1 33 33 SER CA C 33 61.860 61.860 61.871 -0.011 25148 4889 1 8 . 1 1 33 33 SER CB C 33 62.508 62.508 62.992 -0.484 25148 4890 1 8 . 1 1 33 33 SER H H 33 7.558 7.558 7.732 -0.174 25148 4891 1 8 . 1 1 34 34 ALA N N 34 122.893 122.893 124.011 -1.118 25148 4892 1 8 . 1 1 34 34 ALA HA H 34 4.215 4.215 4.106 0.109 25148 4893 1 8 . 1 1 34 34 ALA C C 34 180.814 180.814 179.282 1.532 25148 4894 1 8 . 1 1 34 34 ALA CA C 34 55.283 55.283 54.997 0.286 25148 4895 1 8 . 1 1 34 34 ALA CB C 34 18.273 18.273 18.428 -0.155 25148 4896 1 8 . 1 1 34 34 ALA H H 34 8.409 8.409 8.030 0.379 25148 4897 1 8 . 1 1 35 35 TYR N N 35 120.259 120.259 118.475 1.784 25148 4898 1 8 . 1 1 35 35 TYR HA H 35 4.393 4.393 4.506 -0.113 25148 4899 1 8 . 1 1 35 35 TYR C C 35 177.892 177.892 177.018 0.874 25148 4900 1 8 . 1 1 35 35 TYR CA C 35 63.071 63.071 60.279 2.792 25148 4901 1 8 . 1 1 35 35 TYR CB C 35 38.021 38.021 39.296 -1.275 25148 4902 1 8 . 1 1 35 35 TYR H H 35 8.975 8.975 8.014 0.961 25148 4903 1 8 . 1 1 36 36 LYS N N 36 120.942 120.942 121.912 -0.970 25148 4904 1 8 . 1 1 36 36 LYS HA H 36 4.032 4.032 4.006 0.026 25148 4905 1 8 . 1 1 36 36 LYS C C 36 177.797 177.797 178.259 -0.462 25148 4906 1 8 . 1 1 36 36 LYS CA C 36 59.900 59.900 59.604 0.296 25148 4907 1 8 . 1 1 36 36 LYS CB C 36 32.429 32.429 32.692 -0.263 25148 4908 1 8 . 1 1 36 36 LYS H H 36 8.654 8.654 8.159 0.495 25148 4909 1 8 . 1 1 37 37 ARG N N 37 115.139 115.139 116.482 -1.343 25148 4910 1 8 . 1 1 37 37 ARG HA H 37 4.101 4.101 4.034 0.067 25148 4911 1 8 . 1 1 37 37 ARG C C 37 177.517 177.517 178.467 -0.950 25148 4912 1 8 . 1 1 37 37 ARG CA C 37 58.276 58.276 58.362 -0.086 25148 4913 1 8 . 1 1 37 37 ARG CB C 37 31.014 31.014 29.059 1.954 25148 4914 1 8 . 1 1 37 37 ARG H H 37 8.138 8.138 8.359 -0.221 25148 4915 1 8 . 1 1 38 38 ASN N N 38 112.555 112.555 117.195 -4.640 25148 4916 1 8 . 1 1 38 38 ASN HA H 38 4.540 4.540 4.365 0.175 25148 4917 1 8 . 1 1 38 38 ASN C C 38 173.994 173.994 175.040 -1.046 25148 4918 1 8 . 1 1 38 38 ASN CA C 38 54.722 54.722 55.563 -0.841 25148 4919 1 8 . 1 1 38 38 ASN CB C 38 42.077 42.077 38.994 3.083 25148 4920 1 8 . 1 1 38 38 ASN H H 38 7.426 7.426 8.295 -0.869 25148 4921 1 8 . 1 1 39 39 PHE N N 39 116.711 116.711 115.335 1.376 25148 4922 1 8 . 1 1 39 39 PHE HA H 39 4.569 4.569 4.615 -0.046 25148 4923 1 8 . 1 1 39 39 PHE CA C 39 58.913 58.913 57.253 1.660 25148 4924 1 8 . 1 1 39 39 PHE CB C 39 39.781 39.781 39.116 0.665 25148 4925 1 8 . 1 1 39 39 PHE H H 39 7.959 7.959 7.347 0.612 25148 4926 1 8 . 1 1 40 40 ASN HA H 40 4.018 4.018 4.643 -0.625 25148 4927 1 8 . 1 1 40 40 ASN CA C 40 58.944 58.944 54.782 4.162 25148 4928 1 8 . 1 1 41 41 GLN HA H 41 4.298 4.298 4.144 0.154 25148 4929 1 8 . 1 1 41 41 GLN C C 41 175.237 175.237 176.154 -0.917 25148 4930 1 8 . 1 1 41 41 GLN CA C 41 57.360 57.360 58.117 -0.757 25148 4931 1 8 . 1 1 41 41 GLN CB C 41 28.724 28.724 28.263 0.461 25148 4932 1 8 . 1 1 42 42 ALA N N 42 120.514 120.514 117.887 2.627 25148 4933 1 8 . 1 1 42 42 ALA HA H 42 4.622 4.622 4.251 0.371 25148 4934 1 8 . 1 1 42 42 ALA C C 42 175.922 175.922 177.081 -1.159 25148 4935 1 8 . 1 1 42 42 ALA CA C 42 51.841 51.841 53.213 -1.372 25148 4936 1 8 . 1 1 42 42 ALA CB C 42 21.576 21.576 19.308 2.268 25148 4937 1 8 . 1 1 42 42 ALA H H 42 7.817 7.817 8.333 -0.516 25148 4938 1 8 . 1 1 43 43 GLN N N 43 117.594 117.594 114.215 3.379 25148 4939 1 8 . 1 1 43 43 GLN HA H 43 4.265 4.265 4.529 -0.264 25148 4940 1 8 . 1 1 43 43 GLN C C 43 174.942 174.942 173.948 0.994 25148 4941 1 8 . 1 1 43 43 GLN CA C 43 57.047 57.047 54.961 2.086 25148 4942 1 8 . 1 1 43 43 GLN CB C 43 30.863 30.863 31.322 -0.459 25148 4943 1 8 . 1 1 43 43 GLN H H 43 7.400 7.400 7.443 -0.043 25148 4944 1 8 . 1 1 44 44 ASN N N 44 120.467 120.467 119.989 0.478 25148 4945 1 8 . 1 1 44 44 ASN HA H 44 5.005 5.005 4.718 0.287 25148 4946 1 8 . 1 1 44 44 ASN C C 44 174.365 174.365 174.469 -0.104 25148 4947 1 8 . 1 1 44 44 ASN CA C 44 52.381 52.381 52.881 -0.500 25148 4948 1 8 . 1 1 44 44 ASN CB C 44 38.177 38.177 39.269 -1.092 25148 4949 1 8 . 1 1 44 44 ASN H H 44 9.123 9.123 8.624 0.499 25148 4950 1 8 . 1 1 45 45 VAL N N 45 115.479 115.479 116.944 -1.465 25148 4951 1 8 . 1 1 45 45 VAL HA H 45 5.376 5.376 4.237 1.139 25148 4952 1 8 . 1 1 45 45 VAL C C 45 174.908 174.908 173.880 1.028 25148 4953 1 8 . 1 1 45 45 VAL CA C 45 59.022 59.022 61.760 -2.738 25148 4954 1 8 . 1 1 45 45 VAL CB C 45 35.776 35.776 34.154 1.622 25148 4955 1 8 . 1 1 45 45 VAL H H 45 7.732 7.732 8.020 -0.288 25148 4956 1 8 . 1 1 46 46 ARG N N 46 121.146 121.146 124.271 -3.125 25148 4957 1 8 . 1 1 46 46 ARG HA H 46 4.566 4.566 4.744 -0.178 25148 4958 1 8 . 1 1 46 46 ARG C C 46 173.790 173.790 174.472 -0.682 25148 4959 1 8 . 1 1 46 46 ARG CA C 46 54.762 54.762 54.381 0.381 25148 4960 1 8 . 1 1 46 46 ARG CB C 46 33.946 33.946 32.010 1.936 25148 4961 1 8 . 1 1 46 46 ARG H H 46 8.850 8.850 8.713 0.137 25148 4962 1 8 . 1 1 47 47 VAL N N 47 122.339 122.339 124.394 -2.055 25148 4963 1 8 . 1 1 47 47 VAL HA H 47 4.741 4.741 4.644 0.097 25148 4964 1 8 . 1 1 47 47 VAL C C 47 173.541 173.541 175.826 -2.285 25148 4965 1 8 . 1 1 47 47 VAL CA C 47 60.893 60.893 61.563 -0.670 25148 4966 1 8 . 1 1 47 47 VAL CB C 47 33.563 33.563 32.982 0.581 25148 4967 1 8 . 1 1 47 47 VAL H H 47 8.444 8.444 8.392 0.052 25148 4968 1 8 . 1 1 48 48 ASP N N 48 127.701 127.701 124.073 3.628 25148 4969 1 8 . 1 1 48 48 ASP HA H 48 4.946 4.946 4.905 0.041 25148 4970 1 8 . 1 1 48 48 ASP C C 48 173.744 173.744 174.704 -0.960 25148 4971 1 8 . 1 1 48 48 ASP CA C 48 52.651 52.651 52.666 -0.015 25148 4972 1 8 . 1 1 48 48 ASP CB C 48 45.225 45.225 44.105 1.120 25148 4973 1 8 . 1 1 48 48 ASP H H 48 9.068 9.068 8.443 0.625 25148 4974 1 8 . 1 1 49 49 LEU N N 49 130.945 130.945 126.618 4.327 25148 4975 1 8 . 1 1 49 49 LEU HA H 49 4.774 4.774 4.663 0.111 25148 4976 1 8 . 1 1 49 49 LEU C C 49 174.531 174.531 175.423 -0.892 25148 4977 1 8 . 1 1 49 49 LEU CA C 49 54.337 54.337 54.359 -0.022 25148 4978 1 8 . 1 1 49 49 LEU CB C 49 43.192 43.192 42.989 0.204 25148 4979 1 8 . 1 1 49 49 LEU H H 49 9.369 9.369 8.780 0.589 25148 4980 1 8 . 1 1 50 50 ASN N N 50 126.268 126.268 126.420 -0.152 25148 4981 1 8 . 1 1 50 50 ASN HA H 50 4.629 4.629 4.969 -0.340 25148 4982 1 8 . 1 1 50 50 ASN C C 50 176.602 176.602 175.529 1.073 25148 4983 1 8 . 1 1 50 50 ASN CA C 50 54.048 54.048 52.339 1.709 25148 4984 1 8 . 1 1 50 50 ASN CB C 50 39.891 39.891 38.964 0.927 25148 4985 1 8 . 1 1 50 50 ASN H H 50 8.672 8.672 9.058 -0.386 25148 4986 1 8 . 1 1 51 51 ARG N N 51 125.897 125.897 124.590 1.307 25148 4987 1 8 . 1 1 51 51 ARG HA H 51 3.789 3.789 4.083 -0.294 25148 4988 1 8 . 1 1 51 51 ARG C C 51 175.681 175.681 176.401 -0.720 25148 4989 1 8 . 1 1 51 51 ARG CA C 51 58.162 58.162 58.399 -0.237 25148 4990 1 8 . 1 1 51 51 ARG CB C 51 29.944 29.944 29.814 0.130 25148 4991 1 8 . 1 1 51 51 ARG H H 51 8.984 8.984 8.414 0.570 25148 4992 1 8 . 1 1 52 52 GLU N N 52 116.733 116.733 118.766 -2.033 25148 4993 1 8 . 1 1 52 52 GLU HA H 52 4.368 4.368 4.207 0.161 25148 4994 1 8 . 1 1 52 52 GLU C C 52 178.049 178.049 177.441 0.608 25148 4995 1 8 . 1 1 52 52 GLU CA C 52 58.048 58.048 58.371 -0.323 25148 4996 1 8 . 1 1 52 52 GLU CB C 52 30.716 30.716 29.339 1.377 25148 4997 1 8 . 1 1 52 52 GLU H H 52 8.541 8.541 8.547 -0.006 25148 4998 1 8 . 1 1 53 53 THR N N 53 106.556 106.556 108.219 -1.663 25148 4999 1 8 . 1 1 53 53 THR HA H 53 4.424 4.424 4.607 -0.183 25148 5000 1 8 . 1 1 53 53 THR C C 53 176.352 176.352 174.970 1.382 25148 5001 1 8 . 1 1 53 53 THR CA C 53 61.320 61.320 61.022 0.298 25148 5002 1 8 . 1 1 53 53 THR CB C 53 71.220 71.220 69.643 1.577 25148 5003 1 8 . 1 1 53 53 THR H H 53 8.085 8.085 7.497 0.588 25148 5004 1 8 . 1 1 54 54 GLY N N 54 111.843 111.843 110.329 1.514 25148 5005 1 8 . 1 1 54 54 GLY C C 54 172.690 172.690 174.541 -1.851 25148 5006 1 8 . 1 1 54 54 GLY CA C 54 45.417 45.417 46.207 -0.790 25148 5007 1 8 . 1 1 54 54 GLY H H 54 8.330 8.330 7.870 0.460 25148 5008 1 8 . 1 1 55 55 SER N N 55 113.844 113.844 114.196 -0.352 25148 5009 1 8 . 1 1 55 55 SER HA H 55 4.279 4.279 4.662 -0.383 25148 5010 1 8 . 1 1 55 55 SER C C 55 174.127 174.127 173.019 1.108 25148 5011 1 8 . 1 1 55 55 SER CA C 55 59.229 59.229 57.776 1.453 25148 5012 1 8 . 1 1 55 55 SER CB C 55 63.939 63.939 65.761 -1.822 25148 5013 1 8 . 1 1 55 55 SER H H 55 7.653 7.653 7.563 0.090 25148 5014 1 8 . 1 1 56 56 ILE N N 56 125.286 125.286 120.886 4.400 25148 5015 1 8 . 1 1 56 56 ILE HA H 56 5.082 5.082 4.996 0.086 25148 5016 1 8 . 1 1 56 56 ILE C C 56 175.346 175.346 174.398 0.948 25148 5017 1 8 . 1 1 56 56 ILE CA C 56 59.967 59.967 60.326 -0.359 25148 5018 1 8 . 1 1 56 56 ILE CB C 56 40.165 40.165 42.225 -2.060 25148 5019 1 8 . 1 1 56 56 ILE H H 56 8.478 8.478 8.431 0.047 25148 5020 1 8 . 1 1 57 57 ARG N N 57 126.332 126.332 127.752 -1.420 25148 5021 1 8 . 1 1 57 57 ARG HA H 57 4.740 4.740 4.661 0.079 25148 5022 1 8 . 1 1 57 57 ARG C C 57 173.921 173.921 173.701 0.220 25148 5023 1 8 . 1 1 57 57 ARG CA C 57 54.311 54.311 53.246 1.065 25148 5024 1 8 . 1 1 57 57 ARG CB C 57 35.805 35.805 32.793 3.012 25148 5025 1 8 . 1 1 57 57 ARG H H 57 8.590 8.590 8.535 0.055 25148 5026 1 8 . 1 1 58 58 VAL N N 58 120.987 120.987 123.327 -2.340 25148 5027 1 8 . 1 1 58 58 VAL HA H 58 4.334 4.334 4.157 0.177 25148 5028 1 8 . 1 1 58 58 VAL C C 58 174.204 174.204 173.970 0.234 25148 5029 1 8 . 1 1 58 58 VAL CA C 58 60.861 60.861 61.505 -0.644 25148 5030 1 8 . 1 1 58 58 VAL CB C 58 33.383 33.383 31.571 1.812 25148 5031 1 8 . 1 1 58 58 VAL H H 58 8.585 8.585 8.266 0.319 25148 5032 1 8 . 1 1 59 59 PHE N N 59 124.913 124.913 126.451 -1.538 25148 5033 1 8 . 1 1 59 59 PHE HA H 59 5.046 5.046 5.299 -0.253 25148 5034 1 8 . 1 1 59 59 PHE C C 59 174.446 174.446 174.104 0.342 25148 5035 1 8 . 1 1 59 59 PHE CA C 59 56.695 56.695 55.209 1.486 25148 5036 1 8 . 1 1 59 59 PHE CB C 59 42.779 42.779 43.191 -0.412 25148 5037 1 8 . 1 1 59 59 PHE H H 59 8.920 8.920 8.660 0.260 25148 5038 1 8 . 1 1 60 60 ALA N N 60 124.035 124.035 123.600 0.435 25148 5039 1 8 . 1 1 60 60 ALA HA H 60 5.102 5.102 4.796 0.306 25148 5040 1 8 . 1 1 60 60 ALA C C 60 176.017 176.017 176.185 -0.168 25148 5041 1 8 . 1 1 60 60 ALA CA C 60 50.083 50.083 50.679 -0.596 25148 5042 1 8 . 1 1 60 60 ALA CB C 60 22.400 22.400 20.538 1.862 25148 5043 1 8 . 1 1 60 60 ALA H H 60 9.457 9.457 8.915 0.542 25148 5044 1 8 . 1 1 61 61 ARG N N 61 121.530 121.530 125.002 -3.472 25148 5045 1 8 . 1 1 61 61 ARG HA H 61 4.958 4.958 4.976 -0.018 25148 5046 1 8 . 1 1 61 61 ARG C C 61 176.737 176.737 175.864 0.873 25148 5047 1 8 . 1 1 61 61 ARG CA C 61 55.375 55.375 56.014 -0.639 25148 5048 1 8 . 1 1 61 61 ARG CB C 61 31.230 31.230 31.607 -0.377 25148 5049 1 8 . 1 1 61 61 ARG H H 61 8.447 8.447 8.785 -0.338 25148 5050 1 8 . 1 1 62 62 LYS N N 62 124.784 124.784 124.589 0.195 25148 5051 1 8 . 1 1 62 62 LYS HA H 62 4.709 4.709 4.549 0.160 25148 5052 1 8 . 1 1 62 62 LYS C C 62 173.899 173.899 174.495 -0.596 25148 5053 1 8 . 1 1 62 62 LYS CA C 62 54.812 54.812 55.268 -0.456 25148 5054 1 8 . 1 1 62 62 LYS CB C 62 37.147 37.147 36.526 0.621 25148 5055 1 8 . 1 1 62 62 LYS H H 62 9.137 9.137 8.282 0.855 25148 5056 1 8 . 1 1 63 63 ASP N N 63 122.552 122.552 124.854 -2.302 25148 5057 1 8 . 1 1 63 63 ASP HA H 63 4.877 4.877 4.674 0.203 25148 5058 1 8 . 1 1 63 63 ASP C C 63 175.560 175.560 176.494 -0.934 25148 5059 1 8 . 1 1 63 63 ASP CA C 63 54.576 54.576 54.965 -0.389 25148 5060 1 8 . 1 1 63 63 ASP CB C 63 42.841 42.841 41.569 1.272 25148 5061 1 8 . 1 1 63 63 ASP H H 63 8.334 8.334 8.816 -0.482 25148 5062 1 8 . 1 1 64 64 VAL N N 64 123.109 123.109 127.351 -4.242 25148 5063 1 8 . 1 1 64 64 VAL HA H 64 4.557 4.557 4.499 0.058 25148 5064 1 8 . 1 1 64 64 VAL C C 64 177.260 177.260 175.641 1.619 25148 5065 1 8 . 1 1 64 64 VAL CA C 64 62.268 62.268 63.611 -1.343 25148 5066 1 8 . 1 1 64 64 VAL CB C 64 30.348 30.348 31.276 -0.927 25148 5067 1 8 . 1 1 64 64 VAL H H 64 8.693 8.693 8.082 0.611 25148 5068 1 8 . 1 1 65 65 VAL N N 65 122.320 122.320 122.037 0.283 25148 5069 1 8 . 1 1 65 65 VAL HA H 65 4.939 4.939 4.658 0.281 25148 5070 1 8 . 1 1 65 65 VAL C C 65 174.754 174.754 175.044 -0.290 25148 5071 1 8 . 1 1 65 65 VAL CA C 65 59.173 59.173 59.514 -0.341 25148 5072 1 8 . 1 1 65 65 VAL CB C 65 36.289 36.289 35.896 0.393 25148 5073 1 8 . 1 1 65 65 VAL H H 65 8.656 8.656 8.737 -0.081 25148 5074 1 8 . 1 1 66 66 ASP N N 66 119.805 119.805 122.007 -2.202 25148 5075 1 8 . 1 1 66 66 ASP HA H 66 4.499 4.499 4.423 0.076 25148 5076 1 8 . 1 1 66 66 ASP C C 66 176.565 176.565 176.295 0.270 25148 5077 1 8 . 1 1 66 66 ASP CA C 66 57.236 57.236 56.633 0.603 25148 5078 1 8 . 1 1 66 66 ASP CB C 66 41.662 41.662 41.377 0.284 25148 5079 1 8 . 1 1 66 66 ASP H H 66 8.628 8.628 8.834 -0.206 25148 5080 1 8 . 1 1 67 67 GLU N N 67 117.604 117.604 116.398 1.206 25148 5081 1 8 . 1 1 67 67 GLU HA H 67 4.350 4.350 4.349 0.001 25148 5082 1 8 . 1 1 67 67 GLU C C 67 173.736 173.736 175.286 -1.550 25148 5083 1 8 . 1 1 67 67 GLU CA C 67 55.203 55.203 54.794 0.409 25148 5084 1 8 . 1 1 67 67 GLU CB C 67 32.240 32.240 32.543 -0.303 25148 5085 1 8 . 1 1 67 67 GLU H H 67 7.525 7.525 7.798 -0.273 25148 5086 1 8 . 1 1 68 68 VAL N N 68 125.774 125.774 122.915 2.859 25148 5087 1 8 . 1 1 68 68 VAL HA H 68 3.578 3.578 3.893 -0.315 25148 5088 1 8 . 1 1 68 68 VAL C C 68 175.885 175.885 175.525 0.360 25148 5089 1 8 . 1 1 68 68 VAL CA C 68 63.397 63.397 63.879 -0.482 25148 5090 1 8 . 1 1 68 68 VAL CB C 68 32.452 32.452 31.015 1.437 25148 5091 1 8 . 1 1 68 68 VAL H H 68 8.573 8.573 8.520 0.053 25148 5092 1 8 . 1 1 69 69 TYR N N 69 129.859 129.859 126.465 3.394 25148 5093 1 8 . 1 1 69 69 TYR HA H 69 4.642 4.642 4.624 0.018 25148 5094 1 8 . 1 1 69 69 TYR C C 69 176.100 176.100 175.572 0.528 25148 5095 1 8 . 1 1 69 69 TYR CA C 69 59.092 59.092 59.122 -0.030 25148 5096 1 8 . 1 1 69 69 TYR CB C 69 39.830 39.830 40.458 -0.627 25148 5097 1 8 . 1 1 69 69 TYR H H 69 9.801 9.801 8.686 1.115 25148 5098 1 8 . 1 1 70 70 ASP N N 70 120.204 120.204 120.821 -0.617 25148 5099 1 8 . 1 1 70 70 ASP HA H 70 4.772 4.772 4.976 -0.204 25148 5100 1 8 . 1 1 70 70 ASP C C 70 176.622 176.622 176.263 0.359 25148 5101 1 8 . 1 1 70 70 ASP CA C 70 52.885 52.885 53.045 -0.160 25148 5102 1 8 . 1 1 70 70 ASP CB C 70 41.878 41.878 40.851 1.027 25148 5103 1 8 . 1 1 70 70 ASP H H 70 8.348 8.348 7.932 0.416 25148 5104 1 8 . 1 1 71 71 GLN N N 71 125.440 125.440 123.781 1.659 25148 5105 1 8 . 1 1 71 71 GLN HA H 71 4.315 4.315 3.949 0.366 25148 5106 1 8 . 1 1 71 71 GLN C C 71 175.819 175.819 176.489 -0.670 25148 5107 1 8 . 1 1 71 71 GLN CA C 71 57.914 57.914 58.403 -0.489 25148 5108 1 8 . 1 1 71 71 GLN CB C 71 28.307 28.307 28.600 -0.293 25148 5109 1 8 . 1 1 71 71 GLN H H 71 9.097 9.097 8.786 0.311 25148 5110 1 8 . 1 1 72 72 ARG N N 72 116.306 116.306 116.739 -0.433 25148 5111 1 8 . 1 1 72 72 ARG HA H 72 4.252 4.252 4.221 0.031 25148 5112 1 8 . 1 1 72 72 ARG C C 72 178.087 178.087 175.259 2.828 25148 5113 1 8 . 1 1 72 72 ARG CA C 72 58.532 58.532 57.593 0.939 25148 5114 1 8 . 1 1 72 72 ARG CB C 72 30.143 30.143 30.690 -0.547 25148 5115 1 8 . 1 1 72 72 ARG H H 72 8.534 8.534 7.988 0.546 25148 5116 1 8 . 1 1 73 73 LEU N N 73 116.734 116.734 113.774 2.960 25148 5117 1 8 . 1 1 73 73 LEU HA H 73 4.621 4.621 4.683 -0.062 25148 5118 1 8 . 1 1 73 73 LEU C C 73 175.946 175.946 174.992 0.954 25148 5119 1 8 . 1 1 73 73 LEU CA C 73 55.250 55.250 55.621 -0.371 25148 5120 1 8 . 1 1 73 73 LEU CB C 73 46.960 46.960 44.439 2.521 25148 5121 1 8 . 1 1 73 73 LEU H H 73 7.460 7.460 7.422 0.038 25148 5122 1 8 . 1 1 74 74 GLU N N 74 118.787 118.787 122.052 -3.265 25148 5123 1 8 . 1 1 74 74 GLU HA H 74 5.403 5.403 4.535 0.868 25148 5124 1 8 . 1 1 74 74 GLU C C 74 173.709 173.709 174.500 -0.791 25148 5125 1 8 . 1 1 74 74 GLU CA C 74 54.914 54.914 55.857 -0.943 25148 5126 1 8 . 1 1 74 74 GLU CB C 74 35.053 35.053 33.383 1.670 25148 5127 1 8 . 1 1 74 74 GLU H H 74 7.752 7.752 8.045 -0.293 25148 5128 1 8 . 1 1 75 75 ILE N N 75 119.803 119.803 122.505 -2.702 25148 5129 1 8 . 1 1 75 75 ILE HA H 75 4.507 4.507 4.454 0.053 25148 5130 1 8 . 1 1 75 75 ILE C C 75 172.126 172.126 174.214 -2.088 25148 5131 1 8 . 1 1 75 75 ILE CA C 75 58.664 58.664 60.122 -1.458 25148 5132 1 8 . 1 1 75 75 ILE CB C 75 42.560 42.560 41.829 0.731 25148 5133 1 8 . 1 1 75 75 ILE H H 75 8.975 8.975 8.635 0.340 25148 5134 1 8 . 1 1 76 76 SER N N 76 123.236 123.236 124.499 -1.263 25148 5135 1 8 . 1 1 76 76 SER HA H 76 4.505 4.505 4.895 -0.390 25148 5136 1 8 . 1 1 76 76 SER C C 76 176.145 176.145 175.960 0.185 25148 5137 1 8 . 1 1 76 76 SER CA C 76 58.108 58.108 58.869 -0.761 25148 5138 1 8 . 1 1 76 76 SER CB C 76 65.000 65.000 63.958 1.042 25148 5139 1 8 . 1 1 76 76 SER H H 76 8.810 8.810 8.726 0.084 25148 5140 1 8 . 1 1 77 77 ILE N N 77 120.629 120.629 126.279 -5.650 25148 5141 1 8 . 1 1 77 77 ILE HA H 77 3.935 3.935 3.740 0.195 25148 5142 1 8 . 1 1 77 77 ILE C C 77 175.806 175.806 176.877 -1.071 25148 5143 1 8 . 1 1 77 77 ILE CA C 77 61.928 61.928 63.761 -1.833 25148 5144 1 8 . 1 1 77 77 ILE CB C 77 38.031 38.031 38.281 -0.250 25148 5145 1 8 . 1 1 77 77 ILE H H 77 8.321 8.321 8.313 0.008 25148 5146 1 8 . 1 1 78 78 GLU N N 78 121.032 121.032 117.185 3.847 25148 5147 1 8 . 1 1 78 78 GLU HA H 78 4.082 4.082 3.991 0.091 25148 5148 1 8 . 1 1 78 78 GLU C C 78 179.829 179.829 178.391 1.438 25148 5149 1 8 . 1 1 78 78 GLU CA C 78 60.180 60.180 59.184 0.997 25148 5150 1 8 . 1 1 78 78 GLU CB C 78 28.988 28.988 28.632 0.356 25148 5151 1 8 . 1 1 78 78 GLU H H 78 8.222 8.222 8.490 -0.268 25148 5152 1 8 . 1 1 79 79 GLU N N 79 120.710 120.710 121.133 -0.423 25148 5153 1 8 . 1 1 79 79 GLU HA H 79 4.012 4.012 4.101 -0.089 25148 5154 1 8 . 1 1 79 79 GLU C C 79 180.339 180.339 178.938 1.401 25148 5155 1 8 . 1 1 79 79 GLU CA C 79 59.332 59.332 58.664 0.668 25148 5156 1 8 . 1 1 79 79 GLU CB C 79 29.317 29.317 29.208 0.109 25148 5157 1 8 . 1 1 79 79 GLU H H 79 7.908 7.908 7.572 0.336 25148 5158 1 8 . 1 1 80 80 ALA N N 80 122.879 122.879 121.912 0.967 25148 5159 1 8 . 1 1 80 80 ALA HA H 80 3.966 3.966 4.125 -0.159 25148 5160 1 8 . 1 1 80 80 ALA C C 80 179.833 179.833 179.970 -0.137 25148 5161 1 8 . 1 1 80 80 ALA CA C 80 55.881 55.881 55.048 0.833 25148 5162 1 8 . 1 1 80 80 ALA CB C 80 18.870 18.870 18.085 0.785 25148 5163 1 8 . 1 1 80 80 ALA H H 80 9.132 9.132 8.023 1.109 25148 5164 1 8 . 1 1 81 81 GLN N N 81 115.829 115.829 116.740 -0.911 25148 5165 1 8 . 1 1 81 81 GLN HA H 81 4.749 4.749 4.314 0.435 25148 5166 1 8 . 1 1 81 81 GLN C C 81 178.126 178.126 178.010 0.116 25148 5167 1 8 . 1 1 81 81 GLN CA C 81 57.682 57.682 57.876 -0.194 25148 5168 1 8 . 1 1 81 81 GLN CB C 81 27.307 27.307 28.710 -1.403 25148 5169 1 8 . 1 1 81 81 GLN H H 81 8.709 8.709 7.814 0.895 25148 5170 1 8 . 1 1 82 82 GLY N N 82 105.531 105.531 106.794 -1.263 25148 5171 1 8 . 1 1 82 82 GLY C C 82 174.917 174.917 174.997 -0.080 25148 5172 1 8 . 1 1 82 82 GLY CA C 82 45.915 45.915 46.601 -0.686 25148 5173 1 8 . 1 1 82 82 GLY H H 82 7.479 7.479 8.111 -0.632 25148 5174 1 8 . 1 1 83 83 ILE N N 83 122.828 122.828 113.811 9.017 25148 5175 1 8 . 1 1 83 83 ILE HA H 83 3.970 3.970 4.440 -0.470 25148 5176 1 8 . 1 1 83 83 ILE C C 83 177.209 177.209 175.524 1.685 25148 5177 1 8 . 1 1 83 83 ILE CA C 83 64.305 64.305 61.637 2.668 25148 5178 1 8 . 1 1 83 83 ILE CB C 83 38.452 38.452 40.203 -1.750 25148 5179 1 8 . 1 1 83 83 ILE H H 83 7.634 7.634 7.537 0.097 25148 5180 1 8 . 1 1 84 84 HIS N N 84 118.927 118.927 120.054 -1.127 25148 5181 1 8 . 1 1 84 84 HIS HA H 84 4.713 4.713 4.943 -0.230 25148 5182 1 8 . 1 1 84 84 HIS CA C 84 55.487 55.487 54.380 1.107 25148 5183 1 8 . 1 1 84 84 HIS CB C 84 33.506 33.506 32.244 1.262 25148 5184 1 8 . 1 1 84 84 HIS H H 84 8.155 8.155 8.377 -0.222 25148 5185 1 8 . 1 1 85 85 PRO HA H 85 4.456 4.456 4.511 -0.055 25148 5186 1 8 . 1 1 85 85 PRO C C 85 177.357 177.357 177.227 0.130 25148 5187 1 8 . 1 1 85 85 PRO CA C 85 64.475 64.475 64.071 0.404 25148 5188 1 8 . 1 1 85 85 PRO CB C 85 32.489 32.489 32.103 0.386 25148 5189 1 8 . 1 1 86 86 GLU N N 86 116.314 116.314 117.418 -1.104 25148 5190 1 8 . 1 1 86 86 GLU HA H 86 4.286 4.286 4.184 0.102 25148 5191 1 8 . 1 1 86 86 GLU C C 86 177.624 177.624 177.243 0.381 25148 5192 1 8 . 1 1 86 86 GLU CA C 86 56.619 56.619 56.648 -0.028 25148 5193 1 8 . 1 1 86 86 GLU CB C 86 29.389 29.389 29.485 -0.096 25148 5194 1 8 . 1 1 86 86 GLU H H 86 8.938 8.938 7.786 1.152 25148 5195 1 8 . 1 1 87 87 TYR N N 87 119.773 119.773 120.363 -0.590 25148 5196 1 8 . 1 1 87 87 TYR HA H 87 4.744 4.744 4.192 0.552 25148 5197 1 8 . 1 1 87 87 TYR C C 87 174.533 174.533 176.403 -1.870 25148 5198 1 8 . 1 1 87 87 TYR CA C 87 59.117 59.117 59.372 -0.255 25148 5199 1 8 . 1 1 87 87 TYR CB C 87 38.859 38.859 38.746 0.113 25148 5200 1 8 . 1 1 87 87 TYR H H 87 7.447 7.447 7.365 0.082 25148 5201 1 8 . 1 1 88 88 MET N N 88 118.298 118.298 117.212 1.086 25148 5202 1 8 . 1 1 88 88 MET HA H 88 4.770 4.770 4.707 0.063 25148 5203 1 8 . 1 1 88 88 MET C C 88 175.638 175.638 173.982 1.656 25148 5204 1 8 . 1 1 88 88 MET CA C 88 53.133 53.133 54.723 -1.590 25148 5205 1 8 . 1 1 88 88 MET CB C 88 37.102 37.102 35.399 1.703 25148 5206 1 8 . 1 1 88 88 MET H H 88 9.023 9.023 8.370 0.653 25148 5207 1 8 . 1 1 89 89 VAL N N 89 120.157 120.157 124.087 -3.930 25148 5208 1 8 . 1 1 89 89 VAL HA H 89 3.330 3.330 3.647 -0.317 25148 5209 1 8 . 1 1 89 89 VAL C C 89 177.432 177.432 176.975 0.457 25148 5210 1 8 . 1 1 89 89 VAL CA C 89 65.675 65.675 65.119 0.556 25148 5211 1 8 . 1 1 89 89 VAL CB C 89 31.321 31.321 30.426 0.895 25148 5212 1 8 . 1 1 89 89 VAL H H 89 8.313 8.313 8.621 -0.308 25148 5213 1 8 . 1 1 90 90 GLY N N 90 116.935 116.935 116.707 0.228 25148 5214 1 8 . 1 1 90 90 GLY C C 90 175.196 175.196 174.348 0.848 25148 5215 1 8 . 1 1 90 90 GLY CA C 90 44.685 44.685 44.791 -0.106 25148 5216 1 8 . 1 1 90 90 GLY H H 90 8.551 8.551 8.811 -0.260 25148 5217 1 8 . 1 1 91 91 ASP N N 91 121.616 121.616 122.214 -0.598 25148 5218 1 8 . 1 1 91 91 ASP HA H 91 4.790 4.790 4.883 -0.093 25148 5219 1 8 . 1 1 91 91 ASP C C 91 174.431 174.431 175.172 -0.741 25148 5220 1 8 . 1 1 91 91 ASP CA C 91 55.011 55.011 53.562 1.449 25148 5221 1 8 . 1 1 91 91 ASP CB C 91 42.079 42.079 42.207 -0.128 25148 5222 1 8 . 1 1 91 91 ASP H H 91 8.073 8.073 8.092 -0.019 25148 5223 1 8 . 1 1 92 92 VAL N N 92 118.919 118.919 114.894 4.025 25148 5224 1 8 . 1 1 92 92 VAL HA H 92 4.709 4.709 5.010 -0.301 25148 5225 1 8 . 1 1 92 92 VAL C C 92 175.602 175.602 174.272 1.330 25148 5226 1 8 . 1 1 92 92 VAL CA C 92 61.527 61.527 59.750 1.777 25148 5227 1 8 . 1 1 92 92 VAL CB C 92 34.110 34.110 35.155 -1.045 25148 5228 1 8 . 1 1 92 92 VAL H H 92 8.216 8.216 8.067 0.149 25148 5229 1 8 . 1 1 93 93 VAL N N 93 123.922 123.922 122.835 1.087 25148 5230 1 8 . 1 1 93 93 VAL HA H 93 4.231 4.231 4.244 -0.013 25148 5231 1 8 . 1 1 93 93 VAL C C 93 174.105 174.105 174.119 -0.014 25148 5232 1 8 . 1 1 93 93 VAL CA C 93 59.644 59.644 59.298 0.346 25148 5233 1 8 . 1 1 93 93 VAL CB C 93 34.661 34.661 34.498 0.163 25148 5234 1 8 . 1 1 93 93 VAL H H 93 8.812 8.812 7.906 0.906 25148 5235 1 8 . 1 1 94 94 GLU N N 94 123.605 123.605 128.107 -4.502 25148 5236 1 8 . 1 1 94 94 GLU HA H 94 5.347 5.347 5.111 0.236 25148 5237 1 8 . 1 1 94 94 GLU C C 94 175.708 175.708 175.465 0.243 25148 5238 1 8 . 1 1 94 94 GLU CA C 94 54.979 54.979 55.038 -0.059 25148 5239 1 8 . 1 1 94 94 GLU CB C 94 31.612 31.612 32.045 -0.433 25148 5240 1 8 . 1 1 94 94 GLU H H 94 8.312 8.312 8.461 -0.149 25148 5241 1 8 . 1 1 95 95 ILE N N 95 123.581 123.581 123.690 -0.109 25148 5242 1 8 . 1 1 95 95 ILE HA H 95 4.601 4.601 4.471 0.130 25148 5243 1 8 . 1 1 95 95 ILE C C 95 175.081 175.081 175.421 -0.340 25148 5244 1 8 . 1 1 95 95 ILE CA C 95 58.601 58.601 59.905 -1.304 25148 5245 1 8 . 1 1 95 95 ILE CB C 95 41.727 41.727 42.165 -0.438 25148 5246 1 8 . 1 1 95 95 ILE H H 95 9.045 9.045 8.371 0.674 25148 5247 1 8 . 1 1 96 96 GLU N N 96 128.094 128.094 127.172 0.922 25148 5248 1 8 . 1 1 96 96 GLU HA H 96 4.098 4.098 4.325 -0.227 25148 5249 1 8 . 1 1 96 96 GLU C C 96 176.845 176.845 176.015 0.830 25148 5250 1 8 . 1 1 96 96 GLU CA C 96 57.853 57.853 58.528 -0.675 25148 5251 1 8 . 1 1 96 96 GLU CB C 96 28.323 28.323 29.458 -1.135 25148 5252 1 8 . 1 1 96 96 GLU H H 96 9.256 9.256 8.980 0.276 25148 5253 1 8 . 1 1 97 97 VAL N N 97 118.446 118.446 124.598 -6.152 25148 5254 1 8 . 1 1 97 97 VAL HA H 97 4.568 4.568 4.170 0.398 25148 5255 1 8 . 1 1 97 97 VAL C C 97 175.051 175.051 174.823 0.228 25148 5256 1 8 . 1 1 97 97 VAL CA C 97 59.796 59.796 61.582 -1.786 25148 5257 1 8 . 1 1 97 97 VAL CB C 97 32.399 32.399 33.047 -0.648 25148 5258 1 8 . 1 1 97 97 VAL H H 97 8.609 8.609 8.866 -0.257 25148 5259 1 8 . 1 1 98 98 THR N N 98 119.118 119.118 118.251 0.867 25148 5260 1 8 . 1 1 98 98 THR HA H 98 3.320 3.320 4.051 -0.731 25148 5261 1 8 . 1 1 98 98 THR CA C 98 61.628 61.628 59.595 2.033 25148 5262 1 8 . 1 1 98 98 THR CB C 98 70.031 70.031 69.397 0.634 25148 5263 1 8 . 1 1 98 98 THR H H 98 7.396 7.396 7.586 -0.190 25148 5264 1 8 . 1 1 99 99 PRO HA H 99 4.458 4.458 4.628 -0.170 25148 5265 1 8 . 1 1 99 99 PRO CA C 99 62.348 62.348 62.409 -0.061 25148 5266 1 8 . 1 1 99 99 PRO CB C 99 33.182 33.182 32.724 0.458 25148 5267 1 8 . 1 1 100 100 LYS HA H 100 4.126 4.126 4.169 -0.043 25148 5268 1 8 . 1 1 100 100 LYS CA C 100 58.773 58.773 57.813 0.960 25148 5269 1 8 . 1 1 100 100 LYS CB C 100 32.195 32.195 32.464 -0.269 25148 5270 1 8 . 1 1 101 101 ASP HA H 101 4.924 4.924 4.800 0.124 25148 5271 1 8 . 1 1 101 101 ASP C C 101 176.884 176.884 176.671 0.213 25148 5272 1 8 . 1 1 101 101 ASP CA C 101 54.134 54.134 53.874 0.260 25148 5273 1 8 . 1 1 101 101 ASP CB C 101 40.272 40.272 40.628 -0.356 25148 5274 1 8 . 1 1 102 102 PHE N N 102 118.703 118.703 121.401 -2.698 25148 5275 1 8 . 1 1 102 102 PHE HA H 102 4.295 4.295 4.235 0.060 25148 5276 1 8 . 1 1 102 102 PHE C C 102 176.477 176.477 177.004 -0.527 25148 5277 1 8 . 1 1 102 102 PHE CA C 102 60.748 60.748 60.028 0.721 25148 5278 1 8 . 1 1 102 102 PHE CB C 102 39.667 39.667 39.196 0.471 25148 5279 1 8 . 1 1 102 102 PHE H H 102 7.862 7.862 7.698 0.164 25148 5280 1 8 . 1 1 103 103 GLY CA C 103 47.430 47.430 47.315 0.116 25148 5281 1 8 . 1 1 104 104 ARG N N 104 121.819 121.819 120.560 1.259 25148 5282 1 8 . 1 1 104 104 ARG HA H 104 4.176 4.176 4.144 0.032 25148 5283 1 8 . 1 1 104 104 ARG C C 104 178.912 178.912 178.447 0.465 25148 5284 1 8 . 1 1 104 104 ARG CA C 104 59.235 59.235 58.500 0.735 25148 5285 1 8 . 1 1 104 104 ARG CB C 104 30.000 30.000 30.335 -0.335 25148 5286 1 8 . 1 1 104 104 ARG H H 104 7.809 7.809 7.458 0.351 25148 5287 1 8 . 1 1 105 105 ILE N N 105 120.331 120.331 121.137 -0.806 25148 5288 1 8 . 1 1 105 105 ILE HA H 105 3.836 3.836 3.653 0.183 25148 5289 1 8 . 1 1 105 105 ILE C C 105 179.206 179.206 177.743 1.463 25148 5290 1 8 . 1 1 105 105 ILE CA C 105 63.025 63.025 64.867 -1.842 25148 5291 1 8 . 1 1 105 105 ILE CB C 105 38.127 38.127 37.439 0.688 25148 5292 1 8 . 1 1 105 105 ILE H H 105 7.203 7.203 7.431 -0.228 25148 5293 1 8 . 1 1 106 106 ALA N N 106 124.867 124.867 122.464 2.403 25148 5294 1 8 . 1 1 106 106 ALA HA H 106 3.665 3.665 3.559 0.106 25148 5295 1 8 . 1 1 106 106 ALA C C 106 178.590 178.590 179.049 -0.459 25148 5296 1 8 . 1 1 106 106 ALA CA C 106 54.842 54.842 55.408 -0.566 25148 5297 1 8 . 1 1 106 106 ALA CB C 106 18.659 18.659 17.785 0.874 25148 5298 1 8 . 1 1 106 106 ALA H H 106 8.813 8.813 8.185 0.628 25148 5299 1 8 . 1 1 107 107 ALA N N 107 119.597 119.597 120.363 -0.766 25148 5300 1 8 . 1 1 107 107 ALA HA H 107 4.014 4.014 4.039 -0.025 25148 5301 1 8 . 1 1 107 107 ALA C C 107 180.214 180.214 179.580 0.634 25148 5302 1 8 . 1 1 107 107 ALA CA C 107 55.454 55.454 54.660 0.794 25148 5303 1 8 . 1 1 107 107 ALA CB C 107 18.260 18.260 18.076 0.184 25148 5304 1 8 . 1 1 107 107 ALA H H 107 8.012 8.012 7.546 0.466 25148 5305 1 8 . 1 1 108 108 GLN N N 108 116.896 116.896 118.365 -1.469 25148 5306 1 8 . 1 1 108 108 GLN HA H 108 4.054 4.054 3.973 0.081 25148 5307 1 8 . 1 1 108 108 GLN C C 108 178.784 178.784 178.452 0.332 25148 5308 1 8 . 1 1 108 108 GLN CA C 108 58.705 58.705 59.035 -0.330 25148 5309 1 8 . 1 1 108 108 GLN CB C 108 28.647 28.647 28.789 -0.142 25148 5310 1 8 . 1 1 108 108 GLN H H 108 7.498 7.498 8.630 -1.132 25148 5311 1 8 . 1 1 109 109 THR N N 109 117.495 117.495 114.729 2.766 25148 5312 1 8 . 1 1 109 109 THR HA H 109 3.917 3.917 4.403 -0.486 25148 5313 1 8 . 1 1 109 109 THR C C 109 175.732 175.732 175.599 0.133 25148 5314 1 8 . 1 1 109 109 THR CA C 109 66.989 66.989 65.128 1.861 25148 5315 1 8 . 1 1 109 109 THR CB C 109 68.766 68.766 68.652 0.114 25148 5316 1 8 . 1 1 109 109 THR H H 109 8.203 8.203 8.148 0.055 25148 5317 1 8 . 1 1 110 110 ALA N N 110 122.308 122.308 124.957 -2.649 25148 5318 1 8 . 1 1 110 110 ALA HA H 110 3.854 3.854 4.009 -0.155 25148 5319 1 8 . 1 1 110 110 ALA C C 110 178.380 178.380 178.756 -0.376 25148 5320 1 8 . 1 1 110 110 ALA CA C 110 55.903 55.903 54.826 1.077 25148 5321 1 8 . 1 1 110 110 ALA CB C 110 18.524 18.524 18.302 0.222 25148 5322 1 8 . 1 1 110 110 ALA H H 110 8.668 8.668 7.846 0.822 25148 5323 1 8 . 1 1 111 111 LYS N N 111 115.552 115.552 117.929 -2.377 25148 5324 1 8 . 1 1 111 111 LYS HA H 111 3.923 3.923 3.912 0.011 25148 5325 1 8 . 1 1 111 111 LYS C C 111 179.111 179.111 178.439 0.672 25148 5326 1 8 . 1 1 111 111 LYS CA C 111 59.825 59.825 59.222 0.603 25148 5327 1 8 . 1 1 111 111 LYS CB C 111 32.251 32.251 31.930 0.321 25148 5328 1 8 . 1 1 111 111 LYS H H 111 7.642 7.642 8.658 -1.016 25148 5329 1 8 . 1 1 112 112 GLN N N 112 120.178 120.178 118.611 1.567 25148 5330 1 8 . 1 1 112 112 GLN HA H 112 4.060 4.060 4.141 -0.081 25148 5331 1 8 . 1 1 112 112 GLN C C 112 178.355 178.355 177.964 0.391 25148 5332 1 8 . 1 1 112 112 GLN CA C 112 59.240 59.240 58.276 0.964 25148 5333 1 8 . 1 1 112 112 GLN CB C 112 28.250 28.250 28.697 -0.447 25148 5334 1 8 . 1 1 112 112 GLN H H 112 7.798 7.798 7.526 0.272 25148 5335 1 8 . 1 1 113 113 VAL N N 113 119.799 119.799 120.157 -0.358 25148 5336 1 8 . 1 1 113 113 VAL HA H 113 3.705 3.705 3.766 -0.061 25148 5337 1 8 . 1 1 113 113 VAL C C 113 178.303 178.303 177.981 0.322 25148 5338 1 8 . 1 1 113 113 VAL CA C 113 66.277 66.277 66.279 -0.002 25148 5339 1 8 . 1 1 113 113 VAL CB C 113 31.954 31.954 31.879 0.075 25148 5340 1 8 . 1 1 113 113 VAL H H 113 8.105 8.105 7.358 0.747 25148 5341 1 8 . 1 1 114 114 VAL N N 114 118.265 118.265 116.720 1.545 25148 5342 1 8 . 1 1 114 114 VAL HA H 114 3.392 3.392 3.557 -0.165 25148 5343 1 8 . 1 1 114 114 VAL C C 114 177.360 177.360 177.664 -0.304 25148 5344 1 8 . 1 1 114 114 VAL CA C 114 67.832 67.832 66.691 1.141 25148 5345 1 8 . 1 1 114 114 VAL CB C 114 31.801 31.801 31.245 0.556 25148 5346 1 8 . 1 1 114 114 VAL H H 114 8.180 8.180 8.003 0.177 25148 5347 1 8 . 1 1 115 115 THR N N 115 113.460 113.460 115.283 -1.823 25148 5348 1 8 . 1 1 115 115 THR HA H 115 3.856 3.856 3.871 -0.015 25148 5349 1 8 . 1 1 115 115 THR C C 115 176.529 176.529 176.934 -0.405 25148 5350 1 8 . 1 1 115 115 THR CA C 115 66.706 66.706 66.927 -0.221 25148 5351 1 8 . 1 1 115 115 THR CB C 115 69.008 69.008 68.372 0.636 25148 5352 1 8 . 1 1 115 115 THR H H 115 8.143 8.143 7.732 0.411 25148 5353 1 8 . 1 1 116 116 GLN N N 116 120.129 120.129 120.169 -0.040 25148 5354 1 8 . 1 1 116 116 GLN HA H 116 4.054 4.054 4.079 -0.025 25148 5355 1 8 . 1 1 116 116 GLN C C 116 178.100 178.100 178.493 -0.393 25148 5356 1 8 . 1 1 116 116 GLN CA C 116 58.950 58.950 59.111 -0.161 25148 5357 1 8 . 1 1 116 116 GLN CB C 116 28.244 28.244 28.502 -0.258 25148 5358 1 8 . 1 1 116 116 GLN H H 116 7.936 7.936 7.613 0.323 25148 5359 1 8 . 1 1 117 117 ARG N N 117 117.838 117.838 119.556 -1.718 25148 5360 1 8 . 1 1 117 117 ARG HA H 117 4.174 4.174 4.120 0.054 25148 5361 1 8 . 1 1 117 117 ARG C C 117 179.138 179.138 178.871 0.267 25148 5362 1 8 . 1 1 117 117 ARG CA C 117 57.461 57.461 57.704 -0.243 25148 5363 1 8 . 1 1 117 117 ARG CB C 117 29.548 29.548 29.240 0.308 25148 5364 1 8 . 1 1 117 117 ARG H H 117 8.240 8.240 7.619 0.621 25148 5365 1 8 . 1 1 118 118 VAL N N 118 120.278 120.278 119.424 0.854 25148 5366 1 8 . 1 1 118 118 VAL HA H 118 3.709 3.709 3.618 0.091 25148 5367 1 8 . 1 1 118 118 VAL C C 118 177.597 177.597 177.765 -0.168 25148 5368 1 8 . 1 1 118 118 VAL CA C 118 66.246 66.246 66.857 -0.611 25148 5369 1 8 . 1 1 118 118 VAL CB C 118 31.785 31.785 31.101 0.684 25148 5370 1 8 . 1 1 118 118 VAL H H 118 8.480 8.480 8.356 0.124 25148 5371 1 8 . 1 1 119 119 ARG N N 119 120.197 120.197 119.304 0.893 25148 5372 1 8 . 1 1 119 119 ARG HA H 119 4.173 4.173 4.243 -0.070 25148 5373 1 8 . 1 1 119 119 ARG C C 119 178.864 178.864 179.197 -0.333 25148 5374 1 8 . 1 1 119 119 ARG CA C 119 58.772 58.772 59.626 -0.854 25148 5375 1 8 . 1 1 119 119 ARG CB C 119 29.873 29.873 29.955 -0.082 25148 5376 1 8 . 1 1 119 119 ARG H H 119 7.899 7.899 7.668 0.231 25148 5377 1 8 . 1 1 120 120 GLU N N 120 118.768 118.768 120.004 -1.236 25148 5378 1 8 . 1 1 120 120 GLU HA H 120 4.110 4.110 4.009 0.101 25148 5379 1 8 . 1 1 120 120 GLU C C 120 177.823 177.823 178.984 -1.161 25148 5380 1 8 . 1 1 120 120 GLU CA C 120 58.223 58.223 59.295 -1.072 25148 5381 1 8 . 1 1 120 120 GLU CB C 120 29.854 29.854 29.561 0.293 25148 5382 1 8 . 1 1 120 120 GLU H H 120 8.084 8.084 8.042 0.042 25148 5383 1 8 . 1 1 121 121 ALA N N 121 121.984 121.984 119.804 2.180 25148 5384 1 8 . 1 1 121 121 ALA HA H 121 4.296 4.296 4.139 0.157 25148 5385 1 8 . 1 1 121 121 ALA C C 121 178.586 178.586 178.687 -0.101 25148 5386 1 8 . 1 1 121 121 ALA CA C 121 53.475 53.475 54.242 -0.767 25148 5387 1 8 . 1 1 121 121 ALA CB C 121 18.856 18.856 18.678 0.178 25148 5388 1 8 . 1 1 121 121 ALA H H 121 7.810 7.810 8.091 -0.281 25148 5389 1 8 . 1 1 122 122 GLU N N 122 118.229 118.229 118.080 0.149 25148 5390 1 8 . 1 1 122 122 GLU HA H 122 4.241 4.241 4.113 0.128 25148 5391 1 8 . 1 1 122 122 GLU C C 122 176.839 176.839 179.079 -2.240 25148 5392 1 8 . 1 1 122 122 GLU CA C 122 57.118 57.118 58.335 -1.217 25148 5393 1 8 . 1 1 122 122 GLU CB C 122 30.018 30.018 29.903 0.115 25148 5394 1 8 . 1 1 122 122 GLU H H 122 7.938 7.938 7.733 0.205 25148 5395 1 8 . 1 1 123 123 ARG N N 123 120.601 120.601 117.884 2.717 25148 5396 1 8 . 1 1 123 123 ARG HA H 123 4.348 4.348 4.110 0.238 25148 5397 1 8 . 1 1 123 123 ARG C C 123 176.071 176.071 176.914 -0.843 25148 5398 1 8 . 1 1 123 123 ARG CA C 123 56.510 56.510 58.008 -1.498 25148 5399 1 8 . 1 1 123 123 ARG CB C 123 30.765 30.765 30.758 0.007 25148 5400 1 8 . 1 1 123 123 ARG H H 123 7.977 7.977 8.454 -0.477 25148 5401 1 9 . 1 1 4 4 GLU HA H 4 4.138 4.138 4.046 0.092 25148 5402 1 9 . 1 1 4 4 GLU C C 4 179.152 179.152 177.898 1.254 25148 5403 1 9 . 1 1 4 4 GLU CA C 4 59.566 59.566 59.336 0.230 25148 5404 1 9 . 1 1 4 4 GLU CB C 4 29.407 29.407 29.326 0.081 25148 5405 1 9 . 1 1 5 5 LEU N N 5 121.360 121.360 117.826 3.534 25148 5406 1 9 . 1 1 5 5 LEU HA H 5 4.195 4.195 4.029 0.166 25148 5407 1 9 . 1 1 5 5 LEU C C 5 178.179 178.179 178.078 0.101 25148 5408 1 9 . 1 1 5 5 LEU CA C 5 57.830 57.830 57.584 0.246 25148 5409 1 9 . 1 1 5 5 LEU CB C 5 41.630 41.630 41.260 0.370 25148 5410 1 9 . 1 1 5 5 LEU H H 5 7.877 7.877 7.878 -0.001 25148 5411 1 9 . 1 1 6 6 LEU N N 6 118.058 118.058 119.030 -0.972 25148 5412 1 9 . 1 1 6 6 LEU HA H 6 3.919 3.919 3.808 0.111 25148 5413 1 9 . 1 1 6 6 LEU C C 6 180.274 180.274 179.110 1.164 25148 5414 1 9 . 1 1 6 6 LEU CA C 6 58.221 58.221 57.775 0.446 25148 5415 1 9 . 1 1 6 6 LEU CB C 6 40.684 40.684 41.077 -0.393 25148 5416 1 9 . 1 1 6 6 LEU H H 6 7.685 7.685 7.515 0.170 25148 5417 1 9 . 1 1 7 7 ASP N N 7 120.662 120.662 117.673 2.989 25148 5418 1 9 . 1 1 7 7 ASP HA H 7 4.416 4.416 4.334 0.082 25148 5419 1 9 . 1 1 7 7 ASP C C 7 178.738 178.738 177.668 1.070 25148 5420 1 9 . 1 1 7 7 ASP CA C 7 57.519 57.519 57.371 0.148 25148 5421 1 9 . 1 1 7 7 ASP CB C 7 40.167 40.167 40.865 -0.699 25148 5422 1 9 . 1 1 7 7 ASP H H 7 8.427 8.427 7.798 0.629 25148 5423 1 9 . 1 1 8 8 ALA N N 8 122.612 122.612 122.468 0.144 25148 5424 1 9 . 1 1 8 8 ALA HA H 8 4.146 4.146 4.038 0.108 25148 5425 1 9 . 1 1 8 8 ALA C C 8 180.787 180.787 179.721 1.066 25148 5426 1 9 . 1 1 8 8 ALA CA C 8 55.165 55.165 54.979 0.186 25148 5427 1 9 . 1 1 8 8 ALA CB C 8 17.711 17.711 18.276 -0.565 25148 5428 1 9 . 1 1 8 8 ALA H H 8 7.847 7.847 7.515 0.332 25148 5429 1 9 . 1 1 9 9 LEU N N 9 116.977 116.977 117.879 -0.902 25148 5430 1 9 . 1 1 9 9 LEU HA H 9 4.115 4.115 3.839 0.276 25148 5431 1 9 . 1 1 9 9 LEU C C 9 179.510 179.510 179.314 0.196 25148 5432 1 9 . 1 1 9 9 LEU CA C 9 57.468 57.468 58.035 -0.567 25148 5433 1 9 . 1 1 9 9 LEU CB C 9 41.203 41.203 41.601 -0.398 25148 5434 1 9 . 1 1 9 9 LEU H H 9 8.256 8.256 7.586 0.670 25148 5435 1 9 . 1 1 10 10 THR N N 10 118.764 118.764 116.027 2.737 25148 5436 1 9 . 1 1 10 10 THR HA H 10 4.487 4.487 3.837 0.650 25148 5437 1 9 . 1 1 10 10 THR C C 10 176.567 176.567 176.754 -0.187 25148 5438 1 9 . 1 1 10 10 THR CA C 10 68.768 68.768 66.926 1.842 25148 5439 1 9 . 1 1 10 10 THR CB C 10 66.961 66.961 68.642 -1.681 25148 5440 1 9 . 1 1 10 10 THR H H 10 8.218 8.218 7.375 0.843 25148 5441 1 9 . 1 1 11 11 ILE N N 11 122.555 122.555 120.079 2.476 25148 5442 1 9 . 1 1 11 11 ILE HA H 11 3.779 3.779 3.714 0.065 25148 5443 1 9 . 1 1 11 11 ILE C C 11 177.793 177.793 177.341 0.452 25148 5444 1 9 . 1 1 11 11 ILE CA C 11 64.695 64.695 65.015 -0.320 25148 5445 1 9 . 1 1 11 11 ILE CB C 11 37.856 37.856 37.702 0.154 25148 5446 1 9 . 1 1 11 11 ILE H H 11 7.632 7.632 7.766 -0.134 25148 5447 1 9 . 1 1 12 12 LEU N N 12 120.469 120.469 116.299 4.170 25148 5448 1 9 . 1 1 12 12 LEU HA H 12 4.065 4.065 4.127 -0.062 25148 5449 1 9 . 1 1 12 12 LEU C C 12 179.139 179.139 179.253 -0.114 25148 5450 1 9 . 1 1 12 12 LEU CA C 12 57.944 57.944 56.617 1.327 25148 5451 1 9 . 1 1 12 12 LEU CB C 12 42.170 42.170 41.359 0.811 25148 5452 1 9 . 1 1 12 12 LEU H H 12 7.951 7.951 7.624 0.327 25148 5453 1 9 . 1 1 13 13 GLU N N 13 119.669 119.669 119.883 -0.214 25148 5454 1 9 . 1 1 13 13 GLU HA H 13 4.183 4.183 4.096 0.087 25148 5455 1 9 . 1 1 13 13 GLU C C 13 179.007 179.007 177.791 1.216 25148 5456 1 9 . 1 1 13 13 GLU CA C 13 59.703 59.703 58.453 1.250 25148 5457 1 9 . 1 1 13 13 GLU CB C 13 30.110 30.110 29.190 0.920 25148 5458 1 9 . 1 1 13 13 GLU H H 13 8.003 8.003 7.877 0.126 25148 5459 1 9 . 1 1 14 14 LYS N N 14 118.935 118.935 117.620 1.315 25148 5460 1 9 . 1 1 14 14 LYS HA H 14 4.124 4.124 4.079 0.045 25148 5461 1 9 . 1 1 14 14 LYS CA C 14 58.847 58.847 57.456 1.391 25148 5462 1 9 . 1 1 14 14 LYS CB C 14 33.053 33.053 32.024 1.029 25148 5463 1 9 . 1 1 14 14 LYS H H 14 7.862 7.862 7.567 0.295 25148 5464 1 9 . 1 1 15 15 GLU HA H 15 3.693 3.693 4.261 -0.568 25148 5465 1 9 . 1 1 15 15 GLU CA C 15 56.688 56.688 56.195 0.493 25148 5466 1 9 . 1 1 15 15 GLU CB C 15 32.204 32.204 30.081 2.123 25148 5467 1 9 . 1 1 16 16 LYS HA H 16 4.678 4.678 4.467 0.211 25148 5468 1 9 . 1 1 16 16 LYS CA C 16 55.135 55.135 55.910 -0.775 25148 5469 1 9 . 1 1 16 16 LYS CB C 16 34.049 34.049 33.029 1.020 25148 5470 1 9 . 1 1 17 17 GLY CA C 17 46.541 46.541 45.414 1.127 25148 5471 1 9 . 1 1 18 18 ILE N N 18 115.364 115.364 120.005 -4.641 25148 5472 1 9 . 1 1 18 18 ILE HA H 18 4.079 4.079 4.282 -0.203 25148 5473 1 9 . 1 1 18 18 ILE C C 18 174.751 174.751 175.189 -0.438 25148 5474 1 9 . 1 1 18 18 ILE CA C 18 60.333 60.333 60.192 0.141 25148 5475 1 9 . 1 1 18 18 ILE CB C 18 39.044 39.044 39.321 -0.277 25148 5476 1 9 . 1 1 18 18 ILE H H 18 8.203 8.203 7.591 0.612 25148 5477 1 9 . 1 1 19 19 SER N N 19 119.891 119.891 118.977 0.914 25148 5478 1 9 . 1 1 19 19 SER HA H 19 4.362 4.362 4.849 -0.487 25148 5479 1 9 . 1 1 19 19 SER CA C 19 58.476 58.476 57.375 1.101 25148 5480 1 9 . 1 1 19 19 SER CB C 19 63.533 63.533 64.714 -1.181 25148 5481 1 9 . 1 1 19 19 SER H H 19 8.253 8.253 8.469 -0.216 25148 5482 1 9 . 1 1 20 20 LYS N N 20 124.782 124.782 126.383 -1.601 25148 5483 1 9 . 1 1 20 20 LYS HA H 20 4.137 4.137 4.067 0.070 25148 5484 1 9 . 1 1 20 20 LYS C C 20 177.889 177.889 177.700 0.189 25148 5485 1 9 . 1 1 20 20 LYS CA C 20 59.485 59.485 58.947 0.538 25148 5486 1 9 . 1 1 20 20 LYS CB C 20 32.711 32.711 32.403 0.308 25148 5487 1 9 . 1 1 20 20 LYS H H 20 8.918 8.918 8.430 0.488 25148 5488 1 9 . 1 1 21 21 GLU N N 21 117.831 117.831 119.579 -1.748 25148 5489 1 9 . 1 1 21 21 GLU HA H 21 3.957 3.957 4.074 -0.117 25148 5490 1 9 . 1 1 21 21 GLU C C 21 178.822 178.822 178.733 0.089 25148 5491 1 9 . 1 1 21 21 GLU CA C 21 59.529 59.529 59.010 0.519 25148 5492 1 9 . 1 1 21 21 GLU CB C 21 29.237 29.237 29.291 -0.054 25148 5493 1 9 . 1 1 21 21 GLU H H 21 8.361 8.361 8.491 -0.130 25148 5494 1 9 . 1 1 22 22 ILE N N 22 118.690 118.690 117.857 0.833 25148 5495 1 9 . 1 1 22 22 ILE HA H 22 3.884 3.884 4.226 -0.342 25148 5496 1 9 . 1 1 22 22 ILE C C 22 179.247 179.247 177.866 1.381 25148 5497 1 9 . 1 1 22 22 ILE CA C 22 63.735 63.735 63.638 0.097 25148 5498 1 9 . 1 1 22 22 ILE CB C 22 37.415 37.415 38.159 -0.744 25148 5499 1 9 . 1 1 22 22 ILE H H 22 7.353 7.353 7.413 -0.060 25148 5500 1 9 . 1 1 23 23 ILE N N 23 120.880 120.880 120.829 0.051 25148 5501 1 9 . 1 1 23 23 ILE HA H 23 3.733 3.733 3.706 0.027 25148 5502 1 9 . 1 1 23 23 ILE C C 23 177.817 177.817 177.958 -0.141 25148 5503 1 9 . 1 1 23 23 ILE CA C 23 64.172 64.172 63.793 0.379 25148 5504 1 9 . 1 1 23 23 ILE CB C 23 36.473 36.473 36.838 -0.365 25148 5505 1 9 . 1 1 23 23 ILE H H 23 7.571 7.571 7.242 0.329 25148 5506 1 9 . 1 1 24 24 ILE N N 24 121.460 121.460 119.039 2.421 25148 5507 1 9 . 1 1 24 24 ILE HA H 24 3.486 3.486 3.602 -0.116 25148 5508 1 9 . 1 1 24 24 ILE C C 24 177.759 177.759 177.663 0.096 25148 5509 1 9 . 1 1 24 24 ILE CA C 24 66.641 66.641 66.118 0.523 25148 5510 1 9 . 1 1 24 24 ILE CB C 24 37.307 37.307 37.283 0.023 25148 5511 1 9 . 1 1 24 24 ILE H H 24 8.709 8.709 7.706 1.003 25148 5512 1 9 . 1 1 25 25 GLU N N 25 119.323 119.323 119.118 0.205 25148 5513 1 9 . 1 1 25 25 GLU HA H 25 4.177 4.177 4.269 -0.092 25148 5514 1 9 . 1 1 25 25 GLU C C 25 179.348 179.348 178.654 0.694 25148 5515 1 9 . 1 1 25 25 GLU CA C 25 59.951 59.951 59.063 0.888 25148 5516 1 9 . 1 1 25 25 GLU CB C 25 29.340 29.340 29.164 0.176 25148 5517 1 9 . 1 1 25 25 GLU H H 25 8.048 8.048 7.772 0.276 25148 5518 1 9 . 1 1 26 26 ALA N N 26 122.390 122.390 122.686 -0.296 25148 5519 1 9 . 1 1 26 26 ALA HA H 26 4.325 4.325 4.133 0.192 25148 5520 1 9 . 1 1 26 26 ALA C C 26 181.440 181.440 179.657 1.783 25148 5521 1 9 . 1 1 26 26 ALA CA C 26 54.935 54.935 54.887 0.048 25148 5522 1 9 . 1 1 26 26 ALA CB C 26 17.834 17.834 18.380 -0.546 25148 5523 1 9 . 1 1 26 26 ALA H H 26 7.768 7.768 7.837 -0.069 25148 5524 1 9 . 1 1 27 27 ILE N N 27 122.342 122.342 119.744 2.598 25148 5525 1 9 . 1 1 27 27 ILE HA H 27 3.575 3.575 3.590 -0.015 25148 5526 1 9 . 1 1 27 27 ILE C C 27 177.541 177.541 178.066 -0.525 25148 5527 1 9 . 1 1 27 27 ILE CA C 27 66.536 66.536 65.702 0.834 25148 5528 1 9 . 1 1 27 27 ILE CB C 27 37.886 37.886 37.672 0.214 25148 5529 1 9 . 1 1 27 27 ILE H H 27 8.805 8.805 7.654 1.151 25148 5530 1 9 . 1 1 28 28 GLU N N 28 120.188 120.188 119.365 0.823 25148 5531 1 9 . 1 1 28 28 GLU HA H 28 3.687 3.687 3.885 -0.198 25148 5532 1 9 . 1 1 28 28 GLU C C 28 178.707 178.707 178.932 -0.225 25148 5533 1 9 . 1 1 28 28 GLU CA C 28 61.458 61.458 59.886 1.571 25148 5534 1 9 . 1 1 28 28 GLU CB C 28 29.624 29.624 29.216 0.408 25148 5535 1 9 . 1 1 28 28 GLU H H 28 8.882 8.882 7.834 1.048 25148 5536 1 9 . 1 1 29 29 ALA N N 29 119.293 119.293 121.152 -1.859 25148 5537 1 9 . 1 1 29 29 ALA HA H 29 4.214 4.214 4.063 0.151 25148 5538 1 9 . 1 1 29 29 ALA C C 29 181.200 181.200 179.736 1.464 25148 5539 1 9 . 1 1 29 29 ALA CA C 29 55.435 55.435 54.874 0.561 25148 5540 1 9 . 1 1 29 29 ALA CB C 29 18.090 18.090 18.095 -0.004 25148 5541 1 9 . 1 1 29 29 ALA H H 29 8.065 8.065 7.705 0.360 25148 5542 1 9 . 1 1 30 30 ALA N N 30 121.729 121.729 122.121 -0.392 25148 5543 1 9 . 1 1 30 30 ALA HA H 30 4.307 4.307 4.144 0.163 25148 5544 1 9 . 1 1 30 30 ALA C C 30 181.315 181.315 179.571 1.744 25148 5545 1 9 . 1 1 30 30 ALA CA C 30 54.594 54.594 54.881 -0.287 25148 5546 1 9 . 1 1 30 30 ALA CB C 30 18.704 18.704 18.328 0.376 25148 5547 1 9 . 1 1 30 30 ALA H H 30 8.099 8.099 7.595 0.504 25148 5548 1 9 . 1 1 31 31 LEU N N 31 120.900 120.900 120.508 0.392 25148 5549 1 9 . 1 1 31 31 LEU HA H 31 4.347 4.347 4.129 0.218 25148 5550 1 9 . 1 1 31 31 LEU C C 31 179.137 179.137 179.351 -0.214 25148 5551 1 9 . 1 1 31 31 LEU CA C 31 57.569 57.569 58.034 -0.465 25148 5552 1 9 . 1 1 31 31 LEU CB C 31 42.353 42.353 40.981 1.372 25148 5553 1 9 . 1 1 31 31 LEU H H 31 8.863 8.863 8.271 0.592 25148 5554 1 9 . 1 1 32 32 ILE N N 32 122.410 122.410 119.110 3.300 25148 5555 1 9 . 1 1 32 32 ILE HA H 32 3.699 3.699 3.682 0.017 25148 5556 1 9 . 1 1 32 32 ILE C C 32 178.303 178.303 177.844 0.459 25148 5557 1 9 . 1 1 32 32 ILE CA C 32 66.066 66.066 65.486 0.581 25148 5558 1 9 . 1 1 32 32 ILE CB C 32 37.882 37.882 37.886 -0.004 25148 5559 1 9 . 1 1 32 32 ILE H H 32 8.234 8.234 8.333 -0.099 25148 5560 1 9 . 1 1 33 33 SER N N 33 114.201 114.201 115.456 -1.255 25148 5561 1 9 . 1 1 33 33 SER HA H 33 4.311 4.311 4.096 0.215 25148 5562 1 9 . 1 1 33 33 SER C C 33 177.012 177.012 176.639 0.373 25148 5563 1 9 . 1 1 33 33 SER CA C 33 61.860 61.860 62.073 -0.213 25148 5564 1 9 . 1 1 33 33 SER CB C 33 62.508 62.508 63.076 -0.568 25148 5565 1 9 . 1 1 33 33 SER H H 33 7.558 7.558 7.857 -0.299 25148 5566 1 9 . 1 1 34 34 ALA N N 34 122.893 122.893 124.235 -1.342 25148 5567 1 9 . 1 1 34 34 ALA HA H 34 4.215 4.215 4.081 0.134 25148 5568 1 9 . 1 1 34 34 ALA C C 34 180.814 180.814 179.391 1.423 25148 5569 1 9 . 1 1 34 34 ALA CA C 34 55.283 55.283 55.023 0.260 25148 5570 1 9 . 1 1 34 34 ALA CB C 34 18.273 18.273 18.234 0.039 25148 5571 1 9 . 1 1 34 34 ALA H H 34 8.409 8.409 8.007 0.402 25148 5572 1 9 . 1 1 35 35 TYR N N 35 120.259 120.259 119.062 1.197 25148 5573 1 9 . 1 1 35 35 TYR HA H 35 4.393 4.393 4.271 0.122 25148 5574 1 9 . 1 1 35 35 TYR C C 35 177.892 177.892 177.654 0.238 25148 5575 1 9 . 1 1 35 35 TYR CA C 35 63.071 63.071 61.129 1.942 25148 5576 1 9 . 1 1 35 35 TYR CB C 35 38.021 38.021 38.715 -0.694 25148 5577 1 9 . 1 1 35 35 TYR H H 35 8.975 8.975 8.154 0.821 25148 5578 1 9 . 1 1 36 36 LYS N N 36 120.942 120.942 118.135 2.807 25148 5579 1 9 . 1 1 36 36 LYS HA H 36 4.032 4.032 4.054 -0.022 25148 5580 1 9 . 1 1 36 36 LYS C C 36 177.797 177.797 178.001 -0.204 25148 5581 1 9 . 1 1 36 36 LYS CA C 36 59.900 59.900 59.124 0.776 25148 5582 1 9 . 1 1 36 36 LYS CB C 36 32.429 32.429 32.307 0.122 25148 5583 1 9 . 1 1 36 36 LYS H H 36 8.654 8.654 8.029 0.625 25148 5584 1 9 . 1 1 37 37 ARG N N 37 115.139 115.139 116.453 -1.314 25148 5585 1 9 . 1 1 37 37 ARG HA H 37 4.101 4.101 4.101 0.000 25148 5586 1 9 . 1 1 37 37 ARG C C 37 177.517 177.517 178.151 -0.634 25148 5587 1 9 . 1 1 37 37 ARG CA C 37 58.276 58.276 58.313 -0.037 25148 5588 1 9 . 1 1 37 37 ARG CB C 37 31.014 31.014 29.865 1.149 25148 5589 1 9 . 1 1 37 37 ARG H H 37 8.138 8.138 7.697 0.441 25148 5590 1 9 . 1 1 38 38 ASN N N 38 112.555 112.555 116.528 -3.973 25148 5591 1 9 . 1 1 38 38 ASN HA H 38 4.540 4.540 4.315 0.225 25148 5592 1 9 . 1 1 38 38 ASN C C 38 173.994 173.994 175.576 -1.582 25148 5593 1 9 . 1 1 38 38 ASN CA C 38 54.722 54.722 54.918 -0.196 25148 5594 1 9 . 1 1 38 38 ASN CB C 38 42.077 42.077 39.259 2.818 25148 5595 1 9 . 1 1 38 38 ASN H H 38 7.426 7.426 7.453 -0.027 25148 5596 1 9 . 1 1 39 39 PHE N N 39 116.711 116.711 117.848 -1.137 25148 5597 1 9 . 1 1 39 39 PHE HA H 39 4.569 4.569 4.678 -0.109 25148 5598 1 9 . 1 1 39 39 PHE CA C 39 58.913 58.913 56.406 2.507 25148 5599 1 9 . 1 1 39 39 PHE CB C 39 39.781 39.781 38.983 0.798 25148 5600 1 9 . 1 1 39 39 PHE H H 39 7.959 7.959 7.247 0.712 25148 5601 1 9 . 1 1 40 40 ASN HA H 40 4.018 4.018 4.554 -0.536 25148 5602 1 9 . 1 1 40 40 ASN CA C 40 58.944 58.944 55.451 3.493 25148 5603 1 9 . 1 1 41 41 GLN HA H 41 4.298 4.298 4.469 -0.171 25148 5604 1 9 . 1 1 41 41 GLN C C 41 175.237 175.237 175.666 -0.429 25148 5605 1 9 . 1 1 41 41 GLN CA C 41 57.360 57.360 56.486 0.874 25148 5606 1 9 . 1 1 41 41 GLN CB C 41 28.724 28.724 28.098 0.626 25148 5607 1 9 . 1 1 42 42 ALA N N 42 120.514 120.514 121.056 -0.542 25148 5608 1 9 . 1 1 42 42 ALA HA H 42 4.622 4.622 4.422 0.200 25148 5609 1 9 . 1 1 42 42 ALA C C 42 175.922 175.922 176.638 -0.716 25148 5610 1 9 . 1 1 42 42 ALA CA C 42 51.841 51.841 52.309 -0.467 25148 5611 1 9 . 1 1 42 42 ALA CB C 42 21.576 21.576 20.028 1.548 25148 5612 1 9 . 1 1 42 42 ALA H H 42 7.817 7.817 8.078 -0.261 25148 5613 1 9 . 1 1 43 43 GLN N N 43 117.594 117.594 116.745 0.849 25148 5614 1 9 . 1 1 43 43 GLN HA H 43 4.265 4.265 4.415 -0.150 25148 5615 1 9 . 1 1 43 43 GLN C C 43 174.942 174.942 173.660 1.282 25148 5616 1 9 . 1 1 43 43 GLN CA C 43 57.047 57.047 55.480 1.567 25148 5617 1 9 . 1 1 43 43 GLN CB C 43 30.863 30.863 31.188 -0.325 25148 5618 1 9 . 1 1 43 43 GLN H H 43 7.400 7.400 7.524 -0.124 25148 5619 1 9 . 1 1 44 44 ASN N N 44 120.467 120.467 121.880 -1.413 25148 5620 1 9 . 1 1 44 44 ASN HA H 44 5.005 5.005 4.659 0.346 25148 5621 1 9 . 1 1 44 44 ASN C C 44 174.365 174.365 174.523 -0.158 25148 5622 1 9 . 1 1 44 44 ASN CA C 44 52.381 52.381 53.334 -0.953 25148 5623 1 9 . 1 1 44 44 ASN CB C 44 38.177 38.177 39.142 -0.965 25148 5624 1 9 . 1 1 44 44 ASN H H 44 9.123 9.123 8.609 0.514 25148 5625 1 9 . 1 1 45 45 VAL N N 45 115.479 115.479 116.796 -1.317 25148 5626 1 9 . 1 1 45 45 VAL HA H 45 5.376 5.376 4.377 0.999 25148 5627 1 9 . 1 1 45 45 VAL C C 45 174.908 174.908 173.978 0.930 25148 5628 1 9 . 1 1 45 45 VAL CA C 45 59.022 59.022 61.815 -2.792 25148 5629 1 9 . 1 1 45 45 VAL CB C 45 35.776 35.776 35.033 0.743 25148 5630 1 9 . 1 1 45 45 VAL H H 45 7.732 7.732 8.130 -0.398 25148 5631 1 9 . 1 1 46 46 ARG N N 46 121.146 121.146 125.167 -4.021 25148 5632 1 9 . 1 1 46 46 ARG HA H 46 4.566 4.566 4.885 -0.319 25148 5633 1 9 . 1 1 46 46 ARG C C 46 173.790 173.790 174.181 -0.391 25148 5634 1 9 . 1 1 46 46 ARG CA C 46 54.762 54.762 54.764 -0.002 25148 5635 1 9 . 1 1 46 46 ARG CB C 46 33.946 33.946 33.523 0.423 25148 5636 1 9 . 1 1 46 46 ARG H H 46 8.850 8.850 8.964 -0.114 25148 5637 1 9 . 1 1 47 47 VAL N N 47 122.339 122.339 123.067 -0.728 25148 5638 1 9 . 1 1 47 47 VAL HA H 47 4.741 4.741 4.791 -0.050 25148 5639 1 9 . 1 1 47 47 VAL C C 47 173.541 173.541 175.243 -1.702 25148 5640 1 9 . 1 1 47 47 VAL CA C 47 60.893 60.893 60.621 0.272 25148 5641 1 9 . 1 1 47 47 VAL CB C 47 33.563 33.563 33.808 -0.245 25148 5642 1 9 . 1 1 47 47 VAL H H 47 8.444 8.444 8.474 -0.030 25148 5643 1 9 . 1 1 48 48 ASP N N 48 127.701 127.701 125.623 2.078 25148 5644 1 9 . 1 1 48 48 ASP HA H 48 4.946 4.946 4.955 -0.009 25148 5645 1 9 . 1 1 48 48 ASP C C 48 173.744 173.744 174.672 -0.928 25148 5646 1 9 . 1 1 48 48 ASP CA C 48 52.651 52.651 52.968 -0.317 25148 5647 1 9 . 1 1 48 48 ASP CB C 48 45.225 45.225 44.109 1.116 25148 5648 1 9 . 1 1 48 48 ASP H H 48 9.068 9.068 8.518 0.550 25148 5649 1 9 . 1 1 49 49 LEU N N 49 130.945 130.945 126.475 4.470 25148 5650 1 9 . 1 1 49 49 LEU HA H 49 4.774 4.774 4.620 0.154 25148 5651 1 9 . 1 1 49 49 LEU C C 49 174.531 174.531 175.440 -0.909 25148 5652 1 9 . 1 1 49 49 LEU CA C 49 54.337 54.337 54.124 0.213 25148 5653 1 9 . 1 1 49 49 LEU CB C 49 43.192 43.192 42.785 0.407 25148 5654 1 9 . 1 1 49 49 LEU H H 49 9.369 9.369 8.663 0.706 25148 5655 1 9 . 1 1 50 50 ASN N N 50 126.268 126.268 126.431 -0.163 25148 5656 1 9 . 1 1 50 50 ASN HA H 50 4.629 4.629 4.970 -0.341 25148 5657 1 9 . 1 1 50 50 ASN C C 50 176.602 176.602 175.467 1.135 25148 5658 1 9 . 1 1 50 50 ASN CA C 50 54.048 54.048 52.496 1.552 25148 5659 1 9 . 1 1 50 50 ASN CB C 50 39.891 39.891 38.898 0.993 25148 5660 1 9 . 1 1 50 50 ASN H H 50 8.672 8.672 8.892 -0.220 25148 5661 1 9 . 1 1 51 51 ARG N N 51 125.897 125.897 124.033 1.864 25148 5662 1 9 . 1 1 51 51 ARG HA H 51 3.789 3.789 4.240 -0.451 25148 5663 1 9 . 1 1 51 51 ARG C C 51 175.681 175.681 176.194 -0.513 25148 5664 1 9 . 1 1 51 51 ARG CA C 51 58.162 58.162 58.465 -0.303 25148 5665 1 9 . 1 1 51 51 ARG CB C 51 29.944 29.944 29.835 0.108 25148 5666 1 9 . 1 1 51 51 ARG H H 51 8.984 8.984 8.630 0.354 25148 5667 1 9 . 1 1 52 52 GLU N N 52 116.733 116.733 120.284 -3.551 25148 5668 1 9 . 1 1 52 52 GLU HA H 52 4.368 4.368 4.178 0.190 25148 5669 1 9 . 1 1 52 52 GLU C C 52 178.049 178.049 177.266 0.783 25148 5670 1 9 . 1 1 52 52 GLU CA C 52 58.048 58.048 58.121 -0.073 25148 5671 1 9 . 1 1 52 52 GLU CB C 52 30.716 30.716 29.504 1.212 25148 5672 1 9 . 1 1 52 52 GLU H H 52 8.541 8.541 8.610 -0.069 25148 5673 1 9 . 1 1 53 53 THR N N 53 106.556 106.556 107.398 -0.842 25148 5674 1 9 . 1 1 53 53 THR HA H 53 4.424 4.424 4.599 -0.175 25148 5675 1 9 . 1 1 53 53 THR C C 53 176.352 176.352 174.967 1.385 25148 5676 1 9 . 1 1 53 53 THR CA C 53 61.320 61.320 61.039 0.281 25148 5677 1 9 . 1 1 53 53 THR CB C 53 71.220 71.220 69.564 1.656 25148 5678 1 9 . 1 1 53 53 THR H H 53 8.085 8.085 7.528 0.557 25148 5679 1 9 . 1 1 54 54 GLY N N 54 111.843 111.843 110.352 1.491 25148 5680 1 9 . 1 1 54 54 GLY C C 54 172.690 172.690 174.402 -1.712 25148 5681 1 9 . 1 1 54 54 GLY CA C 54 45.417 45.417 46.201 -0.784 25148 5682 1 9 . 1 1 54 54 GLY H H 54 8.330 8.330 7.870 0.460 25148 5683 1 9 . 1 1 55 55 SER N N 55 113.844 113.844 114.248 -0.404 25148 5684 1 9 . 1 1 55 55 SER HA H 55 4.279 4.279 4.701 -0.422 25148 5685 1 9 . 1 1 55 55 SER C C 55 174.127 174.127 172.954 1.173 25148 5686 1 9 . 1 1 55 55 SER CA C 55 59.229 59.229 58.103 1.126 25148 5687 1 9 . 1 1 55 55 SER CB C 55 63.939 63.939 65.300 -1.361 25148 5688 1 9 . 1 1 55 55 SER H H 55 7.653 7.653 7.533 0.120 25148 5689 1 9 . 1 1 56 56 ILE N N 56 125.286 125.286 120.610 4.676 25148 5690 1 9 . 1 1 56 56 ILE HA H 56 5.082 5.082 5.015 0.067 25148 5691 1 9 . 1 1 56 56 ILE C C 56 175.346 175.346 174.432 0.914 25148 5692 1 9 . 1 1 56 56 ILE CA C 56 59.967 59.967 60.002 -0.035 25148 5693 1 9 . 1 1 56 56 ILE CB C 56 40.165 40.165 42.486 -2.321 25148 5694 1 9 . 1 1 56 56 ILE H H 56 8.478 8.478 8.427 0.051 25148 5695 1 9 . 1 1 57 57 ARG N N 57 126.332 126.332 127.876 -1.544 25148 5696 1 9 . 1 1 57 57 ARG HA H 57 4.740 4.740 4.531 0.209 25148 5697 1 9 . 1 1 57 57 ARG C C 57 173.921 173.921 173.628 0.293 25148 5698 1 9 . 1 1 57 57 ARG CA C 57 54.311 54.311 53.774 0.537 25148 5699 1 9 . 1 1 57 57 ARG CB C 57 35.805 35.805 32.918 2.887 25148 5700 1 9 . 1 1 57 57 ARG H H 57 8.590 8.590 8.527 0.064 25148 5701 1 9 . 1 1 58 58 VAL N N 58 120.987 120.987 123.379 -2.392 25148 5702 1 9 . 1 1 58 58 VAL HA H 58 4.334 4.334 4.781 -0.447 25148 5703 1 9 . 1 1 58 58 VAL C C 58 174.204 174.204 174.353 -0.149 25148 5704 1 9 . 1 1 58 58 VAL CA C 58 60.861 60.861 61.222 -0.361 25148 5705 1 9 . 1 1 58 58 VAL CB C 58 33.383 33.383 32.070 1.313 25148 5706 1 9 . 1 1 58 58 VAL H H 58 8.585 8.585 8.214 0.371 25148 5707 1 9 . 1 1 59 59 PHE N N 59 124.913 124.913 126.281 -1.368 25148 5708 1 9 . 1 1 59 59 PHE HA H 59 5.046 5.046 5.251 -0.205 25148 5709 1 9 . 1 1 59 59 PHE C C 59 174.446 174.446 173.938 0.508 25148 5710 1 9 . 1 1 59 59 PHE CA C 59 56.695 56.695 55.179 1.516 25148 5711 1 9 . 1 1 59 59 PHE CB C 59 42.779 42.779 43.044 -0.265 25148 5712 1 9 . 1 1 59 59 PHE H H 59 8.920 8.920 9.117 -0.197 25148 5713 1 9 . 1 1 60 60 ALA N N 60 124.035 124.035 122.795 1.240 25148 5714 1 9 . 1 1 60 60 ALA HA H 60 5.102 5.102 4.859 0.243 25148 5715 1 9 . 1 1 60 60 ALA C C 60 176.017 176.017 175.916 0.101 25148 5716 1 9 . 1 1 60 60 ALA CA C 60 50.083 50.083 50.565 -0.482 25148 5717 1 9 . 1 1 60 60 ALA CB C 60 22.400 22.400 21.527 0.873 25148 5718 1 9 . 1 1 60 60 ALA H H 60 9.457 9.457 9.133 0.324 25148 5719 1 9 . 1 1 61 61 ARG N N 61 121.530 121.530 124.387 -2.857 25148 5720 1 9 . 1 1 61 61 ARG HA H 61 4.958 4.958 5.174 -0.216 25148 5721 1 9 . 1 1 61 61 ARG C C 61 176.737 176.737 175.765 0.972 25148 5722 1 9 . 1 1 61 61 ARG CA C 61 55.375 55.375 55.193 0.182 25148 5723 1 9 . 1 1 61 61 ARG CB C 61 31.230 31.230 32.445 -1.215 25148 5724 1 9 . 1 1 61 61 ARG H H 61 8.447 8.447 8.517 -0.070 25148 5725 1 9 . 1 1 62 62 LYS N N 62 124.784 124.784 125.329 -0.545 25148 5726 1 9 . 1 1 62 62 LYS HA H 62 4.709 4.709 4.528 0.181 25148 5727 1 9 . 1 1 62 62 LYS C C 62 173.899 173.899 174.934 -1.035 25148 5728 1 9 . 1 1 62 62 LYS CA C 62 54.812 54.812 55.204 -0.392 25148 5729 1 9 . 1 1 62 62 LYS CB C 62 37.147 37.147 36.400 0.747 25148 5730 1 9 . 1 1 62 62 LYS H H 62 9.137 9.137 8.076 1.061 25148 5731 1 9 . 1 1 63 63 ASP N N 63 122.552 122.552 124.140 -1.588 25148 5732 1 9 . 1 1 63 63 ASP HA H 63 4.877 4.877 4.459 0.418 25148 5733 1 9 . 1 1 63 63 ASP C C 63 175.560 175.560 175.654 -0.094 25148 5734 1 9 . 1 1 63 63 ASP CA C 63 54.576 54.576 56.432 -1.856 25148 5735 1 9 . 1 1 63 63 ASP CB C 63 42.841 42.841 41.908 0.932 25148 5736 1 9 . 1 1 63 63 ASP H H 63 8.334 8.334 8.572 -0.238 25148 5737 1 9 . 1 1 64 64 VAL N N 64 123.109 123.109 124.275 -1.166 25148 5738 1 9 . 1 1 64 64 VAL HA H 64 4.557 4.557 4.899 -0.342 25148 5739 1 9 . 1 1 64 64 VAL C C 64 177.260 177.260 174.767 2.493 25148 5740 1 9 . 1 1 64 64 VAL CA C 64 62.268 62.268 61.496 0.772 25148 5741 1 9 . 1 1 64 64 VAL CB C 64 30.348 30.348 32.106 -1.758 25148 5742 1 9 . 1 1 64 64 VAL H H 64 8.693 8.693 7.806 0.887 25148 5743 1 9 . 1 1 65 65 VAL N N 65 122.320 122.320 122.648 -0.328 25148 5744 1 9 . 1 1 65 65 VAL HA H 65 4.939 4.939 4.565 0.374 25148 5745 1 9 . 1 1 65 65 VAL C C 65 174.754 174.754 174.604 0.150 25148 5746 1 9 . 1 1 65 65 VAL CA C 65 59.173 59.173 60.018 -0.845 25148 5747 1 9 . 1 1 65 65 VAL CB C 65 36.289 36.289 35.606 0.683 25148 5748 1 9 . 1 1 65 65 VAL H H 65 8.656 8.656 8.586 0.070 25148 5749 1 9 . 1 1 66 66 ASP N N 66 119.805 119.805 120.584 -0.779 25148 5750 1 9 . 1 1 66 66 ASP HA H 66 4.499 4.499 4.481 0.018 25148 5751 1 9 . 1 1 66 66 ASP C C 66 176.565 176.565 175.798 0.767 25148 5752 1 9 . 1 1 66 66 ASP CA C 66 57.236 57.236 56.177 1.059 25148 5753 1 9 . 1 1 66 66 ASP CB C 66 41.662 41.662 41.217 0.445 25148 5754 1 9 . 1 1 66 66 ASP H H 66 8.628 8.628 8.666 -0.038 25148 5755 1 9 . 1 1 67 67 GLU N N 67 117.604 117.604 119.250 -1.646 25148 5756 1 9 . 1 1 67 67 GLU HA H 67 4.350 4.350 4.441 -0.091 25148 5757 1 9 . 1 1 67 67 GLU C C 67 173.736 173.736 174.908 -1.172 25148 5758 1 9 . 1 1 67 67 GLU CA C 67 55.203 55.203 55.389 -0.187 25148 5759 1 9 . 1 1 67 67 GLU CB C 67 32.240 32.240 30.282 1.958 25148 5760 1 9 . 1 1 67 67 GLU H H 67 7.525 7.525 8.054 -0.529 25148 5761 1 9 . 1 1 68 68 VAL N N 68 125.774 125.774 123.954 1.820 25148 5762 1 9 . 1 1 68 68 VAL HA H 68 3.578 3.578 4.032 -0.454 25148 5763 1 9 . 1 1 68 68 VAL C C 68 175.885 175.885 176.291 -0.406 25148 5764 1 9 . 1 1 68 68 VAL CA C 68 63.397 63.397 63.779 -0.382 25148 5765 1 9 . 1 1 68 68 VAL CB C 68 32.452 32.452 31.690 0.762 25148 5766 1 9 . 1 1 68 68 VAL H H 68 8.573 8.573 8.507 0.066 25148 5767 1 9 . 1 1 69 69 TYR N N 69 129.859 129.859 124.978 4.881 25148 5768 1 9 . 1 1 69 69 TYR HA H 69 4.642 4.642 4.650 -0.008 25148 5769 1 9 . 1 1 69 69 TYR C C 69 176.100 176.100 175.721 0.379 25148 5770 1 9 . 1 1 69 69 TYR CA C 69 59.092 59.092 58.822 0.270 25148 5771 1 9 . 1 1 69 69 TYR CB C 69 39.830 39.830 39.757 0.073 25148 5772 1 9 . 1 1 69 69 TYR H H 69 9.801 9.801 8.302 1.499 25148 5773 1 9 . 1 1 70 70 ASP N N 70 120.204 120.204 121.982 -1.778 25148 5774 1 9 . 1 1 70 70 ASP HA H 70 4.772 4.772 4.988 -0.216 25148 5775 1 9 . 1 1 70 70 ASP C C 70 176.622 176.622 176.561 0.061 25148 5776 1 9 . 1 1 70 70 ASP CA C 70 52.885 52.885 53.661 -0.776 25148 5777 1 9 . 1 1 70 70 ASP CB C 70 41.878 41.878 40.148 1.730 25148 5778 1 9 . 1 1 70 70 ASP H H 70 8.348 8.348 8.375 -0.027 25148 5779 1 9 . 1 1 71 71 GLN N N 71 125.440 125.440 120.957 4.483 25148 5780 1 9 . 1 1 71 71 GLN HA H 71 4.315 4.315 3.989 0.326 25148 5781 1 9 . 1 1 71 71 GLN C C 71 175.819 175.819 176.502 -0.683 25148 5782 1 9 . 1 1 71 71 GLN CA C 71 57.914 57.914 58.297 -0.383 25148 5783 1 9 . 1 1 71 71 GLN CB C 71 28.307 28.307 28.267 0.040 25148 5784 1 9 . 1 1 71 71 GLN H H 71 9.097 9.097 8.645 0.452 25148 5785 1 9 . 1 1 72 72 ARG N N 72 116.306 116.306 117.452 -1.146 25148 5786 1 9 . 1 1 72 72 ARG HA H 72 4.252 4.252 4.197 0.055 25148 5787 1 9 . 1 1 72 72 ARG C C 72 178.087 178.087 175.840 2.247 25148 5788 1 9 . 1 1 72 72 ARG CA C 72 58.532 58.532 57.110 1.422 25148 5789 1 9 . 1 1 72 72 ARG CB C 72 30.143 30.143 30.623 -0.480 25148 5790 1 9 . 1 1 72 72 ARG H H 72 8.534 8.534 8.232 0.302 25148 5791 1 9 . 1 1 73 73 LEU N N 73 116.734 116.734 114.135 2.599 25148 5792 1 9 . 1 1 73 73 LEU HA H 73 4.621 4.621 4.581 0.040 25148 5793 1 9 . 1 1 73 73 LEU C C 73 175.946 175.946 174.805 1.141 25148 5794 1 9 . 1 1 73 73 LEU CA C 73 55.250 55.250 55.169 0.081 25148 5795 1 9 . 1 1 73 73 LEU CB C 73 46.960 46.960 44.931 2.029 25148 5796 1 9 . 1 1 73 73 LEU H H 73 7.460 7.460 7.465 -0.005 25148 5797 1 9 . 1 1 74 74 GLU N N 74 118.787 118.787 122.812 -4.025 25148 5798 1 9 . 1 1 74 74 GLU HA H 74 5.403 5.403 4.715 0.688 25148 5799 1 9 . 1 1 74 74 GLU C C 74 173.709 173.709 174.178 -0.469 25148 5800 1 9 . 1 1 74 74 GLU CA C 74 54.914 54.914 56.035 -1.121 25148 5801 1 9 . 1 1 74 74 GLU CB C 74 35.053 35.053 33.568 1.486 25148 5802 1 9 . 1 1 74 74 GLU H H 74 7.752 7.752 8.107 -0.355 25148 5803 1 9 . 1 1 75 75 ILE N N 75 119.803 119.803 122.682 -2.879 25148 5804 1 9 . 1 1 75 75 ILE HA H 75 4.507 4.507 4.581 -0.074 25148 5805 1 9 . 1 1 75 75 ILE C C 75 172.126 172.126 173.772 -1.646 25148 5806 1 9 . 1 1 75 75 ILE CA C 75 58.664 58.664 59.894 -1.230 25148 5807 1 9 . 1 1 75 75 ILE CB C 75 42.560 42.560 41.677 0.883 25148 5808 1 9 . 1 1 75 75 ILE H H 75 8.975 8.975 9.146 -0.171 25148 5809 1 9 . 1 1 76 76 SER N N 76 123.236 123.236 123.832 -0.596 25148 5810 1 9 . 1 1 76 76 SER HA H 76 4.505 4.505 4.573 -0.068 25148 5811 1 9 . 1 1 76 76 SER C C 76 176.145 176.145 175.875 0.270 25148 5812 1 9 . 1 1 76 76 SER CA C 76 58.108 58.108 58.641 -0.533 25148 5813 1 9 . 1 1 76 76 SER CB C 76 65.000 65.000 63.893 1.107 25148 5814 1 9 . 1 1 76 76 SER H H 76 8.810 8.810 8.706 0.104 25148 5815 1 9 . 1 1 77 77 ILE N N 77 120.629 120.629 127.265 -6.636 25148 5816 1 9 . 1 1 77 77 ILE HA H 77 3.935 3.935 3.770 0.165 25148 5817 1 9 . 1 1 77 77 ILE C C 77 175.806 175.806 176.753 -0.947 25148 5818 1 9 . 1 1 77 77 ILE CA C 77 61.928 61.928 64.044 -2.116 25148 5819 1 9 . 1 1 77 77 ILE CB C 77 38.031 38.031 38.345 -0.314 25148 5820 1 9 . 1 1 77 77 ILE H H 77 8.321 8.321 8.027 0.294 25148 5821 1 9 . 1 1 78 78 GLU N N 78 121.032 121.032 116.897 4.135 25148 5822 1 9 . 1 1 78 78 GLU HA H 78 4.082 4.082 4.009 0.073 25148 5823 1 9 . 1 1 78 78 GLU C C 78 179.829 179.829 178.429 1.400 25148 5824 1 9 . 1 1 78 78 GLU CA C 78 60.180 60.180 58.958 1.222 25148 5825 1 9 . 1 1 78 78 GLU CB C 78 28.988 28.988 28.847 0.141 25148 5826 1 9 . 1 1 78 78 GLU H H 78 8.222 8.222 8.541 -0.319 25148 5827 1 9 . 1 1 79 79 GLU N N 79 120.710 120.710 121.026 -0.316 25148 5828 1 9 . 1 1 79 79 GLU HA H 79 4.012 4.012 4.119 -0.107 25148 5829 1 9 . 1 1 79 79 GLU C C 79 180.339 180.339 178.859 1.480 25148 5830 1 9 . 1 1 79 79 GLU CA C 79 59.332 59.332 58.718 0.614 25148 5831 1 9 . 1 1 79 79 GLU CB C 79 29.317 29.317 29.407 -0.090 25148 5832 1 9 . 1 1 79 79 GLU H H 79 7.908 7.908 7.812 0.096 25148 5833 1 9 . 1 1 80 80 ALA N N 80 122.879 122.879 122.162 0.717 25148 5834 1 9 . 1 1 80 80 ALA HA H 80 3.966 3.966 4.212 -0.246 25148 5835 1 9 . 1 1 80 80 ALA C C 80 179.833 179.833 179.829 0.004 25148 5836 1 9 . 1 1 80 80 ALA CA C 80 55.881 55.881 54.916 0.965 25148 5837 1 9 . 1 1 80 80 ALA CB C 80 18.870 18.870 18.199 0.671 25148 5838 1 9 . 1 1 80 80 ALA H H 80 9.132 9.132 7.932 1.200 25148 5839 1 9 . 1 1 81 81 GLN N N 81 115.829 115.829 116.840 -1.011 25148 5840 1 9 . 1 1 81 81 GLN HA H 81 4.749 4.749 4.312 0.437 25148 5841 1 9 . 1 1 81 81 GLN C C 81 178.126 178.126 177.899 0.227 25148 5842 1 9 . 1 1 81 81 GLN CA C 81 57.682 57.682 58.102 -0.420 25148 5843 1 9 . 1 1 81 81 GLN CB C 81 27.307 27.307 28.565 -1.258 25148 5844 1 9 . 1 1 81 81 GLN H H 81 8.709 8.709 7.785 0.924 25148 5845 1 9 . 1 1 82 82 GLY N N 82 105.531 105.531 106.585 -1.054 25148 5846 1 9 . 1 1 82 82 GLY C C 82 174.917 174.917 175.098 -0.181 25148 5847 1 9 . 1 1 82 82 GLY CA C 82 45.915 45.915 46.599 -0.684 25148 5848 1 9 . 1 1 82 82 GLY H H 82 7.479 7.479 7.788 -0.309 25148 5849 1 9 . 1 1 83 83 ILE N N 83 122.828 122.828 113.718 9.110 25148 5850 1 9 . 1 1 83 83 ILE HA H 83 3.970 3.970 4.437 -0.467 25148 5851 1 9 . 1 1 83 83 ILE C C 83 177.209 177.209 175.520 1.689 25148 5852 1 9 . 1 1 83 83 ILE CA C 83 64.305 64.305 61.641 2.664 25148 5853 1 9 . 1 1 83 83 ILE CB C 83 38.452 38.452 40.244 -1.792 25148 5854 1 9 . 1 1 83 83 ILE H H 83 7.634 7.634 7.575 0.059 25148 5855 1 9 . 1 1 84 84 HIS N N 84 118.927 118.927 120.084 -1.157 25148 5856 1 9 . 1 1 84 84 HIS HA H 84 4.713 4.713 4.928 -0.215 25148 5857 1 9 . 1 1 84 84 HIS CA C 84 55.487 55.487 54.458 1.029 25148 5858 1 9 . 1 1 84 84 HIS CB C 84 33.506 33.506 32.228 1.278 25148 5859 1 9 . 1 1 84 84 HIS H H 84 8.155 8.155 8.306 -0.151 25148 5860 1 9 . 1 1 85 85 PRO HA H 85 4.456 4.456 4.606 -0.150 25148 5861 1 9 . 1 1 85 85 PRO C C 85 177.357 177.357 177.216 0.141 25148 5862 1 9 . 1 1 85 85 PRO CA C 85 64.475 64.475 64.079 0.396 25148 5863 1 9 . 1 1 85 85 PRO CB C 85 32.489 32.489 32.082 0.407 25148 5864 1 9 . 1 1 86 86 GLU N N 86 116.314 116.314 117.441 -1.127 25148 5865 1 9 . 1 1 86 86 GLU HA H 86 4.286 4.286 4.200 0.086 25148 5866 1 9 . 1 1 86 86 GLU C C 86 177.624 177.624 177.248 0.376 25148 5867 1 9 . 1 1 86 86 GLU CA C 86 56.619 56.619 56.518 0.101 25148 5868 1 9 . 1 1 86 86 GLU CB C 86 29.389 29.389 29.473 -0.084 25148 5869 1 9 . 1 1 86 86 GLU H H 86 8.938 8.938 7.812 1.126 25148 5870 1 9 . 1 1 87 87 TYR N N 87 119.773 119.773 120.380 -0.607 25148 5871 1 9 . 1 1 87 87 TYR HA H 87 4.744 4.744 4.186 0.558 25148 5872 1 9 . 1 1 87 87 TYR C C 87 174.533 174.533 176.279 -1.746 25148 5873 1 9 . 1 1 87 87 TYR CA C 87 59.117 59.117 59.380 -0.263 25148 5874 1 9 . 1 1 87 87 TYR CB C 87 38.859 38.859 38.732 0.127 25148 5875 1 9 . 1 1 87 87 TYR H H 87 7.447 7.447 7.368 0.079 25148 5876 1 9 . 1 1 88 88 MET N N 88 118.298 118.298 117.332 0.966 25148 5877 1 9 . 1 1 88 88 MET HA H 88 4.770 4.770 4.714 0.056 25148 5878 1 9 . 1 1 88 88 MET C C 88 175.638 175.638 173.915 1.723 25148 5879 1 9 . 1 1 88 88 MET CA C 88 53.133 53.133 54.649 -1.516 25148 5880 1 9 . 1 1 88 88 MET CB C 88 37.102 37.102 35.565 1.537 25148 5881 1 9 . 1 1 88 88 MET H H 88 9.023 9.023 8.288 0.735 25148 5882 1 9 . 1 1 89 89 VAL N N 89 120.157 120.157 124.489 -4.332 25148 5883 1 9 . 1 1 89 89 VAL HA H 89 3.330 3.330 3.887 -0.557 25148 5884 1 9 . 1 1 89 89 VAL C C 89 177.432 177.432 177.066 0.366 25148 5885 1 9 . 1 1 89 89 VAL CA C 89 65.675 65.675 64.529 1.146 25148 5886 1 9 . 1 1 89 89 VAL CB C 89 31.321 31.321 31.161 0.160 25148 5887 1 9 . 1 1 89 89 VAL H H 89 8.313 8.313 8.591 -0.278 25148 5888 1 9 . 1 1 90 90 GLY N N 90 116.935 116.935 115.541 1.394 25148 5889 1 9 . 1 1 90 90 GLY C C 90 175.196 175.196 174.279 0.917 25148 5890 1 9 . 1 1 90 90 GLY CA C 90 44.685 44.685 44.770 -0.085 25148 5891 1 9 . 1 1 90 90 GLY H H 90 8.551 8.551 9.115 -0.564 25148 5892 1 9 . 1 1 91 91 ASP N N 91 121.616 121.616 121.715 -0.099 25148 5893 1 9 . 1 1 91 91 ASP HA H 91 4.790 4.790 4.957 -0.167 25148 5894 1 9 . 1 1 91 91 ASP C C 91 174.431 174.431 174.991 -0.560 25148 5895 1 9 . 1 1 91 91 ASP CA C 91 55.011 55.011 53.265 1.746 25148 5896 1 9 . 1 1 91 91 ASP CB C 91 42.079 42.079 42.412 -0.333 25148 5897 1 9 . 1 1 91 91 ASP H H 91 8.073 8.073 7.910 0.163 25148 5898 1 9 . 1 1 92 92 VAL N N 92 118.919 118.919 114.114 4.805 25148 5899 1 9 . 1 1 92 92 VAL HA H 92 4.709 4.709 4.570 0.139 25148 5900 1 9 . 1 1 92 92 VAL C C 92 175.602 175.602 174.084 1.518 25148 5901 1 9 . 1 1 92 92 VAL CA C 92 61.527 61.527 59.911 1.616 25148 5902 1 9 . 1 1 92 92 VAL CB C 92 34.110 34.110 35.077 -0.967 25148 5903 1 9 . 1 1 92 92 VAL H H 92 8.216 8.216 7.994 0.222 25148 5904 1 9 . 1 1 93 93 VAL N N 93 123.922 123.922 121.980 1.942 25148 5905 1 9 . 1 1 93 93 VAL HA H 93 4.231 4.231 4.299 -0.068 25148 5906 1 9 . 1 1 93 93 VAL C C 93 174.105 174.105 174.212 -0.107 25148 5907 1 9 . 1 1 93 93 VAL CA C 93 59.644 59.644 60.156 -0.512 25148 5908 1 9 . 1 1 93 93 VAL CB C 93 34.661 34.661 35.696 -1.035 25148 5909 1 9 . 1 1 93 93 VAL H H 93 8.812 8.812 7.899 0.913 25148 5910 1 9 . 1 1 94 94 GLU N N 94 123.605 123.605 128.437 -4.832 25148 5911 1 9 . 1 1 94 94 GLU HA H 94 5.347 5.347 5.197 0.150 25148 5912 1 9 . 1 1 94 94 GLU C C 94 175.708 175.708 175.734 -0.026 25148 5913 1 9 . 1 1 94 94 GLU CA C 94 54.979 54.979 55.350 -0.371 25148 5914 1 9 . 1 1 94 94 GLU CB C 94 31.612 31.612 31.846 -0.234 25148 5915 1 9 . 1 1 94 94 GLU H H 94 8.312 8.312 8.680 -0.368 25148 5916 1 9 . 1 1 95 95 ILE N N 95 123.581 123.581 123.151 0.430 25148 5917 1 9 . 1 1 95 95 ILE HA H 95 4.601 4.601 4.499 0.102 25148 5918 1 9 . 1 1 95 95 ILE C C 95 175.081 175.081 175.047 0.034 25148 5919 1 9 . 1 1 95 95 ILE CA C 95 58.601 58.601 59.634 -1.033 25148 5920 1 9 . 1 1 95 95 ILE CB C 95 41.727 41.727 42.516 -0.789 25148 5921 1 9 . 1 1 95 95 ILE H H 95 9.045 9.045 8.547 0.498 25148 5922 1 9 . 1 1 96 96 GLU N N 96 128.094 128.094 128.117 -0.023 25148 5923 1 9 . 1 1 96 96 GLU HA H 96 4.098 4.098 4.300 -0.202 25148 5924 1 9 . 1 1 96 96 GLU C C 96 176.845 176.845 175.650 1.195 25148 5925 1 9 . 1 1 96 96 GLU CA C 96 57.853 57.853 58.027 -0.174 25148 5926 1 9 . 1 1 96 96 GLU CB C 96 28.323 28.323 29.353 -1.030 25148 5927 1 9 . 1 1 96 96 GLU H H 96 9.256 9.256 8.903 0.353 25148 5928 1 9 . 1 1 97 97 VAL N N 97 118.446 118.446 124.597 -6.151 25148 5929 1 9 . 1 1 97 97 VAL HA H 97 4.568 4.568 4.228 0.340 25148 5930 1 9 . 1 1 97 97 VAL C C 97 175.051 175.051 174.712 0.339 25148 5931 1 9 . 1 1 97 97 VAL CA C 97 59.796 59.796 61.062 -1.266 25148 5932 1 9 . 1 1 97 97 VAL CB C 97 32.399 32.399 32.863 -0.464 25148 5933 1 9 . 1 1 97 97 VAL H H 97 8.609 8.609 8.862 -0.253 25148 5934 1 9 . 1 1 98 98 THR N N 98 119.118 119.118 119.000 0.118 25148 5935 1 9 . 1 1 98 98 THR HA H 98 3.320 3.320 4.029 -0.709 25148 5936 1 9 . 1 1 98 98 THR CA C 98 61.628 61.628 59.217 2.411 25148 5937 1 9 . 1 1 98 98 THR CB C 98 70.031 70.031 69.334 0.697 25148 5938 1 9 . 1 1 98 98 THR H H 98 7.396 7.396 7.486 -0.090 25148 5939 1 9 . 1 1 99 99 PRO HA H 99 4.458 4.458 4.661 -0.203 25148 5940 1 9 . 1 1 99 99 PRO CA C 99 62.348 62.348 62.506 -0.158 25148 5941 1 9 . 1 1 99 99 PRO CB C 99 33.182 33.182 32.642 0.540 25148 5942 1 9 . 1 1 100 100 LYS HA H 100 4.126 4.126 4.202 -0.076 25148 5943 1 9 . 1 1 100 100 LYS CA C 100 58.773 58.773 57.886 0.886 25148 5944 1 9 . 1 1 100 100 LYS CB C 100 32.195 32.195 32.393 -0.198 25148 5945 1 9 . 1 1 101 101 ASP HA H 101 4.924 4.924 4.813 0.111 25148 5946 1 9 . 1 1 101 101 ASP C C 101 176.884 176.884 176.603 0.281 25148 5947 1 9 . 1 1 101 101 ASP CA C 101 54.134 54.134 54.108 0.026 25148 5948 1 9 . 1 1 101 101 ASP CB C 101 40.272 40.272 40.921 -0.649 25148 5949 1 9 . 1 1 102 102 PHE N N 102 118.703 118.703 121.487 -2.784 25148 5950 1 9 . 1 1 102 102 PHE HA H 102 4.295 4.295 4.216 0.079 25148 5951 1 9 . 1 1 102 102 PHE C C 102 176.477 176.477 177.036 -0.559 25148 5952 1 9 . 1 1 102 102 PHE CA C 102 60.748 60.748 60.261 0.487 25148 5953 1 9 . 1 1 102 102 PHE CB C 102 39.667 39.667 39.130 0.537 25148 5954 1 9 . 1 1 102 102 PHE H H 102 7.862 7.862 7.724 0.138 25148 5955 1 9 . 1 1 103 103 GLY CA C 103 47.430 47.430 47.425 0.005 25148 5956 1 9 . 1 1 104 104 ARG N N 104 121.819 121.819 120.522 1.297 25148 5957 1 9 . 1 1 104 104 ARG HA H 104 4.176 4.176 4.159 0.017 25148 5958 1 9 . 1 1 104 104 ARG C C 104 178.912 178.912 178.382 0.530 25148 5959 1 9 . 1 1 104 104 ARG CA C 104 59.235 59.235 58.141 1.094 25148 5960 1 9 . 1 1 104 104 ARG CB C 104 30.000 30.000 29.580 0.420 25148 5961 1 9 . 1 1 104 104 ARG H H 104 7.809 7.809 7.389 0.420 25148 5962 1 9 . 1 1 105 105 ILE N N 105 120.331 120.331 121.587 -1.256 25148 5963 1 9 . 1 1 105 105 ILE HA H 105 3.836 3.836 3.640 0.196 25148 5964 1 9 . 1 1 105 105 ILE C C 105 179.206 179.206 177.893 1.313 25148 5965 1 9 . 1 1 105 105 ILE CA C 105 63.025 63.025 64.943 -1.918 25148 5966 1 9 . 1 1 105 105 ILE CB C 105 38.127 38.127 37.501 0.626 25148 5967 1 9 . 1 1 105 105 ILE H H 105 7.203 7.203 7.488 -0.285 25148 5968 1 9 . 1 1 106 106 ALA N N 106 124.867 124.867 121.386 3.481 25148 5969 1 9 . 1 1 106 106 ALA HA H 106 3.665 3.665 3.579 0.086 25148 5970 1 9 . 1 1 106 106 ALA C C 106 178.590 178.590 179.001 -0.411 25148 5971 1 9 . 1 1 106 106 ALA CA C 106 54.842 54.842 55.067 -0.225 25148 5972 1 9 . 1 1 106 106 ALA CB C 106 18.659 18.659 17.769 0.890 25148 5973 1 9 . 1 1 106 106 ALA H H 106 8.813 8.813 8.159 0.654 25148 5974 1 9 . 1 1 107 107 ALA N N 107 119.597 119.597 120.819 -1.222 25148 5975 1 9 . 1 1 107 107 ALA HA H 107 4.014 4.014 4.015 -0.001 25148 5976 1 9 . 1 1 107 107 ALA C C 107 180.214 180.214 179.569 0.645 25148 5977 1 9 . 1 1 107 107 ALA CA C 107 55.454 55.454 54.719 0.735 25148 5978 1 9 . 1 1 107 107 ALA CB C 107 18.260 18.260 18.154 0.106 25148 5979 1 9 . 1 1 107 107 ALA H H 107 8.012 8.012 7.565 0.447 25148 5980 1 9 . 1 1 108 108 GLN N N 108 116.896 116.896 118.318 -1.422 25148 5981 1 9 . 1 1 108 108 GLN HA H 108 4.054 4.054 4.022 0.032 25148 5982 1 9 . 1 1 108 108 GLN C C 108 178.784 178.784 178.436 0.348 25148 5983 1 9 . 1 1 108 108 GLN CA C 108 58.705 58.705 59.019 -0.314 25148 5984 1 9 . 1 1 108 108 GLN CB C 108 28.647 28.647 28.835 -0.188 25148 5985 1 9 . 1 1 108 108 GLN H H 108 7.498 7.498 8.264 -0.765 25148 5986 1 9 . 1 1 109 109 THR N N 109 117.495 117.495 115.992 1.503 25148 5987 1 9 . 1 1 109 109 THR HA H 109 3.917 3.917 4.302 -0.385 25148 5988 1 9 . 1 1 109 109 THR C C 109 175.732 175.732 175.918 -0.186 25148 5989 1 9 . 1 1 109 109 THR CA C 109 66.989 66.989 65.451 1.538 25148 5990 1 9 . 1 1 109 109 THR CB C 109 68.766 68.766 68.487 0.279 25148 5991 1 9 . 1 1 109 109 THR H H 109 8.203 8.203 8.325 -0.122 25148 5992 1 9 . 1 1 110 110 ALA N N 110 122.308 122.308 125.048 -2.740 25148 5993 1 9 . 1 1 110 110 ALA HA H 110 3.854 3.854 4.023 -0.169 25148 5994 1 9 . 1 1 110 110 ALA C C 110 178.380 178.380 178.838 -0.458 25148 5995 1 9 . 1 1 110 110 ALA CA C 110 55.903 55.903 55.011 0.892 25148 5996 1 9 . 1 1 110 110 ALA CB C 110 18.524 18.524 18.277 0.247 25148 5997 1 9 . 1 1 110 110 ALA H H 110 8.668 8.668 8.041 0.627 25148 5998 1 9 . 1 1 111 111 LYS N N 111 115.552 115.552 118.248 -2.696 25148 5999 1 9 . 1 1 111 111 LYS HA H 111 3.923 3.923 3.959 -0.036 25148 6000 1 9 . 1 1 111 111 LYS C C 111 179.111 179.111 178.861 0.250 25148 6001 1 9 . 1 1 111 111 LYS CA C 111 59.825 59.825 59.312 0.513 25148 6002 1 9 . 1 1 111 111 LYS CB C 111 32.251 32.251 31.619 0.632 25148 6003 1 9 . 1 1 111 111 LYS H H 111 7.642 7.642 8.456 -0.814 25148 6004 1 9 . 1 1 112 112 GLN N N 112 120.178 120.178 118.565 1.613 25148 6005 1 9 . 1 1 112 112 GLN HA H 112 4.060 4.060 4.118 -0.058 25148 6006 1 9 . 1 1 112 112 GLN C C 112 178.355 178.355 178.249 0.106 25148 6007 1 9 . 1 1 112 112 GLN CA C 112 59.240 59.240 58.221 1.020 25148 6008 1 9 . 1 1 112 112 GLN CB C 112 28.250 28.250 28.499 -0.249 25148 6009 1 9 . 1 1 112 112 GLN H H 112 7.798 7.798 7.653 0.145 25148 6010 1 9 . 1 1 113 113 VAL N N 113 119.799 119.799 120.667 -0.868 25148 6011 1 9 . 1 1 113 113 VAL HA H 113 3.705 3.705 4.038 -0.333 25148 6012 1 9 . 1 1 113 113 VAL C C 113 178.303 178.303 178.311 -0.008 25148 6013 1 9 . 1 1 113 113 VAL CA C 113 66.277 66.277 66.143 0.134 25148 6014 1 9 . 1 1 113 113 VAL CB C 113 31.954 31.954 31.881 0.073 25148 6015 1 9 . 1 1 113 113 VAL H H 113 8.105 8.105 7.588 0.517 25148 6016 1 9 . 1 1 114 114 VAL N N 114 118.265 118.265 116.722 1.543 25148 6017 1 9 . 1 1 114 114 VAL HA H 114 3.392 3.392 3.689 -0.297 25148 6018 1 9 . 1 1 114 114 VAL C C 114 177.360 177.360 178.067 -0.707 25148 6019 1 9 . 1 1 114 114 VAL CA C 114 67.832 67.832 66.637 1.195 25148 6020 1 9 . 1 1 114 114 VAL CB C 114 31.801 31.801 30.857 0.944 25148 6021 1 9 . 1 1 114 114 VAL H H 114 8.180 8.180 8.324 -0.144 25148 6022 1 9 . 1 1 115 115 THR N N 115 113.460 113.460 114.391 -0.931 25148 6023 1 9 . 1 1 115 115 THR HA H 115 3.856 3.856 4.018 -0.162 25148 6024 1 9 . 1 1 115 115 THR C C 115 176.529 176.529 176.569 -0.040 25148 6025 1 9 . 1 1 115 115 THR CA C 115 66.706 66.706 66.320 0.386 25148 6026 1 9 . 1 1 115 115 THR CB C 115 69.008 69.008 68.519 0.489 25148 6027 1 9 . 1 1 115 115 THR H H 115 8.143 8.143 7.714 0.429 25148 6028 1 9 . 1 1 116 116 GLN N N 116 120.129 120.129 120.742 -0.613 25148 6029 1 9 . 1 1 116 116 GLN HA H 116 4.054 4.054 4.097 -0.043 25148 6030 1 9 . 1 1 116 116 GLN C C 116 178.100 178.100 178.755 -0.655 25148 6031 1 9 . 1 1 116 116 GLN CA C 116 58.950 58.950 58.997 -0.047 25148 6032 1 9 . 1 1 116 116 GLN CB C 116 28.244 28.244 28.616 -0.373 25148 6033 1 9 . 1 1 116 116 GLN H H 116 7.936 7.936 7.591 0.345 25148 6034 1 9 . 1 1 117 117 ARG N N 117 117.838 117.838 119.888 -2.050 25148 6035 1 9 . 1 1 117 117 ARG HA H 117 4.174 4.174 4.063 0.111 25148 6036 1 9 . 1 1 117 117 ARG C C 117 179.138 179.138 178.505 0.633 25148 6037 1 9 . 1 1 117 117 ARG CA C 117 57.461 57.461 58.578 -1.117 25148 6038 1 9 . 1 1 117 117 ARG CB C 117 29.548 29.548 29.446 0.102 25148 6039 1 9 . 1 1 117 117 ARG H H 117 8.240 8.240 8.106 0.134 25148 6040 1 9 . 1 1 118 118 VAL N N 118 120.278 120.278 118.872 1.406 25148 6041 1 9 . 1 1 118 118 VAL HA H 118 3.709 3.709 3.709 -0.000 25148 6042 1 9 . 1 1 118 118 VAL C C 118 177.597 177.597 178.154 -0.557 25148 6043 1 9 . 1 1 118 118 VAL CA C 118 66.246 66.246 65.897 0.349 25148 6044 1 9 . 1 1 118 118 VAL CB C 118 31.785 31.785 30.881 0.904 25148 6045 1 9 . 1 1 118 118 VAL H H 118 8.480 8.480 7.537 0.943 25148 6046 1 9 . 1 1 119 119 ARG N N 119 120.197 120.197 119.954 0.243 25148 6047 1 9 . 1 1 119 119 ARG HA H 119 4.173 4.173 4.054 0.119 25148 6048 1 9 . 1 1 119 119 ARG C C 119 178.864 178.864 178.708 0.156 25148 6049 1 9 . 1 1 119 119 ARG CA C 119 58.772 58.772 59.703 -0.931 25148 6050 1 9 . 1 1 119 119 ARG CB C 119 29.873 29.873 29.961 -0.088 25148 6051 1 9 . 1 1 119 119 ARG H H 119 7.899 7.899 8.040 -0.141 25148 6052 1 9 . 1 1 120 120 GLU N N 120 118.768 118.768 119.312 -0.544 25148 6053 1 9 . 1 1 120 120 GLU HA H 120 4.110 4.110 4.023 0.087 25148 6054 1 9 . 1 1 120 120 GLU C C 120 177.823 177.823 178.860 -1.037 25148 6055 1 9 . 1 1 120 120 GLU CA C 120 58.223 58.223 59.060 -0.837 25148 6056 1 9 . 1 1 120 120 GLU CB C 120 29.854 29.854 29.141 0.713 25148 6057 1 9 . 1 1 120 120 GLU H H 120 8.084 8.084 7.610 0.474 25148 6058 1 9 . 1 1 121 121 ALA N N 121 121.984 121.984 121.354 0.630 25148 6059 1 9 . 1 1 121 121 ALA HA H 121 4.296 4.296 4.058 0.238 25148 6060 1 9 . 1 1 121 121 ALA C C 121 178.586 178.586 180.079 -1.493 25148 6061 1 9 . 1 1 121 121 ALA CA C 121 53.475 53.475 55.137 -1.662 25148 6062 1 9 . 1 1 121 121 ALA CB C 121 18.856 18.856 18.270 0.586 25148 6063 1 9 . 1 1 121 121 ALA H H 121 7.810 7.810 8.307 -0.497 25148 6064 1 9 . 1 1 122 122 GLU N N 122 118.229 118.229 118.524 -0.295 25148 6065 1 9 . 1 1 122 122 GLU HA H 122 4.241 4.241 4.034 0.207 25148 6066 1 9 . 1 1 122 122 GLU C C 122 176.839 176.839 178.589 -1.750 25148 6067 1 9 . 1 1 122 122 GLU CA C 122 57.118 57.118 58.360 -1.242 25148 6068 1 9 . 1 1 122 122 GLU CB C 122 30.018 30.018 29.359 0.659 25148 6069 1 9 . 1 1 122 122 GLU H H 122 7.938 7.938 7.955 -0.017 25148 6070 1 9 . 1 1 123 123 ARG N N 123 120.601 120.601 120.376 0.225 25148 6071 1 9 . 1 1 123 123 ARG HA H 123 4.348 4.348 4.175 0.173 25148 6072 1 9 . 1 1 123 123 ARG C C 123 176.071 176.071 175.983 0.088 25148 6073 1 9 . 1 1 123 123 ARG CA C 123 56.510 56.510 56.619 -0.109 25148 6074 1 9 . 1 1 123 123 ARG CB C 123 30.765 30.765 30.986 -0.221 25148 6075 1 9 . 1 1 123 123 ARG H H 123 7.977 7.977 8.032 -0.055 25148 6076 1 10 . 1 1 4 4 GLU HA H 4 4.138 4.138 4.167 -0.029 25148 6077 1 10 . 1 1 4 4 GLU C C 4 179.152 179.152 178.376 0.776 25148 6078 1 10 . 1 1 4 4 GLU CA C 4 59.566 59.566 59.304 0.262 25148 6079 1 10 . 1 1 4 4 GLU CB C 4 29.407 29.407 29.168 0.239 25148 6080 1 10 . 1 1 5 5 LEU N N 5 121.360 121.360 116.779 4.581 25148 6081 1 10 . 1 1 5 5 LEU HA H 5 4.195 4.195 4.073 0.122 25148 6082 1 10 . 1 1 5 5 LEU C C 5 178.179 178.179 178.312 -0.133 25148 6083 1 10 . 1 1 5 5 LEU CA C 5 57.830 57.830 57.665 0.165 25148 6084 1 10 . 1 1 5 5 LEU CB C 5 41.630 41.630 41.286 0.344 25148 6085 1 10 . 1 1 5 5 LEU H H 5 7.877 7.877 7.971 -0.094 25148 6086 1 10 . 1 1 6 6 LEU N N 6 118.058 118.058 119.677 -1.619 25148 6087 1 10 . 1 1 6 6 LEU HA H 6 3.919 3.919 3.905 0.014 25148 6088 1 10 . 1 1 6 6 LEU C C 6 180.274 180.274 179.062 1.212 25148 6089 1 10 . 1 1 6 6 LEU CA C 6 58.221 58.221 57.622 0.599 25148 6090 1 10 . 1 1 6 6 LEU CB C 6 40.684 40.684 41.105 -0.421 25148 6091 1 10 . 1 1 6 6 LEU H H 6 7.685 7.685 7.360 0.325 25148 6092 1 10 . 1 1 7 7 ASP N N 7 120.662 120.662 118.035 2.627 25148 6093 1 10 . 1 1 7 7 ASP HA H 7 4.416 4.416 4.354 0.062 25148 6094 1 10 . 1 1 7 7 ASP C C 7 178.738 178.738 177.955 0.783 25148 6095 1 10 . 1 1 7 7 ASP CA C 7 57.519 57.519 56.909 0.610 25148 6096 1 10 . 1 1 7 7 ASP CB C 7 40.167 40.167 40.680 -0.513 25148 6097 1 10 . 1 1 7 7 ASP H H 7 8.427 8.427 7.762 0.665 25148 6098 1 10 . 1 1 8 8 ALA N N 8 122.612 122.612 122.749 -0.137 25148 6099 1 10 . 1 1 8 8 ALA HA H 8 4.146 4.146 3.926 0.220 25148 6100 1 10 . 1 1 8 8 ALA C C 8 180.787 180.787 179.482 1.305 25148 6101 1 10 . 1 1 8 8 ALA CA C 8 55.165 55.165 55.373 -0.208 25148 6102 1 10 . 1 1 8 8 ALA CB C 8 17.711 17.711 18.649 -0.938 25148 6103 1 10 . 1 1 8 8 ALA H H 8 7.847 7.847 7.876 -0.029 25148 6104 1 10 . 1 1 9 9 LEU N N 9 116.977 116.977 117.406 -0.429 25148 6105 1 10 . 1 1 9 9 LEU HA H 9 4.115 4.115 3.823 0.292 25148 6106 1 10 . 1 1 9 9 LEU C C 9 179.510 179.510 179.446 0.064 25148 6107 1 10 . 1 1 9 9 LEU CA C 9 57.468 57.468 57.833 -0.365 25148 6108 1 10 . 1 1 9 9 LEU CB C 9 41.203 41.203 41.618 -0.416 25148 6109 1 10 . 1 1 9 9 LEU H H 9 8.256 8.256 7.620 0.636 25148 6110 1 10 . 1 1 10 10 THR N N 10 118.764 118.764 115.817 2.947 25148 6111 1 10 . 1 1 10 10 THR HA H 10 4.487 4.487 3.904 0.583 25148 6112 1 10 . 1 1 10 10 THR C C 10 176.567 176.567 177.267 -0.700 25148 6113 1 10 . 1 1 10 10 THR CA C 10 68.768 68.768 66.552 2.216 25148 6114 1 10 . 1 1 10 10 THR CB C 10 66.961 66.961 68.674 -1.713 25148 6115 1 10 . 1 1 10 10 THR H H 10 8.218 8.218 7.375 0.843 25148 6116 1 10 . 1 1 11 11 ILE N N 11 122.555 122.555 121.314 1.241 25148 6117 1 10 . 1 1 11 11 ILE HA H 11 3.779 3.779 3.741 0.038 25148 6118 1 10 . 1 1 11 11 ILE C C 11 177.793 177.793 177.732 0.061 25148 6119 1 10 . 1 1 11 11 ILE CA C 11 64.695 64.695 64.949 -0.254 25148 6120 1 10 . 1 1 11 11 ILE CB C 11 37.856 37.856 37.641 0.215 25148 6121 1 10 . 1 1 11 11 ILE H H 11 7.632 7.632 7.946 -0.314 25148 6122 1 10 . 1 1 12 12 LEU N N 12 120.469 120.469 118.286 2.183 25148 6123 1 10 . 1 1 12 12 LEU HA H 12 4.065 4.065 3.994 0.071 25148 6124 1 10 . 1 1 12 12 LEU C C 12 179.139 179.139 178.908 0.231 25148 6125 1 10 . 1 1 12 12 LEU CA C 12 57.944 57.944 57.048 0.896 25148 6126 1 10 . 1 1 12 12 LEU CB C 12 42.170 42.170 40.762 1.408 25148 6127 1 10 . 1 1 12 12 LEU H H 12 7.951 7.951 7.663 0.288 25148 6128 1 10 . 1 1 13 13 GLU N N 13 119.669 119.669 118.055 1.614 25148 6129 1 10 . 1 1 13 13 GLU HA H 13 4.183 4.183 4.003 0.180 25148 6130 1 10 . 1 1 13 13 GLU C C 13 179.007 179.007 177.448 1.559 25148 6131 1 10 . 1 1 13 13 GLU CA C 13 59.703 59.703 58.733 0.969 25148 6132 1 10 . 1 1 13 13 GLU CB C 13 30.110 30.110 28.836 1.274 25148 6133 1 10 . 1 1 13 13 GLU H H 13 8.003 8.003 7.947 0.056 25148 6134 1 10 . 1 1 14 14 LYS N N 14 118.935 118.935 117.822 1.113 25148 6135 1 10 . 1 1 14 14 LYS HA H 14 4.124 4.124 4.070 0.054 25148 6136 1 10 . 1 1 14 14 LYS CA C 14 58.847 58.847 57.720 1.127 25148 6137 1 10 . 1 1 14 14 LYS CB C 14 33.053 33.053 32.976 0.077 25148 6138 1 10 . 1 1 14 14 LYS H H 14 7.862 7.862 7.372 0.490 25148 6139 1 10 . 1 1 15 15 GLU HA H 15 3.693 3.693 4.373 -0.680 25148 6140 1 10 . 1 1 15 15 GLU CA C 15 56.688 56.688 55.709 0.979 25148 6141 1 10 . 1 1 15 15 GLU CB C 15 32.204 32.204 30.265 1.939 25148 6142 1 10 . 1 1 16 16 LYS HA H 16 4.678 4.678 4.251 0.427 25148 6143 1 10 . 1 1 16 16 LYS CA C 16 55.135 55.135 56.212 -1.077 25148 6144 1 10 . 1 1 16 16 LYS CB C 16 34.049 34.049 33.108 0.941 25148 6145 1 10 . 1 1 17 17 GLY CA C 17 46.541 46.541 45.795 0.746 25148 6146 1 10 . 1 1 18 18 ILE N N 18 115.364 115.364 113.792 1.572 25148 6147 1 10 . 1 1 18 18 ILE HA H 18 4.079 4.079 4.494 -0.415 25148 6148 1 10 . 1 1 18 18 ILE C C 18 174.751 174.751 174.017 0.734 25148 6149 1 10 . 1 1 18 18 ILE CA C 18 60.333 60.333 59.427 0.906 25148 6150 1 10 . 1 1 18 18 ILE CB C 18 39.044 39.044 40.440 -1.396 25148 6151 1 10 . 1 1 18 18 ILE H H 18 8.203 8.203 7.385 0.818 25148 6152 1 10 . 1 1 19 19 SER N N 19 119.891 119.891 116.449 3.442 25148 6153 1 10 . 1 1 19 19 SER HA H 19 4.362 4.362 4.891 -0.529 25148 6154 1 10 . 1 1 19 19 SER CA C 19 58.476 58.476 57.671 0.805 25148 6155 1 10 . 1 1 19 19 SER CB C 19 63.533 63.533 65.434 -1.901 25148 6156 1 10 . 1 1 19 19 SER H H 19 8.253 8.253 8.213 0.040 25148 6157 1 10 . 1 1 20 20 LYS N N 20 124.782 124.782 125.620 -0.838 25148 6158 1 10 . 1 1 20 20 LYS HA H 20 4.137 4.137 4.106 0.031 25148 6159 1 10 . 1 1 20 20 LYS C C 20 177.889 177.889 177.634 0.255 25148 6160 1 10 . 1 1 20 20 LYS CA C 20 59.485 59.485 58.728 0.757 25148 6161 1 10 . 1 1 20 20 LYS CB C 20 32.711 32.711 32.404 0.307 25148 6162 1 10 . 1 1 20 20 LYS H H 20 8.918 8.918 8.748 0.170 25148 6163 1 10 . 1 1 21 21 GLU N N 21 117.831 117.831 119.708 -1.877 25148 6164 1 10 . 1 1 21 21 GLU HA H 21 3.957 3.957 4.066 -0.109 25148 6165 1 10 . 1 1 21 21 GLU C C 21 178.822 178.822 178.764 0.058 25148 6166 1 10 . 1 1 21 21 GLU CA C 21 59.529 59.529 58.910 0.619 25148 6167 1 10 . 1 1 21 21 GLU CB C 21 29.237 29.237 29.223 0.014 25148 6168 1 10 . 1 1 21 21 GLU H H 21 8.361 8.361 8.539 -0.178 25148 6169 1 10 . 1 1 22 22 ILE N N 22 118.690 118.690 118.436 0.254 25148 6170 1 10 . 1 1 22 22 ILE HA H 22 3.884 3.884 3.890 -0.006 25148 6171 1 10 . 1 1 22 22 ILE C C 22 179.247 179.247 177.542 1.705 25148 6172 1 10 . 1 1 22 22 ILE CA C 22 63.735 63.735 63.915 -0.180 25148 6173 1 10 . 1 1 22 22 ILE CB C 22 37.415 37.415 37.913 -0.498 25148 6174 1 10 . 1 1 22 22 ILE H H 22 7.353 7.353 7.362 -0.009 25148 6175 1 10 . 1 1 23 23 ILE N N 23 120.880 120.880 120.942 -0.062 25148 6176 1 10 . 1 1 23 23 ILE HA H 23 3.733 3.733 3.673 0.060 25148 6177 1 10 . 1 1 23 23 ILE C C 23 177.817 177.817 177.864 -0.047 25148 6178 1 10 . 1 1 23 23 ILE CA C 23 64.172 64.172 63.622 0.550 25148 6179 1 10 . 1 1 23 23 ILE CB C 23 36.473 36.473 36.709 -0.236 25148 6180 1 10 . 1 1 23 23 ILE H H 23 7.571 7.571 7.165 0.406 25148 6181 1 10 . 1 1 24 24 ILE N N 24 121.460 121.460 119.196 2.264 25148 6182 1 10 . 1 1 24 24 ILE HA H 24 3.486 3.486 3.603 -0.117 25148 6183 1 10 . 1 1 24 24 ILE C C 24 177.759 177.759 177.952 -0.193 25148 6184 1 10 . 1 1 24 24 ILE CA C 24 66.641 66.641 66.239 0.402 25148 6185 1 10 . 1 1 24 24 ILE CB C 24 37.307 37.307 37.347 -0.040 25148 6186 1 10 . 1 1 24 24 ILE H H 24 8.709 8.709 7.760 0.949 25148 6187 1 10 . 1 1 25 25 GLU N N 25 119.323 119.323 118.398 0.925 25148 6188 1 10 . 1 1 25 25 GLU HA H 25 4.177 4.177 4.336 -0.159 25148 6189 1 10 . 1 1 25 25 GLU C C 25 179.348 179.348 178.632 0.716 25148 6190 1 10 . 1 1 25 25 GLU CA C 25 59.951 59.951 59.093 0.858 25148 6191 1 10 . 1 1 25 25 GLU CB C 25 29.340 29.340 28.993 0.347 25148 6192 1 10 . 1 1 25 25 GLU H H 25 8.048 8.048 7.781 0.267 25148 6193 1 10 . 1 1 26 26 ALA N N 26 122.390 122.390 122.848 -0.458 25148 6194 1 10 . 1 1 26 26 ALA HA H 26 4.325 4.325 4.104 0.221 25148 6195 1 10 . 1 1 26 26 ALA C C 26 181.440 181.440 179.795 1.645 25148 6196 1 10 . 1 1 26 26 ALA CA C 26 54.935 54.935 54.946 -0.011 25148 6197 1 10 . 1 1 26 26 ALA CB C 26 17.834 17.834 18.263 -0.429 25148 6198 1 10 . 1 1 26 26 ALA H H 26 7.768 7.768 7.745 0.023 25148 6199 1 10 . 1 1 27 27 ILE N N 27 122.342 122.342 119.418 2.924 25148 6200 1 10 . 1 1 27 27 ILE HA H 27 3.575 3.575 3.593 -0.018 25148 6201 1 10 . 1 1 27 27 ILE C C 27 177.541 177.541 178.097 -0.556 25148 6202 1 10 . 1 1 27 27 ILE CA C 27 66.536 66.536 65.784 0.752 25148 6203 1 10 . 1 1 27 27 ILE CB C 27 37.886 37.886 37.680 0.206 25148 6204 1 10 . 1 1 27 27 ILE H H 27 8.805 8.805 7.753 1.052 25148 6205 1 10 . 1 1 28 28 GLU N N 28 120.188 120.188 119.323 0.865 25148 6206 1 10 . 1 1 28 28 GLU HA H 28 3.687 3.687 3.935 -0.248 25148 6207 1 10 . 1 1 28 28 GLU C C 28 178.707 178.707 179.032 -0.325 25148 6208 1 10 . 1 1 28 28 GLU CA C 28 61.458 61.458 59.889 1.569 25148 6209 1 10 . 1 1 28 28 GLU CB C 28 29.624 29.624 29.188 0.436 25148 6210 1 10 . 1 1 28 28 GLU H H 28 8.882 8.882 7.791 1.091 25148 6211 1 10 . 1 1 29 29 ALA N N 29 119.293 119.293 121.232 -1.939 25148 6212 1 10 . 1 1 29 29 ALA HA H 29 4.214 4.214 4.242 -0.028 25148 6213 1 10 . 1 1 29 29 ALA C C 29 181.200 181.200 179.537 1.663 25148 6214 1 10 . 1 1 29 29 ALA CA C 29 55.435 55.435 54.644 0.791 25148 6215 1 10 . 1 1 29 29 ALA CB C 29 18.090 18.090 18.179 -0.089 25148 6216 1 10 . 1 1 29 29 ALA H H 29 8.065 8.065 7.585 0.480 25148 6217 1 10 . 1 1 30 30 ALA N N 30 121.729 121.729 122.828 -1.099 25148 6218 1 10 . 1 1 30 30 ALA HA H 30 4.307 4.307 4.136 0.171 25148 6219 1 10 . 1 1 30 30 ALA C C 30 181.315 181.315 179.536 1.779 25148 6220 1 10 . 1 1 30 30 ALA CA C 30 54.594 54.594 55.030 -0.436 25148 6221 1 10 . 1 1 30 30 ALA CB C 30 18.704 18.704 18.314 0.390 25148 6222 1 10 . 1 1 30 30 ALA H H 30 8.099 8.099 7.930 0.169 25148 6223 1 10 . 1 1 31 31 LEU N N 31 120.900 120.900 120.038 0.862 25148 6224 1 10 . 1 1 31 31 LEU HA H 31 4.347 4.347 4.152 0.195 25148 6225 1 10 . 1 1 31 31 LEU C C 31 179.137 179.137 179.280 -0.143 25148 6226 1 10 . 1 1 31 31 LEU CA C 31 57.569 57.569 58.229 -0.660 25148 6227 1 10 . 1 1 31 31 LEU CB C 31 42.353 42.353 41.008 1.345 25148 6228 1 10 . 1 1 31 31 LEU H H 31 8.863 8.863 8.338 0.525 25148 6229 1 10 . 1 1 32 32 ILE N N 32 122.410 122.410 118.975 3.435 25148 6230 1 10 . 1 1 32 32 ILE HA H 32 3.699 3.699 3.699 0.000 25148 6231 1 10 . 1 1 32 32 ILE C C 32 178.303 178.303 177.911 0.392 25148 6232 1 10 . 1 1 32 32 ILE CA C 32 66.066 66.066 65.193 0.873 25148 6233 1 10 . 1 1 32 32 ILE CB C 32 37.882 37.882 37.909 -0.027 25148 6234 1 10 . 1 1 32 32 ILE H H 32 8.234 8.234 7.802 0.432 25148 6235 1 10 . 1 1 33 33 SER N N 33 114.201 114.201 115.786 -1.585 25148 6236 1 10 . 1 1 33 33 SER HA H 33 4.311 4.311 4.157 0.154 25148 6237 1 10 . 1 1 33 33 SER C C 33 177.012 177.012 176.793 0.219 25148 6238 1 10 . 1 1 33 33 SER CA C 33 61.860 61.860 61.766 0.094 25148 6239 1 10 . 1 1 33 33 SER CB C 33 62.508 62.508 63.254 -0.746 25148 6240 1 10 . 1 1 33 33 SER H H 33 7.558 7.558 7.999 -0.441 25148 6241 1 10 . 1 1 34 34 ALA N N 34 122.893 122.893 124.786 -1.893 25148 6242 1 10 . 1 1 34 34 ALA HA H 34 4.215 4.215 4.072 0.143 25148 6243 1 10 . 1 1 34 34 ALA C C 34 180.814 180.814 179.342 1.472 25148 6244 1 10 . 1 1 34 34 ALA CA C 34 55.283 55.283 55.011 0.272 25148 6245 1 10 . 1 1 34 34 ALA CB C 34 18.273 18.273 18.200 0.073 25148 6246 1 10 . 1 1 34 34 ALA H H 34 8.409 8.409 8.331 0.078 25148 6247 1 10 . 1 1 35 35 TYR N N 35 120.259 120.259 118.956 1.303 25148 6248 1 10 . 1 1 35 35 TYR HA H 35 4.393 4.393 4.310 0.083 25148 6249 1 10 . 1 1 35 35 TYR C C 35 177.892 177.892 178.319 -0.427 25148 6250 1 10 . 1 1 35 35 TYR CA C 35 63.071 63.071 61.032 2.039 25148 6251 1 10 . 1 1 35 35 TYR CB C 35 38.021 38.021 38.784 -0.763 25148 6252 1 10 . 1 1 35 35 TYR H H 35 8.975 8.975 8.194 0.781 25148 6253 1 10 . 1 1 36 36 LYS N N 36 120.942 120.942 120.395 0.547 25148 6254 1 10 . 1 1 36 36 LYS HA H 36 4.032 4.032 4.041 -0.009 25148 6255 1 10 . 1 1 36 36 LYS C C 36 177.797 177.797 179.119 -1.322 25148 6256 1 10 . 1 1 36 36 LYS CA C 36 59.900 59.900 59.375 0.525 25148 6257 1 10 . 1 1 36 36 LYS CB C 36 32.429 32.429 32.226 0.203 25148 6258 1 10 . 1 1 36 36 LYS H H 36 8.654 8.654 8.219 0.435 25148 6259 1 10 . 1 1 37 37 ARG N N 37 115.139 115.139 117.931 -2.792 25148 6260 1 10 . 1 1 37 37 ARG HA H 37 4.101 4.101 4.057 0.044 25148 6261 1 10 . 1 1 37 37 ARG C C 37 177.517 177.517 177.962 -0.445 25148 6262 1 10 . 1 1 37 37 ARG CA C 37 58.276 58.276 58.657 -0.381 25148 6263 1 10 . 1 1 37 37 ARG CB C 37 31.014 31.014 29.786 1.228 25148 6264 1 10 . 1 1 37 37 ARG H H 37 8.138 8.138 7.936 0.202 25148 6265 1 10 . 1 1 38 38 ASN N N 38 112.555 112.555 115.869 -3.314 25148 6266 1 10 . 1 1 38 38 ASN HA H 38 4.540 4.540 4.315 0.225 25148 6267 1 10 . 1 1 38 38 ASN C C 38 173.994 173.994 174.852 -0.858 25148 6268 1 10 . 1 1 38 38 ASN CA C 38 54.722 54.722 54.938 -0.216 25148 6269 1 10 . 1 1 38 38 ASN CB C 38 42.077 42.077 39.469 2.608 25148 6270 1 10 . 1 1 38 38 ASN H H 38 7.426 7.426 7.497 -0.071 25148 6271 1 10 . 1 1 39 39 PHE N N 39 116.711 116.711 117.375 -0.664 25148 6272 1 10 . 1 1 39 39 PHE HA H 39 4.569 4.569 4.680 -0.111 25148 6273 1 10 . 1 1 39 39 PHE CA C 39 58.913 58.913 56.568 2.345 25148 6274 1 10 . 1 1 39 39 PHE CB C 39 39.781 39.781 38.804 0.977 25148 6275 1 10 . 1 1 39 39 PHE H H 39 7.959 7.959 7.658 0.301 25148 6276 1 10 . 1 1 40 40 ASN HA H 40 4.018 4.018 4.553 -0.535 25148 6277 1 10 . 1 1 40 40 ASN CA C 40 58.944 58.944 55.539 3.405 25148 6278 1 10 . 1 1 41 41 GLN HA H 41 4.298 4.298 4.485 -0.187 25148 6279 1 10 . 1 1 41 41 GLN C C 41 175.237 175.237 175.609 -0.372 25148 6280 1 10 . 1 1 41 41 GLN CA C 41 57.360 57.360 56.421 0.939 25148 6281 1 10 . 1 1 41 41 GLN CB C 41 28.724 28.724 28.139 0.585 25148 6282 1 10 . 1 1 42 42 ALA N N 42 120.514 120.514 121.362 -0.848 25148 6283 1 10 . 1 1 42 42 ALA HA H 42 4.622 4.622 4.420 0.202 25148 6284 1 10 . 1 1 42 42 ALA C C 42 175.922 175.922 176.558 -0.636 25148 6285 1 10 . 1 1 42 42 ALA CA C 42 51.841 51.841 52.221 -0.380 25148 6286 1 10 . 1 1 42 42 ALA CB C 42 21.576 21.576 20.142 1.433 25148 6287 1 10 . 1 1 42 42 ALA H H 42 7.817 7.817 8.096 -0.279 25148 6288 1 10 . 1 1 43 43 GLN N N 43 117.594 117.594 115.075 2.519 25148 6289 1 10 . 1 1 43 43 GLN HA H 43 4.265 4.265 4.492 -0.227 25148 6290 1 10 . 1 1 43 43 GLN C C 43 174.942 174.942 173.610 1.332 25148 6291 1 10 . 1 1 43 43 GLN CA C 43 57.047 57.047 55.356 1.690 25148 6292 1 10 . 1 1 43 43 GLN CB C 43 30.863 30.863 31.681 -0.818 25148 6293 1 10 . 1 1 43 43 GLN H H 43 7.400 7.400 7.497 -0.097 25148 6294 1 10 . 1 1 44 44 ASN N N 44 120.467 120.467 119.630 0.837 25148 6295 1 10 . 1 1 44 44 ASN HA H 44 5.005 5.005 4.708 0.297 25148 6296 1 10 . 1 1 44 44 ASN C C 44 174.365 174.365 174.118 0.247 25148 6297 1 10 . 1 1 44 44 ASN CA C 44 52.381 52.381 52.788 -0.407 25148 6298 1 10 . 1 1 44 44 ASN CB C 44 38.177 38.177 39.126 -0.949 25148 6299 1 10 . 1 1 44 44 ASN H H 44 9.123 9.123 8.565 0.558 25148 6300 1 10 . 1 1 45 45 VAL N N 45 115.479 115.479 117.285 -1.806 25148 6301 1 10 . 1 1 45 45 VAL HA H 45 5.376 5.376 4.293 1.083 25148 6302 1 10 . 1 1 45 45 VAL C C 45 174.908 174.908 174.159 0.749 25148 6303 1 10 . 1 1 45 45 VAL CA C 45 59.022 59.022 61.661 -2.639 25148 6304 1 10 . 1 1 45 45 VAL CB C 45 35.776 35.776 35.112 0.664 25148 6305 1 10 . 1 1 45 45 VAL H H 45 7.732 7.732 8.201 -0.469 25148 6306 1 10 . 1 1 46 46 ARG N N 46 121.146 121.146 126.725 -5.579 25148 6307 1 10 . 1 1 46 46 ARG HA H 46 4.566 4.566 4.759 -0.193 25148 6308 1 10 . 1 1 46 46 ARG C C 46 173.790 173.790 174.851 -1.061 25148 6309 1 10 . 1 1 46 46 ARG CA C 46 54.762 54.762 55.004 -0.242 25148 6310 1 10 . 1 1 46 46 ARG CB C 46 33.946 33.946 31.960 1.986 25148 6311 1 10 . 1 1 46 46 ARG H H 46 8.850 8.850 9.051 -0.201 25148 6312 1 10 . 1 1 47 47 VAL N N 47 122.339 122.339 124.800 -2.461 25148 6313 1 10 . 1 1 47 47 VAL HA H 47 4.741 4.741 4.537 0.204 25148 6314 1 10 . 1 1 47 47 VAL C C 47 173.541 173.541 175.892 -2.351 25148 6315 1 10 . 1 1 47 47 VAL CA C 47 60.893 60.893 61.477 -0.584 25148 6316 1 10 . 1 1 47 47 VAL CB C 47 33.563 33.563 32.718 0.845 25148 6317 1 10 . 1 1 47 47 VAL H H 47 8.444 8.444 8.437 0.007 25148 6318 1 10 . 1 1 48 48 ASP N N 48 127.701 127.701 126.016 1.685 25148 6319 1 10 . 1 1 48 48 ASP HA H 48 4.946 4.946 4.916 0.030 25148 6320 1 10 . 1 1 48 48 ASP C C 48 173.744 173.744 174.470 -0.726 25148 6321 1 10 . 1 1 48 48 ASP CA C 48 52.651 52.651 53.185 -0.534 25148 6322 1 10 . 1 1 48 48 ASP CB C 48 45.225 45.225 43.262 1.963 25148 6323 1 10 . 1 1 48 48 ASP H H 48 9.068 9.068 8.470 0.598 25148 6324 1 10 . 1 1 49 49 LEU N N 49 130.945 130.945 125.994 4.951 25148 6325 1 10 . 1 1 49 49 LEU HA H 49 4.774 4.774 4.455 0.319 25148 6326 1 10 . 1 1 49 49 LEU C C 49 174.531 174.531 175.873 -1.342 25148 6327 1 10 . 1 1 49 49 LEU CA C 49 54.337 54.337 55.022 -0.685 25148 6328 1 10 . 1 1 49 49 LEU CB C 49 43.192 43.192 43.452 -0.260 25148 6329 1 10 . 1 1 49 49 LEU H H 49 9.369 9.369 8.554 0.815 25148 6330 1 10 . 1 1 50 50 ASN N N 50 126.268 126.268 124.412 1.856 25148 6331 1 10 . 1 1 50 50 ASN HA H 50 4.629 4.629 5.028 -0.399 25148 6332 1 10 . 1 1 50 50 ASN C C 50 176.602 176.602 175.275 1.327 25148 6333 1 10 . 1 1 50 50 ASN CA C 50 54.048 54.048 52.441 1.607 25148 6334 1 10 . 1 1 50 50 ASN CB C 50 39.891 39.891 38.927 0.964 25148 6335 1 10 . 1 1 50 50 ASN H H 50 8.672 8.672 8.859 -0.187 25148 6336 1 10 . 1 1 51 51 ARG N N 51 125.897 125.897 123.959 1.938 25148 6337 1 10 . 1 1 51 51 ARG HA H 51 3.789 3.789 4.259 -0.470 25148 6338 1 10 . 1 1 51 51 ARG C C 51 175.681 175.681 176.105 -0.424 25148 6339 1 10 . 1 1 51 51 ARG CA C 51 58.162 58.162 58.555 -0.393 25148 6340 1 10 . 1 1 51 51 ARG CB C 51 29.944 29.944 29.837 0.107 25148 6341 1 10 . 1 1 51 51 ARG H H 51 8.984 8.984 8.715 0.269 25148 6342 1 10 . 1 1 52 52 GLU N N 52 116.733 116.733 118.515 -1.782 25148 6343 1 10 . 1 1 52 52 GLU HA H 52 4.368 4.368 4.175 0.193 25148 6344 1 10 . 1 1 52 52 GLU C C 52 178.049 178.049 177.051 0.998 25148 6345 1 10 . 1 1 52 52 GLU CA C 52 58.048 58.048 58.064 -0.016 25148 6346 1 10 . 1 1 52 52 GLU CB C 52 30.716 30.716 29.475 1.241 25148 6347 1 10 . 1 1 52 52 GLU H H 52 8.541 8.541 8.387 0.154 25148 6348 1 10 . 1 1 53 53 THR N N 53 106.556 106.556 109.278 -2.722 25148 6349 1 10 . 1 1 53 53 THR HA H 53 4.424 4.424 4.490 -0.066 25148 6350 1 10 . 1 1 53 53 THR C C 53 176.352 176.352 175.423 0.929 25148 6351 1 10 . 1 1 53 53 THR CA C 53 61.320 61.320 60.747 0.573 25148 6352 1 10 . 1 1 53 53 THR CB C 53 71.220 71.220 70.032 1.188 25148 6353 1 10 . 1 1 53 53 THR H H 53 8.085 8.085 7.624 0.461 25148 6354 1 10 . 1 1 54 54 GLY N N 54 111.843 111.843 110.772 1.071 25148 6355 1 10 . 1 1 54 54 GLY C C 54 172.690 172.690 174.361 -1.671 25148 6356 1 10 . 1 1 54 54 GLY CA C 54 45.417 45.417 46.278 -0.861 25148 6357 1 10 . 1 1 54 54 GLY H H 54 8.330 8.330 7.882 0.448 25148 6358 1 10 . 1 1 55 55 SER N N 55 113.844 113.844 114.066 -0.222 25148 6359 1 10 . 1 1 55 55 SER HA H 55 4.279 4.279 4.708 -0.429 25148 6360 1 10 . 1 1 55 55 SER C C 55 174.127 174.127 173.017 1.110 25148 6361 1 10 . 1 1 55 55 SER CA C 55 59.229 59.229 57.671 1.558 25148 6362 1 10 . 1 1 55 55 SER CB C 55 63.939 63.939 65.688 -1.748 25148 6363 1 10 . 1 1 55 55 SER H H 55 7.653 7.653 7.518 0.135 25148 6364 1 10 . 1 1 56 56 ILE N N 56 125.286 125.286 120.358 4.928 25148 6365 1 10 . 1 1 56 56 ILE HA H 56 5.082 5.082 4.389 0.693 25148 6366 1 10 . 1 1 56 56 ILE C C 56 175.346 175.346 174.338 1.008 25148 6367 1 10 . 1 1 56 56 ILE CA C 56 59.967 59.967 60.621 -0.654 25148 6368 1 10 . 1 1 56 56 ILE CB C 56 40.165 40.165 41.904 -1.739 25148 6369 1 10 . 1 1 56 56 ILE H H 56 8.478 8.478 8.421 0.057 25148 6370 1 10 . 1 1 57 57 ARG N N 57 126.332 126.332 127.377 -1.045 25148 6371 1 10 . 1 1 57 57 ARG HA H 57 4.740 4.740 4.537 0.203 25148 6372 1 10 . 1 1 57 57 ARG C C 57 173.921 173.921 173.593 0.328 25148 6373 1 10 . 1 1 57 57 ARG CA C 57 54.311 54.311 53.975 0.336 25148 6374 1 10 . 1 1 57 57 ARG CB C 57 35.805 35.805 33.044 2.761 25148 6375 1 10 . 1 1 57 57 ARG H H 57 8.590 8.590 8.218 0.372 25148 6376 1 10 . 1 1 58 58 VAL N N 58 120.987 120.987 122.952 -1.965 25148 6377 1 10 . 1 1 58 58 VAL HA H 58 4.334 4.334 3.979 0.355 25148 6378 1 10 . 1 1 58 58 VAL C C 58 174.204 174.204 173.601 0.603 25148 6379 1 10 . 1 1 58 58 VAL CA C 58 60.861 60.861 61.519 -0.658 25148 6380 1 10 . 1 1 58 58 VAL CB C 58 33.383 33.383 31.739 1.644 25148 6381 1 10 . 1 1 58 58 VAL H H 58 8.585 8.585 8.223 0.362 25148 6382 1 10 . 1 1 59 59 PHE N N 59 124.913 124.913 126.312 -1.399 25148 6383 1 10 . 1 1 59 59 PHE HA H 59 5.046 5.046 5.370 -0.324 25148 6384 1 10 . 1 1 59 59 PHE C C 59 174.446 174.446 174.184 0.262 25148 6385 1 10 . 1 1 59 59 PHE CA C 59 56.695 56.695 55.281 1.414 25148 6386 1 10 . 1 1 59 59 PHE CB C 59 42.779 42.779 43.329 -0.550 25148 6387 1 10 . 1 1 59 59 PHE H H 59 8.920 8.920 8.142 0.778 25148 6388 1 10 . 1 1 60 60 ALA N N 60 124.035 124.035 123.205 0.830 25148 6389 1 10 . 1 1 60 60 ALA HA H 60 5.102 5.102 4.839 0.263 25148 6390 1 10 . 1 1 60 60 ALA C C 60 176.017 176.017 176.048 -0.031 25148 6391 1 10 . 1 1 60 60 ALA CA C 60 50.083 50.083 50.521 -0.438 25148 6392 1 10 . 1 1 60 60 ALA CB C 60 22.400 22.400 20.966 1.434 25148 6393 1 10 . 1 1 60 60 ALA H H 60 9.457 9.457 8.734 0.723 25148 6394 1 10 . 1 1 61 61 ARG N N 61 121.530 121.530 124.440 -2.910 25148 6395 1 10 . 1 1 61 61 ARG HA H 61 4.958 4.958 4.985 -0.027 25148 6396 1 10 . 1 1 61 61 ARG C C 61 176.737 176.737 175.726 1.011 25148 6397 1 10 . 1 1 61 61 ARG CA C 61 55.375 55.375 55.736 -0.361 25148 6398 1 10 . 1 1 61 61 ARG CB C 61 31.230 31.230 31.306 -0.076 25148 6399 1 10 . 1 1 61 61 ARG H H 61 8.447 8.447 8.776 -0.329 25148 6400 1 10 . 1 1 62 62 LYS N N 62 124.784 124.784 126.125 -1.341 25148 6401 1 10 . 1 1 62 62 LYS HA H 62 4.709 4.709 4.487 0.222 25148 6402 1 10 . 1 1 62 62 LYS C C 62 173.899 173.899 174.919 -1.020 25148 6403 1 10 . 1 1 62 62 LYS CA C 62 54.812 54.812 55.121 -0.309 25148 6404 1 10 . 1 1 62 62 LYS CB C 62 37.147 37.147 35.538 1.609 25148 6405 1 10 . 1 1 62 62 LYS H H 62 9.137 9.137 8.231 0.906 25148 6406 1 10 . 1 1 63 63 ASP N N 63 122.552 122.552 125.288 -2.736 25148 6407 1 10 . 1 1 63 63 ASP HA H 63 4.877 4.877 4.599 0.278 25148 6408 1 10 . 1 1 63 63 ASP C C 63 175.560 175.560 175.986 -0.426 25148 6409 1 10 . 1 1 63 63 ASP CA C 63 54.576 54.576 54.918 -0.342 25148 6410 1 10 . 1 1 63 63 ASP CB C 63 42.841 42.841 41.775 1.066 25148 6411 1 10 . 1 1 63 63 ASP H H 63 8.334 8.334 8.804 -0.470 25148 6412 1 10 . 1 1 64 64 VAL N N 64 123.109 123.109 127.278 -4.169 25148 6413 1 10 . 1 1 64 64 VAL HA H 64 4.557 4.557 4.544 0.013 25148 6414 1 10 . 1 1 64 64 VAL C C 64 177.260 177.260 175.662 1.598 25148 6415 1 10 . 1 1 64 64 VAL CA C 64 62.268 62.268 63.126 -0.858 25148 6416 1 10 . 1 1 64 64 VAL CB C 64 30.348 30.348 31.047 -0.700 25148 6417 1 10 . 1 1 64 64 VAL H H 64 8.693 8.693 8.059 0.634 25148 6418 1 10 . 1 1 65 65 VAL N N 65 122.320 122.320 123.156 -0.836 25148 6419 1 10 . 1 1 65 65 VAL HA H 65 4.939 4.939 4.475 0.464 25148 6420 1 10 . 1 1 65 65 VAL C C 65 174.754 174.754 174.979 -0.225 25148 6421 1 10 . 1 1 65 65 VAL CA C 65 59.173 59.173 59.533 -0.360 25148 6422 1 10 . 1 1 65 65 VAL CB C 65 36.289 36.289 35.971 0.319 25148 6423 1 10 . 1 1 65 65 VAL H H 65 8.656 8.656 8.518 0.138 25148 6424 1 10 . 1 1 66 66 ASP N N 66 119.805 119.805 121.863 -2.058 25148 6425 1 10 . 1 1 66 66 ASP HA H 66 4.499 4.499 4.365 0.134 25148 6426 1 10 . 1 1 66 66 ASP C C 66 176.565 176.565 175.956 0.609 25148 6427 1 10 . 1 1 66 66 ASP CA C 66 57.236 57.236 56.210 1.026 25148 6428 1 10 . 1 1 66 66 ASP CB C 66 41.662 41.662 41.114 0.548 25148 6429 1 10 . 1 1 66 66 ASP H H 66 8.628 8.628 8.714 -0.086 25148 6430 1 10 . 1 1 67 67 GLU N N 67 117.604 117.604 117.814 -0.210 25148 6431 1 10 . 1 1 67 67 GLU HA H 67 4.350 4.350 4.545 -0.195 25148 6432 1 10 . 1 1 67 67 GLU C C 67 173.736 173.736 175.918 -2.182 25148 6433 1 10 . 1 1 67 67 GLU CA C 67 55.203 55.203 55.160 0.043 25148 6434 1 10 . 1 1 67 67 GLU CB C 67 32.240 32.240 32.882 -0.642 25148 6435 1 10 . 1 1 67 67 GLU H H 67 7.525 7.525 7.714 -0.189 25148 6436 1 10 . 1 1 68 68 VAL N N 68 125.774 125.774 123.449 2.325 25148 6437 1 10 . 1 1 68 68 VAL HA H 68 3.578 3.578 3.936 -0.358 25148 6438 1 10 . 1 1 68 68 VAL C C 68 175.885 175.885 175.527 0.358 25148 6439 1 10 . 1 1 68 68 VAL CA C 68 63.397 63.397 64.066 -0.669 25148 6440 1 10 . 1 1 68 68 VAL CB C 68 32.452 32.452 31.555 0.897 25148 6441 1 10 . 1 1 68 68 VAL H H 68 8.573 8.573 8.549 0.024 25148 6442 1 10 . 1 1 69 69 TYR N N 69 129.859 129.859 127.072 2.787 25148 6443 1 10 . 1 1 69 69 TYR HA H 69 4.642 4.642 4.630 0.012 25148 6444 1 10 . 1 1 69 69 TYR C C 69 176.100 176.100 175.470 0.630 25148 6445 1 10 . 1 1 69 69 TYR CA C 69 59.092 59.092 58.141 0.951 25148 6446 1 10 . 1 1 69 69 TYR CB C 69 39.830 39.830 40.452 -0.622 25148 6447 1 10 . 1 1 69 69 TYR H H 69 9.801 9.801 8.573 1.228 25148 6448 1 10 . 1 1 70 70 ASP N N 70 120.204 120.204 120.308 -0.104 25148 6449 1 10 . 1 1 70 70 ASP HA H 70 4.772 4.772 4.885 -0.113 25148 6450 1 10 . 1 1 70 70 ASP C C 70 176.622 176.622 176.184 0.438 25148 6451 1 10 . 1 1 70 70 ASP CA C 70 52.885 52.885 52.977 -0.092 25148 6452 1 10 . 1 1 70 70 ASP CB C 70 41.878 41.878 41.318 0.560 25148 6453 1 10 . 1 1 70 70 ASP H H 70 8.348 8.348 7.860 0.488 25148 6454 1 10 . 1 1 71 71 GLN N N 71 125.440 125.440 124.635 0.805 25148 6455 1 10 . 1 1 71 71 GLN HA H 71 4.315 4.315 4.001 0.314 25148 6456 1 10 . 1 1 71 71 GLN C C 71 175.819 175.819 176.918 -1.099 25148 6457 1 10 . 1 1 71 71 GLN CA C 71 57.914 57.914 58.207 -0.293 25148 6458 1 10 . 1 1 71 71 GLN CB C 71 28.307 28.307 28.845 -0.538 25148 6459 1 10 . 1 1 71 71 GLN H H 71 9.097 9.097 8.769 0.328 25148 6460 1 10 . 1 1 72 72 ARG N N 72 116.306 116.306 114.610 1.696 25148 6461 1 10 . 1 1 72 72 ARG HA H 72 4.252 4.252 4.132 0.120 25148 6462 1 10 . 1 1 72 72 ARG C C 72 178.087 178.087 175.907 2.180 25148 6463 1 10 . 1 1 72 72 ARG CA C 72 58.532 58.532 57.629 0.903 25148 6464 1 10 . 1 1 72 72 ARG CB C 72 30.143 30.143 30.619 -0.476 25148 6465 1 10 . 1 1 72 72 ARG H H 72 8.534 8.534 7.959 0.575 25148 6466 1 10 . 1 1 73 73 LEU N N 73 116.734 116.734 113.959 2.775 25148 6467 1 10 . 1 1 73 73 LEU HA H 73 4.621 4.621 4.661 -0.040 25148 6468 1 10 . 1 1 73 73 LEU C C 73 175.946 175.946 175.059 0.887 25148 6469 1 10 . 1 1 73 73 LEU CA C 73 55.250 55.250 55.506 -0.256 25148 6470 1 10 . 1 1 73 73 LEU CB C 73 46.960 46.960 44.401 2.559 25148 6471 1 10 . 1 1 73 73 LEU H H 73 7.460 7.460 7.459 0.001 25148 6472 1 10 . 1 1 74 74 GLU N N 74 118.787 118.787 122.066 -3.279 25148 6473 1 10 . 1 1 74 74 GLU HA H 74 5.403 5.403 4.652 0.751 25148 6474 1 10 . 1 1 74 74 GLU C C 74 173.709 173.709 174.561 -0.852 25148 6475 1 10 . 1 1 74 74 GLU CA C 74 54.914 54.914 55.696 -0.782 25148 6476 1 10 . 1 1 74 74 GLU CB C 74 35.053 35.053 33.492 1.561 25148 6477 1 10 . 1 1 74 74 GLU H H 74 7.752 7.752 8.071 -0.319 25148 6478 1 10 . 1 1 75 75 ILE N N 75 119.803 119.803 121.997 -2.194 25148 6479 1 10 . 1 1 75 75 ILE HA H 75 4.507 4.507 4.455 0.052 25148 6480 1 10 . 1 1 75 75 ILE C C 75 172.126 172.126 173.720 -1.594 25148 6481 1 10 . 1 1 75 75 ILE CA C 75 58.664 58.664 60.433 -1.769 25148 6482 1 10 . 1 1 75 75 ILE CB C 75 42.560 42.560 42.177 0.383 25148 6483 1 10 . 1 1 75 75 ILE H H 75 8.975 8.975 8.553 0.422 25148 6484 1 10 . 1 1 76 76 SER N N 76 123.236 123.236 124.378 -1.142 25148 6485 1 10 . 1 1 76 76 SER HA H 76 4.505 4.505 5.003 -0.498 25148 6486 1 10 . 1 1 76 76 SER C C 76 176.145 176.145 175.747 0.398 25148 6487 1 10 . 1 1 76 76 SER CA C 76 58.108 58.108 57.907 0.201 25148 6488 1 10 . 1 1 76 76 SER CB C 76 65.000 65.000 64.573 0.427 25148 6489 1 10 . 1 1 76 76 SER H H 76 8.810 8.810 8.416 0.394 25148 6490 1 10 . 1 1 77 77 ILE N N 77 120.629 120.629 125.021 -4.392 25148 6491 1 10 . 1 1 77 77 ILE HA H 77 3.935 3.935 3.706 0.229 25148 6492 1 10 . 1 1 77 77 ILE C C 77 175.806 175.806 176.960 -1.154 25148 6493 1 10 . 1 1 77 77 ILE CA C 77 61.928 61.928 63.613 -1.685 25148 6494 1 10 . 1 1 77 77 ILE CB C 77 38.031 38.031 38.097 -0.067 25148 6495 1 10 . 1 1 77 77 ILE H H 77 8.321 8.321 8.088 0.233 25148 6496 1 10 . 1 1 78 78 GLU N N 78 121.032 121.032 117.584 3.448 25148 6497 1 10 . 1 1 78 78 GLU HA H 78 4.082 4.082 3.985 0.097 25148 6498 1 10 . 1 1 78 78 GLU C C 78 179.829 179.829 178.384 1.445 25148 6499 1 10 . 1 1 78 78 GLU CA C 78 60.180 60.180 59.030 1.150 25148 6500 1 10 . 1 1 78 78 GLU CB C 78 28.988 28.988 28.671 0.317 25148 6501 1 10 . 1 1 78 78 GLU H H 78 8.222 8.222 8.393 -0.171 25148 6502 1 10 . 1 1 79 79 GLU N N 79 120.710 120.710 121.215 -0.505 25148 6503 1 10 . 1 1 79 79 GLU HA H 79 4.012 4.012 4.103 -0.091 25148 6504 1 10 . 1 1 79 79 GLU C C 79 180.339 180.339 179.116 1.223 25148 6505 1 10 . 1 1 79 79 GLU CA C 79 59.332 59.332 58.827 0.505 25148 6506 1 10 . 1 1 79 79 GLU CB C 79 29.317 29.317 29.637 -0.320 25148 6507 1 10 . 1 1 79 79 GLU H H 79 7.908 7.908 7.891 0.017 25148 6508 1 10 . 1 1 80 80 ALA N N 80 122.879 122.879 122.308 0.571 25148 6509 1 10 . 1 1 80 80 ALA HA H 80 3.966 3.966 4.092 -0.126 25148 6510 1 10 . 1 1 80 80 ALA C C 80 179.833 179.833 179.903 -0.070 25148 6511 1 10 . 1 1 80 80 ALA CA C 80 55.881 55.881 55.149 0.732 25148 6512 1 10 . 1 1 80 80 ALA CB C 80 18.870 18.870 18.082 0.788 25148 6513 1 10 . 1 1 80 80 ALA H H 80 9.132 9.132 7.995 1.137 25148 6514 1 10 . 1 1 81 81 GLN N N 81 115.829 115.829 116.649 -0.820 25148 6515 1 10 . 1 1 81 81 GLN HA H 81 4.749 4.749 4.324 0.425 25148 6516 1 10 . 1 1 81 81 GLN C C 81 178.126 178.126 177.945 0.181 25148 6517 1 10 . 1 1 81 81 GLN CA C 81 57.682 57.682 57.518 0.164 25148 6518 1 10 . 1 1 81 81 GLN CB C 81 27.307 27.307 28.832 -1.525 25148 6519 1 10 . 1 1 81 81 GLN H H 81 8.709 8.709 7.876 0.833 25148 6520 1 10 . 1 1 82 82 GLY N N 82 105.531 105.531 106.919 -1.388 25148 6521 1 10 . 1 1 82 82 GLY C C 82 174.917 174.917 174.992 -0.075 25148 6522 1 10 . 1 1 82 82 GLY CA C 82 45.915 45.915 46.572 -0.657 25148 6523 1 10 . 1 1 82 82 GLY H H 82 7.479 7.479 8.036 -0.557 25148 6524 1 10 . 1 1 83 83 ILE N N 83 122.828 122.828 113.969 8.859 25148 6525 1 10 . 1 1 83 83 ILE HA H 83 3.970 3.970 4.425 -0.455 25148 6526 1 10 . 1 1 83 83 ILE C C 83 177.209 177.209 175.579 1.630 25148 6527 1 10 . 1 1 83 83 ILE CA C 83 64.305 64.305 61.678 2.627 25148 6528 1 10 . 1 1 83 83 ILE CB C 83 38.452 38.452 40.078 -1.626 25148 6529 1 10 . 1 1 83 83 ILE H H 83 7.634 7.634 7.531 0.103 25148 6530 1 10 . 1 1 84 84 HIS N N 84 118.927 118.927 120.033 -1.106 25148 6531 1 10 . 1 1 84 84 HIS HA H 84 4.713 4.713 4.937 -0.224 25148 6532 1 10 . 1 1 84 84 HIS CA C 84 55.487 55.487 54.380 1.107 25148 6533 1 10 . 1 1 84 84 HIS CB C 84 33.506 33.506 32.366 1.140 25148 6534 1 10 . 1 1 84 84 HIS H H 84 8.155 8.155 8.418 -0.263 25148 6535 1 10 . 1 1 85 85 PRO HA H 85 4.456 4.456 4.500 -0.044 25148 6536 1 10 . 1 1 85 85 PRO C C 85 177.357 177.357 177.267 0.090 25148 6537 1 10 . 1 1 85 85 PRO CA C 85 64.475 64.475 64.067 0.408 25148 6538 1 10 . 1 1 85 85 PRO CB C 85 32.489 32.489 32.073 0.416 25148 6539 1 10 . 1 1 86 86 GLU N N 86 116.314 116.314 117.526 -1.212 25148 6540 1 10 . 1 1 86 86 GLU HA H 86 4.286 4.286 4.177 0.109 25148 6541 1 10 . 1 1 86 86 GLU C C 86 177.624 177.624 177.221 0.403 25148 6542 1 10 . 1 1 86 86 GLU CA C 86 56.619 56.619 56.677 -0.058 25148 6543 1 10 . 1 1 86 86 GLU CB C 86 29.389 29.389 29.529 -0.140 25148 6544 1 10 . 1 1 86 86 GLU H H 86 8.938 8.938 7.805 1.133 25148 6545 1 10 . 1 1 87 87 TYR N N 87 119.773 119.773 120.270 -0.497 25148 6546 1 10 . 1 1 87 87 TYR HA H 87 4.744 4.744 4.208 0.536 25148 6547 1 10 . 1 1 87 87 TYR C C 87 174.533 174.533 176.117 -1.584 25148 6548 1 10 . 1 1 87 87 TYR CA C 87 59.117 59.117 59.563 -0.446 25148 6549 1 10 . 1 1 87 87 TYR CB C 87 38.859 38.859 38.744 0.115 25148 6550 1 10 . 1 1 87 87 TYR H H 87 7.447 7.447 7.376 0.071 25148 6551 1 10 . 1 1 88 88 MET N N 88 118.298 118.298 117.059 1.239 25148 6552 1 10 . 1 1 88 88 MET HA H 88 4.770 4.770 4.696 0.074 25148 6553 1 10 . 1 1 88 88 MET C C 88 175.638 175.638 174.015 1.623 25148 6554 1 10 . 1 1 88 88 MET CA C 88 53.133 53.133 54.694 -1.561 25148 6555 1 10 . 1 1 88 88 MET CB C 88 37.102 37.102 35.558 1.544 25148 6556 1 10 . 1 1 88 88 MET H H 88 9.023 9.023 8.247 0.776 25148 6557 1 10 . 1 1 89 89 VAL N N 89 120.157 120.157 124.234 -4.077 25148 6558 1 10 . 1 1 89 89 VAL HA H 89 3.330 3.330 3.552 -0.222 25148 6559 1 10 . 1 1 89 89 VAL C C 89 177.432 177.432 176.578 0.854 25148 6560 1 10 . 1 1 89 89 VAL CA C 89 65.675 65.675 64.936 0.740 25148 6561 1 10 . 1 1 89 89 VAL CB C 89 31.321 31.321 31.017 0.304 25148 6562 1 10 . 1 1 89 89 VAL H H 89 8.313 8.313 8.611 -0.298 25148 6563 1 10 . 1 1 90 90 GLY N N 90 116.935 116.935 115.467 1.468 25148 6564 1 10 . 1 1 90 90 GLY C C 90 175.196 175.196 174.416 0.780 25148 6565 1 10 . 1 1 90 90 GLY CA C 90 44.685 44.685 44.705 -0.020 25148 6566 1 10 . 1 1 90 90 GLY H H 90 8.551 8.551 8.803 -0.252 25148 6567 1 10 . 1 1 91 91 ASP N N 91 121.616 121.616 121.981 -0.365 25148 6568 1 10 . 1 1 91 91 ASP HA H 91 4.790 4.790 4.871 -0.081 25148 6569 1 10 . 1 1 91 91 ASP C C 91 174.431 174.431 175.195 -0.764 25148 6570 1 10 . 1 1 91 91 ASP CA C 91 55.011 55.011 54.502 0.509 25148 6571 1 10 . 1 1 91 91 ASP CB C 91 42.079 42.079 42.491 -0.412 25148 6572 1 10 . 1 1 91 91 ASP H H 91 8.073 8.073 8.102 -0.029 25148 6573 1 10 . 1 1 92 92 VAL N N 92 118.919 118.919 114.113 4.806 25148 6574 1 10 . 1 1 92 92 VAL HA H 92 4.709 4.709 4.915 -0.206 25148 6575 1 10 . 1 1 92 92 VAL C C 92 175.602 175.602 174.344 1.258 25148 6576 1 10 . 1 1 92 92 VAL CA C 92 61.527 61.527 60.132 1.395 25148 6577 1 10 . 1 1 92 92 VAL CB C 92 34.110 34.110 35.021 -0.911 25148 6578 1 10 . 1 1 92 92 VAL H H 92 8.216 8.216 8.048 0.168 25148 6579 1 10 . 1 1 93 93 VAL N N 93 123.922 123.922 123.235 0.687 25148 6580 1 10 . 1 1 93 93 VAL HA H 93 4.231 4.231 4.218 0.013 25148 6581 1 10 . 1 1 93 93 VAL C C 93 174.105 174.105 174.242 -0.137 25148 6582 1 10 . 1 1 93 93 VAL CA C 93 59.644 59.644 59.296 0.348 25148 6583 1 10 . 1 1 93 93 VAL CB C 93 34.661 34.661 35.363 -0.702 25148 6584 1 10 . 1 1 93 93 VAL H H 93 8.812 8.812 7.932 0.880 25148 6585 1 10 . 1 1 94 94 GLU N N 94 123.605 123.605 128.565 -4.960 25148 6586 1 10 . 1 1 94 94 GLU HA H 94 5.347 5.347 5.266 0.081 25148 6587 1 10 . 1 1 94 94 GLU C C 94 175.708 175.708 175.641 0.067 25148 6588 1 10 . 1 1 94 94 GLU CA C 94 54.979 54.979 55.013 -0.034 25148 6589 1 10 . 1 1 94 94 GLU CB C 94 31.612 31.612 31.865 -0.253 25148 6590 1 10 . 1 1 94 94 GLU H H 94 8.312 8.312 8.178 0.134 25148 6591 1 10 . 1 1 95 95 ILE N N 95 123.581 123.581 123.539 0.042 25148 6592 1 10 . 1 1 95 95 ILE HA H 95 4.601 4.601 4.488 0.113 25148 6593 1 10 . 1 1 95 95 ILE C C 95 175.081 175.081 175.049 0.032 25148 6594 1 10 . 1 1 95 95 ILE CA C 95 58.601 58.601 59.689 -1.088 25148 6595 1 10 . 1 1 95 95 ILE CB C 95 41.727 41.727 42.424 -0.697 25148 6596 1 10 . 1 1 95 95 ILE H H 95 9.045 9.045 8.248 0.797 25148 6597 1 10 . 1 1 96 96 GLU N N 96 128.094 128.094 127.213 0.881 25148 6598 1 10 . 1 1 96 96 GLU HA H 96 4.098 4.098 4.391 -0.293 25148 6599 1 10 . 1 1 96 96 GLU C C 96 176.845 176.845 175.891 0.954 25148 6600 1 10 . 1 1 96 96 GLU CA C 96 57.853 57.853 58.221 -0.367 25148 6601 1 10 . 1 1 96 96 GLU CB C 96 28.323 28.323 29.267 -0.944 25148 6602 1 10 . 1 1 96 96 GLU H H 96 9.256 9.256 8.915 0.341 25148 6603 1 10 . 1 1 97 97 VAL N N 97 118.446 118.446 123.488 -5.042 25148 6604 1 10 . 1 1 97 97 VAL HA H 97 4.568 4.568 4.255 0.313 25148 6605 1 10 . 1 1 97 97 VAL C C 97 175.051 175.051 175.043 0.008 25148 6606 1 10 . 1 1 97 97 VAL CA C 97 59.796 59.796 61.088 -1.292 25148 6607 1 10 . 1 1 97 97 VAL CB C 97 32.399 32.399 33.575 -1.176 25148 6608 1 10 . 1 1 97 97 VAL H H 97 8.609 8.609 8.796 -0.187 25148 6609 1 10 . 1 1 98 98 THR N N 98 119.118 119.118 117.774 1.344 25148 6610 1 10 . 1 1 98 98 THR HA H 98 3.320 3.320 4.016 -0.696 25148 6611 1 10 . 1 1 98 98 THR CA C 98 61.628 61.628 58.886 2.742 25148 6612 1 10 . 1 1 98 98 THR CB C 98 70.031 70.031 69.338 0.693 25148 6613 1 10 . 1 1 98 98 THR H H 98 7.396 7.396 7.529 -0.133 25148 6614 1 10 . 1 1 99 99 PRO HA H 99 4.458 4.458 4.590 -0.132 25148 6615 1 10 . 1 1 99 99 PRO CA C 99 62.348 62.348 62.429 -0.081 25148 6616 1 10 . 1 1 99 99 PRO CB C 99 33.182 33.182 32.663 0.519 25148 6617 1 10 . 1 1 100 100 LYS HA H 100 4.126 4.126 4.168 -0.042 25148 6618 1 10 . 1 1 100 100 LYS CA C 100 58.773 58.773 57.836 0.937 25148 6619 1 10 . 1 1 100 100 LYS CB C 100 32.195 32.195 32.478 -0.283 25148 6620 1 10 . 1 1 101 101 ASP HA H 101 4.924 4.924 4.811 0.113 25148 6621 1 10 . 1 1 101 101 ASP C C 101 176.884 176.884 176.660 0.224 25148 6622 1 10 . 1 1 101 101 ASP CA C 101 54.134 54.134 53.771 0.363 25148 6623 1 10 . 1 1 101 101 ASP CB C 101 40.272 40.272 40.617 -0.345 25148 6624 1 10 . 1 1 102 102 PHE N N 102 118.703 118.703 121.538 -2.835 25148 6625 1 10 . 1 1 102 102 PHE HA H 102 4.295 4.295 4.191 0.104 25148 6626 1 10 . 1 1 102 102 PHE C C 102 176.477 176.477 177.048 -0.571 25148 6627 1 10 . 1 1 102 102 PHE CA C 102 60.748 60.748 60.167 0.581 25148 6628 1 10 . 1 1 102 102 PHE CB C 102 39.667 39.667 39.152 0.515 25148 6629 1 10 . 1 1 102 102 PHE H H 102 7.862 7.862 7.704 0.158 25148 6630 1 10 . 1 1 103 103 GLY CA C 103 47.430 47.430 47.135 0.296 25148 6631 1 10 . 1 1 104 104 ARG N N 104 121.819 121.819 121.720 0.099 25148 6632 1 10 . 1 1 104 104 ARG HA H 104 4.176 4.176 4.172 0.004 25148 6633 1 10 . 1 1 104 104 ARG C C 104 178.912 178.912 178.362 0.550 25148 6634 1 10 . 1 1 104 104 ARG CA C 104 59.235 59.235 58.248 0.987 25148 6635 1 10 . 1 1 104 104 ARG CB C 104 30.000 30.000 30.429 -0.429 25148 6636 1 10 . 1 1 104 104 ARG H H 104 7.809 7.809 7.462 0.347 25148 6637 1 10 . 1 1 105 105 ILE N N 105 120.331 120.331 120.495 -0.164 25148 6638 1 10 . 1 1 105 105 ILE HA H 105 3.836 3.836 3.545 0.291 25148 6639 1 10 . 1 1 105 105 ILE C C 105 179.206 179.206 177.548 1.658 25148 6640 1 10 . 1 1 105 105 ILE CA C 105 63.025 63.025 64.961 -1.936 25148 6641 1 10 . 1 1 105 105 ILE CB C 105 38.127 38.127 37.483 0.644 25148 6642 1 10 . 1 1 105 105 ILE H H 105 7.203 7.203 7.405 -0.202 25148 6643 1 10 . 1 1 106 106 ALA N N 106 124.867 124.867 121.738 3.129 25148 6644 1 10 . 1 1 106 106 ALA HA H 106 3.665 3.665 3.539 0.126 25148 6645 1 10 . 1 1 106 106 ALA C C 106 178.590 178.590 179.061 -0.471 25148 6646 1 10 . 1 1 106 106 ALA CA C 106 54.842 54.842 55.153 -0.311 25148 6647 1 10 . 1 1 106 106 ALA CB C 106 18.659 18.659 17.821 0.838 25148 6648 1 10 . 1 1 106 106 ALA H H 106 8.813 8.813 8.151 0.662 25148 6649 1 10 . 1 1 107 107 ALA N N 107 119.597 119.597 120.680 -1.083 25148 6650 1 10 . 1 1 107 107 ALA HA H 107 4.014 4.014 4.015 -0.001 25148 6651 1 10 . 1 1 107 107 ALA C C 107 180.214 180.214 179.483 0.731 25148 6652 1 10 . 1 1 107 107 ALA CA C 107 55.454 55.454 54.681 0.773 25148 6653 1 10 . 1 1 107 107 ALA CB C 107 18.260 18.260 18.020 0.240 25148 6654 1 10 . 1 1 107 107 ALA H H 107 8.012 8.012 7.278 0.734 25148 6655 1 10 . 1 1 108 108 GLN N N 108 116.896 116.896 118.269 -1.373 25148 6656 1 10 . 1 1 108 108 GLN HA H 108 4.054 4.054 3.968 0.086 25148 6657 1 10 . 1 1 108 108 GLN C C 108 178.784 178.784 178.408 0.376 25148 6658 1 10 . 1 1 108 108 GLN CA C 108 58.705 58.705 58.993 -0.288 25148 6659 1 10 . 1 1 108 108 GLN CB C 108 28.647 28.647 28.759 -0.112 25148 6660 1 10 . 1 1 108 108 GLN H H 108 7.498 7.498 8.483 -0.985 25148 6661 1 10 . 1 1 109 109 THR N N 109 117.495 117.495 114.998 2.497 25148 6662 1 10 . 1 1 109 109 THR HA H 109 3.917 3.917 4.378 -0.461 25148 6663 1 10 . 1 1 109 109 THR C C 109 175.732 175.732 175.490 0.242 25148 6664 1 10 . 1 1 109 109 THR CA C 109 66.989 66.989 65.333 1.656 25148 6665 1 10 . 1 1 109 109 THR CB C 109 68.766 68.766 68.367 0.399 25148 6666 1 10 . 1 1 109 109 THR H H 109 8.203 8.203 8.251 -0.048 25148 6667 1 10 . 1 1 110 110 ALA N N 110 122.308 122.308 125.091 -2.783 25148 6668 1 10 . 1 1 110 110 ALA HA H 110 3.854 3.854 4.054 -0.200 25148 6669 1 10 . 1 1 110 110 ALA C C 110 178.380 178.380 178.860 -0.480 25148 6670 1 10 . 1 1 110 110 ALA CA C 110 55.903 55.903 54.902 1.001 25148 6671 1 10 . 1 1 110 110 ALA CB C 110 18.524 18.524 18.250 0.275 25148 6672 1 10 . 1 1 110 110 ALA H H 110 8.668 8.668 7.409 1.259 25148 6673 1 10 . 1 1 111 111 LYS N N 111 115.552 115.552 117.710 -2.158 25148 6674 1 10 . 1 1 111 111 LYS HA H 111 3.923 3.923 3.977 -0.054 25148 6675 1 10 . 1 1 111 111 LYS C C 111 179.111 179.111 178.860 0.251 25148 6676 1 10 . 1 1 111 111 LYS CA C 111 59.825 59.825 59.311 0.514 25148 6677 1 10 . 1 1 111 111 LYS CB C 111 32.251 32.251 31.955 0.296 25148 6678 1 10 . 1 1 111 111 LYS H H 111 7.642 7.642 8.472 -0.830 25148 6679 1 10 . 1 1 112 112 GLN N N 112 120.178 120.178 118.834 1.344 25148 6680 1 10 . 1 1 112 112 GLN HA H 112 4.060 4.060 4.135 -0.075 25148 6681 1 10 . 1 1 112 112 GLN C C 112 178.355 178.355 178.330 0.025 25148 6682 1 10 . 1 1 112 112 GLN CA C 112 59.240 59.240 58.137 1.103 25148 6683 1 10 . 1 1 112 112 GLN CB C 112 28.250 28.250 28.471 -0.221 25148 6684 1 10 . 1 1 112 112 GLN H H 112 7.798 7.798 7.663 0.135 25148 6685 1 10 . 1 1 113 113 VAL N N 113 119.799 119.799 121.124 -1.325 25148 6686 1 10 . 1 1 113 113 VAL HA H 113 3.705 3.705 3.668 0.037 25148 6687 1 10 . 1 1 113 113 VAL C C 113 178.303 178.303 177.722 0.581 25148 6688 1 10 . 1 1 113 113 VAL CA C 113 66.277 66.277 66.563 -0.286 25148 6689 1 10 . 1 1 113 113 VAL CB C 113 31.954 31.954 32.027 -0.073 25148 6690 1 10 . 1 1 113 113 VAL H H 113 8.105 8.105 7.547 0.558 25148 6691 1 10 . 1 1 114 114 VAL N N 114 118.265 118.265 116.196 2.069 25148 6692 1 10 . 1 1 114 114 VAL HA H 114 3.392 3.392 3.644 -0.252 25148 6693 1 10 . 1 1 114 114 VAL C C 114 177.360 177.360 177.608 -0.248 25148 6694 1 10 . 1 1 114 114 VAL CA C 114 67.832 67.832 66.974 0.858 25148 6695 1 10 . 1 1 114 114 VAL CB C 114 31.801 31.801 31.411 0.390 25148 6696 1 10 . 1 1 114 114 VAL H H 114 8.180 8.180 8.036 0.144 25148 6697 1 10 . 1 1 115 115 THR N N 115 113.460 113.460 115.188 -1.728 25148 6698 1 10 . 1 1 115 115 THR HA H 115 3.856 3.856 4.002 -0.146 25148 6699 1 10 . 1 1 115 115 THR C C 115 176.529 176.529 176.343 0.186 25148 6700 1 10 . 1 1 115 115 THR CA C 115 66.706 66.706 66.817 -0.111 25148 6701 1 10 . 1 1 115 115 THR CB C 115 69.008 69.008 68.661 0.347 25148 6702 1 10 . 1 1 115 115 THR H H 115 8.143 8.143 7.606 0.537 25148 6703 1 10 . 1 1 116 116 GLN N N 116 120.129 120.129 120.984 -0.855 25148 6704 1 10 . 1 1 116 116 GLN HA H 116 4.054 4.054 4.086 -0.032 25148 6705 1 10 . 1 1 116 116 GLN C C 116 178.100 178.100 178.389 -0.289 25148 6706 1 10 . 1 1 116 116 GLN CA C 116 58.950 58.950 59.040 -0.090 25148 6707 1 10 . 1 1 116 116 GLN CB C 116 28.244 28.244 28.667 -0.423 25148 6708 1 10 . 1 1 116 116 GLN H H 116 7.936 7.936 7.646 0.290 25148 6709 1 10 . 1 1 117 117 ARG N N 117 117.838 117.838 120.146 -2.308 25148 6710 1 10 . 1 1 117 117 ARG HA H 117 4.174 4.174 4.064 0.110 25148 6711 1 10 . 1 1 117 117 ARG C C 117 179.138 179.138 178.774 0.364 25148 6712 1 10 . 1 1 117 117 ARG CA C 117 57.461 57.461 58.761 -1.300 25148 6713 1 10 . 1 1 117 117 ARG CB C 117 29.548 29.548 29.578 -0.030 25148 6714 1 10 . 1 1 117 117 ARG H H 117 8.240 8.240 8.099 0.141 25148 6715 1 10 . 1 1 118 118 VAL N N 118 120.278 120.278 117.544 2.734 25148 6716 1 10 . 1 1 118 118 VAL HA H 118 3.709 3.709 3.613 0.096 25148 6717 1 10 . 1 1 118 118 VAL C C 118 177.597 177.597 177.881 -0.284 25148 6718 1 10 . 1 1 118 118 VAL CA C 118 66.246 66.246 66.247 -0.001 25148 6719 1 10 . 1 1 118 118 VAL CB C 118 31.785 31.785 30.924 0.861 25148 6720 1 10 . 1 1 118 118 VAL H H 118 8.480 8.480 7.649 0.831 25148 6721 1 10 . 1 1 119 119 ARG N N 119 120.197 120.197 119.295 0.902 25148 6722 1 10 . 1 1 119 119 ARG HA H 119 4.173 4.173 4.074 0.099 25148 6723 1 10 . 1 1 119 119 ARG C C 119 178.864 178.864 178.654 0.210 25148 6724 1 10 . 1 1 119 119 ARG CA C 119 58.772 58.772 59.448 -0.676 25148 6725 1 10 . 1 1 119 119 ARG CB C 119 29.873 29.873 29.987 -0.114 25148 6726 1 10 . 1 1 119 119 ARG H H 119 7.899 7.899 7.831 0.068 25148 6727 1 10 . 1 1 120 120 GLU N N 120 118.768 118.768 120.221 -1.453 25148 6728 1 10 . 1 1 120 120 GLU HA H 120 4.110 4.110 4.001 0.109 25148 6729 1 10 . 1 1 120 120 GLU C C 120 177.823 177.823 178.849 -1.026 25148 6730 1 10 . 1 1 120 120 GLU CA C 120 58.223 58.223 59.281 -1.058 25148 6731 1 10 . 1 1 120 120 GLU CB C 120 29.854 29.854 29.583 0.271 25148 6732 1 10 . 1 1 120 120 GLU H H 120 8.084 8.084 7.588 0.496 25148 6733 1 10 . 1 1 121 121 ALA N N 121 121.984 121.984 121.049 0.935 25148 6734 1 10 . 1 1 121 121 ALA HA H 121 4.296 4.296 4.004 0.292 25148 6735 1 10 . 1 1 121 121 ALA C C 121 178.586 178.586 179.039 -0.453 25148 6736 1 10 . 1 1 121 121 ALA CA C 121 53.475 53.475 55.125 -1.650 25148 6737 1 10 . 1 1 121 121 ALA CB C 121 18.856 18.856 18.540 0.316 25148 6738 1 10 . 1 1 121 121 ALA H H 121 7.810 7.810 8.405 -0.595 25148 6739 1 10 . 1 1 122 122 GLU N N 122 118.229 118.229 115.918 2.311 25148 6740 1 10 . 1 1 122 122 GLU HA H 122 4.241 4.241 4.133 0.108 25148 6741 1 10 . 1 1 122 122 GLU C C 122 176.839 176.839 178.666 -1.827 25148 6742 1 10 . 1 1 122 122 GLU CA C 122 57.118 57.118 57.766 -0.647 25148 6743 1 10 . 1 1 122 122 GLU CB C 122 30.018 30.018 29.647 0.371 25148 6744 1 10 . 1 1 122 122 GLU H H 122 7.938 7.938 7.662 0.276 25148 6745 1 10 . 1 1 123 123 ARG N N 123 120.601 120.601 119.320 1.281 25148 6746 1 10 . 1 1 123 123 ARG HA H 123 4.348 4.348 4.169 0.179 25148 6747 1 10 . 1 1 123 123 ARG C C 123 176.071 176.071 176.538 -0.467 25148 6748 1 10 . 1 1 123 123 ARG CA C 123 56.510 56.510 57.255 -0.746 25148 6749 1 10 . 1 1 123 123 ARG CB C 123 30.765 30.765 31.253 -0.488 25148 6750 1 10 . 1 1 123 123 ARG H H 123 7.977 7.977 7.867 0.110 25148 6751 1 11 . 1 1 4 4 GLU HA H 4 4.138 4.138 4.038 0.100 25148 6752 1 11 . 1 1 4 4 GLU C C 4 179.152 179.152 178.419 0.733 25148 6753 1 11 . 1 1 4 4 GLU CA C 4 59.566 59.566 59.316 0.251 25148 6754 1 11 . 1 1 4 4 GLU CB C 4 29.407 29.407 29.886 -0.479 25148 6755 1 11 . 1 1 5 5 LEU N N 5 121.360 121.360 118.490 2.870 25148 6756 1 11 . 1 1 5 5 LEU HA H 5 4.195 4.195 4.051 0.144 25148 6757 1 11 . 1 1 5 5 LEU C C 5 178.179 178.179 178.644 -0.465 25148 6758 1 11 . 1 1 5 5 LEU CA C 5 57.830 57.830 58.136 -0.306 25148 6759 1 11 . 1 1 5 5 LEU CB C 5 41.630 41.630 41.007 0.623 25148 6760 1 11 . 1 1 5 5 LEU H H 5 7.877 7.877 8.068 -0.191 25148 6761 1 11 . 1 1 6 6 LEU N N 6 118.058 118.058 118.263 -0.205 25148 6762 1 11 . 1 1 6 6 LEU HA H 6 3.919 3.919 3.958 -0.039 25148 6763 1 11 . 1 1 6 6 LEU C C 6 180.274 180.274 179.201 1.073 25148 6764 1 11 . 1 1 6 6 LEU CA C 6 58.221 58.221 57.710 0.511 25148 6765 1 11 . 1 1 6 6 LEU CB C 6 40.684 40.684 41.111 -0.427 25148 6766 1 11 . 1 1 6 6 LEU H H 6 7.685 7.685 7.810 -0.125 25148 6767 1 11 . 1 1 7 7 ASP N N 7 120.662 120.662 118.531 2.131 25148 6768 1 11 . 1 1 7 7 ASP HA H 7 4.416 4.416 4.407 0.009 25148 6769 1 11 . 1 1 7 7 ASP C C 7 178.738 178.738 177.784 0.954 25148 6770 1 11 . 1 1 7 7 ASP CA C 7 57.519 57.519 57.074 0.445 25148 6771 1 11 . 1 1 7 7 ASP CB C 7 40.167 40.167 40.993 -0.826 25148 6772 1 11 . 1 1 7 7 ASP H H 7 8.427 8.427 7.712 0.715 25148 6773 1 11 . 1 1 8 8 ALA N N 8 122.612 122.612 122.362 0.250 25148 6774 1 11 . 1 1 8 8 ALA HA H 8 4.146 4.146 4.058 0.088 25148 6775 1 11 . 1 1 8 8 ALA C C 8 180.787 180.787 179.821 0.966 25148 6776 1 11 . 1 1 8 8 ALA CA C 8 55.165 55.165 55.111 0.054 25148 6777 1 11 . 1 1 8 8 ALA CB C 8 17.711 17.711 18.364 -0.653 25148 6778 1 11 . 1 1 8 8 ALA H H 8 7.847 7.847 7.716 0.131 25148 6779 1 11 . 1 1 9 9 LEU N N 9 116.977 116.977 116.972 0.005 25148 6780 1 11 . 1 1 9 9 LEU HA H 9 4.115 4.115 3.981 0.134 25148 6781 1 11 . 1 1 9 9 LEU C C 9 179.510 179.510 179.163 0.347 25148 6782 1 11 . 1 1 9 9 LEU CA C 9 57.468 57.468 57.622 -0.154 25148 6783 1 11 . 1 1 9 9 LEU CB C 9 41.203 41.203 41.794 -0.591 25148 6784 1 11 . 1 1 9 9 LEU H H 9 8.256 8.256 7.576 0.680 25148 6785 1 11 . 1 1 10 10 THR N N 10 118.764 118.764 116.306 2.458 25148 6786 1 11 . 1 1 10 10 THR HA H 10 4.487 4.487 3.917 0.570 25148 6787 1 11 . 1 1 10 10 THR C C 10 176.567 176.567 176.562 0.005 25148 6788 1 11 . 1 1 10 10 THR CA C 10 68.768 68.768 67.275 1.493 25148 6789 1 11 . 1 1 10 10 THR CB C 10 66.961 66.961 68.671 -1.710 25148 6790 1 11 . 1 1 10 10 THR H H 10 8.218 8.218 7.313 0.905 25148 6791 1 11 . 1 1 11 11 ILE N N 11 122.555 122.555 120.163 2.392 25148 6792 1 11 . 1 1 11 11 ILE HA H 11 3.779 3.779 3.717 0.062 25148 6793 1 11 . 1 1 11 11 ILE C C 11 177.793 177.793 178.055 -0.262 25148 6794 1 11 . 1 1 11 11 ILE CA C 11 64.695 64.695 65.027 -0.332 25148 6795 1 11 . 1 1 11 11 ILE CB C 11 37.856 37.856 37.726 0.130 25148 6796 1 11 . 1 1 11 11 ILE H H 11 7.632 7.632 8.064 -0.432 25148 6797 1 11 . 1 1 12 12 LEU N N 12 120.469 120.469 117.719 2.750 25148 6798 1 11 . 1 1 12 12 LEU HA H 12 4.065 4.065 4.109 -0.044 25148 6799 1 11 . 1 1 12 12 LEU C C 12 179.139 179.139 178.949 0.190 25148 6800 1 11 . 1 1 12 12 LEU CA C 12 57.944 57.944 56.790 1.154 25148 6801 1 11 . 1 1 12 12 LEU CB C 12 42.170 42.170 41.078 1.093 25148 6802 1 11 . 1 1 12 12 LEU H H 12 7.951 7.951 7.429 0.522 25148 6803 1 11 . 1 1 13 13 GLU N N 13 119.669 119.669 119.464 0.205 25148 6804 1 11 . 1 1 13 13 GLU HA H 13 4.183 4.183 4.070 0.113 25148 6805 1 11 . 1 1 13 13 GLU C C 13 179.007 179.007 177.428 1.579 25148 6806 1 11 . 1 1 13 13 GLU CA C 13 59.703 59.703 58.456 1.247 25148 6807 1 11 . 1 1 13 13 GLU CB C 13 30.110 30.110 28.979 1.131 25148 6808 1 11 . 1 1 13 13 GLU H H 13 8.003 8.003 7.926 0.077 25148 6809 1 11 . 1 1 14 14 LYS N N 14 118.935 118.935 118.188 0.747 25148 6810 1 11 . 1 1 14 14 LYS HA H 14 4.124 4.124 4.071 0.053 25148 6811 1 11 . 1 1 14 14 LYS CA C 14 58.847 58.847 57.748 1.099 25148 6812 1 11 . 1 1 14 14 LYS CB C 14 33.053 33.053 32.173 0.880 25148 6813 1 11 . 1 1 14 14 LYS H H 14 7.862 7.862 7.488 0.374 25148 6814 1 11 . 1 1 15 15 GLU HA H 15 3.693 3.693 4.331 -0.638 25148 6815 1 11 . 1 1 15 15 GLU CA C 15 56.688 56.688 55.728 0.960 25148 6816 1 11 . 1 1 15 15 GLU CB C 15 32.204 32.204 30.400 1.804 25148 6817 1 11 . 1 1 16 16 LYS HA H 16 4.678 4.678 4.416 0.262 25148 6818 1 11 . 1 1 16 16 LYS CA C 16 55.135 55.135 55.610 -0.475 25148 6819 1 11 . 1 1 16 16 LYS CB C 16 34.049 34.049 33.111 0.938 25148 6820 1 11 . 1 1 17 17 GLY CA C 17 46.541 46.541 45.446 1.095 25148 6821 1 11 . 1 1 18 18 ILE N N 18 115.364 115.364 121.168 -5.804 25148 6822 1 11 . 1 1 18 18 ILE HA H 18 4.079 4.079 4.272 -0.193 25148 6823 1 11 . 1 1 18 18 ILE C C 18 174.751 174.751 175.191 -0.440 25148 6824 1 11 . 1 1 18 18 ILE CA C 18 60.333 60.333 59.696 0.637 25148 6825 1 11 . 1 1 18 18 ILE CB C 18 39.044 39.044 37.321 1.723 25148 6826 1 11 . 1 1 18 18 ILE H H 18 8.203 8.203 7.888 0.315 25148 6827 1 11 . 1 1 19 19 SER N N 19 119.891 119.891 119.048 0.843 25148 6828 1 11 . 1 1 19 19 SER HA H 19 4.362 4.362 4.420 -0.058 25148 6829 1 11 . 1 1 19 19 SER CA C 19 58.476 58.476 58.722 -0.246 25148 6830 1 11 . 1 1 19 19 SER CB C 19 63.533 63.533 63.666 -0.133 25148 6831 1 11 . 1 1 19 19 SER H H 19 8.253 8.253 8.522 -0.269 25148 6832 1 11 . 1 1 20 20 LYS N N 20 124.782 124.782 125.893 -1.111 25148 6833 1 11 . 1 1 20 20 LYS HA H 20 4.137 4.137 4.014 0.123 25148 6834 1 11 . 1 1 20 20 LYS C C 20 177.889 177.889 178.048 -0.159 25148 6835 1 11 . 1 1 20 20 LYS CA C 20 59.485 59.485 59.266 0.220 25148 6836 1 11 . 1 1 20 20 LYS CB C 20 32.711 32.711 32.410 0.301 25148 6837 1 11 . 1 1 20 20 LYS H H 20 8.918 8.918 8.793 0.125 25148 6838 1 11 . 1 1 21 21 GLU N N 21 117.831 117.831 120.009 -2.178 25148 6839 1 11 . 1 1 21 21 GLU HA H 21 3.957 3.957 4.089 -0.132 25148 6840 1 11 . 1 1 21 21 GLU C C 21 178.822 178.822 178.660 0.162 25148 6841 1 11 . 1 1 21 21 GLU CA C 21 59.529 59.529 58.977 0.552 25148 6842 1 11 . 1 1 21 21 GLU CB C 21 29.237 29.237 29.113 0.124 25148 6843 1 11 . 1 1 21 21 GLU H H 21 8.361 8.361 8.451 -0.090 25148 6844 1 11 . 1 1 22 22 ILE N N 22 118.690 118.690 117.585 1.105 25148 6845 1 11 . 1 1 22 22 ILE HA H 22 3.884 3.884 3.931 -0.047 25148 6846 1 11 . 1 1 22 22 ILE C C 22 179.247 179.247 177.466 1.781 25148 6847 1 11 . 1 1 22 22 ILE CA C 22 63.735 63.735 64.060 -0.325 25148 6848 1 11 . 1 1 22 22 ILE CB C 22 37.415 37.415 38.071 -0.656 25148 6849 1 11 . 1 1 22 22 ILE H H 22 7.353 7.353 7.442 -0.089 25148 6850 1 11 . 1 1 23 23 ILE N N 23 120.880 120.880 120.947 -0.067 25148 6851 1 11 . 1 1 23 23 ILE HA H 23 3.733 3.733 3.744 -0.011 25148 6852 1 11 . 1 1 23 23 ILE C C 23 177.817 177.817 177.813 0.004 25148 6853 1 11 . 1 1 23 23 ILE CA C 23 64.172 64.172 63.340 0.832 25148 6854 1 11 . 1 1 23 23 ILE CB C 23 36.473 36.473 36.890 -0.417 25148 6855 1 11 . 1 1 23 23 ILE H H 23 7.571 7.571 7.522 0.049 25148 6856 1 11 . 1 1 24 24 ILE N N 24 121.460 121.460 119.752 1.708 25148 6857 1 11 . 1 1 24 24 ILE HA H 24 3.486 3.486 3.566 -0.080 25148 6858 1 11 . 1 1 24 24 ILE C C 24 177.759 177.759 177.926 -0.167 25148 6859 1 11 . 1 1 24 24 ILE CA C 24 66.641 66.641 66.275 0.366 25148 6860 1 11 . 1 1 24 24 ILE CB C 24 37.307 37.307 37.425 -0.118 25148 6861 1 11 . 1 1 24 24 ILE H H 24 8.709 8.709 8.160 0.549 25148 6862 1 11 . 1 1 25 25 GLU N N 25 119.323 119.323 118.105 1.218 25148 6863 1 11 . 1 1 25 25 GLU HA H 25 4.177 4.177 4.058 0.119 25148 6864 1 11 . 1 1 25 25 GLU C C 25 179.348 179.348 178.678 0.670 25148 6865 1 11 . 1 1 25 25 GLU CA C 25 59.951 59.951 59.105 0.847 25148 6866 1 11 . 1 1 25 25 GLU CB C 25 29.340 29.340 29.244 0.096 25148 6867 1 11 . 1 1 25 25 GLU H H 25 8.048 8.048 7.954 0.094 25148 6868 1 11 . 1 1 26 26 ALA N N 26 122.390 122.390 122.917 -0.527 25148 6869 1 11 . 1 1 26 26 ALA HA H 26 4.325 4.325 4.147 0.178 25148 6870 1 11 . 1 1 26 26 ALA C C 26 181.440 181.440 179.654 1.786 25148 6871 1 11 . 1 1 26 26 ALA CA C 26 54.935 54.935 54.799 0.136 25148 6872 1 11 . 1 1 26 26 ALA CB C 26 17.834 17.834 18.351 -0.517 25148 6873 1 11 . 1 1 26 26 ALA H H 26 7.768 7.768 7.765 0.003 25148 6874 1 11 . 1 1 27 27 ILE N N 27 122.342 122.342 119.926 2.416 25148 6875 1 11 . 1 1 27 27 ILE HA H 27 3.575 3.575 3.620 -0.045 25148 6876 1 11 . 1 1 27 27 ILE C C 27 177.541 177.541 177.805 -0.264 25148 6877 1 11 . 1 1 27 27 ILE CA C 27 66.536 66.536 65.884 0.652 25148 6878 1 11 . 1 1 27 27 ILE CB C 27 37.886 37.886 37.973 -0.087 25148 6879 1 11 . 1 1 27 27 ILE H H 27 8.805 8.805 7.915 0.890 25148 6880 1 11 . 1 1 28 28 GLU N N 28 120.188 120.188 119.328 0.860 25148 6881 1 11 . 1 1 28 28 GLU HA H 28 3.687 3.687 3.967 -0.280 25148 6882 1 11 . 1 1 28 28 GLU C C 28 178.707 178.707 178.853 -0.146 25148 6883 1 11 . 1 1 28 28 GLU CA C 28 61.458 61.458 59.534 1.924 25148 6884 1 11 . 1 1 28 28 GLU CB C 28 29.624 29.624 28.890 0.734 25148 6885 1 11 . 1 1 28 28 GLU H H 28 8.882 8.882 7.732 1.150 25148 6886 1 11 . 1 1 29 29 ALA N N 29 119.293 119.293 121.672 -2.379 25148 6887 1 11 . 1 1 29 29 ALA HA H 29 4.214 4.214 4.098 0.116 25148 6888 1 11 . 1 1 29 29 ALA C C 29 181.200 181.200 179.717 1.483 25148 6889 1 11 . 1 1 29 29 ALA CA C 29 55.435 55.435 54.733 0.703 25148 6890 1 11 . 1 1 29 29 ALA CB C 29 18.090 18.090 17.975 0.115 25148 6891 1 11 . 1 1 29 29 ALA H H 29 8.065 8.065 7.880 0.185 25148 6892 1 11 . 1 1 30 30 ALA N N 30 121.729 121.729 121.654 0.075 25148 6893 1 11 . 1 1 30 30 ALA HA H 30 4.307 4.307 4.162 0.145 25148 6894 1 11 . 1 1 30 30 ALA C C 30 181.315 181.315 179.577 1.738 25148 6895 1 11 . 1 1 30 30 ALA CA C 30 54.594 54.594 54.633 -0.039 25148 6896 1 11 . 1 1 30 30 ALA CB C 30 18.704 18.704 18.409 0.295 25148 6897 1 11 . 1 1 30 30 ALA H H 30 8.099 8.099 7.691 0.408 25148 6898 1 11 . 1 1 31 31 LEU N N 31 120.900 120.900 120.967 -0.067 25148 6899 1 11 . 1 1 31 31 LEU HA H 31 4.347 4.347 4.047 0.300 25148 6900 1 11 . 1 1 31 31 LEU C C 31 179.137 179.137 179.018 0.119 25148 6901 1 11 . 1 1 31 31 LEU CA C 31 57.569 57.569 59.211 -1.642 25148 6902 1 11 . 1 1 31 31 LEU CB C 31 42.353 42.353 42.015 0.338 25148 6903 1 11 . 1 1 31 31 LEU H H 31 8.863 8.863 7.781 1.082 25148 6904 1 11 . 1 1 32 32 ILE N N 32 122.410 122.410 118.629 3.781 25148 6905 1 11 . 1 1 32 32 ILE HA H 32 3.699 3.699 3.664 0.035 25148 6906 1 11 . 1 1 32 32 ILE C C 32 178.303 178.303 177.711 0.592 25148 6907 1 11 . 1 1 32 32 ILE CA C 32 66.066 66.066 65.341 0.725 25148 6908 1 11 . 1 1 32 32 ILE CB C 32 37.882 37.882 37.970 -0.088 25148 6909 1 11 . 1 1 32 32 ILE H H 32 8.234 8.234 8.305 -0.071 25148 6910 1 11 . 1 1 33 33 SER N N 33 114.201 114.201 115.587 -1.386 25148 6911 1 11 . 1 1 33 33 SER HA H 33 4.311 4.311 4.206 0.105 25148 6912 1 11 . 1 1 33 33 SER C C 33 177.012 177.012 176.815 0.197 25148 6913 1 11 . 1 1 33 33 SER CA C 33 61.860 61.860 61.911 -0.051 25148 6914 1 11 . 1 1 33 33 SER CB C 33 62.508 62.508 63.128 -0.620 25148 6915 1 11 . 1 1 33 33 SER H H 33 7.558 7.558 7.667 -0.109 25148 6916 1 11 . 1 1 34 34 ALA N N 34 122.893 122.893 124.967 -2.074 25148 6917 1 11 . 1 1 34 34 ALA HA H 34 4.215 4.215 4.141 0.074 25148 6918 1 11 . 1 1 34 34 ALA C C 34 180.814 180.814 179.221 1.593 25148 6919 1 11 . 1 1 34 34 ALA CA C 34 55.283 55.283 54.878 0.405 25148 6920 1 11 . 1 1 34 34 ALA CB C 34 18.273 18.273 18.340 -0.067 25148 6921 1 11 . 1 1 34 34 ALA H H 34 8.409 8.409 7.841 0.568 25148 6922 1 11 . 1 1 35 35 TYR N N 35 120.259 120.259 119.297 0.962 25148 6923 1 11 . 1 1 35 35 TYR HA H 35 4.393 4.393 4.378 0.015 25148 6924 1 11 . 1 1 35 35 TYR C C 35 177.892 177.892 177.947 -0.055 25148 6925 1 11 . 1 1 35 35 TYR CA C 35 63.071 63.071 60.468 2.603 25148 6926 1 11 . 1 1 35 35 TYR CB C 35 38.021 38.021 38.928 -0.907 25148 6927 1 11 . 1 1 35 35 TYR H H 35 8.975 8.975 8.317 0.658 25148 6928 1 11 . 1 1 36 36 LYS N N 36 120.942 120.942 120.808 0.134 25148 6929 1 11 . 1 1 36 36 LYS HA H 36 4.032 4.032 4.057 -0.025 25148 6930 1 11 . 1 1 36 36 LYS C C 36 177.797 177.797 178.443 -0.646 25148 6931 1 11 . 1 1 36 36 LYS CA C 36 59.900 59.900 59.136 0.764 25148 6932 1 11 . 1 1 36 36 LYS CB C 36 32.429 32.429 32.160 0.269 25148 6933 1 11 . 1 1 36 36 LYS H H 36 8.654 8.654 8.197 0.457 25148 6934 1 11 . 1 1 37 37 ARG N N 37 115.139 115.139 115.663 -0.524 25148 6935 1 11 . 1 1 37 37 ARG HA H 37 4.101 4.101 4.073 0.028 25148 6936 1 11 . 1 1 37 37 ARG C C 37 177.517 177.517 177.852 -0.335 25148 6937 1 11 . 1 1 37 37 ARG CA C 37 58.276 58.276 58.217 0.059 25148 6938 1 11 . 1 1 37 37 ARG CB C 37 31.014 31.014 29.629 1.385 25148 6939 1 11 . 1 1 37 37 ARG H H 37 8.138 8.138 7.607 0.531 25148 6940 1 11 . 1 1 38 38 ASN N N 38 112.555 112.555 117.174 -4.619 25148 6941 1 11 . 1 1 38 38 ASN HA H 38 4.540 4.540 4.212 0.328 25148 6942 1 11 . 1 1 38 38 ASN C C 38 173.994 173.994 175.196 -1.202 25148 6943 1 11 . 1 1 38 38 ASN CA C 38 54.722 54.722 55.336 -0.614 25148 6944 1 11 . 1 1 38 38 ASN CB C 38 42.077 42.077 38.919 3.158 25148 6945 1 11 . 1 1 38 38 ASN H H 38 7.426 7.426 7.629 -0.203 25148 6946 1 11 . 1 1 39 39 PHE N N 39 116.711 116.711 115.911 0.800 25148 6947 1 11 . 1 1 39 39 PHE HA H 39 4.569 4.569 4.713 -0.144 25148 6948 1 11 . 1 1 39 39 PHE CA C 39 58.913 58.913 56.245 2.668 25148 6949 1 11 . 1 1 39 39 PHE CB C 39 39.781 39.781 38.502 1.278 25148 6950 1 11 . 1 1 39 39 PHE H H 39 7.959 7.959 7.265 0.694 25148 6951 1 11 . 1 1 40 40 ASN HA H 40 4.018 4.018 4.550 -0.532 25148 6952 1 11 . 1 1 40 40 ASN CA C 40 58.944 58.944 55.231 3.713 25148 6953 1 11 . 1 1 41 41 GLN HA H 41 4.298 4.298 4.512 -0.214 25148 6954 1 11 . 1 1 41 41 GLN C C 41 175.237 175.237 175.621 -0.384 25148 6955 1 11 . 1 1 41 41 GLN CA C 41 57.360 57.360 56.529 0.831 25148 6956 1 11 . 1 1 41 41 GLN CB C 41 28.724 28.724 28.022 0.702 25148 6957 1 11 . 1 1 42 42 ALA N N 42 120.514 120.514 121.123 -0.609 25148 6958 1 11 . 1 1 42 42 ALA HA H 42 4.622 4.622 4.520 0.102 25148 6959 1 11 . 1 1 42 42 ALA C C 42 175.922 175.922 176.175 -0.253 25148 6960 1 11 . 1 1 42 42 ALA CA C 42 51.841 51.841 52.123 -0.282 25148 6961 1 11 . 1 1 42 42 ALA CB C 42 21.576 21.576 20.879 0.697 25148 6962 1 11 . 1 1 42 42 ALA H H 42 7.817 7.817 8.015 -0.198 25148 6963 1 11 . 1 1 43 43 GLN N N 43 117.594 117.594 116.575 1.019 25148 6964 1 11 . 1 1 43 43 GLN HA H 43 4.265 4.265 4.528 -0.263 25148 6965 1 11 . 1 1 43 43 GLN C C 43 174.942 174.942 173.964 0.978 25148 6966 1 11 . 1 1 43 43 GLN CA C 43 57.047 57.047 55.629 1.418 25148 6967 1 11 . 1 1 43 43 GLN CB C 43 30.863 30.863 31.604 -0.741 25148 6968 1 11 . 1 1 43 43 GLN H H 43 7.400 7.400 7.596 -0.196 25148 6969 1 11 . 1 1 44 44 ASN N N 44 120.467 120.467 124.000 -3.533 25148 6970 1 11 . 1 1 44 44 ASN HA H 44 5.005 5.005 4.630 0.375 25148 6971 1 11 . 1 1 44 44 ASN C C 44 174.365 174.365 173.954 0.411 25148 6972 1 11 . 1 1 44 44 ASN CA C 44 52.381 52.381 53.554 -1.173 25148 6973 1 11 . 1 1 44 44 ASN CB C 44 38.177 38.177 39.388 -1.211 25148 6974 1 11 . 1 1 44 44 ASN H H 44 9.123 9.123 8.599 0.524 25148 6975 1 11 . 1 1 45 45 VAL N N 45 115.479 115.479 117.440 -1.961 25148 6976 1 11 . 1 1 45 45 VAL HA H 45 5.376 5.376 4.153 1.223 25148 6977 1 11 . 1 1 45 45 VAL C C 45 174.908 174.908 173.628 1.280 25148 6978 1 11 . 1 1 45 45 VAL CA C 45 59.022 59.022 61.823 -2.801 25148 6979 1 11 . 1 1 45 45 VAL CB C 45 35.776 35.776 34.306 1.470 25148 6980 1 11 . 1 1 45 45 VAL H H 45 7.732 7.732 8.084 -0.352 25148 6981 1 11 . 1 1 46 46 ARG N N 46 121.146 121.146 125.197 -4.051 25148 6982 1 11 . 1 1 46 46 ARG HA H 46 4.566 4.566 4.781 -0.215 25148 6983 1 11 . 1 1 46 46 ARG C C 46 173.790 173.790 174.766 -0.976 25148 6984 1 11 . 1 1 46 46 ARG CA C 46 54.762 54.762 54.774 -0.012 25148 6985 1 11 . 1 1 46 46 ARG CB C 46 33.946 33.946 32.485 1.461 25148 6986 1 11 . 1 1 46 46 ARG H H 46 8.850 8.850 9.007 -0.157 25148 6987 1 11 . 1 1 47 47 VAL N N 47 122.339 122.339 125.602 -3.263 25148 6988 1 11 . 1 1 47 47 VAL HA H 47 4.741 4.741 4.209 0.532 25148 6989 1 11 . 1 1 47 47 VAL C C 47 173.541 173.541 175.661 -2.120 25148 6990 1 11 . 1 1 47 47 VAL CA C 47 60.893 60.893 62.056 -1.163 25148 6991 1 11 . 1 1 47 47 VAL CB C 47 33.563 33.563 32.303 1.260 25148 6992 1 11 . 1 1 47 47 VAL H H 47 8.444 8.444 8.556 -0.112 25148 6993 1 11 . 1 1 48 48 ASP N N 48 127.701 127.701 125.866 1.835 25148 6994 1 11 . 1 1 48 48 ASP HA H 48 4.946 4.946 4.919 0.027 25148 6995 1 11 . 1 1 48 48 ASP C C 48 173.744 173.744 174.300 -0.556 25148 6996 1 11 . 1 1 48 48 ASP CA C 48 52.651 52.651 52.815 -0.164 25148 6997 1 11 . 1 1 48 48 ASP CB C 48 45.225 45.225 44.123 1.102 25148 6998 1 11 . 1 1 48 48 ASP H H 48 9.068 9.068 8.791 0.277 25148 6999 1 11 . 1 1 49 49 LEU N N 49 130.945 130.945 126.362 4.583 25148 7000 1 11 . 1 1 49 49 LEU HA H 49 4.774 4.774 4.767 0.007 25148 7001 1 11 . 1 1 49 49 LEU C C 49 174.531 174.531 175.344 -0.813 25148 7002 1 11 . 1 1 49 49 LEU CA C 49 54.337 54.337 54.007 0.330 25148 7003 1 11 . 1 1 49 49 LEU CB C 49 43.192 43.192 44.788 -1.596 25148 7004 1 11 . 1 1 49 49 LEU H H 49 9.369 9.369 8.137 1.232 25148 7005 1 11 . 1 1 50 50 ASN N N 50 126.268 126.268 122.807 3.461 25148 7006 1 11 . 1 1 50 50 ASN HA H 50 4.629 4.629 5.063 -0.434 25148 7007 1 11 . 1 1 50 50 ASN C C 50 176.602 176.602 175.117 1.485 25148 7008 1 11 . 1 1 50 50 ASN CA C 50 54.048 54.048 52.867 1.181 25148 7009 1 11 . 1 1 50 50 ASN CB C 50 39.891 39.891 39.883 0.008 25148 7010 1 11 . 1 1 50 50 ASN H H 50 8.672 8.672 8.896 -0.224 25148 7011 1 11 . 1 1 51 51 ARG N N 51 125.897 125.897 124.299 1.598 25148 7012 1 11 . 1 1 51 51 ARG HA H 51 3.789 3.789 4.235 -0.446 25148 7013 1 11 . 1 1 51 51 ARG C C 51 175.681 175.681 176.258 -0.577 25148 7014 1 11 . 1 1 51 51 ARG CA C 51 58.162 58.162 58.499 -0.337 25148 7015 1 11 . 1 1 51 51 ARG CB C 51 29.944 29.944 29.885 0.059 25148 7016 1 11 . 1 1 51 51 ARG H H 51 8.984 8.984 8.822 0.162 25148 7017 1 11 . 1 1 52 52 GLU N N 52 116.733 116.733 117.682 -0.949 25148 7018 1 11 . 1 1 52 52 GLU HA H 52 4.368 4.368 4.146 0.222 25148 7019 1 11 . 1 1 52 52 GLU C C 52 178.049 178.049 177.273 0.776 25148 7020 1 11 . 1 1 52 52 GLU CA C 52 58.048 58.048 58.150 -0.102 25148 7021 1 11 . 1 1 52 52 GLU CB C 52 30.716 30.716 29.260 1.456 25148 7022 1 11 . 1 1 52 52 GLU H H 52 8.541 8.541 8.277 0.264 25148 7023 1 11 . 1 1 53 53 THR N N 53 106.556 106.556 113.133 -6.577 25148 7024 1 11 . 1 1 53 53 THR HA H 53 4.424 4.424 4.514 -0.090 25148 7025 1 11 . 1 1 53 53 THR C C 53 176.352 176.352 174.870 1.482 25148 7026 1 11 . 1 1 53 53 THR CA C 53 61.320 61.320 60.801 0.519 25148 7027 1 11 . 1 1 53 53 THR CB C 53 71.220 71.220 69.620 1.600 25148 7028 1 11 . 1 1 53 53 THR H H 53 8.085 8.085 7.582 0.503 25148 7029 1 11 . 1 1 54 54 GLY N N 54 111.843 111.843 110.336 1.507 25148 7030 1 11 . 1 1 54 54 GLY C C 54 172.690 172.690 174.612 -1.922 25148 7031 1 11 . 1 1 54 54 GLY CA C 54 45.417 45.417 46.262 -0.845 25148 7032 1 11 . 1 1 54 54 GLY H H 54 8.330 8.330 7.643 0.687 25148 7033 1 11 . 1 1 55 55 SER N N 55 113.844 113.844 113.970 -0.126 25148 7034 1 11 . 1 1 55 55 SER HA H 55 4.279 4.279 4.669 -0.390 25148 7035 1 11 . 1 1 55 55 SER C C 55 174.127 174.127 173.160 0.967 25148 7036 1 11 . 1 1 55 55 SER CA C 55 59.229 59.229 58.295 0.934 25148 7037 1 11 . 1 1 55 55 SER CB C 55 63.939 63.939 65.846 -1.907 25148 7038 1 11 . 1 1 55 55 SER H H 55 7.653 7.653 7.586 0.067 25148 7039 1 11 . 1 1 56 56 ILE N N 56 125.286 125.286 120.420 4.866 25148 7040 1 11 . 1 1 56 56 ILE HA H 56 5.082 5.082 4.823 0.259 25148 7041 1 11 . 1 1 56 56 ILE C C 56 175.346 175.346 174.163 1.183 25148 7042 1 11 . 1 1 56 56 ILE CA C 56 59.967 59.967 60.457 -0.490 25148 7043 1 11 . 1 1 56 56 ILE CB C 56 40.165 40.165 42.306 -2.140 25148 7044 1 11 . 1 1 56 56 ILE H H 56 8.478 8.478 8.441 0.037 25148 7045 1 11 . 1 1 57 57 ARG N N 57 126.332 126.332 126.989 -0.657 25148 7046 1 11 . 1 1 57 57 ARG HA H 57 4.740 4.740 4.592 0.148 25148 7047 1 11 . 1 1 57 57 ARG C C 57 173.921 173.921 173.629 0.292 25148 7048 1 11 . 1 1 57 57 ARG CA C 57 54.311 54.311 53.158 1.153 25148 7049 1 11 . 1 1 57 57 ARG CB C 57 35.805 35.805 33.534 2.271 25148 7050 1 11 . 1 1 57 57 ARG H H 57 8.590 8.590 8.931 -0.341 25148 7051 1 11 . 1 1 58 58 VAL N N 58 120.987 120.987 123.347 -2.360 25148 7052 1 11 . 1 1 58 58 VAL HA H 58 4.334 4.334 3.991 0.343 25148 7053 1 11 . 1 1 58 58 VAL C C 58 174.204 174.204 174.226 -0.022 25148 7054 1 11 . 1 1 58 58 VAL CA C 58 60.861 60.861 60.863 -0.002 25148 7055 1 11 . 1 1 58 58 VAL CB C 58 33.383 33.383 31.478 1.905 25148 7056 1 11 . 1 1 58 58 VAL H H 58 8.585 8.585 8.272 0.313 25148 7057 1 11 . 1 1 59 59 PHE N N 59 124.913 124.913 126.045 -1.132 25148 7058 1 11 . 1 1 59 59 PHE HA H 59 5.046 5.046 5.295 -0.249 25148 7059 1 11 . 1 1 59 59 PHE C C 59 174.446 174.446 174.262 0.184 25148 7060 1 11 . 1 1 59 59 PHE CA C 59 56.695 56.695 55.639 1.056 25148 7061 1 11 . 1 1 59 59 PHE CB C 59 42.779 42.779 43.398 -0.619 25148 7062 1 11 . 1 1 59 59 PHE H H 59 8.920 8.920 8.541 0.379 25148 7063 1 11 . 1 1 60 60 ALA N N 60 124.035 124.035 123.997 0.038 25148 7064 1 11 . 1 1 60 60 ALA HA H 60 5.102 5.102 4.821 0.281 25148 7065 1 11 . 1 1 60 60 ALA C C 60 176.017 176.017 176.310 -0.293 25148 7066 1 11 . 1 1 60 60 ALA CA C 60 50.083 50.083 50.665 -0.582 25148 7067 1 11 . 1 1 60 60 ALA CB C 60 22.400 22.400 20.683 1.717 25148 7068 1 11 . 1 1 60 60 ALA H H 60 9.457 9.457 8.855 0.602 25148 7069 1 11 . 1 1 61 61 ARG N N 61 121.530 121.530 123.782 -2.252 25148 7070 1 11 . 1 1 61 61 ARG HA H 61 4.958 4.958 5.097 -0.139 25148 7071 1 11 . 1 1 61 61 ARG C C 61 176.737 176.737 175.931 0.806 25148 7072 1 11 . 1 1 61 61 ARG CA C 61 55.375 55.375 55.889 -0.513 25148 7073 1 11 . 1 1 61 61 ARG CB C 61 31.230 31.230 31.780 -0.550 25148 7074 1 11 . 1 1 61 61 ARG H H 61 8.447 8.447 8.670 -0.223 25148 7075 1 11 . 1 1 62 62 LYS N N 62 124.784 124.784 124.264 0.520 25148 7076 1 11 . 1 1 62 62 LYS HA H 62 4.709 4.709 4.504 0.205 25148 7077 1 11 . 1 1 62 62 LYS C C 62 173.899 173.899 174.628 -0.729 25148 7078 1 11 . 1 1 62 62 LYS CA C 62 54.812 54.812 55.153 -0.341 25148 7079 1 11 . 1 1 62 62 LYS CB C 62 37.147 37.147 36.288 0.860 25148 7080 1 11 . 1 1 62 62 LYS H H 62 9.137 9.137 8.152 0.985 25148 7081 1 11 . 1 1 63 63 ASP N N 63 122.552 122.552 125.539 -2.987 25148 7082 1 11 . 1 1 63 63 ASP HA H 63 4.877 4.877 4.570 0.307 25148 7083 1 11 . 1 1 63 63 ASP C C 63 175.560 175.560 176.155 -0.595 25148 7084 1 11 . 1 1 63 63 ASP CA C 63 54.576 54.576 55.061 -0.485 25148 7085 1 11 . 1 1 63 63 ASP CB C 63 42.841 42.841 41.691 1.149 25148 7086 1 11 . 1 1 63 63 ASP H H 63 8.334 8.334 8.776 -0.442 25148 7087 1 11 . 1 1 64 64 VAL N N 64 123.109 123.109 127.204 -4.095 25148 7088 1 11 . 1 1 64 64 VAL HA H 64 4.557 4.557 4.440 0.117 25148 7089 1 11 . 1 1 64 64 VAL C C 64 177.260 177.260 175.681 1.579 25148 7090 1 11 . 1 1 64 64 VAL CA C 64 62.268 62.268 63.355 -1.087 25148 7091 1 11 . 1 1 64 64 VAL CB C 64 30.348 30.348 30.679 -0.331 25148 7092 1 11 . 1 1 64 64 VAL H H 64 8.693 8.693 8.157 0.536 25148 7093 1 11 . 1 1 65 65 VAL N N 65 122.320 122.320 123.145 -0.825 25148 7094 1 11 . 1 1 65 65 VAL HA H 65 4.939 4.939 4.641 0.298 25148 7095 1 11 . 1 1 65 65 VAL C C 65 174.754 174.754 175.479 -0.725 25148 7096 1 11 . 1 1 65 65 VAL CA C 65 59.173 59.173 59.576 -0.403 25148 7097 1 11 . 1 1 65 65 VAL CB C 65 36.289 36.289 36.136 0.153 25148 7098 1 11 . 1 1 65 65 VAL H H 65 8.656 8.656 8.658 -0.002 25148 7099 1 11 . 1 1 66 66 ASP N N 66 119.805 119.805 121.072 -1.267 25148 7100 1 11 . 1 1 66 66 ASP HA H 66 4.499 4.499 4.445 0.054 25148 7101 1 11 . 1 1 66 66 ASP C C 66 176.565 176.565 175.870 0.695 25148 7102 1 11 . 1 1 66 66 ASP CA C 66 57.236 57.236 56.955 0.281 25148 7103 1 11 . 1 1 66 66 ASP CB C 66 41.662 41.662 41.011 0.651 25148 7104 1 11 . 1 1 66 66 ASP H H 66 8.628 8.628 8.839 -0.211 25148 7105 1 11 . 1 1 67 67 GLU N N 67 117.604 117.604 116.359 1.245 25148 7106 1 11 . 1 1 67 67 GLU HA H 67 4.350 4.350 4.485 -0.135 25148 7107 1 11 . 1 1 67 67 GLU C C 67 173.736 173.736 174.809 -1.073 25148 7108 1 11 . 1 1 67 67 GLU CA C 67 55.203 55.203 54.897 0.306 25148 7109 1 11 . 1 1 67 67 GLU CB C 67 32.240 32.240 32.988 -0.748 25148 7110 1 11 . 1 1 67 67 GLU H H 67 7.525 7.525 8.060 -0.535 25148 7111 1 11 . 1 1 68 68 VAL N N 68 125.774 125.774 123.052 2.722 25148 7112 1 11 . 1 1 68 68 VAL HA H 68 3.578 3.578 3.834 -0.256 25148 7113 1 11 . 1 1 68 68 VAL C C 68 175.885 175.885 175.018 0.867 25148 7114 1 11 . 1 1 68 68 VAL CA C 68 63.397 63.397 63.967 -0.570 25148 7115 1 11 . 1 1 68 68 VAL CB C 68 32.452 32.452 31.516 0.936 25148 7116 1 11 . 1 1 68 68 VAL H H 68 8.573 8.573 8.601 -0.028 25148 7117 1 11 . 1 1 69 69 TYR N N 69 129.859 129.859 127.021 2.838 25148 7118 1 11 . 1 1 69 69 TYR HA H 69 4.642 4.642 4.607 0.035 25148 7119 1 11 . 1 1 69 69 TYR C C 69 176.100 176.100 175.444 0.656 25148 7120 1 11 . 1 1 69 69 TYR CA C 69 59.092 59.092 59.023 0.069 25148 7121 1 11 . 1 1 69 69 TYR CB C 69 39.830 39.830 40.576 -0.746 25148 7122 1 11 . 1 1 69 69 TYR H H 69 9.801 9.801 8.530 1.271 25148 7123 1 11 . 1 1 70 70 ASP N N 70 120.204 120.204 120.011 0.193 25148 7124 1 11 . 1 1 70 70 ASP HA H 70 4.772 4.772 4.957 -0.185 25148 7125 1 11 . 1 1 70 70 ASP C C 70 176.622 176.622 175.917 0.705 25148 7126 1 11 . 1 1 70 70 ASP CA C 70 52.885 52.885 53.154 -0.269 25148 7127 1 11 . 1 1 70 70 ASP CB C 70 41.878 41.878 41.424 0.454 25148 7128 1 11 . 1 1 70 70 ASP H H 70 8.348 8.348 7.887 0.461 25148 7129 1 11 . 1 1 71 71 GLN N N 71 125.440 125.440 124.478 0.962 25148 7130 1 11 . 1 1 71 71 GLN HA H 71 4.315 4.315 3.948 0.367 25148 7131 1 11 . 1 1 71 71 GLN C C 71 175.819 175.819 176.833 -1.014 25148 7132 1 11 . 1 1 71 71 GLN CA C 71 57.914 57.914 58.621 -0.707 25148 7133 1 11 . 1 1 71 71 GLN CB C 71 28.307 28.307 29.024 -0.717 25148 7134 1 11 . 1 1 71 71 GLN H H 71 9.097 9.097 8.757 0.340 25148 7135 1 11 . 1 1 72 72 ARG N N 72 116.306 116.306 115.354 0.952 25148 7136 1 11 . 1 1 72 72 ARG HA H 72 4.252 4.252 4.240 0.012 25148 7137 1 11 . 1 1 72 72 ARG C C 72 178.087 178.087 176.106 1.981 25148 7138 1 11 . 1 1 72 72 ARG CA C 72 58.532 58.532 57.622 0.910 25148 7139 1 11 . 1 1 72 72 ARG CB C 72 30.143 30.143 30.696 -0.553 25148 7140 1 11 . 1 1 72 72 ARG H H 72 8.534 8.534 7.957 0.577 25148 7141 1 11 . 1 1 73 73 LEU N N 73 116.734 116.734 114.081 2.653 25148 7142 1 11 . 1 1 73 73 LEU HA H 73 4.621 4.621 4.664 -0.043 25148 7143 1 11 . 1 1 73 73 LEU C C 73 175.946 175.946 175.030 0.916 25148 7144 1 11 . 1 1 73 73 LEU CA C 73 55.250 55.250 55.299 -0.049 25148 7145 1 11 . 1 1 73 73 LEU CB C 73 46.960 46.960 44.468 2.493 25148 7146 1 11 . 1 1 73 73 LEU H H 73 7.460 7.460 7.459 0.001 25148 7147 1 11 . 1 1 74 74 GLU N N 74 118.787 118.787 121.833 -3.046 25148 7148 1 11 . 1 1 74 74 GLU HA H 74 5.403 5.403 4.624 0.779 25148 7149 1 11 . 1 1 74 74 GLU C C 74 173.709 173.709 174.545 -0.836 25148 7150 1 11 . 1 1 74 74 GLU CA C 74 54.914 54.914 55.843 -0.929 25148 7151 1 11 . 1 1 74 74 GLU CB C 74 35.053 35.053 33.623 1.430 25148 7152 1 11 . 1 1 74 74 GLU H H 74 7.752 7.752 8.085 -0.333 25148 7153 1 11 . 1 1 75 75 ILE N N 75 119.803 119.803 121.837 -2.034 25148 7154 1 11 . 1 1 75 75 ILE HA H 75 4.507 4.507 4.452 0.055 25148 7155 1 11 . 1 1 75 75 ILE C C 75 172.126 172.126 173.734 -1.608 25148 7156 1 11 . 1 1 75 75 ILE CA C 75 58.664 58.664 60.404 -1.740 25148 7157 1 11 . 1 1 75 75 ILE CB C 75 42.560 42.560 42.217 0.343 25148 7158 1 11 . 1 1 75 75 ILE H H 75 8.975 8.975 8.510 0.465 25148 7159 1 11 . 1 1 76 76 SER N N 76 123.236 123.236 124.340 -1.104 25148 7160 1 11 . 1 1 76 76 SER HA H 76 4.505 4.505 5.054 -0.549 25148 7161 1 11 . 1 1 76 76 SER C C 76 176.145 176.145 175.788 0.357 25148 7162 1 11 . 1 1 76 76 SER CA C 76 58.108 58.108 57.947 0.161 25148 7163 1 11 . 1 1 76 76 SER CB C 76 65.000 65.000 64.644 0.356 25148 7164 1 11 . 1 1 76 76 SER H H 76 8.810 8.810 8.372 0.438 25148 7165 1 11 . 1 1 77 77 ILE N N 77 120.629 120.629 125.220 -4.591 25148 7166 1 11 . 1 1 77 77 ILE HA H 77 3.935 3.935 3.718 0.217 25148 7167 1 11 . 1 1 77 77 ILE C C 77 175.806 175.806 176.958 -1.152 25148 7168 1 11 . 1 1 77 77 ILE CA C 77 61.928 61.928 63.813 -1.885 25148 7169 1 11 . 1 1 77 77 ILE CB C 77 38.031 38.031 38.128 -0.097 25148 7170 1 11 . 1 1 77 77 ILE H H 77 8.321 8.321 8.397 -0.076 25148 7171 1 11 . 1 1 78 78 GLU N N 78 121.032 121.032 117.295 3.737 25148 7172 1 11 . 1 1 78 78 GLU HA H 78 4.082 4.082 4.016 0.066 25148 7173 1 11 . 1 1 78 78 GLU C C 78 179.829 179.829 178.289 1.540 25148 7174 1 11 . 1 1 78 78 GLU CA C 78 60.180 60.180 58.950 1.230 25148 7175 1 11 . 1 1 78 78 GLU CB C 78 28.988 28.988 28.587 0.401 25148 7176 1 11 . 1 1 78 78 GLU H H 78 8.222 8.222 8.358 -0.136 25148 7177 1 11 . 1 1 79 79 GLU N N 79 120.710 120.710 121.240 -0.530 25148 7178 1 11 . 1 1 79 79 GLU HA H 79 4.012 4.012 4.085 -0.073 25148 7179 1 11 . 1 1 79 79 GLU C C 79 180.339 180.339 179.149 1.190 25148 7180 1 11 . 1 1 79 79 GLU CA C 79 59.332 59.332 58.888 0.444 25148 7181 1 11 . 1 1 79 79 GLU CB C 79 29.317 29.317 29.647 -0.330 25148 7182 1 11 . 1 1 79 79 GLU H H 79 7.908 7.908 8.060 -0.152 25148 7183 1 11 . 1 1 80 80 ALA N N 80 122.879 122.879 122.234 0.645 25148 7184 1 11 . 1 1 80 80 ALA HA H 80 3.966 3.966 4.083 -0.117 25148 7185 1 11 . 1 1 80 80 ALA C C 80 179.833 179.833 179.921 -0.088 25148 7186 1 11 . 1 1 80 80 ALA CA C 80 55.881 55.881 55.182 0.699 25148 7187 1 11 . 1 1 80 80 ALA CB C 80 18.870 18.870 18.090 0.780 25148 7188 1 11 . 1 1 80 80 ALA H H 80 9.132 9.132 8.076 1.056 25148 7189 1 11 . 1 1 81 81 GLN N N 81 115.829 115.829 116.859 -1.030 25148 7190 1 11 . 1 1 81 81 GLN HA H 81 4.749 4.749 4.318 0.431 25148 7191 1 11 . 1 1 81 81 GLN C C 81 178.126 178.126 178.037 0.089 25148 7192 1 11 . 1 1 81 81 GLN CA C 81 57.682 57.682 57.661 0.021 25148 7193 1 11 . 1 1 81 81 GLN CB C 81 27.307 27.307 28.789 -1.482 25148 7194 1 11 . 1 1 81 81 GLN H H 81 8.709 8.709 7.885 0.824 25148 7195 1 11 . 1 1 82 82 GLY N N 82 105.531 105.531 106.843 -1.312 25148 7196 1 11 . 1 1 82 82 GLY C C 82 174.917 174.917 175.052 -0.135 25148 7197 1 11 . 1 1 82 82 GLY CA C 82 45.915 45.915 46.659 -0.744 25148 7198 1 11 . 1 1 82 82 GLY H H 82 7.479 7.479 7.966 -0.487 25148 7199 1 11 . 1 1 83 83 ILE N N 83 122.828 122.828 113.962 8.866 25148 7200 1 11 . 1 1 83 83 ILE HA H 83 3.970 3.970 4.422 -0.452 25148 7201 1 11 . 1 1 83 83 ILE C C 83 177.209 177.209 175.595 1.614 25148 7202 1 11 . 1 1 83 83 ILE CA C 83 64.305 64.305 61.706 2.599 25148 7203 1 11 . 1 1 83 83 ILE CB C 83 38.452 38.452 40.083 -1.631 25148 7204 1 11 . 1 1 83 83 ILE H H 83 7.634 7.634 7.561 0.073 25148 7205 1 11 . 1 1 84 84 HIS N N 84 118.927 118.927 120.065 -1.138 25148 7206 1 11 . 1 1 84 84 HIS HA H 84 4.713 4.713 4.944 -0.231 25148 7207 1 11 . 1 1 84 84 HIS CA C 84 55.487 55.487 54.386 1.101 25148 7208 1 11 . 1 1 84 84 HIS CB C 84 33.506 33.506 32.366 1.140 25148 7209 1 11 . 1 1 84 84 HIS H H 84 8.155 8.155 8.417 -0.262 25148 7210 1 11 . 1 1 85 85 PRO HA H 85 4.456 4.456 4.507 -0.051 25148 7211 1 11 . 1 1 85 85 PRO C C 85 177.357 177.357 177.266 0.091 25148 7212 1 11 . 1 1 85 85 PRO CA C 85 64.475 64.475 64.066 0.409 25148 7213 1 11 . 1 1 85 85 PRO CB C 85 32.489 32.489 32.085 0.404 25148 7214 1 11 . 1 1 86 86 GLU N N 86 116.314 116.314 116.886 -0.572 25148 7215 1 11 . 1 1 86 86 GLU HA H 86 4.286 4.286 4.166 0.120 25148 7216 1 11 . 1 1 86 86 GLU C C 86 177.624 177.624 177.168 0.456 25148 7217 1 11 . 1 1 86 86 GLU CA C 86 56.619 56.619 56.728 -0.109 25148 7218 1 11 . 1 1 86 86 GLU CB C 86 29.389 29.389 29.421 -0.032 25148 7219 1 11 . 1 1 86 86 GLU H H 86 8.938 8.938 7.852 1.086 25148 7220 1 11 . 1 1 87 87 TYR N N 87 119.773 119.773 120.252 -0.479 25148 7221 1 11 . 1 1 87 87 TYR HA H 87 4.744 4.744 4.202 0.542 25148 7222 1 11 . 1 1 87 87 TYR C C 87 174.533 174.533 176.217 -1.684 25148 7223 1 11 . 1 1 87 87 TYR CA C 87 59.117 59.117 59.110 0.007 25148 7224 1 11 . 1 1 87 87 TYR CB C 87 38.859 38.859 38.746 0.113 25148 7225 1 11 . 1 1 87 87 TYR H H 87 7.447 7.447 7.365 0.082 25148 7226 1 11 . 1 1 88 88 MET N N 88 118.298 118.298 117.216 1.082 25148 7227 1 11 . 1 1 88 88 MET HA H 88 4.770 4.770 4.690 0.080 25148 7228 1 11 . 1 1 88 88 MET C C 88 175.638 175.638 173.777 1.861 25148 7229 1 11 . 1 1 88 88 MET CA C 88 53.133 53.133 54.512 -1.379 25148 7230 1 11 . 1 1 88 88 MET CB C 88 37.102 37.102 35.442 1.660 25148 7231 1 11 . 1 1 88 88 MET H H 88 9.023 9.023 8.349 0.674 25148 7232 1 11 . 1 1 89 89 VAL N N 89 120.157 120.157 124.342 -4.185 25148 7233 1 11 . 1 1 89 89 VAL HA H 89 3.330 3.330 3.854 -0.524 25148 7234 1 11 . 1 1 89 89 VAL C C 89 177.432 177.432 177.273 0.159 25148 7235 1 11 . 1 1 89 89 VAL CA C 89 65.675 65.675 63.498 2.177 25148 7236 1 11 . 1 1 89 89 VAL CB C 89 31.321 31.321 30.244 1.077 25148 7237 1 11 . 1 1 89 89 VAL H H 89 8.313 8.313 8.592 -0.279 25148 7238 1 11 . 1 1 90 90 GLY N N 90 116.935 116.935 116.319 0.616 25148 7239 1 11 . 1 1 90 90 GLY C C 90 175.196 175.196 174.235 0.961 25148 7240 1 11 . 1 1 90 90 GLY CA C 90 44.685 44.685 44.822 -0.137 25148 7241 1 11 . 1 1 90 90 GLY H H 90 8.551 8.551 8.939 -0.388 25148 7242 1 11 . 1 1 91 91 ASP N N 91 121.616 121.616 121.837 -0.221 25148 7243 1 11 . 1 1 91 91 ASP HA H 91 4.790 4.790 4.904 -0.114 25148 7244 1 11 . 1 1 91 91 ASP C C 91 174.431 174.431 174.847 -0.416 25148 7245 1 11 . 1 1 91 91 ASP CA C 91 55.011 55.011 53.822 1.189 25148 7246 1 11 . 1 1 91 91 ASP CB C 91 42.079 42.079 42.313 -0.234 25148 7247 1 11 . 1 1 91 91 ASP H H 91 8.073 8.073 8.042 0.031 25148 7248 1 11 . 1 1 92 92 VAL N N 92 118.919 118.919 115.809 3.110 25148 7249 1 11 . 1 1 92 92 VAL HA H 92 4.709 4.709 4.968 -0.259 25148 7250 1 11 . 1 1 92 92 VAL C C 92 175.602 175.602 174.451 1.151 25148 7251 1 11 . 1 1 92 92 VAL CA C 92 61.527 61.527 59.364 2.163 25148 7252 1 11 . 1 1 92 92 VAL CB C 92 34.110 34.110 34.840 -0.730 25148 7253 1 11 . 1 1 92 92 VAL H H 92 8.216 8.216 8.144 0.072 25148 7254 1 11 . 1 1 93 93 VAL N N 93 123.922 123.922 122.821 1.101 25148 7255 1 11 . 1 1 93 93 VAL HA H 93 4.231 4.231 4.212 0.019 25148 7256 1 11 . 1 1 93 93 VAL C C 93 174.105 174.105 174.180 -0.075 25148 7257 1 11 . 1 1 93 93 VAL CA C 93 59.644 59.644 59.311 0.333 25148 7258 1 11 . 1 1 93 93 VAL CB C 93 34.661 34.661 34.353 0.308 25148 7259 1 11 . 1 1 93 93 VAL H H 93 8.812 8.812 7.855 0.957 25148 7260 1 11 . 1 1 94 94 GLU N N 94 123.605 123.605 127.547 -3.942 25148 7261 1 11 . 1 1 94 94 GLU HA H 94 5.347 5.347 5.233 0.114 25148 7262 1 11 . 1 1 94 94 GLU C C 94 175.708 175.708 175.547 0.161 25148 7263 1 11 . 1 1 94 94 GLU CA C 94 54.979 54.979 54.967 0.012 25148 7264 1 11 . 1 1 94 94 GLU CB C 94 31.612 31.612 32.214 -0.602 25148 7265 1 11 . 1 1 94 94 GLU H H 94 8.312 8.312 8.420 -0.108 25148 7266 1 11 . 1 1 95 95 ILE N N 95 123.581 123.581 123.439 0.142 25148 7267 1 11 . 1 1 95 95 ILE HA H 95 4.601 4.601 4.541 0.060 25148 7268 1 11 . 1 1 95 95 ILE C C 95 175.081 175.081 175.072 0.009 25148 7269 1 11 . 1 1 95 95 ILE CA C 95 58.601 58.601 59.734 -1.133 25148 7270 1 11 . 1 1 95 95 ILE CB C 95 41.727 41.727 42.156 -0.429 25148 7271 1 11 . 1 1 95 95 ILE H H 95 9.045 9.045 8.395 0.650 25148 7272 1 11 . 1 1 96 96 GLU N N 96 128.094 128.094 128.280 -0.186 25148 7273 1 11 . 1 1 96 96 GLU HA H 96 4.098 4.098 4.198 -0.100 25148 7274 1 11 . 1 1 96 96 GLU C C 96 176.845 176.845 175.767 1.078 25148 7275 1 11 . 1 1 96 96 GLU CA C 96 57.853 57.853 57.930 -0.077 25148 7276 1 11 . 1 1 96 96 GLU CB C 96 28.323 28.323 29.272 -0.949 25148 7277 1 11 . 1 1 96 96 GLU H H 96 9.256 9.256 8.935 0.321 25148 7278 1 11 . 1 1 97 97 VAL N N 97 118.446 118.446 124.463 -6.017 25148 7279 1 11 . 1 1 97 97 VAL HA H 97 4.568 4.568 4.226 0.342 25148 7280 1 11 . 1 1 97 97 VAL C C 97 175.051 175.051 174.755 0.296 25148 7281 1 11 . 1 1 97 97 VAL CA C 97 59.796 59.796 61.087 -1.291 25148 7282 1 11 . 1 1 97 97 VAL CB C 97 32.399 32.399 32.942 -0.543 25148 7283 1 11 . 1 1 97 97 VAL H H 97 8.609 8.609 8.706 -0.097 25148 7284 1 11 . 1 1 98 98 THR N N 98 119.118 119.118 118.959 0.159 25148 7285 1 11 . 1 1 98 98 THR HA H 98 3.320 3.320 3.981 -0.661 25148 7286 1 11 . 1 1 98 98 THR CA C 98 61.628 61.628 59.120 2.508 25148 7287 1 11 . 1 1 98 98 THR CB C 98 70.031 70.031 69.287 0.744 25148 7288 1 11 . 1 1 98 98 THR H H 98 7.396 7.396 7.425 -0.029 25148 7289 1 11 . 1 1 99 99 PRO HA H 99 4.458 4.458 4.558 -0.100 25148 7290 1 11 . 1 1 99 99 PRO CA C 99 62.348 62.348 62.332 0.016 25148 7291 1 11 . 1 1 99 99 PRO CB C 99 33.182 33.182 32.576 0.606 25148 7292 1 11 . 1 1 100 100 LYS HA H 100 4.126 4.126 4.152 -0.026 25148 7293 1 11 . 1 1 100 100 LYS CA C 100 58.773 58.773 57.763 1.010 25148 7294 1 11 . 1 1 100 100 LYS CB C 100 32.195 32.195 32.123 0.072 25148 7295 1 11 . 1 1 101 101 ASP HA H 101 4.924 4.924 4.724 0.200 25148 7296 1 11 . 1 1 101 101 ASP C C 101 176.884 176.884 176.777 0.107 25148 7297 1 11 . 1 1 101 101 ASP CA C 101 54.134 54.134 53.153 0.981 25148 7298 1 11 . 1 1 101 101 ASP CB C 101 40.272 40.272 40.747 -0.475 25148 7299 1 11 . 1 1 102 102 PHE N N 102 118.703 118.703 121.243 -2.540 25148 7300 1 11 . 1 1 102 102 PHE HA H 102 4.295 4.295 4.202 0.093 25148 7301 1 11 . 1 1 102 102 PHE C C 102 176.477 176.477 177.214 -0.737 25148 7302 1 11 . 1 1 102 102 PHE CA C 102 60.748 60.748 60.042 0.706 25148 7303 1 11 . 1 1 102 102 PHE CB C 102 39.667 39.667 39.232 0.435 25148 7304 1 11 . 1 1 102 102 PHE H H 102 7.862 7.862 7.701 0.161 25148 7305 1 11 . 1 1 103 103 GLY CA C 103 47.430 47.430 47.289 0.141 25148 7306 1 11 . 1 1 104 104 ARG N N 104 121.819 121.819 121.237 0.582 25148 7307 1 11 . 1 1 104 104 ARG HA H 104 4.176 4.176 4.184 -0.008 25148 7308 1 11 . 1 1 104 104 ARG C C 104 178.912 178.912 178.759 0.153 25148 7309 1 11 . 1 1 104 104 ARG CA C 104 59.235 59.235 58.225 1.010 25148 7310 1 11 . 1 1 104 104 ARG CB C 104 30.000 30.000 30.292 -0.292 25148 7311 1 11 . 1 1 104 104 ARG H H 104 7.809 7.809 7.490 0.319 25148 7312 1 11 . 1 1 105 105 ILE N N 105 120.331 120.331 120.564 -0.233 25148 7313 1 11 . 1 1 105 105 ILE HA H 105 3.836 3.836 3.543 0.293 25148 7314 1 11 . 1 1 105 105 ILE C C 105 179.206 179.206 177.288 1.918 25148 7315 1 11 . 1 1 105 105 ILE CA C 105 63.025 63.025 64.664 -1.639 25148 7316 1 11 . 1 1 105 105 ILE CB C 105 38.127 38.127 37.369 0.758 25148 7317 1 11 . 1 1 105 105 ILE H H 105 7.203 7.203 7.358 -0.155 25148 7318 1 11 . 1 1 106 106 ALA N N 106 124.867 124.867 122.684 2.183 25148 7319 1 11 . 1 1 106 106 ALA HA H 106 3.665 3.665 3.571 0.094 25148 7320 1 11 . 1 1 106 106 ALA C C 106 178.590 178.590 178.962 -0.372 25148 7321 1 11 . 1 1 106 106 ALA CA C 106 54.842 54.842 55.450 -0.608 25148 7322 1 11 . 1 1 106 106 ALA CB C 106 18.659 18.659 17.776 0.884 25148 7323 1 11 . 1 1 106 106 ALA H H 106 8.813 8.813 8.172 0.641 25148 7324 1 11 . 1 1 107 107 ALA N N 107 119.597 119.597 119.537 0.060 25148 7325 1 11 . 1 1 107 107 ALA HA H 107 4.014 4.014 4.051 -0.037 25148 7326 1 11 . 1 1 107 107 ALA C C 107 180.214 180.214 179.734 0.480 25148 7327 1 11 . 1 1 107 107 ALA CA C 107 55.454 55.454 54.550 0.904 25148 7328 1 11 . 1 1 107 107 ALA CB C 107 18.260 18.260 18.102 0.158 25148 7329 1 11 . 1 1 107 107 ALA H H 107 8.012 8.012 7.810 0.202 25148 7330 1 11 . 1 1 108 108 GLN N N 108 116.896 116.896 118.035 -1.139 25148 7331 1 11 . 1 1 108 108 GLN HA H 108 4.054 4.054 4.088 -0.034 25148 7332 1 11 . 1 1 108 108 GLN C C 108 178.784 178.784 178.178 0.606 25148 7333 1 11 . 1 1 108 108 GLN CA C 108 58.705 58.705 58.782 -0.077 25148 7334 1 11 . 1 1 108 108 GLN CB C 108 28.647 28.647 28.848 -0.201 25148 7335 1 11 . 1 1 108 108 GLN H H 108 7.498 7.498 7.805 -0.307 25148 7336 1 11 . 1 1 109 109 THR N N 109 117.495 117.495 116.289 1.206 25148 7337 1 11 . 1 1 109 109 THR HA H 109 3.917 3.917 4.127 -0.210 25148 7338 1 11 . 1 1 109 109 THR C C 109 175.732 175.732 175.855 -0.123 25148 7339 1 11 . 1 1 109 109 THR CA C 109 66.989 66.989 65.567 1.422 25148 7340 1 11 . 1 1 109 109 THR CB C 109 68.766 68.766 68.403 0.363 25148 7341 1 11 . 1 1 109 109 THR H H 109 8.203 8.203 8.181 0.021 25148 7342 1 11 . 1 1 110 110 ALA N N 110 122.308 122.308 124.667 -2.359 25148 7343 1 11 . 1 1 110 110 ALA HA H 110 3.854 3.854 4.056 -0.202 25148 7344 1 11 . 1 1 110 110 ALA C C 110 178.380 178.380 178.659 -0.279 25148 7345 1 11 . 1 1 110 110 ALA CA C 110 55.903 55.903 54.848 1.055 25148 7346 1 11 . 1 1 110 110 ALA CB C 110 18.524 18.524 18.272 0.252 25148 7347 1 11 . 1 1 110 110 ALA H H 110 8.668 8.668 7.871 0.797 25148 7348 1 11 . 1 1 111 111 LYS N N 111 115.552 115.552 117.750 -2.198 25148 7349 1 11 . 1 1 111 111 LYS HA H 111 3.923 3.923 3.980 -0.057 25148 7350 1 11 . 1 1 111 111 LYS C C 111 179.111 179.111 178.786 0.325 25148 7351 1 11 . 1 1 111 111 LYS CA C 111 59.825 59.825 59.272 0.553 25148 7352 1 11 . 1 1 111 111 LYS CB C 111 32.251 32.251 31.914 0.337 25148 7353 1 11 . 1 1 111 111 LYS H H 111 7.642 7.642 7.789 -0.147 25148 7354 1 11 . 1 1 112 112 GLN N N 112 120.178 120.178 118.572 1.606 25148 7355 1 11 . 1 1 112 112 GLN HA H 112 4.060 4.060 4.141 -0.081 25148 7356 1 11 . 1 1 112 112 GLN C C 112 178.355 178.355 178.238 0.117 25148 7357 1 11 . 1 1 112 112 GLN CA C 112 59.240 59.240 58.199 1.041 25148 7358 1 11 . 1 1 112 112 GLN CB C 112 28.250 28.250 28.578 -0.328 25148 7359 1 11 . 1 1 112 112 GLN H H 112 7.798 7.798 7.676 0.122 25148 7360 1 11 . 1 1 113 113 VAL N N 113 119.799 119.799 120.563 -0.764 25148 7361 1 11 . 1 1 113 113 VAL HA H 113 3.705 3.705 3.744 -0.039 25148 7362 1 11 . 1 1 113 113 VAL C C 113 178.303 178.303 177.866 0.437 25148 7363 1 11 . 1 1 113 113 VAL CA C 113 66.277 66.277 66.365 -0.088 25148 7364 1 11 . 1 1 113 113 VAL CB C 113 31.954 31.954 31.884 0.070 25148 7365 1 11 . 1 1 113 113 VAL H H 113 8.105 8.105 7.370 0.735 25148 7366 1 11 . 1 1 114 114 VAL N N 114 118.265 118.265 116.531 1.734 25148 7367 1 11 . 1 1 114 114 VAL HA H 114 3.392 3.392 3.637 -0.245 25148 7368 1 11 . 1 1 114 114 VAL C C 114 177.360 177.360 177.999 -0.639 25148 7369 1 11 . 1 1 114 114 VAL CA C 114 67.832 67.832 66.839 0.993 25148 7370 1 11 . 1 1 114 114 VAL CB C 114 31.801 31.801 31.354 0.447 25148 7371 1 11 . 1 1 114 114 VAL H H 114 8.180 8.180 8.220 -0.040 25148 7372 1 11 . 1 1 115 115 THR N N 115 113.460 113.460 114.461 -1.001 25148 7373 1 11 . 1 1 115 115 THR HA H 115 3.856 3.856 4.045 -0.189 25148 7374 1 11 . 1 1 115 115 THR C C 115 176.529 176.529 176.405 0.124 25148 7375 1 11 . 1 1 115 115 THR CA C 115 66.706 66.706 65.971 0.735 25148 7376 1 11 . 1 1 115 115 THR CB C 115 69.008 69.008 68.642 0.366 25148 7377 1 11 . 1 1 115 115 THR H H 115 8.143 8.143 7.640 0.503 25148 7378 1 11 . 1 1 116 116 GLN N N 116 120.129 120.129 121.249 -1.120 25148 7379 1 11 . 1 1 116 116 GLN HA H 116 4.054 4.054 4.075 -0.021 25148 7380 1 11 . 1 1 116 116 GLN C C 116 178.100 178.100 178.392 -0.292 25148 7381 1 11 . 1 1 116 116 GLN CA C 116 58.950 58.950 59.386 -0.436 25148 7382 1 11 . 1 1 116 116 GLN CB C 116 28.244 28.244 28.517 -0.273 25148 7383 1 11 . 1 1 116 116 GLN H H 116 7.936 7.936 7.406 0.530 25148 7384 1 11 . 1 1 117 117 ARG N N 117 117.838 117.838 118.612 -0.774 25148 7385 1 11 . 1 1 117 117 ARG HA H 117 4.174 4.174 4.088 0.086 25148 7386 1 11 . 1 1 117 117 ARG C C 117 179.138 179.138 178.785 0.353 25148 7387 1 11 . 1 1 117 117 ARG CA C 117 57.461 57.461 58.352 -0.891 25148 7388 1 11 . 1 1 117 117 ARG CB C 117 29.548 29.548 29.465 0.083 25148 7389 1 11 . 1 1 117 117 ARG H H 117 8.240 8.240 8.088 0.152 25148 7390 1 11 . 1 1 118 118 VAL N N 118 120.278 120.278 119.597 0.681 25148 7391 1 11 . 1 1 118 118 VAL HA H 118 3.709 3.709 3.692 0.017 25148 7392 1 11 . 1 1 118 118 VAL C C 118 177.597 177.597 178.255 -0.658 25148 7393 1 11 . 1 1 118 118 VAL CA C 118 66.246 66.246 65.857 0.389 25148 7394 1 11 . 1 1 118 118 VAL CB C 118 31.785 31.785 31.084 0.701 25148 7395 1 11 . 1 1 118 118 VAL H H 118 8.480 8.480 7.606 0.874 25148 7396 1 11 . 1 1 119 119 ARG N N 119 120.197 120.197 119.093 1.104 25148 7397 1 11 . 1 1 119 119 ARG HA H 119 4.173 4.173 4.097 0.076 25148 7398 1 11 . 1 1 119 119 ARG C C 119 178.864 178.864 178.671 0.193 25148 7399 1 11 . 1 1 119 119 ARG CA C 119 58.772 58.772 59.109 -0.337 25148 7400 1 11 . 1 1 119 119 ARG CB C 119 29.873 29.873 29.855 0.018 25148 7401 1 11 . 1 1 119 119 ARG H H 119 7.899 7.899 7.611 0.288 25148 7402 1 11 . 1 1 120 120 GLU N N 120 118.768 118.768 118.961 -0.193 25148 7403 1 11 . 1 1 120 120 GLU HA H 120 4.110 4.110 4.094 0.016 25148 7404 1 11 . 1 1 120 120 GLU C C 120 177.823 177.823 178.770 -0.947 25148 7405 1 11 . 1 1 120 120 GLU CA C 120 58.223 58.223 59.182 -0.959 25148 7406 1 11 . 1 1 120 120 GLU CB C 120 29.854 29.854 29.780 0.074 25148 7407 1 11 . 1 1 120 120 GLU H H 120 8.084 8.084 8.010 0.074 25148 7408 1 11 . 1 1 121 121 ALA N N 121 121.984 121.984 120.726 1.258 25148 7409 1 11 . 1 1 121 121 ALA HA H 121 4.296 4.296 4.151 0.145 25148 7410 1 11 . 1 1 121 121 ALA C C 121 178.586 178.586 178.388 0.198 25148 7411 1 11 . 1 1 121 121 ALA CA C 121 53.475 53.475 54.601 -1.126 25148 7412 1 11 . 1 1 121 121 ALA CB C 121 18.856 18.856 18.857 -0.001 25148 7413 1 11 . 1 1 121 121 ALA H H 121 7.810 7.810 8.092 -0.282 25148 7414 1 11 . 1 1 122 122 GLU N N 122 118.229 118.229 116.317 1.912 25148 7415 1 11 . 1 1 122 122 GLU HA H 122 4.241 4.241 4.343 -0.102 25148 7416 1 11 . 1 1 122 122 GLU C C 122 176.839 176.839 176.707 0.132 25148 7417 1 11 . 1 1 122 122 GLU CA C 122 57.118 57.118 56.526 0.592 25148 7418 1 11 . 1 1 122 122 GLU CB C 122 30.018 30.018 29.357 0.661 25148 7419 1 11 . 1 1 122 122 GLU H H 122 7.938 7.938 7.439 0.499 25148 7420 1 11 . 1 1 123 123 ARG N N 123 120.601 120.601 119.263 1.338 25148 7421 1 11 . 1 1 123 123 ARG HA H 123 4.348 4.348 4.493 -0.145 25148 7422 1 11 . 1 1 123 123 ARG C C 123 176.071 176.071 175.699 0.372 25148 7423 1 11 . 1 1 123 123 ARG CA C 123 56.510 56.510 55.056 1.454 25148 7424 1 11 . 1 1 123 123 ARG CB C 123 30.765 30.765 29.871 0.894 25148 7425 1 11 . 1 1 123 123 ARG H H 123 7.977 7.977 7.496 0.481 25148 7426 1 12 . 1 1 4 4 GLU HA H 4 4.138 4.138 3.890 0.248 25148 7427 1 12 . 1 1 4 4 GLU C C 4 179.152 179.152 177.697 1.455 25148 7428 1 12 . 1 1 4 4 GLU CA C 4 59.566 59.566 59.420 0.146 25148 7429 1 12 . 1 1 4 4 GLU CB C 4 29.407 29.407 29.088 0.319 25148 7430 1 12 . 1 1 5 5 LEU N N 5 121.360 121.360 120.174 1.186 25148 7431 1 12 . 1 1 5 5 LEU HA H 5 4.195 4.195 4.051 0.144 25148 7432 1 12 . 1 1 5 5 LEU C C 5 178.179 178.179 178.071 0.108 25148 7433 1 12 . 1 1 5 5 LEU CA C 5 57.830 57.830 57.390 0.440 25148 7434 1 12 . 1 1 5 5 LEU CB C 5 41.630 41.630 41.715 -0.085 25148 7435 1 12 . 1 1 5 5 LEU H H 5 7.877 7.877 8.075 -0.198 25148 7436 1 12 . 1 1 6 6 LEU N N 6 118.058 118.058 119.182 -1.124 25148 7437 1 12 . 1 1 6 6 LEU HA H 6 3.919 3.919 3.946 -0.027 25148 7438 1 12 . 1 1 6 6 LEU C C 6 180.274 180.274 179.105 1.169 25148 7439 1 12 . 1 1 6 6 LEU CA C 6 58.221 58.221 57.888 0.333 25148 7440 1 12 . 1 1 6 6 LEU CB C 6 40.684 40.684 41.276 -0.592 25148 7441 1 12 . 1 1 6 6 LEU H H 6 7.685 7.685 7.685 0.000 25148 7442 1 12 . 1 1 7 7 ASP N N 7 120.662 120.662 119.330 1.332 25148 7443 1 12 . 1 1 7 7 ASP HA H 7 4.416 4.416 4.378 0.038 25148 7444 1 12 . 1 1 7 7 ASP C C 7 178.738 178.738 178.142 0.596 25148 7445 1 12 . 1 1 7 7 ASP CA C 7 57.519 57.519 56.803 0.716 25148 7446 1 12 . 1 1 7 7 ASP CB C 7 40.167 40.167 40.818 -0.651 25148 7447 1 12 . 1 1 7 7 ASP H H 7 8.427 8.427 7.945 0.482 25148 7448 1 12 . 1 1 8 8 ALA N N 8 122.612 122.612 122.420 0.192 25148 7449 1 12 . 1 1 8 8 ALA HA H 8 4.146 4.146 4.038 0.108 25148 7450 1 12 . 1 1 8 8 ALA C C 8 180.787 180.787 179.778 1.009 25148 7451 1 12 . 1 1 8 8 ALA CA C 8 55.165 55.165 55.248 -0.083 25148 7452 1 12 . 1 1 8 8 ALA CB C 8 17.711 17.711 18.397 -0.686 25148 7453 1 12 . 1 1 8 8 ALA H H 8 7.847 7.847 8.310 -0.463 25148 7454 1 12 . 1 1 9 9 LEU N N 9 116.977 116.977 117.347 -0.370 25148 7455 1 12 . 1 1 9 9 LEU HA H 9 4.115 4.115 3.873 0.242 25148 7456 1 12 . 1 1 9 9 LEU C C 9 179.510 179.510 179.523 -0.013 25148 7457 1 12 . 1 1 9 9 LEU CA C 9 57.468 57.468 57.852 -0.384 25148 7458 1 12 . 1 1 9 9 LEU CB C 9 41.203 41.203 41.526 -0.323 25148 7459 1 12 . 1 1 9 9 LEU H H 9 8.256 8.256 7.587 0.669 25148 7460 1 12 . 1 1 10 10 THR N N 10 118.764 118.764 115.639 3.125 25148 7461 1 12 . 1 1 10 10 THR HA H 10 4.487 4.487 4.007 0.480 25148 7462 1 12 . 1 1 10 10 THR C C 10 176.567 176.567 176.747 -0.180 25148 7463 1 12 . 1 1 10 10 THR CA C 10 68.768 68.768 66.446 2.322 25148 7464 1 12 . 1 1 10 10 THR CB C 10 66.961 66.961 68.617 -1.656 25148 7465 1 12 . 1 1 10 10 THR H H 10 8.218 8.218 7.417 0.801 25148 7466 1 12 . 1 1 11 11 ILE N N 11 122.555 122.555 120.228 2.327 25148 7467 1 12 . 1 1 11 11 ILE HA H 11 3.779 3.779 3.780 -0.001 25148 7468 1 12 . 1 1 11 11 ILE C C 11 177.793 177.793 178.105 -0.312 25148 7469 1 12 . 1 1 11 11 ILE CA C 11 64.695 64.695 64.793 -0.098 25148 7470 1 12 . 1 1 11 11 ILE CB C 11 37.856 37.856 37.713 0.143 25148 7471 1 12 . 1 1 11 11 ILE H H 11 7.632 7.632 7.799 -0.167 25148 7472 1 12 . 1 1 12 12 LEU N N 12 120.469 120.469 117.372 3.097 25148 7473 1 12 . 1 1 12 12 LEU HA H 12 4.065 4.065 4.088 -0.023 25148 7474 1 12 . 1 1 12 12 LEU C C 12 179.139 179.139 178.818 0.321 25148 7475 1 12 . 1 1 12 12 LEU CA C 12 57.944 57.944 56.721 1.223 25148 7476 1 12 . 1 1 12 12 LEU CB C 12 42.170 42.170 41.139 1.031 25148 7477 1 12 . 1 1 12 12 LEU H H 12 7.951 7.951 7.328 0.623 25148 7478 1 12 . 1 1 13 13 GLU N N 13 119.669 119.669 119.357 0.312 25148 7479 1 12 . 1 1 13 13 GLU HA H 13 4.183 4.183 4.043 0.140 25148 7480 1 12 . 1 1 13 13 GLU C C 13 179.007 179.007 177.313 1.694 25148 7481 1 12 . 1 1 13 13 GLU CA C 13 59.703 59.703 58.650 1.053 25148 7482 1 12 . 1 1 13 13 GLU CB C 13 30.110 30.110 29.346 0.764 25148 7483 1 12 . 1 1 13 13 GLU H H 13 8.003 8.003 7.737 0.266 25148 7484 1 12 . 1 1 14 14 LYS N N 14 118.935 118.935 117.153 1.782 25148 7485 1 12 . 1 1 14 14 LYS HA H 14 4.124 4.124 4.061 0.063 25148 7486 1 12 . 1 1 14 14 LYS CA C 14 58.847 58.847 57.888 0.959 25148 7487 1 12 . 1 1 14 14 LYS CB C 14 33.053 33.053 32.317 0.736 25148 7488 1 12 . 1 1 14 14 LYS H H 14 7.862 7.862 7.389 0.473 25148 7489 1 12 . 1 1 15 15 GLU HA H 15 3.693 3.693 4.304 -0.611 25148 7490 1 12 . 1 1 15 15 GLU CA C 15 56.688 56.688 55.597 1.091 25148 7491 1 12 . 1 1 15 15 GLU CB C 15 32.204 32.204 30.671 1.533 25148 7492 1 12 . 1 1 16 16 LYS HA H 16 4.678 4.678 4.407 0.271 25148 7493 1 12 . 1 1 16 16 LYS CA C 16 55.135 55.135 55.907 -0.772 25148 7494 1 12 . 1 1 16 16 LYS CB C 16 34.049 34.049 33.306 0.743 25148 7495 1 12 . 1 1 17 17 GLY CA C 17 46.541 46.541 45.197 1.344 25148 7496 1 12 . 1 1 18 18 ILE N N 18 115.364 115.364 121.712 -6.348 25148 7497 1 12 . 1 1 18 18 ILE HA H 18 4.079 4.079 4.210 -0.131 25148 7498 1 12 . 1 1 18 18 ILE C C 18 174.751 174.751 175.017 -0.266 25148 7499 1 12 . 1 1 18 18 ILE CA C 18 60.333 60.333 59.866 0.467 25148 7500 1 12 . 1 1 18 18 ILE CB C 18 39.044 39.044 36.923 2.121 25148 7501 1 12 . 1 1 18 18 ILE H H 18 8.203 8.203 7.782 0.421 25148 7502 1 12 . 1 1 19 19 SER N N 19 119.891 119.891 118.960 0.931 25148 7503 1 12 . 1 1 19 19 SER HA H 19 4.362 4.362 4.390 -0.028 25148 7504 1 12 . 1 1 19 19 SER CA C 19 58.476 58.476 58.191 0.286 25148 7505 1 12 . 1 1 19 19 SER CB C 19 63.533 63.533 64.330 -0.797 25148 7506 1 12 . 1 1 19 19 SER H H 19 8.253 8.253 8.299 -0.046 25148 7507 1 12 . 1 1 20 20 LYS N N 20 124.782 124.782 128.635 -3.853 25148 7508 1 12 . 1 1 20 20 LYS HA H 20 4.137 4.137 4.090 0.047 25148 7509 1 12 . 1 1 20 20 LYS C C 20 177.889 177.889 177.641 0.248 25148 7510 1 12 . 1 1 20 20 LYS CA C 20 59.485 59.485 58.839 0.646 25148 7511 1 12 . 1 1 20 20 LYS CB C 20 32.711 32.711 32.222 0.488 25148 7512 1 12 . 1 1 20 20 LYS H H 20 8.918 8.918 8.952 -0.034 25148 7513 1 12 . 1 1 21 21 GLU N N 21 117.831 117.831 119.248 -1.417 25148 7514 1 12 . 1 1 21 21 GLU HA H 21 3.957 3.957 4.066 -0.109 25148 7515 1 12 . 1 1 21 21 GLU C C 21 178.822 178.822 178.508 0.314 25148 7516 1 12 . 1 1 21 21 GLU CA C 21 59.529 59.529 58.855 0.673 25148 7517 1 12 . 1 1 21 21 GLU CB C 21 29.237 29.237 29.147 0.090 25148 7518 1 12 . 1 1 21 21 GLU H H 21 8.361 8.361 7.742 0.619 25148 7519 1 12 . 1 1 22 22 ILE N N 22 118.690 118.690 119.078 -0.388 25148 7520 1 12 . 1 1 22 22 ILE HA H 22 3.884 3.884 3.917 -0.033 25148 7521 1 12 . 1 1 22 22 ILE C C 22 179.247 179.247 177.577 1.670 25148 7522 1 12 . 1 1 22 22 ILE CA C 22 63.735 63.735 63.959 -0.224 25148 7523 1 12 . 1 1 22 22 ILE CB C 22 37.415 37.415 38.178 -0.763 25148 7524 1 12 . 1 1 22 22 ILE H H 22 7.353 7.353 7.416 -0.063 25148 7525 1 12 . 1 1 23 23 ILE N N 23 120.880 120.880 120.880 0.000 25148 7526 1 12 . 1 1 23 23 ILE HA H 23 3.733 3.733 3.759 -0.026 25148 7527 1 12 . 1 1 23 23 ILE C C 23 177.817 177.817 177.827 -0.010 25148 7528 1 12 . 1 1 23 23 ILE CA C 23 64.172 64.172 63.250 0.922 25148 7529 1 12 . 1 1 23 23 ILE CB C 23 36.473 36.473 36.979 -0.506 25148 7530 1 12 . 1 1 23 23 ILE H H 23 7.571 7.571 7.535 0.036 25148 7531 1 12 . 1 1 24 24 ILE N N 24 121.460 121.460 119.707 1.753 25148 7532 1 12 . 1 1 24 24 ILE HA H 24 3.486 3.486 3.602 -0.116 25148 7533 1 12 . 1 1 24 24 ILE C C 24 177.759 177.759 177.974 -0.215 25148 7534 1 12 . 1 1 24 24 ILE CA C 24 66.641 66.641 66.092 0.549 25148 7535 1 12 . 1 1 24 24 ILE CB C 24 37.307 37.307 37.484 -0.178 25148 7536 1 12 . 1 1 24 24 ILE H H 24 8.709 8.709 8.220 0.489 25148 7537 1 12 . 1 1 25 25 GLU N N 25 119.323 119.323 118.587 0.736 25148 7538 1 12 . 1 1 25 25 GLU HA H 25 4.177 4.177 4.329 -0.152 25148 7539 1 12 . 1 1 25 25 GLU C C 25 179.348 179.348 178.593 0.755 25148 7540 1 12 . 1 1 25 25 GLU CA C 25 59.951 59.951 58.960 0.991 25148 7541 1 12 . 1 1 25 25 GLU CB C 25 29.340 29.340 29.177 0.163 25148 7542 1 12 . 1 1 25 25 GLU H H 25 8.048 8.048 7.989 0.059 25148 7543 1 12 . 1 1 26 26 ALA N N 26 122.390 122.390 122.797 -0.407 25148 7544 1 12 . 1 1 26 26 ALA HA H 26 4.325 4.325 4.115 0.210 25148 7545 1 12 . 1 1 26 26 ALA C C 26 181.440 181.440 179.836 1.604 25148 7546 1 12 . 1 1 26 26 ALA CA C 26 54.935 54.935 54.951 -0.016 25148 7547 1 12 . 1 1 26 26 ALA CB C 26 17.834 17.834 18.265 -0.431 25148 7548 1 12 . 1 1 26 26 ALA H H 26 7.768 7.768 7.895 -0.127 25148 7549 1 12 . 1 1 27 27 ILE N N 27 122.342 122.342 119.550 2.792 25148 7550 1 12 . 1 1 27 27 ILE HA H 27 3.575 3.575 3.635 -0.060 25148 7551 1 12 . 1 1 27 27 ILE C C 27 177.541 177.541 178.068 -0.527 25148 7552 1 12 . 1 1 27 27 ILE CA C 27 66.536 66.536 65.495 1.042 25148 7553 1 12 . 1 1 27 27 ILE CB C 27 37.886 37.886 37.718 0.168 25148 7554 1 12 . 1 1 27 27 ILE H H 27 8.805 8.805 7.629 1.176 25148 7555 1 12 . 1 1 28 28 GLU N N 28 120.188 120.188 119.354 0.834 25148 7556 1 12 . 1 1 28 28 GLU HA H 28 3.687 3.687 3.914 -0.227 25148 7557 1 12 . 1 1 28 28 GLU C C 28 178.707 178.707 178.954 -0.247 25148 7558 1 12 . 1 1 28 28 GLU CA C 28 61.458 61.458 59.829 1.629 25148 7559 1 12 . 1 1 28 28 GLU CB C 28 29.624 29.624 29.206 0.418 25148 7560 1 12 . 1 1 28 28 GLU H H 28 8.882 8.882 7.674 1.208 25148 7561 1 12 . 1 1 29 29 ALA N N 29 119.293 119.293 121.271 -1.978 25148 7562 1 12 . 1 1 29 29 ALA HA H 29 4.214 4.214 4.052 0.162 25148 7563 1 12 . 1 1 29 29 ALA C C 29 181.200 181.200 179.731 1.469 25148 7564 1 12 . 1 1 29 29 ALA CA C 29 55.435 55.435 54.909 0.526 25148 7565 1 12 . 1 1 29 29 ALA CB C 29 18.090 18.090 18.055 0.035 25148 7566 1 12 . 1 1 29 29 ALA H H 29 8.065 8.065 7.864 0.201 25148 7567 1 12 . 1 1 30 30 ALA N N 30 121.729 121.729 121.696 0.033 25148 7568 1 12 . 1 1 30 30 ALA HA H 30 4.307 4.307 4.134 0.173 25148 7569 1 12 . 1 1 30 30 ALA C C 30 181.315 181.315 179.616 1.699 25148 7570 1 12 . 1 1 30 30 ALA CA C 30 54.594 54.594 54.626 -0.032 25148 7571 1 12 . 1 1 30 30 ALA CB C 30 18.704 18.704 18.433 0.271 25148 7572 1 12 . 1 1 30 30 ALA H H 30 8.099 8.099 7.494 0.605 25148 7573 1 12 . 1 1 31 31 LEU N N 31 120.900 120.900 120.776 0.124 25148 7574 1 12 . 1 1 31 31 LEU HA H 31 4.347 4.347 4.035 0.312 25148 7575 1 12 . 1 1 31 31 LEU C C 31 179.137 179.137 179.209 -0.072 25148 7576 1 12 . 1 1 31 31 LEU CA C 31 57.569 57.569 59.211 -1.642 25148 7577 1 12 . 1 1 31 31 LEU CB C 31 42.353 42.353 42.000 0.353 25148 7578 1 12 . 1 1 31 31 LEU H H 31 8.863 8.863 8.018 0.845 25148 7579 1 12 . 1 1 32 32 ILE N N 32 122.410 122.410 118.482 3.928 25148 7580 1 12 . 1 1 32 32 ILE HA H 32 3.699 3.699 3.701 -0.002 25148 7581 1 12 . 1 1 32 32 ILE C C 32 178.303 178.303 177.663 0.640 25148 7582 1 12 . 1 1 32 32 ILE CA C 32 66.066 66.066 65.326 0.740 25148 7583 1 12 . 1 1 32 32 ILE CB C 32 37.882 37.882 37.983 -0.101 25148 7584 1 12 . 1 1 32 32 ILE H H 32 8.234 8.234 8.633 -0.399 25148 7585 1 12 . 1 1 33 33 SER N N 33 114.201 114.201 115.642 -1.441 25148 7586 1 12 . 1 1 33 33 SER HA H 33 4.311 4.311 4.234 0.077 25148 7587 1 12 . 1 1 33 33 SER C C 33 177.012 177.012 176.830 0.182 25148 7588 1 12 . 1 1 33 33 SER CA C 33 61.860 61.860 61.810 0.050 25148 7589 1 12 . 1 1 33 33 SER CB C 33 62.508 62.508 63.053 -0.545 25148 7590 1 12 . 1 1 33 33 SER H H 33 7.558 7.558 7.781 -0.223 25148 7591 1 12 . 1 1 34 34 ALA N N 34 122.893 122.893 125.007 -2.114 25148 7592 1 12 . 1 1 34 34 ALA HA H 34 4.215 4.215 4.198 0.017 25148 7593 1 12 . 1 1 34 34 ALA C C 34 180.814 180.814 178.913 1.901 25148 7594 1 12 . 1 1 34 34 ALA CA C 34 55.283 55.283 54.705 0.579 25148 7595 1 12 . 1 1 34 34 ALA CB C 34 18.273 18.273 18.453 -0.180 25148 7596 1 12 . 1 1 34 34 ALA H H 34 8.409 8.409 7.827 0.582 25148 7597 1 12 . 1 1 35 35 TYR N N 35 120.259 120.259 119.294 0.965 25148 7598 1 12 . 1 1 35 35 TYR HA H 35 4.393 4.393 4.437 -0.044 25148 7599 1 12 . 1 1 35 35 TYR C C 35 177.892 177.892 177.872 0.020 25148 7600 1 12 . 1 1 35 35 TYR CA C 35 63.071 63.071 60.340 2.731 25148 7601 1 12 . 1 1 35 35 TYR CB C 35 38.021 38.021 39.140 -1.119 25148 7602 1 12 . 1 1 35 35 TYR H H 35 8.975 8.975 8.195 0.780 25148 7603 1 12 . 1 1 36 36 LYS N N 36 120.942 120.942 120.512 0.430 25148 7604 1 12 . 1 1 36 36 LYS HA H 36 4.032 4.032 4.051 -0.019 25148 7605 1 12 . 1 1 36 36 LYS C C 36 177.797 177.797 177.717 0.080 25148 7606 1 12 . 1 1 36 36 LYS CA C 36 59.900 59.900 59.224 0.676 25148 7607 1 12 . 1 1 36 36 LYS CB C 36 32.429 32.429 32.212 0.218 25148 7608 1 12 . 1 1 36 36 LYS H H 36 8.654 8.654 8.234 0.420 25148 7609 1 12 . 1 1 37 37 ARG N N 37 115.139 115.139 116.068 -0.929 25148 7610 1 12 . 1 1 37 37 ARG HA H 37 4.101 4.101 4.083 0.018 25148 7611 1 12 . 1 1 37 37 ARG C C 37 177.517 177.517 178.000 -0.483 25148 7612 1 12 . 1 1 37 37 ARG CA C 37 58.276 58.276 58.286 -0.010 25148 7613 1 12 . 1 1 37 37 ARG CB C 37 31.014 31.014 30.030 0.984 25148 7614 1 12 . 1 1 37 37 ARG H H 37 8.138 8.138 7.539 0.599 25148 7615 1 12 . 1 1 38 38 ASN N N 38 112.555 112.555 117.487 -4.932 25148 7616 1 12 . 1 1 38 38 ASN HA H 38 4.540 4.540 4.222 0.318 25148 7617 1 12 . 1 1 38 38 ASN C C 38 173.994 173.994 175.371 -1.377 25148 7618 1 12 . 1 1 38 38 ASN CA C 38 54.722 54.722 55.383 -0.661 25148 7619 1 12 . 1 1 38 38 ASN CB C 38 42.077 42.077 38.803 3.274 25148 7620 1 12 . 1 1 38 38 ASN H H 38 7.426 7.426 7.601 -0.175 25148 7621 1 12 . 1 1 39 39 PHE N N 39 116.711 116.711 116.122 0.589 25148 7622 1 12 . 1 1 39 39 PHE HA H 39 4.569 4.569 4.719 -0.150 25148 7623 1 12 . 1 1 39 39 PHE CA C 39 58.913 58.913 56.007 2.906 25148 7624 1 12 . 1 1 39 39 PHE CB C 39 39.781 39.781 38.316 1.465 25148 7625 1 12 . 1 1 39 39 PHE H H 39 7.959 7.959 7.274 0.685 25148 7626 1 12 . 1 1 40 40 ASN HA H 40 4.018 4.018 4.562 -0.544 25148 7627 1 12 . 1 1 40 40 ASN CA C 40 58.944 58.944 55.081 3.863 25148 7628 1 12 . 1 1 41 41 GLN HA H 41 4.298 4.298 4.526 -0.228 25148 7629 1 12 . 1 1 41 41 GLN C C 41 175.237 175.237 175.603 -0.366 25148 7630 1 12 . 1 1 41 41 GLN CA C 41 57.360 57.360 56.445 0.915 25148 7631 1 12 . 1 1 41 41 GLN CB C 41 28.724 28.724 28.111 0.613 25148 7632 1 12 . 1 1 42 42 ALA N N 42 120.514 120.514 121.612 -1.098 25148 7633 1 12 . 1 1 42 42 ALA HA H 42 4.622 4.622 4.502 0.120 25148 7634 1 12 . 1 1 42 42 ALA C C 42 175.922 175.922 176.586 -0.664 25148 7635 1 12 . 1 1 42 42 ALA CA C 42 51.841 51.841 52.067 -0.226 25148 7636 1 12 . 1 1 42 42 ALA CB C 42 21.576 21.576 20.558 1.018 25148 7637 1 12 . 1 1 42 42 ALA H H 42 7.817 7.817 8.077 -0.260 25148 7638 1 12 . 1 1 43 43 GLN N N 43 117.594 117.594 115.267 2.327 25148 7639 1 12 . 1 1 43 43 GLN HA H 43 4.265 4.265 4.566 -0.301 25148 7640 1 12 . 1 1 43 43 GLN C C 43 174.942 174.942 173.666 1.276 25148 7641 1 12 . 1 1 43 43 GLN CA C 43 57.047 57.047 55.277 1.770 25148 7642 1 12 . 1 1 43 43 GLN CB C 43 30.863 30.863 31.657 -0.794 25148 7643 1 12 . 1 1 43 43 GLN H H 43 7.400 7.400 7.579 -0.179 25148 7644 1 12 . 1 1 44 44 ASN N N 44 120.467 120.467 120.290 0.177 25148 7645 1 12 . 1 1 44 44 ASN HA H 44 5.005 5.005 4.673 0.332 25148 7646 1 12 . 1 1 44 44 ASN C C 44 174.365 174.365 174.385 -0.020 25148 7647 1 12 . 1 1 44 44 ASN CA C 44 52.381 52.381 52.997 -0.616 25148 7648 1 12 . 1 1 44 44 ASN CB C 44 38.177 38.177 38.989 -0.812 25148 7649 1 12 . 1 1 44 44 ASN H H 44 9.123 9.123 8.595 0.528 25148 7650 1 12 . 1 1 45 45 VAL N N 45 115.479 115.479 116.291 -0.812 25148 7651 1 12 . 1 1 45 45 VAL HA H 45 5.376 5.376 4.240 1.136 25148 7652 1 12 . 1 1 45 45 VAL C C 45 174.908 174.908 173.618 1.290 25148 7653 1 12 . 1 1 45 45 VAL CA C 45 59.022 59.022 62.160 -3.138 25148 7654 1 12 . 1 1 45 45 VAL CB C 45 35.776 35.776 34.972 0.804 25148 7655 1 12 . 1 1 45 45 VAL H H 45 7.732 7.732 8.136 -0.404 25148 7656 1 12 . 1 1 46 46 ARG N N 46 121.146 121.146 123.605 -2.459 25148 7657 1 12 . 1 1 46 46 ARG HA H 46 4.566 4.566 4.925 -0.359 25148 7658 1 12 . 1 1 46 46 ARG C C 46 173.790 173.790 174.004 -0.214 25148 7659 1 12 . 1 1 46 46 ARG CA C 46 54.762 54.762 53.816 0.946 25148 7660 1 12 . 1 1 46 46 ARG CB C 46 33.946 33.946 33.783 0.163 25148 7661 1 12 . 1 1 46 46 ARG H H 46 8.850 8.850 8.823 0.027 25148 7662 1 12 . 1 1 47 47 VAL N N 47 122.339 122.339 122.881 -0.542 25148 7663 1 12 . 1 1 47 47 VAL HA H 47 4.741 4.741 4.972 -0.231 25148 7664 1 12 . 1 1 47 47 VAL C C 47 173.541 173.541 175.155 -1.614 25148 7665 1 12 . 1 1 47 47 VAL CA C 47 60.893 60.893 60.486 0.407 25148 7666 1 12 . 1 1 47 47 VAL CB C 47 33.563 33.563 34.689 -1.126 25148 7667 1 12 . 1 1 47 47 VAL H H 47 8.444 8.444 8.464 -0.020 25148 7668 1 12 . 1 1 48 48 ASP N N 48 127.701 127.701 125.249 2.452 25148 7669 1 12 . 1 1 48 48 ASP HA H 48 4.946 4.946 4.965 -0.019 25148 7670 1 12 . 1 1 48 48 ASP C C 48 173.744 173.744 174.554 -0.810 25148 7671 1 12 . 1 1 48 48 ASP CA C 48 52.651 52.651 52.977 -0.326 25148 7672 1 12 . 1 1 48 48 ASP CB C 48 45.225 45.225 44.013 1.212 25148 7673 1 12 . 1 1 48 48 ASP H H 48 9.068 9.068 8.401 0.667 25148 7674 1 12 . 1 1 49 49 LEU N N 49 130.945 130.945 126.723 4.222 25148 7675 1 12 . 1 1 49 49 LEU HA H 49 4.774 4.774 4.796 -0.022 25148 7676 1 12 . 1 1 49 49 LEU C C 49 174.531 174.531 175.581 -1.050 25148 7677 1 12 . 1 1 49 49 LEU CA C 49 54.337 54.337 53.650 0.687 25148 7678 1 12 . 1 1 49 49 LEU CB C 49 43.192 43.192 42.811 0.381 25148 7679 1 12 . 1 1 49 49 LEU H H 49 9.369 9.369 8.572 0.797 25148 7680 1 12 . 1 1 50 50 ASN N N 50 126.268 126.268 126.079 0.189 25148 7681 1 12 . 1 1 50 50 ASN HA H 50 4.629 4.629 4.795 -0.166 25148 7682 1 12 . 1 1 50 50 ASN C C 50 176.602 176.602 175.552 1.050 25148 7683 1 12 . 1 1 50 50 ASN CA C 50 54.048 54.048 53.188 0.861 25148 7684 1 12 . 1 1 50 50 ASN CB C 50 39.891 39.891 39.446 0.445 25148 7685 1 12 . 1 1 50 50 ASN H H 50 8.672 8.672 9.040 -0.368 25148 7686 1 12 . 1 1 51 51 ARG N N 51 125.897 125.897 125.131 0.766 25148 7687 1 12 . 1 1 51 51 ARG HA H 51 3.789 3.789 4.078 -0.289 25148 7688 1 12 . 1 1 51 51 ARG C C 51 175.681 175.681 176.740 -1.059 25148 7689 1 12 . 1 1 51 51 ARG CA C 51 58.162 58.162 58.342 -0.180 25148 7690 1 12 . 1 1 51 51 ARG CB C 51 29.944 29.944 30.126 -0.182 25148 7691 1 12 . 1 1 51 51 ARG H H 51 8.984 8.984 8.494 0.490 25148 7692 1 12 . 1 1 52 52 GLU N N 52 116.733 116.733 120.376 -3.643 25148 7693 1 12 . 1 1 52 52 GLU HA H 52 4.368 4.368 4.281 0.087 25148 7694 1 12 . 1 1 52 52 GLU C C 52 178.049 178.049 177.483 0.566 25148 7695 1 12 . 1 1 52 52 GLU CA C 52 58.048 58.048 58.262 -0.214 25148 7696 1 12 . 1 1 52 52 GLU CB C 52 30.716 30.716 29.519 1.197 25148 7697 1 12 . 1 1 52 52 GLU H H 52 8.541 8.541 8.128 0.413 25148 7698 1 12 . 1 1 53 53 THR N N 53 106.556 106.556 108.404 -1.848 25148 7699 1 12 . 1 1 53 53 THR HA H 53 4.424 4.424 4.477 -0.053 25148 7700 1 12 . 1 1 53 53 THR C C 53 176.352 176.352 174.754 1.598 25148 7701 1 12 . 1 1 53 53 THR CA C 53 61.320 61.320 61.634 -0.314 25148 7702 1 12 . 1 1 53 53 THR CB C 53 71.220 71.220 69.863 1.357 25148 7703 1 12 . 1 1 53 53 THR H H 53 8.085 8.085 7.772 0.313 25148 7704 1 12 . 1 1 54 54 GLY N N 54 111.843 111.843 110.897 0.946 25148 7705 1 12 . 1 1 54 54 GLY C C 54 172.690 172.690 174.378 -1.688 25148 7706 1 12 . 1 1 54 54 GLY CA C 54 45.417 45.417 46.151 -0.734 25148 7707 1 12 . 1 1 54 54 GLY H H 54 8.330 8.330 7.827 0.503 25148 7708 1 12 . 1 1 55 55 SER N N 55 113.844 113.844 113.715 0.129 25148 7709 1 12 . 1 1 55 55 SER HA H 55 4.279 4.279 4.641 -0.362 25148 7710 1 12 . 1 1 55 55 SER C C 55 174.127 174.127 173.066 1.061 25148 7711 1 12 . 1 1 55 55 SER CA C 55 59.229 59.229 57.981 1.248 25148 7712 1 12 . 1 1 55 55 SER CB C 55 63.939 63.939 65.306 -1.367 25148 7713 1 12 . 1 1 55 55 SER H H 55 7.653 7.653 7.517 0.136 25148 7714 1 12 . 1 1 56 56 ILE N N 56 125.286 125.286 120.185 5.101 25148 7715 1 12 . 1 1 56 56 ILE HA H 56 5.082 5.082 5.038 0.044 25148 7716 1 12 . 1 1 56 56 ILE C C 56 175.346 175.346 174.364 0.982 25148 7717 1 12 . 1 1 56 56 ILE CA C 56 59.967 59.967 60.165 -0.198 25148 7718 1 12 . 1 1 56 56 ILE CB C 56 40.165 40.165 42.466 -2.301 25148 7719 1 12 . 1 1 56 56 ILE H H 56 8.478 8.478 8.463 0.015 25148 7720 1 12 . 1 1 57 57 ARG N N 57 126.332 126.332 128.036 -1.704 25148 7721 1 12 . 1 1 57 57 ARG HA H 57 4.740 4.740 4.646 0.094 25148 7722 1 12 . 1 1 57 57 ARG C C 57 173.921 173.921 173.803 0.118 25148 7723 1 12 . 1 1 57 57 ARG CA C 57 54.311 54.311 53.320 0.991 25148 7724 1 12 . 1 1 57 57 ARG CB C 57 35.805 35.805 33.048 2.757 25148 7725 1 12 . 1 1 57 57 ARG H H 57 8.590 8.590 8.265 0.325 25148 7726 1 12 . 1 1 58 58 VAL N N 58 120.987 120.987 123.683 -2.696 25148 7727 1 12 . 1 1 58 58 VAL HA H 58 4.334 4.334 4.608 -0.274 25148 7728 1 12 . 1 1 58 58 VAL C C 58 174.204 174.204 174.550 -0.346 25148 7729 1 12 . 1 1 58 58 VAL CA C 58 60.861 60.861 60.731 0.130 25148 7730 1 12 . 1 1 58 58 VAL CB C 58 33.383 33.383 31.531 1.852 25148 7731 1 12 . 1 1 58 58 VAL H H 58 8.585 8.585 8.268 0.317 25148 7732 1 12 . 1 1 59 59 PHE N N 59 124.913 124.913 126.445 -1.532 25148 7733 1 12 . 1 1 59 59 PHE HA H 59 5.046 5.046 5.345 -0.299 25148 7734 1 12 . 1 1 59 59 PHE C C 59 174.446 174.446 174.345 0.101 25148 7735 1 12 . 1 1 59 59 PHE CA C 59 56.695 56.695 55.233 1.462 25148 7736 1 12 . 1 1 59 59 PHE CB C 59 42.779 42.779 43.105 -0.326 25148 7737 1 12 . 1 1 59 59 PHE H H 59 8.920 8.920 9.232 -0.312 25148 7738 1 12 . 1 1 60 60 ALA N N 60 124.035 124.035 123.723 0.312 25148 7739 1 12 . 1 1 60 60 ALA HA H 60 5.102 5.102 4.776 0.326 25148 7740 1 12 . 1 1 60 60 ALA C C 60 176.017 176.017 176.660 -0.643 25148 7741 1 12 . 1 1 60 60 ALA CA C 60 50.083 50.083 50.761 -0.678 25148 7742 1 12 . 1 1 60 60 ALA CB C 60 22.400 22.400 20.284 2.116 25148 7743 1 12 . 1 1 60 60 ALA H H 60 9.457 9.457 8.841 0.616 25148 7744 1 12 . 1 1 61 61 ARG N N 61 121.530 121.530 124.750 -3.220 25148 7745 1 12 . 1 1 61 61 ARG HA H 61 4.958 4.958 4.923 0.035 25148 7746 1 12 . 1 1 61 61 ARG C C 61 176.737 176.737 175.836 0.901 25148 7747 1 12 . 1 1 61 61 ARG CA C 61 55.375 55.375 55.845 -0.470 25148 7748 1 12 . 1 1 61 61 ARG CB C 61 31.230 31.230 31.255 -0.025 25148 7749 1 12 . 1 1 61 61 ARG H H 61 8.447 8.447 8.790 -0.343 25148 7750 1 12 . 1 1 62 62 LYS N N 62 124.784 124.784 124.478 0.306 25148 7751 1 12 . 1 1 62 62 LYS HA H 62 4.709 4.709 4.479 0.230 25148 7752 1 12 . 1 1 62 62 LYS C C 62 173.899 173.899 174.721 -0.822 25148 7753 1 12 . 1 1 62 62 LYS CA C 62 54.812 54.812 55.002 -0.190 25148 7754 1 12 . 1 1 62 62 LYS CB C 62 37.147 37.147 35.633 1.514 25148 7755 1 12 . 1 1 62 62 LYS H H 62 9.137 9.137 8.316 0.821 25148 7756 1 12 . 1 1 63 63 ASP N N 63 122.552 122.552 124.869 -2.317 25148 7757 1 12 . 1 1 63 63 ASP HA H 63 4.877 4.877 4.667 0.210 25148 7758 1 12 . 1 1 63 63 ASP C C 63 175.560 175.560 176.673 -1.113 25148 7759 1 12 . 1 1 63 63 ASP CA C 63 54.576 54.576 54.616 -0.040 25148 7760 1 12 . 1 1 63 63 ASP CB C 63 42.841 42.841 41.385 1.456 25148 7761 1 12 . 1 1 63 63 ASP H H 63 8.334 8.334 8.726 -0.392 25148 7762 1 12 . 1 1 64 64 VAL N N 64 123.109 123.109 126.812 -3.703 25148 7763 1 12 . 1 1 64 64 VAL HA H 64 4.557 4.557 4.493 0.064 25148 7764 1 12 . 1 1 64 64 VAL C C 64 177.260 177.260 175.545 1.715 25148 7765 1 12 . 1 1 64 64 VAL CA C 64 62.268 62.268 63.374 -1.106 25148 7766 1 12 . 1 1 64 64 VAL CB C 64 30.348 30.348 31.394 -1.046 25148 7767 1 12 . 1 1 64 64 VAL H H 64 8.693 8.693 8.183 0.510 25148 7768 1 12 . 1 1 65 65 VAL N N 65 122.320 122.320 121.696 0.624 25148 7769 1 12 . 1 1 65 65 VAL HA H 65 4.939 4.939 4.648 0.291 25148 7770 1 12 . 1 1 65 65 VAL C C 65 174.754 174.754 174.738 0.016 25148 7771 1 12 . 1 1 65 65 VAL CA C 65 59.173 59.173 59.422 -0.249 25148 7772 1 12 . 1 1 65 65 VAL CB C 65 36.289 36.289 35.682 0.607 25148 7773 1 12 . 1 1 65 65 VAL H H 65 8.656 8.656 8.733 -0.077 25148 7774 1 12 . 1 1 66 66 ASP N N 66 119.805 119.805 120.537 -0.732 25148 7775 1 12 . 1 1 66 66 ASP HA H 66 4.499 4.499 4.417 0.082 25148 7776 1 12 . 1 1 66 66 ASP C C 66 176.565 176.565 176.042 0.523 25148 7777 1 12 . 1 1 66 66 ASP CA C 66 57.236 57.236 56.511 0.725 25148 7778 1 12 . 1 1 66 66 ASP CB C 66 41.662 41.662 41.283 0.379 25148 7779 1 12 . 1 1 66 66 ASP H H 66 8.628 8.628 8.782 -0.154 25148 7780 1 12 . 1 1 67 67 GLU N N 67 117.604 117.604 116.655 0.949 25148 7781 1 12 . 1 1 67 67 GLU HA H 67 4.350 4.350 4.473 -0.123 25148 7782 1 12 . 1 1 67 67 GLU C C 67 173.736 173.736 175.386 -1.650 25148 7783 1 12 . 1 1 67 67 GLU CA C 67 55.203 55.203 54.232 0.971 25148 7784 1 12 . 1 1 67 67 GLU CB C 67 32.240 32.240 32.624 -0.384 25148 7785 1 12 . 1 1 67 67 GLU H H 67 7.525 7.525 7.944 -0.419 25148 7786 1 12 . 1 1 68 68 VAL N N 68 125.774 125.774 122.787 2.987 25148 7787 1 12 . 1 1 68 68 VAL HA H 68 3.578 3.578 3.864 -0.286 25148 7788 1 12 . 1 1 68 68 VAL C C 68 175.885 175.885 175.479 0.406 25148 7789 1 12 . 1 1 68 68 VAL CA C 68 63.397 63.397 64.224 -0.827 25148 7790 1 12 . 1 1 68 68 VAL CB C 68 32.452 32.452 31.411 1.041 25148 7791 1 12 . 1 1 68 68 VAL H H 68 8.573 8.573 8.437 0.136 25148 7792 1 12 . 1 1 69 69 TYR N N 69 129.859 129.859 126.788 3.071 25148 7793 1 12 . 1 1 69 69 TYR HA H 69 4.642 4.642 4.614 0.028 25148 7794 1 12 . 1 1 69 69 TYR C C 69 176.100 176.100 175.527 0.573 25148 7795 1 12 . 1 1 69 69 TYR CA C 69 59.092 59.092 59.005 0.086 25148 7796 1 12 . 1 1 69 69 TYR CB C 69 39.830 39.830 40.514 -0.684 25148 7797 1 12 . 1 1 69 69 TYR H H 69 9.801 9.801 8.848 0.953 25148 7798 1 12 . 1 1 70 70 ASP N N 70 120.204 120.204 120.736 -0.532 25148 7799 1 12 . 1 1 70 70 ASP HA H 70 4.772 4.772 4.902 -0.130 25148 7800 1 12 . 1 1 70 70 ASP C C 70 176.622 176.622 176.542 0.080 25148 7801 1 12 . 1 1 70 70 ASP CA C 70 52.885 52.885 52.737 0.148 25148 7802 1 12 . 1 1 70 70 ASP CB C 70 41.878 41.878 40.733 1.145 25148 7803 1 12 . 1 1 70 70 ASP H H 70 8.348 8.348 8.068 0.280 25148 7804 1 12 . 1 1 71 71 GLN N N 71 125.440 125.440 122.592 2.848 25148 7805 1 12 . 1 1 71 71 GLN HA H 71 4.315 4.315 4.030 0.285 25148 7806 1 12 . 1 1 71 71 GLN C C 71 175.819 175.819 176.952 -1.133 25148 7807 1 12 . 1 1 71 71 GLN CA C 71 57.914 57.914 58.187 -0.273 25148 7808 1 12 . 1 1 71 71 GLN CB C 71 28.307 28.307 28.287 0.020 25148 7809 1 12 . 1 1 71 71 GLN H H 71 9.097 9.097 8.816 0.281 25148 7810 1 12 . 1 1 72 72 ARG N N 72 116.306 116.306 114.900 1.406 25148 7811 1 12 . 1 1 72 72 ARG HA H 72 4.252 4.252 4.144 0.108 25148 7812 1 12 . 1 1 72 72 ARG C C 72 178.087 178.087 175.713 2.374 25148 7813 1 12 . 1 1 72 72 ARG CA C 72 58.532 58.532 57.781 0.751 25148 7814 1 12 . 1 1 72 72 ARG CB C 72 30.143 30.143 30.751 -0.608 25148 7815 1 12 . 1 1 72 72 ARG H H 72 8.534 8.534 8.019 0.515 25148 7816 1 12 . 1 1 73 73 LEU N N 73 116.734 116.734 113.760 2.974 25148 7817 1 12 . 1 1 73 73 LEU HA H 73 4.621 4.621 4.664 -0.043 25148 7818 1 12 . 1 1 73 73 LEU C C 73 175.946 175.946 174.987 0.959 25148 7819 1 12 . 1 1 73 73 LEU CA C 73 55.250 55.250 55.605 -0.355 25148 7820 1 12 . 1 1 73 73 LEU CB C 73 46.960 46.960 44.456 2.504 25148 7821 1 12 . 1 1 73 73 LEU H H 73 7.460 7.460 7.445 0.015 25148 7822 1 12 . 1 1 74 74 GLU N N 74 118.787 118.787 122.186 -3.399 25148 7823 1 12 . 1 1 74 74 GLU HA H 74 5.403 5.403 4.630 0.773 25148 7824 1 12 . 1 1 74 74 GLU C C 74 173.709 173.709 174.489 -0.780 25148 7825 1 12 . 1 1 74 74 GLU CA C 74 54.914 54.914 55.848 -0.934 25148 7826 1 12 . 1 1 74 74 GLU CB C 74 35.053 35.053 33.392 1.661 25148 7827 1 12 . 1 1 74 74 GLU H H 74 7.752 7.752 8.041 -0.289 25148 7828 1 12 . 1 1 75 75 ILE N N 75 119.803 119.803 123.617 -3.814 25148 7829 1 12 . 1 1 75 75 ILE HA H 75 4.507 4.507 4.562 -0.055 25148 7830 1 12 . 1 1 75 75 ILE C C 75 172.126 172.126 173.783 -1.657 25148 7831 1 12 . 1 1 75 75 ILE CA C 75 58.664 58.664 60.283 -1.619 25148 7832 1 12 . 1 1 75 75 ILE CB C 75 42.560 42.560 42.130 0.430 25148 7833 1 12 . 1 1 75 75 ILE H H 75 8.975 8.975 8.859 0.116 25148 7834 1 12 . 1 1 76 76 SER N N 76 123.236 123.236 123.637 -0.401 25148 7835 1 12 . 1 1 76 76 SER HA H 76 4.505 4.505 4.962 -0.457 25148 7836 1 12 . 1 1 76 76 SER C C 76 176.145 176.145 175.849 0.296 25148 7837 1 12 . 1 1 76 76 SER CA C 76 58.108 58.108 58.775 -0.666 25148 7838 1 12 . 1 1 76 76 SER CB C 76 65.000 65.000 64.171 0.829 25148 7839 1 12 . 1 1 76 76 SER H H 76 8.810 8.810 8.420 0.390 25148 7840 1 12 . 1 1 77 77 ILE N N 77 120.629 120.629 127.547 -6.918 25148 7841 1 12 . 1 1 77 77 ILE HA H 77 3.935 3.935 3.798 0.137 25148 7842 1 12 . 1 1 77 77 ILE C C 77 175.806 175.806 176.688 -0.882 25148 7843 1 12 . 1 1 77 77 ILE CA C 77 61.928 61.928 63.957 -2.029 25148 7844 1 12 . 1 1 77 77 ILE CB C 77 38.031 38.031 38.392 -0.361 25148 7845 1 12 . 1 1 77 77 ILE H H 77 8.321 8.321 8.366 -0.045 25148 7846 1 12 . 1 1 78 78 GLU N N 78 121.032 121.032 117.274 3.758 25148 7847 1 12 . 1 1 78 78 GLU HA H 78 4.082 4.082 4.026 0.056 25148 7848 1 12 . 1 1 78 78 GLU C C 78 179.829 179.829 178.413 1.416 25148 7849 1 12 . 1 1 78 78 GLU CA C 78 60.180 60.180 58.785 1.395 25148 7850 1 12 . 1 1 78 78 GLU CB C 78 28.988 28.988 28.956 0.033 25148 7851 1 12 . 1 1 78 78 GLU H H 78 8.222 8.222 8.460 -0.238 25148 7852 1 12 . 1 1 79 79 GLU N N 79 120.710 120.710 121.142 -0.432 25148 7853 1 12 . 1 1 79 79 GLU HA H 79 4.012 4.012 4.097 -0.085 25148 7854 1 12 . 1 1 79 79 GLU C C 79 180.339 180.339 179.048 1.291 25148 7855 1 12 . 1 1 79 79 GLU CA C 79 59.332 59.332 58.790 0.542 25148 7856 1 12 . 1 1 79 79 GLU CB C 79 29.317 29.317 29.572 -0.255 25148 7857 1 12 . 1 1 79 79 GLU H H 79 7.908 7.908 7.776 0.132 25148 7858 1 12 . 1 1 80 80 ALA N N 80 122.879 122.879 122.004 0.875 25148 7859 1 12 . 1 1 80 80 ALA HA H 80 3.966 3.966 4.130 -0.164 25148 7860 1 12 . 1 1 80 80 ALA C C 80 179.833 179.833 179.961 -0.128 25148 7861 1 12 . 1 1 80 80 ALA CA C 80 55.881 55.881 55.075 0.806 25148 7862 1 12 . 1 1 80 80 ALA CB C 80 18.870 18.870 18.077 0.793 25148 7863 1 12 . 1 1 80 80 ALA H H 80 9.132 9.132 7.992 1.140 25148 7864 1 12 . 1 1 81 81 GLN N N 81 115.829 115.829 116.758 -0.929 25148 7865 1 12 . 1 1 81 81 GLN HA H 81 4.749 4.749 4.322 0.427 25148 7866 1 12 . 1 1 81 81 GLN C C 81 178.126 178.126 178.013 0.113 25148 7867 1 12 . 1 1 81 81 GLN CA C 81 57.682 57.682 58.058 -0.376 25148 7868 1 12 . 1 1 81 81 GLN CB C 81 27.307 27.307 28.650 -1.343 25148 7869 1 12 . 1 1 81 81 GLN H H 81 8.709 8.709 7.786 0.923 25148 7870 1 12 . 1 1 82 82 GLY N N 82 105.531 105.531 106.661 -1.130 25148 7871 1 12 . 1 1 82 82 GLY C C 82 174.917 174.917 175.032 -0.115 25148 7872 1 12 . 1 1 82 82 GLY CA C 82 45.915 45.915 46.520 -0.605 25148 7873 1 12 . 1 1 82 82 GLY H H 82 7.479 7.479 8.017 -0.538 25148 7874 1 12 . 1 1 83 83 ILE N N 83 122.828 122.828 113.759 9.069 25148 7875 1 12 . 1 1 83 83 ILE HA H 83 3.970 3.970 4.443 -0.473 25148 7876 1 12 . 1 1 83 83 ILE C C 83 177.209 177.209 175.549 1.660 25148 7877 1 12 . 1 1 83 83 ILE CA C 83 64.305 64.305 61.639 2.667 25148 7878 1 12 . 1 1 83 83 ILE CB C 83 38.452 38.452 40.212 -1.760 25148 7879 1 12 . 1 1 83 83 ILE H H 83 7.634 7.634 7.551 0.083 25148 7880 1 12 . 1 1 84 84 HIS N N 84 118.927 118.927 120.044 -1.117 25148 7881 1 12 . 1 1 84 84 HIS HA H 84 4.713 4.713 4.938 -0.225 25148 7882 1 12 . 1 1 84 84 HIS CA C 84 55.487 55.487 54.445 1.042 25148 7883 1 12 . 1 1 84 84 HIS CB C 84 33.506 33.506 32.307 1.199 25148 7884 1 12 . 1 1 84 84 HIS H H 84 8.155 8.155 8.414 -0.259 25148 7885 1 12 . 1 1 85 85 PRO HA H 85 4.456 4.456 4.639 -0.183 25148 7886 1 12 . 1 1 85 85 PRO C C 85 177.357 177.357 177.284 0.073 25148 7887 1 12 . 1 1 85 85 PRO CA C 85 64.475 64.475 64.109 0.366 25148 7888 1 12 . 1 1 85 85 PRO CB C 85 32.489 32.489 32.128 0.361 25148 7889 1 12 . 1 1 86 86 GLU N N 86 116.314 116.314 117.819 -1.505 25148 7890 1 12 . 1 1 86 86 GLU HA H 86 4.286 4.286 4.102 0.184 25148 7891 1 12 . 1 1 86 86 GLU C C 86 177.624 177.624 177.357 0.267 25148 7892 1 12 . 1 1 86 86 GLU CA C 86 56.619 56.619 57.287 -0.668 25148 7893 1 12 . 1 1 86 86 GLU CB C 86 29.389 29.389 29.673 -0.284 25148 7894 1 12 . 1 1 86 86 GLU H H 86 8.938 8.938 7.755 1.183 25148 7895 1 12 . 1 1 87 87 TYR N N 87 119.773 119.773 120.050 -0.277 25148 7896 1 12 . 1 1 87 87 TYR HA H 87 4.744 4.744 4.231 0.513 25148 7897 1 12 . 1 1 87 87 TYR C C 87 174.533 174.533 176.056 -1.523 25148 7898 1 12 . 1 1 87 87 TYR CA C 87 59.117 59.117 59.799 -0.682 25148 7899 1 12 . 1 1 87 87 TYR CB C 87 38.859 38.859 38.805 0.054 25148 7900 1 12 . 1 1 87 87 TYR H H 87 7.447 7.447 7.378 0.069 25148 7901 1 12 . 1 1 88 88 MET N N 88 118.298 118.298 117.214 1.084 25148 7902 1 12 . 1 1 88 88 MET HA H 88 4.770 4.770 4.678 0.092 25148 7903 1 12 . 1 1 88 88 MET C C 88 175.638 175.638 173.982 1.656 25148 7904 1 12 . 1 1 88 88 MET CA C 88 53.133 53.133 54.598 -1.465 25148 7905 1 12 . 1 1 88 88 MET CB C 88 37.102 37.102 35.532 1.571 25148 7906 1 12 . 1 1 88 88 MET H H 88 9.023 9.023 8.287 0.736 25148 7907 1 12 . 1 1 89 89 VAL N N 89 120.157 120.157 123.463 -3.306 25148 7908 1 12 . 1 1 89 89 VAL HA H 89 3.330 3.330 3.727 -0.397 25148 7909 1 12 . 1 1 89 89 VAL C C 89 177.432 177.432 177.123 0.309 25148 7910 1 12 . 1 1 89 89 VAL CA C 89 65.675 65.675 63.605 2.070 25148 7911 1 12 . 1 1 89 89 VAL CB C 89 31.321 31.321 30.087 1.234 25148 7912 1 12 . 1 1 89 89 VAL H H 89 8.313 8.313 8.590 -0.277 25148 7913 1 12 . 1 1 90 90 GLY N N 90 116.935 116.935 116.295 0.640 25148 7914 1 12 . 1 1 90 90 GLY C C 90 175.196 175.196 174.345 0.851 25148 7915 1 12 . 1 1 90 90 GLY CA C 90 44.685 44.685 44.849 -0.164 25148 7916 1 12 . 1 1 90 90 GLY H H 90 8.551 8.551 9.018 -0.467 25148 7917 1 12 . 1 1 91 91 ASP N N 91 121.616 121.616 121.936 -0.320 25148 7918 1 12 . 1 1 91 91 ASP HA H 91 4.790 4.790 4.894 -0.104 25148 7919 1 12 . 1 1 91 91 ASP C C 91 174.431 174.431 174.971 -0.540 25148 7920 1 12 . 1 1 91 91 ASP CA C 91 55.011 55.011 54.247 0.764 25148 7921 1 12 . 1 1 91 91 ASP CB C 91 42.079 42.079 42.103 -0.024 25148 7922 1 12 . 1 1 91 91 ASP H H 91 8.073 8.073 8.077 -0.004 25148 7923 1 12 . 1 1 92 92 VAL N N 92 118.919 118.919 115.321 3.598 25148 7924 1 12 . 1 1 92 92 VAL HA H 92 4.709 4.709 5.044 -0.335 25148 7925 1 12 . 1 1 92 92 VAL C C 92 175.602 175.602 174.157 1.445 25148 7926 1 12 . 1 1 92 92 VAL CA C 92 61.527 61.527 59.501 2.026 25148 7927 1 12 . 1 1 92 92 VAL CB C 92 34.110 34.110 35.200 -1.090 25148 7928 1 12 . 1 1 92 92 VAL H H 92 8.216 8.216 8.010 0.206 25148 7929 1 12 . 1 1 93 93 VAL N N 93 123.922 123.922 121.911 2.011 25148 7930 1 12 . 1 1 93 93 VAL HA H 93 4.231 4.231 4.289 -0.058 25148 7931 1 12 . 1 1 93 93 VAL C C 93 174.105 174.105 174.048 0.057 25148 7932 1 12 . 1 1 93 93 VAL CA C 93 59.644 59.644 59.263 0.381 25148 7933 1 12 . 1 1 93 93 VAL CB C 93 34.661 34.661 34.339 0.322 25148 7934 1 12 . 1 1 93 93 VAL H H 93 8.812 8.812 7.906 0.906 25148 7935 1 12 . 1 1 94 94 GLU N N 94 123.605 123.605 127.555 -3.950 25148 7936 1 12 . 1 1 94 94 GLU HA H 94 5.347 5.347 5.245 0.102 25148 7937 1 12 . 1 1 94 94 GLU C C 94 175.708 175.708 175.464 0.244 25148 7938 1 12 . 1 1 94 94 GLU CA C 94 54.979 54.979 54.845 0.134 25148 7939 1 12 . 1 1 94 94 GLU CB C 94 31.612 31.612 32.287 -0.675 25148 7940 1 12 . 1 1 94 94 GLU H H 94 8.312 8.312 8.444 -0.132 25148 7941 1 12 . 1 1 95 95 ILE N N 95 123.581 123.581 123.393 0.188 25148 7942 1 12 . 1 1 95 95 ILE HA H 95 4.601 4.601 4.511 0.090 25148 7943 1 12 . 1 1 95 95 ILE C C 95 175.081 175.081 175.122 -0.041 25148 7944 1 12 . 1 1 95 95 ILE CA C 95 58.601 58.601 59.680 -1.079 25148 7945 1 12 . 1 1 95 95 ILE CB C 95 41.727 41.727 42.184 -0.457 25148 7946 1 12 . 1 1 95 95 ILE H H 95 9.045 9.045 8.247 0.798 25148 7947 1 12 . 1 1 96 96 GLU N N 96 128.094 128.094 128.210 -0.116 25148 7948 1 12 . 1 1 96 96 GLU HA H 96 4.098 4.098 4.226 -0.128 25148 7949 1 12 . 1 1 96 96 GLU C C 96 176.845 176.845 175.650 1.195 25148 7950 1 12 . 1 1 96 96 GLU CA C 96 57.853 57.853 58.046 -0.193 25148 7951 1 12 . 1 1 96 96 GLU CB C 96 28.323 28.323 29.213 -0.890 25148 7952 1 12 . 1 1 96 96 GLU H H 96 9.256 9.256 8.950 0.306 25148 7953 1 12 . 1 1 97 97 VAL N N 97 118.446 118.446 123.966 -5.520 25148 7954 1 12 . 1 1 97 97 VAL HA H 97 4.568 4.568 4.245 0.323 25148 7955 1 12 . 1 1 97 97 VAL C C 97 175.051 175.051 175.167 -0.116 25148 7956 1 12 . 1 1 97 97 VAL CA C 97 59.796 59.796 60.975 -1.179 25148 7957 1 12 . 1 1 97 97 VAL CB C 97 32.399 32.399 33.125 -0.726 25148 7958 1 12 . 1 1 97 97 VAL H H 97 8.609 8.609 8.893 -0.284 25148 7959 1 12 . 1 1 98 98 THR N N 98 119.118 119.118 117.723 1.395 25148 7960 1 12 . 1 1 98 98 THR HA H 98 3.320 3.320 3.927 -0.607 25148 7961 1 12 . 1 1 98 98 THR CA C 98 61.628 61.628 59.402 2.226 25148 7962 1 12 . 1 1 98 98 THR CB C 98 70.031 70.031 69.212 0.819 25148 7963 1 12 . 1 1 98 98 THR H H 98 7.396 7.396 7.453 -0.057 25148 7964 1 12 . 1 1 99 99 PRO HA H 99 4.458 4.458 4.621 -0.163 25148 7965 1 12 . 1 1 99 99 PRO CA C 99 62.348 62.348 62.464 -0.116 25148 7966 1 12 . 1 1 99 99 PRO CB C 99 33.182 33.182 32.717 0.466 25148 7967 1 12 . 1 1 100 100 LYS HA H 100 4.126 4.126 4.158 -0.032 25148 7968 1 12 . 1 1 100 100 LYS CA C 100 58.773 58.773 57.867 0.906 25148 7969 1 12 . 1 1 100 100 LYS CB C 100 32.195 32.195 32.441 -0.246 25148 7970 1 12 . 1 1 101 101 ASP HA H 101 4.924 4.924 4.787 0.137 25148 7971 1 12 . 1 1 101 101 ASP C C 101 176.884 176.884 176.703 0.181 25148 7972 1 12 . 1 1 101 101 ASP CA C 101 54.134 54.134 54.115 0.019 25148 7973 1 12 . 1 1 101 101 ASP CB C 101 40.272 40.272 40.849 -0.577 25148 7974 1 12 . 1 1 102 102 PHE N N 102 118.703 118.703 121.207 -2.504 25148 7975 1 12 . 1 1 102 102 PHE HA H 102 4.295 4.295 4.245 0.050 25148 7976 1 12 . 1 1 102 102 PHE C C 102 176.477 176.477 177.000 -0.523 25148 7977 1 12 . 1 1 102 102 PHE CA C 102 60.748 60.748 59.897 0.851 25148 7978 1 12 . 1 1 102 102 PHE CB C 102 39.667 39.667 39.186 0.481 25148 7979 1 12 . 1 1 102 102 PHE H H 102 7.862 7.862 7.703 0.159 25148 7980 1 12 . 1 1 103 103 GLY CA C 103 47.430 47.430 47.311 0.119 25148 7981 1 12 . 1 1 104 104 ARG N N 104 121.819 121.819 120.470 1.349 25148 7982 1 12 . 1 1 104 104 ARG HA H 104 4.176 4.176 4.214 -0.038 25148 7983 1 12 . 1 1 104 104 ARG C C 104 178.912 178.912 178.515 0.397 25148 7984 1 12 . 1 1 104 104 ARG CA C 104 59.235 59.235 57.106 2.129 25148 7985 1 12 . 1 1 104 104 ARG CB C 104 30.000 30.000 29.871 0.129 25148 7986 1 12 . 1 1 104 104 ARG H H 104 7.809 7.809 7.491 0.318 25148 7987 1 12 . 1 1 105 105 ILE N N 105 120.331 120.331 120.560 -0.229 25148 7988 1 12 . 1 1 105 105 ILE HA H 105 3.836 3.836 3.573 0.263 25148 7989 1 12 . 1 1 105 105 ILE C C 105 179.206 179.206 177.357 1.849 25148 7990 1 12 . 1 1 105 105 ILE CA C 105 63.025 63.025 64.611 -1.586 25148 7991 1 12 . 1 1 105 105 ILE CB C 105 38.127 38.127 37.084 1.043 25148 7992 1 12 . 1 1 105 105 ILE H H 105 7.203 7.203 7.382 -0.179 25148 7993 1 12 . 1 1 106 106 ALA N N 106 124.867 124.867 122.209 2.658 25148 7994 1 12 . 1 1 106 106 ALA HA H 106 3.665 3.665 3.578 0.087 25148 7995 1 12 . 1 1 106 106 ALA C C 106 178.590 178.590 178.965 -0.375 25148 7996 1 12 . 1 1 106 106 ALA CA C 106 54.842 54.842 55.202 -0.360 25148 7997 1 12 . 1 1 106 106 ALA CB C 106 18.659 18.659 17.720 0.939 25148 7998 1 12 . 1 1 106 106 ALA H H 106 8.813 8.813 8.279 0.534 25148 7999 1 12 . 1 1 107 107 ALA N N 107 119.597 119.597 120.469 -0.872 25148 8000 1 12 . 1 1 107 107 ALA HA H 107 4.014 4.014 4.021 -0.007 25148 8001 1 12 . 1 1 107 107 ALA C C 107 180.214 180.214 179.624 0.590 25148 8002 1 12 . 1 1 107 107 ALA CA C 107 55.454 55.454 54.641 0.813 25148 8003 1 12 . 1 1 107 107 ALA CB C 107 18.260 18.260 18.124 0.136 25148 8004 1 12 . 1 1 107 107 ALA H H 107 8.012 8.012 7.630 0.382 25148 8005 1 12 . 1 1 108 108 GLN N N 108 116.896 116.896 118.211 -1.315 25148 8006 1 12 . 1 1 108 108 GLN HA H 108 4.054 4.054 3.935 0.119 25148 8007 1 12 . 1 1 108 108 GLN C C 108 178.784 178.784 178.513 0.271 25148 8008 1 12 . 1 1 108 108 GLN CA C 108 58.705 58.705 59.174 -0.469 25148 8009 1 12 . 1 1 108 108 GLN CB C 108 28.647 28.647 28.648 -0.001 25148 8010 1 12 . 1 1 108 108 GLN H H 108 7.498 7.498 8.115 -0.617 25148 8011 1 12 . 1 1 109 109 THR N N 109 117.495 117.495 115.032 2.463 25148 8012 1 12 . 1 1 109 109 THR HA H 109 3.917 3.917 4.122 -0.205 25148 8013 1 12 . 1 1 109 109 THR C C 109 175.732 175.732 175.909 -0.177 25148 8014 1 12 . 1 1 109 109 THR CA C 109 66.989 66.989 65.694 1.295 25148 8015 1 12 . 1 1 109 109 THR CB C 109 68.766 68.766 68.835 -0.069 25148 8016 1 12 . 1 1 109 109 THR H H 109 8.203 8.203 8.276 -0.073 25148 8017 1 12 . 1 1 110 110 ALA N N 110 122.308 122.308 125.293 -2.985 25148 8018 1 12 . 1 1 110 110 ALA HA H 110 3.854 3.854 4.030 -0.176 25148 8019 1 12 . 1 1 110 110 ALA C C 110 178.380 178.380 178.773 -0.393 25148 8020 1 12 . 1 1 110 110 ALA CA C 110 55.903 55.903 55.185 0.718 25148 8021 1 12 . 1 1 110 110 ALA CB C 110 18.524 18.524 18.377 0.147 25148 8022 1 12 . 1 1 110 110 ALA H H 110 8.668 8.668 7.796 0.872 25148 8023 1 12 . 1 1 111 111 LYS N N 111 115.552 115.552 118.501 -2.949 25148 8024 1 12 . 1 1 111 111 LYS HA H 111 3.923 3.923 3.900 0.023 25148 8025 1 12 . 1 1 111 111 LYS C C 111 179.111 179.111 178.691 0.420 25148 8026 1 12 . 1 1 111 111 LYS CA C 111 59.825 59.825 59.403 0.422 25148 8027 1 12 . 1 1 111 111 LYS CB C 111 32.251 32.251 31.639 0.612 25148 8028 1 12 . 1 1 111 111 LYS H H 111 7.642 7.642 8.531 -0.889 25148 8029 1 12 . 1 1 112 112 GLN N N 112 120.178 120.178 118.632 1.546 25148 8030 1 12 . 1 1 112 112 GLN HA H 112 4.060 4.060 4.068 -0.008 25148 8031 1 12 . 1 1 112 112 GLN C C 112 178.355 178.355 178.267 0.088 25148 8032 1 12 . 1 1 112 112 GLN CA C 112 59.240 59.240 58.258 0.982 25148 8033 1 12 . 1 1 112 112 GLN CB C 112 28.250 28.250 28.298 -0.048 25148 8034 1 12 . 1 1 112 112 GLN H H 112 7.798 7.798 7.611 0.187 25148 8035 1 12 . 1 1 113 113 VAL N N 113 119.799 119.799 120.294 -0.495 25148 8036 1 12 . 1 1 113 113 VAL HA H 113 3.705 3.705 3.733 -0.028 25148 8037 1 12 . 1 1 113 113 VAL C C 113 178.303 178.303 177.909 0.394 25148 8038 1 12 . 1 1 113 113 VAL CA C 113 66.277 66.277 66.456 -0.179 25148 8039 1 12 . 1 1 113 113 VAL CB C 113 31.954 31.954 32.138 -0.184 25148 8040 1 12 . 1 1 113 113 VAL H H 113 8.105 8.105 7.131 0.974 25148 8041 1 12 . 1 1 114 114 VAL N N 114 118.265 118.265 117.517 0.748 25148 8042 1 12 . 1 1 114 114 VAL HA H 114 3.392 3.392 3.656 -0.264 25148 8043 1 12 . 1 1 114 114 VAL C C 114 177.360 177.360 177.739 -0.379 25148 8044 1 12 . 1 1 114 114 VAL CA C 114 67.832 67.832 65.969 1.863 25148 8045 1 12 . 1 1 114 114 VAL CB C 114 31.801 31.801 30.408 1.393 25148 8046 1 12 . 1 1 114 114 VAL H H 114 8.180 8.180 8.283 -0.103 25148 8047 1 12 . 1 1 115 115 THR N N 115 113.460 113.460 115.877 -2.417 25148 8048 1 12 . 1 1 115 115 THR HA H 115 3.856 3.856 3.887 -0.031 25148 8049 1 12 . 1 1 115 115 THR C C 115 176.529 176.529 176.913 -0.384 25148 8050 1 12 . 1 1 115 115 THR CA C 115 66.706 66.706 66.829 -0.123 25148 8051 1 12 . 1 1 115 115 THR CB C 115 69.008 69.008 68.184 0.824 25148 8052 1 12 . 1 1 115 115 THR H H 115 8.143 8.143 8.219 -0.076 25148 8053 1 12 . 1 1 116 116 GLN N N 116 120.129 120.129 119.916 0.213 25148 8054 1 12 . 1 1 116 116 GLN HA H 116 4.054 4.054 3.949 0.105 25148 8055 1 12 . 1 1 116 116 GLN C C 116 178.100 178.100 178.148 -0.048 25148 8056 1 12 . 1 1 116 116 GLN CA C 116 58.950 58.950 59.269 -0.319 25148 8057 1 12 . 1 1 116 116 GLN CB C 116 28.244 28.244 28.605 -0.360 25148 8058 1 12 . 1 1 116 116 GLN H H 116 7.936 7.936 7.751 0.185 25148 8059 1 12 . 1 1 117 117 ARG N N 117 117.838 117.838 119.806 -1.968 25148 8060 1 12 . 1 1 117 117 ARG HA H 117 4.174 4.174 4.067 0.107 25148 8061 1 12 . 1 1 117 117 ARG C C 117 179.138 179.138 178.829 0.309 25148 8062 1 12 . 1 1 117 117 ARG CA C 117 57.461 57.461 58.180 -0.719 25148 8063 1 12 . 1 1 117 117 ARG CB C 117 29.548 29.548 29.242 0.306 25148 8064 1 12 . 1 1 117 117 ARG H H 117 8.240 8.240 7.581 0.659 25148 8065 1 12 . 1 1 118 118 VAL N N 118 120.278 120.278 118.501 1.777 25148 8066 1 12 . 1 1 118 118 VAL HA H 118 3.709 3.709 3.671 0.038 25148 8067 1 12 . 1 1 118 118 VAL C C 118 177.597 177.597 178.002 -0.405 25148 8068 1 12 . 1 1 118 118 VAL CA C 118 66.246 66.246 65.712 0.534 25148 8069 1 12 . 1 1 118 118 VAL CB C 118 31.785 31.785 30.816 0.969 25148 8070 1 12 . 1 1 118 118 VAL H H 118 8.480 8.480 8.386 0.094 25148 8071 1 12 . 1 1 119 119 ARG N N 119 120.197 120.197 119.125 1.072 25148 8072 1 12 . 1 1 119 119 ARG HA H 119 4.173 4.173 4.101 0.072 25148 8073 1 12 . 1 1 119 119 ARG C C 119 178.864 178.864 179.213 -0.349 25148 8074 1 12 . 1 1 119 119 ARG CA C 119 58.772 58.772 59.078 -0.306 25148 8075 1 12 . 1 1 119 119 ARG CB C 119 29.873 29.873 30.033 -0.160 25148 8076 1 12 . 1 1 119 119 ARG H H 119 7.899 7.899 7.579 0.320 25148 8077 1 12 . 1 1 120 120 GLU N N 120 118.768 118.768 119.592 -0.824 25148 8078 1 12 . 1 1 120 120 GLU HA H 120 4.110 4.110 4.061 0.049 25148 8079 1 12 . 1 1 120 120 GLU C C 120 177.823 177.823 178.933 -1.110 25148 8080 1 12 . 1 1 120 120 GLU CA C 120 58.223 58.223 59.033 -0.810 25148 8081 1 12 . 1 1 120 120 GLU CB C 120 29.854 29.854 29.148 0.707 25148 8082 1 12 . 1 1 120 120 GLU H H 120 8.084 8.084 7.957 0.127 25148 8083 1 12 . 1 1 121 121 ALA N N 121 121.984 121.984 120.055 1.929 25148 8084 1 12 . 1 1 121 121 ALA HA H 121 4.296 4.296 4.093 0.203 25148 8085 1 12 . 1 1 121 121 ALA C C 121 178.586 178.586 178.264 0.322 25148 8086 1 12 . 1 1 121 121 ALA CA C 121 53.475 53.475 54.619 -1.144 25148 8087 1 12 . 1 1 121 121 ALA CB C 121 18.856 18.856 18.547 0.308 25148 8088 1 12 . 1 1 121 121 ALA H H 121 7.810 7.810 8.294 -0.484 25148 8089 1 12 . 1 1 122 122 GLU N N 122 118.229 118.229 115.816 2.413 25148 8090 1 12 . 1 1 122 122 GLU HA H 122 4.241 4.241 4.330 -0.089 25148 8091 1 12 . 1 1 122 122 GLU C C 122 176.839 176.839 176.996 -0.157 25148 8092 1 12 . 1 1 122 122 GLU CA C 122 57.118 57.118 56.711 0.407 25148 8093 1 12 . 1 1 122 122 GLU CB C 122 30.018 30.018 29.507 0.511 25148 8094 1 12 . 1 1 122 122 GLU H H 122 7.938 7.938 7.522 0.416 25148 8095 1 12 . 1 1 123 123 ARG N N 123 120.601 120.601 117.718 2.883 25148 8096 1 12 . 1 1 123 123 ARG HA H 123 4.348 4.348 4.518 -0.170 25148 8097 1 12 . 1 1 123 123 ARG C C 123 176.071 176.071 176.857 -0.786 25148 8098 1 12 . 1 1 123 123 ARG CA C 123 56.510 56.510 55.713 0.797 25148 8099 1 12 . 1 1 123 123 ARG CB C 123 30.765 30.765 31.834 -1.069 25148 8100 1 12 . 1 1 123 123 ARG H H 123 7.977 7.977 8.064 -0.087 25148 8101 1 13 . 1 1 4 4 GLU HA H 4 4.138 4.138 4.161 -0.023 25148 8102 1 13 . 1 1 4 4 GLU C C 4 179.152 179.152 177.952 1.200 25148 8103 1 13 . 1 1 4 4 GLU CA C 4 59.566 59.566 58.930 0.636 25148 8104 1 13 . 1 1 4 4 GLU CB C 4 29.407 29.407 29.422 -0.015 25148 8105 1 13 . 1 1 5 5 LEU N N 5 121.360 121.360 117.708 3.652 25148 8106 1 13 . 1 1 5 5 LEU HA H 5 4.195 4.195 4.058 0.137 25148 8107 1 13 . 1 1 5 5 LEU C C 5 178.179 178.179 177.996 0.183 25148 8108 1 13 . 1 1 5 5 LEU CA C 5 57.830 57.830 57.854 -0.024 25148 8109 1 13 . 1 1 5 5 LEU CB C 5 41.630 41.630 41.105 0.525 25148 8110 1 13 . 1 1 5 5 LEU H H 5 7.877 7.877 7.938 -0.061 25148 8111 1 13 . 1 1 6 6 LEU N N 6 118.058 118.058 118.601 -0.543 25148 8112 1 13 . 1 1 6 6 LEU HA H 6 3.919 3.919 3.868 0.051 25148 8113 1 13 . 1 1 6 6 LEU C C 6 180.274 180.274 178.981 1.293 25148 8114 1 13 . 1 1 6 6 LEU CA C 6 58.221 58.221 57.892 0.329 25148 8115 1 13 . 1 1 6 6 LEU CB C 6 40.684 40.684 41.109 -0.425 25148 8116 1 13 . 1 1 6 6 LEU H H 6 7.685 7.685 7.454 0.231 25148 8117 1 13 . 1 1 7 7 ASP N N 7 120.662 120.662 117.988 2.674 25148 8118 1 13 . 1 1 7 7 ASP HA H 7 4.416 4.416 4.340 0.076 25148 8119 1 13 . 1 1 7 7 ASP C C 7 178.738 178.738 177.626 1.112 25148 8120 1 13 . 1 1 7 7 ASP CA C 7 57.519 57.519 56.844 0.675 25148 8121 1 13 . 1 1 7 7 ASP CB C 7 40.167 40.167 40.922 -0.755 25148 8122 1 13 . 1 1 7 7 ASP H H 7 8.427 8.427 7.714 0.713 25148 8123 1 13 . 1 1 8 8 ALA N N 8 122.612 122.612 122.666 -0.054 25148 8124 1 13 . 1 1 8 8 ALA HA H 8 4.146 4.146 4.033 0.113 25148 8125 1 13 . 1 1 8 8 ALA C C 8 180.787 180.787 179.928 0.859 25148 8126 1 13 . 1 1 8 8 ALA CA C 8 55.165 55.165 54.950 0.215 25148 8127 1 13 . 1 1 8 8 ALA CB C 8 17.711 17.711 18.237 -0.526 25148 8128 1 13 . 1 1 8 8 ALA H H 8 7.847 7.847 7.443 0.404 25148 8129 1 13 . 1 1 9 9 LEU N N 9 116.977 116.977 117.866 -0.889 25148 8130 1 13 . 1 1 9 9 LEU HA H 9 4.115 4.115 3.852 0.263 25148 8131 1 13 . 1 1 9 9 LEU C C 9 179.510 179.510 179.303 0.207 25148 8132 1 13 . 1 1 9 9 LEU CA C 9 57.468 57.468 57.982 -0.514 25148 8133 1 13 . 1 1 9 9 LEU CB C 9 41.203 41.203 41.581 -0.378 25148 8134 1 13 . 1 1 9 9 LEU H H 9 8.256 8.256 7.606 0.650 25148 8135 1 13 . 1 1 10 10 THR N N 10 118.764 118.764 115.606 3.158 25148 8136 1 13 . 1 1 10 10 THR HA H 10 4.487 4.487 3.894 0.593 25148 8137 1 13 . 1 1 10 10 THR C C 10 176.567 176.567 176.646 -0.079 25148 8138 1 13 . 1 1 10 10 THR CA C 10 68.768 68.768 67.093 1.675 25148 8139 1 13 . 1 1 10 10 THR CB C 10 66.961 66.961 68.513 -1.552 25148 8140 1 13 . 1 1 10 10 THR H H 10 8.218 8.218 7.425 0.793 25148 8141 1 13 . 1 1 11 11 ILE N N 11 122.555 122.555 119.777 2.778 25148 8142 1 13 . 1 1 11 11 ILE HA H 11 3.779 3.779 3.690 0.089 25148 8143 1 13 . 1 1 11 11 ILE C C 11 177.793 177.793 177.393 0.400 25148 8144 1 13 . 1 1 11 11 ILE CA C 11 64.695 64.695 64.940 -0.245 25148 8145 1 13 . 1 1 11 11 ILE CB C 11 37.856 37.856 37.711 0.145 25148 8146 1 13 . 1 1 11 11 ILE H H 11 7.632 7.632 7.761 -0.129 25148 8147 1 13 . 1 1 12 12 LEU N N 12 120.469 120.469 117.329 3.140 25148 8148 1 13 . 1 1 12 12 LEU HA H 12 4.065 4.065 4.070 -0.005 25148 8149 1 13 . 1 1 12 12 LEU C C 12 179.139 179.139 179.173 -0.034 25148 8150 1 13 . 1 1 12 12 LEU CA C 12 57.944 57.944 57.005 0.939 25148 8151 1 13 . 1 1 12 12 LEU CB C 12 42.170 42.170 41.393 0.777 25148 8152 1 13 . 1 1 12 12 LEU H H 12 7.951 7.951 7.682 0.269 25148 8153 1 13 . 1 1 13 13 GLU N N 13 119.669 119.669 120.023 -0.354 25148 8154 1 13 . 1 1 13 13 GLU HA H 13 4.183 4.183 3.977 0.206 25148 8155 1 13 . 1 1 13 13 GLU C C 13 179.007 179.007 177.850 1.157 25148 8156 1 13 . 1 1 13 13 GLU CA C 13 59.703 59.703 58.841 0.862 25148 8157 1 13 . 1 1 13 13 GLU CB C 13 30.110 30.110 29.290 0.820 25148 8158 1 13 . 1 1 13 13 GLU H H 13 8.003 8.003 7.766 0.237 25148 8159 1 13 . 1 1 14 14 LYS N N 14 118.935 118.935 117.376 1.559 25148 8160 1 13 . 1 1 14 14 LYS HA H 14 4.124 4.124 4.091 0.033 25148 8161 1 13 . 1 1 14 14 LYS CA C 14 58.847 58.847 57.786 1.061 25148 8162 1 13 . 1 1 14 14 LYS CB C 14 33.053 33.053 32.567 0.486 25148 8163 1 13 . 1 1 14 14 LYS H H 14 7.862 7.862 7.361 0.501 25148 8164 1 13 . 1 1 15 15 GLU HA H 15 3.693 3.693 4.260 -0.567 25148 8165 1 13 . 1 1 15 15 GLU CA C 15 56.688 56.688 56.327 0.361 25148 8166 1 13 . 1 1 15 15 GLU CB C 15 32.204 32.204 30.280 1.924 25148 8167 1 13 . 1 1 16 16 LYS HA H 16 4.678 4.678 4.370 0.308 25148 8168 1 13 . 1 1 16 16 LYS CA C 16 55.135 55.135 55.807 -0.672 25148 8169 1 13 . 1 1 16 16 LYS CB C 16 34.049 34.049 32.997 1.052 25148 8170 1 13 . 1 1 17 17 GLY CA C 17 46.541 46.541 45.058 1.483 25148 8171 1 13 . 1 1 18 18 ILE N N 18 115.364 115.364 120.205 -4.841 25148 8172 1 13 . 1 1 18 18 ILE HA H 18 4.079 4.079 4.235 -0.156 25148 8173 1 13 . 1 1 18 18 ILE C C 18 174.751 174.751 175.315 -0.564 25148 8174 1 13 . 1 1 18 18 ILE CA C 18 60.333 60.333 59.876 0.457 25148 8175 1 13 . 1 1 18 18 ILE CB C 18 39.044 39.044 37.740 1.304 25148 8176 1 13 . 1 1 18 18 ILE H H 18 8.203 8.203 7.714 0.489 25148 8177 1 13 . 1 1 19 19 SER N N 19 119.891 119.891 119.884 0.007 25148 8178 1 13 . 1 1 19 19 SER HA H 19 4.362 4.362 4.327 0.035 25148 8179 1 13 . 1 1 19 19 SER CA C 19 58.476 58.476 59.195 -0.719 25148 8180 1 13 . 1 1 19 19 SER CB C 19 63.533 63.533 64.396 -0.863 25148 8181 1 13 . 1 1 19 19 SER H H 19 8.253 8.253 8.537 -0.284 25148 8182 1 13 . 1 1 20 20 LYS N N 20 124.782 124.782 127.506 -2.724 25148 8183 1 13 . 1 1 20 20 LYS HA H 20 4.137 4.137 4.036 0.101 25148 8184 1 13 . 1 1 20 20 LYS C C 20 177.889 177.889 177.777 0.112 25148 8185 1 13 . 1 1 20 20 LYS CA C 20 59.485 59.485 58.757 0.728 25148 8186 1 13 . 1 1 20 20 LYS CB C 20 32.711 32.711 32.242 0.469 25148 8187 1 13 . 1 1 20 20 LYS H H 20 8.918 8.918 8.790 0.128 25148 8188 1 13 . 1 1 21 21 GLU N N 21 117.831 117.831 118.084 -0.253 25148 8189 1 13 . 1 1 21 21 GLU HA H 21 3.957 3.957 4.081 -0.124 25148 8190 1 13 . 1 1 21 21 GLU C C 21 178.822 178.822 178.806 0.016 25148 8191 1 13 . 1 1 21 21 GLU CA C 21 59.529 59.529 59.299 0.230 25148 8192 1 13 . 1 1 21 21 GLU CB C 21 29.237 29.237 29.111 0.126 25148 8193 1 13 . 1 1 21 21 GLU H H 21 8.361 8.361 8.638 -0.277 25148 8194 1 13 . 1 1 22 22 ILE N N 22 118.690 118.690 117.749 0.941 25148 8195 1 13 . 1 1 22 22 ILE HA H 22 3.884 3.884 3.975 -0.091 25148 8196 1 13 . 1 1 22 22 ILE C C 22 179.247 179.247 177.772 1.475 25148 8197 1 13 . 1 1 22 22 ILE CA C 22 63.735 63.735 63.396 0.339 25148 8198 1 13 . 1 1 22 22 ILE CB C 22 37.415 37.415 38.018 -0.603 25148 8199 1 13 . 1 1 22 22 ILE H H 22 7.353 7.353 7.404 -0.051 25148 8200 1 13 . 1 1 23 23 ILE N N 23 120.880 120.880 120.935 -0.055 25148 8201 1 13 . 1 1 23 23 ILE HA H 23 3.733 3.733 3.706 0.027 25148 8202 1 13 . 1 1 23 23 ILE C C 23 177.817 177.817 177.851 -0.034 25148 8203 1 13 . 1 1 23 23 ILE CA C 23 64.172 64.172 63.379 0.793 25148 8204 1 13 . 1 1 23 23 ILE CB C 23 36.473 36.473 36.860 -0.387 25148 8205 1 13 . 1 1 23 23 ILE H H 23 7.571 7.571 7.288 0.283 25148 8206 1 13 . 1 1 24 24 ILE N N 24 121.460 121.460 119.001 2.459 25148 8207 1 13 . 1 1 24 24 ILE HA H 24 3.486 3.486 3.607 -0.121 25148 8208 1 13 . 1 1 24 24 ILE C C 24 177.759 177.759 177.762 -0.003 25148 8209 1 13 . 1 1 24 24 ILE CA C 24 66.641 66.641 66.105 0.536 25148 8210 1 13 . 1 1 24 24 ILE CB C 24 37.307 37.307 37.311 -0.004 25148 8211 1 13 . 1 1 24 24 ILE H H 24 8.709 8.709 7.684 1.025 25148 8212 1 13 . 1 1 25 25 GLU N N 25 119.323 119.323 118.396 0.927 25148 8213 1 13 . 1 1 25 25 GLU HA H 25 4.177 4.177 3.953 0.224 25148 8214 1 13 . 1 1 25 25 GLU C C 25 179.348 179.348 178.452 0.896 25148 8215 1 13 . 1 1 25 25 GLU CA C 25 59.951 59.951 59.145 0.806 25148 8216 1 13 . 1 1 25 25 GLU CB C 25 29.340 29.340 29.030 0.310 25148 8217 1 13 . 1 1 25 25 GLU H H 25 8.048 8.048 7.857 0.191 25148 8218 1 13 . 1 1 26 26 ALA N N 26 122.390 122.390 122.960 -0.570 25148 8219 1 13 . 1 1 26 26 ALA HA H 26 4.325 4.325 4.112 0.213 25148 8220 1 13 . 1 1 26 26 ALA C C 26 181.440 181.440 179.671 1.769 25148 8221 1 13 . 1 1 26 26 ALA CA C 26 54.935 54.935 54.920 0.015 25148 8222 1 13 . 1 1 26 26 ALA CB C 26 17.834 17.834 18.316 -0.482 25148 8223 1 13 . 1 1 26 26 ALA H H 26 7.768 7.768 7.778 -0.010 25148 8224 1 13 . 1 1 27 27 ILE N N 27 122.342 122.342 119.329 3.013 25148 8225 1 13 . 1 1 27 27 ILE HA H 27 3.575 3.575 3.593 -0.018 25148 8226 1 13 . 1 1 27 27 ILE C C 27 177.541 177.541 178.106 -0.565 25148 8227 1 13 . 1 1 27 27 ILE CA C 27 66.536 66.536 65.678 0.858 25148 8228 1 13 . 1 1 27 27 ILE CB C 27 37.886 37.886 37.597 0.289 25148 8229 1 13 . 1 1 27 27 ILE H H 27 8.805 8.805 7.657 1.148 25148 8230 1 13 . 1 1 28 28 GLU N N 28 120.188 120.188 119.364 0.824 25148 8231 1 13 . 1 1 28 28 GLU HA H 28 3.687 3.687 3.903 -0.216 25148 8232 1 13 . 1 1 28 28 GLU C C 28 178.707 178.707 178.925 -0.218 25148 8233 1 13 . 1 1 28 28 GLU CA C 28 61.458 61.458 59.830 1.628 25148 8234 1 13 . 1 1 28 28 GLU CB C 28 29.624 29.624 29.331 0.293 25148 8235 1 13 . 1 1 28 28 GLU H H 28 8.882 8.882 7.706 1.176 25148 8236 1 13 . 1 1 29 29 ALA N N 29 119.293 119.293 121.178 -1.885 25148 8237 1 13 . 1 1 29 29 ALA HA H 29 4.214 4.214 4.118 0.096 25148 8238 1 13 . 1 1 29 29 ALA C C 29 181.200 181.200 179.712 1.488 25148 8239 1 13 . 1 1 29 29 ALA CA C 29 55.435 55.435 54.882 0.554 25148 8240 1 13 . 1 1 29 29 ALA CB C 29 18.090 18.090 18.124 -0.034 25148 8241 1 13 . 1 1 29 29 ALA H H 29 8.065 8.065 7.789 0.276 25148 8242 1 13 . 1 1 30 30 ALA N N 30 121.729 121.729 122.096 -0.367 25148 8243 1 13 . 1 1 30 30 ALA HA H 30 4.307 4.307 4.150 0.157 25148 8244 1 13 . 1 1 30 30 ALA C C 30 181.315 181.315 179.606 1.709 25148 8245 1 13 . 1 1 30 30 ALA CA C 30 54.594 54.594 54.910 -0.316 25148 8246 1 13 . 1 1 30 30 ALA CB C 30 18.704 18.704 18.337 0.367 25148 8247 1 13 . 1 1 30 30 ALA H H 30 8.099 8.099 7.693 0.406 25148 8248 1 13 . 1 1 31 31 LEU N N 31 120.900 120.900 120.531 0.369 25148 8249 1 13 . 1 1 31 31 LEU HA H 31 4.347 4.347 4.164 0.183 25148 8250 1 13 . 1 1 31 31 LEU C C 31 179.137 179.137 179.237 -0.100 25148 8251 1 13 . 1 1 31 31 LEU CA C 31 57.569 57.569 58.035 -0.466 25148 8252 1 13 . 1 1 31 31 LEU CB C 31 42.353 42.353 41.079 1.274 25148 8253 1 13 . 1 1 31 31 LEU H H 31 8.863 8.863 8.221 0.642 25148 8254 1 13 . 1 1 32 32 ILE N N 32 122.410 122.410 119.271 3.139 25148 8255 1 13 . 1 1 32 32 ILE HA H 32 3.699 3.699 3.692 0.007 25148 8256 1 13 . 1 1 32 32 ILE C C 32 178.303 178.303 177.842 0.461 25148 8257 1 13 . 1 1 32 32 ILE CA C 32 66.066 66.066 65.608 0.459 25148 8258 1 13 . 1 1 32 32 ILE CB C 32 37.882 37.882 37.912 -0.030 25148 8259 1 13 . 1 1 32 32 ILE H H 32 8.234 8.234 8.266 -0.032 25148 8260 1 13 . 1 1 33 33 SER N N 33 114.201 114.201 115.744 -1.543 25148 8261 1 13 . 1 1 33 33 SER HA H 33 4.311 4.311 4.154 0.157 25148 8262 1 13 . 1 1 33 33 SER C C 33 177.012 177.012 176.571 0.441 25148 8263 1 13 . 1 1 33 33 SER CA C 33 61.860 61.860 61.988 -0.128 25148 8264 1 13 . 1 1 33 33 SER CB C 33 62.508 62.508 63.132 -0.624 25148 8265 1 13 . 1 1 33 33 SER H H 33 7.558 7.558 7.888 -0.330 25148 8266 1 13 . 1 1 34 34 ALA N N 34 122.893 122.893 124.580 -1.687 25148 8267 1 13 . 1 1 34 34 ALA HA H 34 4.215 4.215 4.075 0.140 25148 8268 1 13 . 1 1 34 34 ALA C C 34 180.814 180.814 179.433 1.381 25148 8269 1 13 . 1 1 34 34 ALA CA C 34 55.283 55.283 55.000 0.283 25148 8270 1 13 . 1 1 34 34 ALA CB C 34 18.273 18.273 18.167 0.106 25148 8271 1 13 . 1 1 34 34 ALA H H 34 8.409 8.409 8.039 0.370 25148 8272 1 13 . 1 1 35 35 TYR N N 35 120.259 120.259 119.109 1.150 25148 8273 1 13 . 1 1 35 35 TYR HA H 35 4.393 4.393 4.281 0.112 25148 8274 1 13 . 1 1 35 35 TYR C C 35 177.892 177.892 178.379 -0.487 25148 8275 1 13 . 1 1 35 35 TYR CA C 35 63.071 63.071 61.143 1.928 25148 8276 1 13 . 1 1 35 35 TYR CB C 35 38.021 38.021 38.744 -0.723 25148 8277 1 13 . 1 1 35 35 TYR H H 35 8.975 8.975 8.217 0.758 25148 8278 1 13 . 1 1 36 36 LYS N N 36 120.942 120.942 120.203 0.739 25148 8279 1 13 . 1 1 36 36 LYS HA H 36 4.032 4.032 4.054 -0.022 25148 8280 1 13 . 1 1 36 36 LYS C C 36 177.797 177.797 179.135 -1.338 25148 8281 1 13 . 1 1 36 36 LYS CA C 36 59.900 59.900 59.288 0.612 25148 8282 1 13 . 1 1 36 36 LYS CB C 36 32.429 32.429 32.275 0.154 25148 8283 1 13 . 1 1 36 36 LYS H H 36 8.654 8.654 8.254 0.400 25148 8284 1 13 . 1 1 37 37 ARG N N 37 115.139 115.139 117.880 -2.741 25148 8285 1 13 . 1 1 37 37 ARG HA H 37 4.101 4.101 4.081 0.020 25148 8286 1 13 . 1 1 37 37 ARG C C 37 177.517 177.517 177.898 -0.381 25148 8287 1 13 . 1 1 37 37 ARG CA C 37 58.276 58.276 58.425 -0.149 25148 8288 1 13 . 1 1 37 37 ARG CB C 37 31.014 31.014 29.586 1.428 25148 8289 1 13 . 1 1 37 37 ARG H H 37 8.138 8.138 8.008 0.130 25148 8290 1 13 . 1 1 38 38 ASN N N 38 112.555 112.555 115.902 -3.347 25148 8291 1 13 . 1 1 38 38 ASN HA H 38 4.540 4.540 4.351 0.189 25148 8292 1 13 . 1 1 38 38 ASN C C 38 173.994 173.994 174.783 -0.789 25148 8293 1 13 . 1 1 38 38 ASN CA C 38 54.722 54.722 54.699 0.023 25148 8294 1 13 . 1 1 38 38 ASN CB C 38 42.077 42.077 39.378 2.699 25148 8295 1 13 . 1 1 38 38 ASN H H 38 7.426 7.426 7.534 -0.108 25148 8296 1 13 . 1 1 39 39 PHE N N 39 116.711 116.711 117.278 -0.567 25148 8297 1 13 . 1 1 39 39 PHE HA H 39 4.569 4.569 4.694 -0.124 25148 8298 1 13 . 1 1 39 39 PHE CA C 39 58.913 58.913 56.672 2.241 25148 8299 1 13 . 1 1 39 39 PHE CB C 39 39.781 39.781 38.855 0.926 25148 8300 1 13 . 1 1 39 39 PHE H H 39 7.959 7.959 7.562 0.397 25148 8301 1 13 . 1 1 40 40 ASN HA H 40 4.018 4.018 4.554 -0.536 25148 8302 1 13 . 1 1 40 40 ASN CA C 40 58.944 58.944 55.150 3.794 25148 8303 1 13 . 1 1 41 41 GLN HA H 41 4.298 4.298 4.439 -0.141 25148 8304 1 13 . 1 1 41 41 GLN C C 41 175.237 175.237 175.610 -0.373 25148 8305 1 13 . 1 1 41 41 GLN CA C 41 57.360 57.360 56.401 0.959 25148 8306 1 13 . 1 1 41 41 GLN CB C 41 28.724 28.724 28.049 0.675 25148 8307 1 13 . 1 1 42 42 ALA N N 42 120.514 120.514 120.946 -0.432 25148 8308 1 13 . 1 1 42 42 ALA HA H 42 4.622 4.622 4.399 0.223 25148 8309 1 13 . 1 1 42 42 ALA C C 42 175.922 175.922 176.270 -0.348 25148 8310 1 13 . 1 1 42 42 ALA CA C 42 51.841 51.841 52.443 -0.602 25148 8311 1 13 . 1 1 42 42 ALA CB C 42 21.576 21.576 20.180 1.396 25148 8312 1 13 . 1 1 42 42 ALA H H 42 7.817 7.817 8.111 -0.294 25148 8313 1 13 . 1 1 43 43 GLN N N 43 117.594 117.594 116.073 1.521 25148 8314 1 13 . 1 1 43 43 GLN HA H 43 4.265 4.265 4.352 -0.087 25148 8315 1 13 . 1 1 43 43 GLN C C 43 174.942 174.942 173.432 1.510 25148 8316 1 13 . 1 1 43 43 GLN CA C 43 57.047 57.047 55.594 1.453 25148 8317 1 13 . 1 1 43 43 GLN CB C 43 30.863 30.863 31.112 -0.249 25148 8318 1 13 . 1 1 43 43 GLN H H 43 7.400 7.400 7.469 -0.069 25148 8319 1 13 . 1 1 44 44 ASN N N 44 120.467 120.467 121.061 -0.594 25148 8320 1 13 . 1 1 44 44 ASN HA H 44 5.005 5.005 4.714 0.291 25148 8321 1 13 . 1 1 44 44 ASN C C 44 174.365 174.365 174.551 -0.186 25148 8322 1 13 . 1 1 44 44 ASN CA C 44 52.381 52.381 52.713 -0.332 25148 8323 1 13 . 1 1 44 44 ASN CB C 44 38.177 38.177 39.131 -0.954 25148 8324 1 13 . 1 1 44 44 ASN H H 44 9.123 9.123 8.535 0.588 25148 8325 1 13 . 1 1 45 45 VAL N N 45 115.479 115.479 116.518 -1.039 25148 8326 1 13 . 1 1 45 45 VAL HA H 45 5.376 5.376 4.256 1.120 25148 8327 1 13 . 1 1 45 45 VAL C C 45 174.908 174.908 173.929 0.979 25148 8328 1 13 . 1 1 45 45 VAL CA C 45 59.022 59.022 62.084 -3.062 25148 8329 1 13 . 1 1 45 45 VAL CB C 45 35.776 35.776 34.937 0.839 25148 8330 1 13 . 1 1 45 45 VAL H H 45 7.732 7.732 8.076 -0.344 25148 8331 1 13 . 1 1 46 46 ARG N N 46 121.146 121.146 126.198 -5.052 25148 8332 1 13 . 1 1 46 46 ARG HA H 46 4.566 4.566 4.849 -0.283 25148 8333 1 13 . 1 1 46 46 ARG C C 46 173.790 173.790 174.747 -0.957 25148 8334 1 13 . 1 1 46 46 ARG CA C 46 54.762 54.762 55.053 -0.291 25148 8335 1 13 . 1 1 46 46 ARG CB C 46 33.946 33.946 32.523 1.423 25148 8336 1 13 . 1 1 46 46 ARG H H 46 8.850 8.850 9.097 -0.247 25148 8337 1 13 . 1 1 47 47 VAL N N 47 122.339 122.339 125.511 -3.172 25148 8338 1 13 . 1 1 47 47 VAL HA H 47 4.741 4.741 4.327 0.414 25148 8339 1 13 . 1 1 47 47 VAL C C 47 173.541 173.541 175.606 -2.065 25148 8340 1 13 . 1 1 47 47 VAL CA C 47 60.893 60.893 62.128 -1.235 25148 8341 1 13 . 1 1 47 47 VAL CB C 47 33.563 33.563 33.137 0.426 25148 8342 1 13 . 1 1 47 47 VAL H H 47 8.444 8.444 8.573 -0.129 25148 8343 1 13 . 1 1 48 48 ASP N N 48 127.701 127.701 126.090 1.611 25148 8344 1 13 . 1 1 48 48 ASP HA H 48 4.946 4.946 5.112 -0.166 25148 8345 1 13 . 1 1 48 48 ASP C C 48 173.744 173.744 174.634 -0.890 25148 8346 1 13 . 1 1 48 48 ASP CA C 48 52.651 52.651 53.343 -0.692 25148 8347 1 13 . 1 1 48 48 ASP CB C 48 45.225 45.225 43.487 1.738 25148 8348 1 13 . 1 1 48 48 ASP H H 48 9.068 9.068 8.518 0.550 25148 8349 1 13 . 1 1 49 49 LEU N N 49 130.945 130.945 125.728 5.217 25148 8350 1 13 . 1 1 49 49 LEU HA H 49 4.774 4.774 4.813 -0.039 25148 8351 1 13 . 1 1 49 49 LEU C C 49 174.531 174.531 175.394 -0.863 25148 8352 1 13 . 1 1 49 49 LEU CA C 49 54.337 54.337 54.145 0.192 25148 8353 1 13 . 1 1 49 49 LEU CB C 49 43.192 43.192 44.404 -1.212 25148 8354 1 13 . 1 1 49 49 LEU H H 49 9.369 9.369 8.725 0.644 25148 8355 1 13 . 1 1 50 50 ASN N N 50 126.268 126.268 124.080 2.188 25148 8356 1 13 . 1 1 50 50 ASN HA H 50 4.629 4.629 5.026 -0.397 25148 8357 1 13 . 1 1 50 50 ASN C C 50 176.602 176.602 175.327 1.275 25148 8358 1 13 . 1 1 50 50 ASN CA C 50 54.048 54.048 52.258 1.790 25148 8359 1 13 . 1 1 50 50 ASN CB C 50 39.891 39.891 39.303 0.588 25148 8360 1 13 . 1 1 50 50 ASN H H 50 8.672 8.672 8.971 -0.299 25148 8361 1 13 . 1 1 51 51 ARG N N 51 125.897 125.897 125.371 0.526 25148 8362 1 13 . 1 1 51 51 ARG HA H 51 3.789 3.789 4.272 -0.483 25148 8363 1 13 . 1 1 51 51 ARG C C 51 175.681 175.681 175.977 -0.296 25148 8364 1 13 . 1 1 51 51 ARG CA C 51 58.162 58.162 58.437 -0.275 25148 8365 1 13 . 1 1 51 51 ARG CB C 51 29.944 29.944 29.251 0.693 25148 8366 1 13 . 1 1 51 51 ARG H H 51 8.984 8.984 8.776 0.208 25148 8367 1 13 . 1 1 52 52 GLU N N 52 116.733 116.733 119.706 -2.973 25148 8368 1 13 . 1 1 52 52 GLU HA H 52 4.368 4.368 4.205 0.163 25148 8369 1 13 . 1 1 52 52 GLU C C 52 178.049 178.049 177.042 1.007 25148 8370 1 13 . 1 1 52 52 GLU CA C 52 58.048 58.048 57.915 0.133 25148 8371 1 13 . 1 1 52 52 GLU CB C 52 30.716 30.716 29.490 1.226 25148 8372 1 13 . 1 1 52 52 GLU H H 52 8.541 8.541 8.554 -0.013 25148 8373 1 13 . 1 1 53 53 THR N N 53 106.556 106.556 107.495 -0.939 25148 8374 1 13 . 1 1 53 53 THR HA H 53 4.424 4.424 4.595 -0.171 25148 8375 1 13 . 1 1 53 53 THR C C 53 176.352 176.352 175.284 1.068 25148 8376 1 13 . 1 1 53 53 THR CA C 53 61.320 61.320 61.024 0.296 25148 8377 1 13 . 1 1 53 53 THR CB C 53 71.220 71.220 69.573 1.647 25148 8378 1 13 . 1 1 53 53 THR H H 53 8.085 8.085 7.589 0.496 25148 8379 1 13 . 1 1 54 54 GLY N N 54 111.843 111.843 110.314 1.529 25148 8380 1 13 . 1 1 54 54 GLY C C 54 172.690 172.690 174.669 -1.979 25148 8381 1 13 . 1 1 54 54 GLY CA C 54 45.417 45.417 46.208 -0.791 25148 8382 1 13 . 1 1 54 54 GLY H H 54 8.330 8.330 7.854 0.476 25148 8383 1 13 . 1 1 55 55 SER N N 55 113.844 113.844 114.068 -0.224 25148 8384 1 13 . 1 1 55 55 SER HA H 55 4.279 4.279 4.697 -0.418 25148 8385 1 13 . 1 1 55 55 SER C C 55 174.127 174.127 173.158 0.969 25148 8386 1 13 . 1 1 55 55 SER CA C 55 59.229 59.229 58.215 1.014 25148 8387 1 13 . 1 1 55 55 SER CB C 55 63.939 63.939 65.750 -1.811 25148 8388 1 13 . 1 1 55 55 SER H H 55 7.653 7.653 7.631 0.022 25148 8389 1 13 . 1 1 56 56 ILE N N 56 125.286 125.286 120.959 4.327 25148 8390 1 13 . 1 1 56 56 ILE HA H 56 5.082 5.082 4.594 0.488 25148 8391 1 13 . 1 1 56 56 ILE C C 56 175.346 175.346 174.722 0.624 25148 8392 1 13 . 1 1 56 56 ILE CA C 56 59.967 59.967 60.353 -0.387 25148 8393 1 13 . 1 1 56 56 ILE CB C 56 40.165 40.165 41.513 -1.348 25148 8394 1 13 . 1 1 56 56 ILE H H 56 8.478 8.478 8.463 0.015 25148 8395 1 13 . 1 1 57 57 ARG N N 57 126.332 126.332 126.519 -0.187 25148 8396 1 13 . 1 1 57 57 ARG HA H 57 4.740 4.740 4.546 0.194 25148 8397 1 13 . 1 1 57 57 ARG C C 57 173.921 173.921 173.517 0.404 25148 8398 1 13 . 1 1 57 57 ARG CA C 57 54.311 54.311 53.961 0.350 25148 8399 1 13 . 1 1 57 57 ARG CB C 57 35.805 35.805 33.994 1.811 25148 8400 1 13 . 1 1 57 57 ARG H H 57 8.590 8.590 8.235 0.355 25148 8401 1 13 . 1 1 58 58 VAL N N 58 120.987 120.987 122.242 -1.255 25148 8402 1 13 . 1 1 58 58 VAL HA H 58 4.334 4.334 4.138 0.196 25148 8403 1 13 . 1 1 58 58 VAL C C 58 174.204 174.204 174.273 -0.069 25148 8404 1 13 . 1 1 58 58 VAL CA C 58 60.861 60.861 60.612 0.249 25148 8405 1 13 . 1 1 58 58 VAL CB C 58 33.383 33.383 32.074 1.309 25148 8406 1 13 . 1 1 58 58 VAL H H 58 8.585 8.585 8.154 0.431 25148 8407 1 13 . 1 1 59 59 PHE N N 59 124.913 124.913 126.117 -1.204 25148 8408 1 13 . 1 1 59 59 PHE HA H 59 5.046 5.046 5.367 -0.321 25148 8409 1 13 . 1 1 59 59 PHE C C 59 174.446 174.446 174.231 0.215 25148 8410 1 13 . 1 1 59 59 PHE CA C 59 56.695 56.695 55.305 1.390 25148 8411 1 13 . 1 1 59 59 PHE CB C 59 42.779 42.779 43.227 -0.448 25148 8412 1 13 . 1 1 59 59 PHE H H 59 8.920 8.920 8.439 0.481 25148 8413 1 13 . 1 1 60 60 ALA N N 60 124.035 124.035 123.529 0.506 25148 8414 1 13 . 1 1 60 60 ALA HA H 60 5.102 5.102 4.721 0.381 25148 8415 1 13 . 1 1 60 60 ALA C C 60 176.017 176.017 176.005 0.012 25148 8416 1 13 . 1 1 60 60 ALA CA C 60 50.083 50.083 50.696 -0.613 25148 8417 1 13 . 1 1 60 60 ALA CB C 60 22.400 22.400 21.105 1.295 25148 8418 1 13 . 1 1 60 60 ALA H H 60 9.457 9.457 8.877 0.580 25148 8419 1 13 . 1 1 61 61 ARG N N 61 121.530 121.530 124.821 -3.291 25148 8420 1 13 . 1 1 61 61 ARG HA H 61 4.958 4.958 4.846 0.112 25148 8421 1 13 . 1 1 61 61 ARG C C 61 176.737 176.737 175.638 1.099 25148 8422 1 13 . 1 1 61 61 ARG CA C 61 55.375 55.375 55.693 -0.318 25148 8423 1 13 . 1 1 61 61 ARG CB C 61 31.230 31.230 31.251 -0.021 25148 8424 1 13 . 1 1 61 61 ARG H H 61 8.447 8.447 8.642 -0.195 25148 8425 1 13 . 1 1 62 62 LYS N N 62 124.784 124.784 124.429 0.355 25148 8426 1 13 . 1 1 62 62 LYS HA H 62 4.709 4.709 4.466 0.243 25148 8427 1 13 . 1 1 62 62 LYS C C 62 173.899 173.899 174.841 -0.942 25148 8428 1 13 . 1 1 62 62 LYS CA C 62 54.812 54.812 55.181 -0.369 25148 8429 1 13 . 1 1 62 62 LYS CB C 62 37.147 37.147 36.187 0.960 25148 8430 1 13 . 1 1 62 62 LYS H H 62 9.137 9.137 8.213 0.924 25148 8431 1 13 . 1 1 63 63 ASP N N 63 122.552 122.552 125.161 -2.609 25148 8432 1 13 . 1 1 63 63 ASP HA H 63 4.877 4.877 4.634 0.243 25148 8433 1 13 . 1 1 63 63 ASP C C 63 175.560 175.560 176.179 -0.619 25148 8434 1 13 . 1 1 63 63 ASP CA C 63 54.576 54.576 54.508 0.068 25148 8435 1 13 . 1 1 63 63 ASP CB C 63 42.841 42.841 41.435 1.406 25148 8436 1 13 . 1 1 63 63 ASP H H 63 8.334 8.334 8.853 -0.519 25148 8437 1 13 . 1 1 64 64 VAL N N 64 123.109 123.109 127.192 -4.083 25148 8438 1 13 . 1 1 64 64 VAL HA H 64 4.557 4.557 4.448 0.109 25148 8439 1 13 . 1 1 64 64 VAL C C 64 177.260 177.260 175.695 1.565 25148 8440 1 13 . 1 1 64 64 VAL CA C 64 62.268 62.268 63.383 -1.115 25148 8441 1 13 . 1 1 64 64 VAL CB C 64 30.348 30.348 31.099 -0.751 25148 8442 1 13 . 1 1 64 64 VAL H H 64 8.693 8.693 7.873 0.820 25148 8443 1 13 . 1 1 65 65 VAL N N 65 122.320 122.320 121.927 0.393 25148 8444 1 13 . 1 1 65 65 VAL HA H 65 4.939 4.939 4.579 0.360 25148 8445 1 13 . 1 1 65 65 VAL C C 65 174.754 174.754 175.033 -0.279 25148 8446 1 13 . 1 1 65 65 VAL CA C 65 59.173 59.173 59.218 -0.045 25148 8447 1 13 . 1 1 65 65 VAL CB C 65 36.289 36.289 36.116 0.173 25148 8448 1 13 . 1 1 65 65 VAL H H 65 8.656 8.656 8.489 0.167 25148 8449 1 13 . 1 1 66 66 ASP N N 66 119.805 119.805 122.712 -2.907 25148 8450 1 13 . 1 1 66 66 ASP HA H 66 4.499 4.499 4.329 0.170 25148 8451 1 13 . 1 1 66 66 ASP C C 66 176.565 176.565 175.979 0.586 25148 8452 1 13 . 1 1 66 66 ASP CA C 66 57.236 57.236 56.986 0.250 25148 8453 1 13 . 1 1 66 66 ASP CB C 66 41.662 41.662 41.263 0.399 25148 8454 1 13 . 1 1 66 66 ASP H H 66 8.628 8.628 8.924 -0.296 25148 8455 1 13 . 1 1 67 67 GLU N N 67 117.604 117.604 117.384 0.220 25148 8456 1 13 . 1 1 67 67 GLU HA H 67 4.350 4.350 4.452 -0.102 25148 8457 1 13 . 1 1 67 67 GLU C C 67 173.736 173.736 175.434 -1.698 25148 8458 1 13 . 1 1 67 67 GLU CA C 67 55.203 55.203 54.953 0.250 25148 8459 1 13 . 1 1 67 67 GLU CB C 67 32.240 32.240 32.711 -0.471 25148 8460 1 13 . 1 1 67 67 GLU H H 67 7.525 7.525 7.856 -0.331 25148 8461 1 13 . 1 1 68 68 VAL N N 68 125.774 125.774 122.793 2.981 25148 8462 1 13 . 1 1 68 68 VAL HA H 68 3.578 3.578 3.881 -0.303 25148 8463 1 13 . 1 1 68 68 VAL C C 68 175.885 175.885 175.259 0.626 25148 8464 1 13 . 1 1 68 68 VAL CA C 68 63.397 63.397 63.807 -0.410 25148 8465 1 13 . 1 1 68 68 VAL CB C 68 32.452 32.452 31.050 1.402 25148 8466 1 13 . 1 1 68 68 VAL H H 68 8.573 8.573 8.419 0.154 25148 8467 1 13 . 1 1 69 69 TYR N N 69 129.859 129.859 126.435 3.424 25148 8468 1 13 . 1 1 69 69 TYR HA H 69 4.642 4.642 4.600 0.042 25148 8469 1 13 . 1 1 69 69 TYR C C 69 176.100 176.100 175.596 0.504 25148 8470 1 13 . 1 1 69 69 TYR CA C 69 59.092 59.092 59.135 -0.043 25148 8471 1 13 . 1 1 69 69 TYR CB C 69 39.830 39.830 40.562 -0.732 25148 8472 1 13 . 1 1 69 69 TYR H H 69 9.801 9.801 8.472 1.329 25148 8473 1 13 . 1 1 70 70 ASP N N 70 120.204 120.204 120.301 -0.097 25148 8474 1 13 . 1 1 70 70 ASP HA H 70 4.772 4.772 4.931 -0.159 25148 8475 1 13 . 1 1 70 70 ASP C C 70 176.622 176.622 176.463 0.159 25148 8476 1 13 . 1 1 70 70 ASP CA C 70 52.885 52.885 52.931 -0.047 25148 8477 1 13 . 1 1 70 70 ASP CB C 70 41.878 41.878 41.282 0.596 25148 8478 1 13 . 1 1 70 70 ASP H H 70 8.348 8.348 7.888 0.460 25148 8479 1 13 . 1 1 71 71 GLN N N 71 125.440 125.440 123.017 2.423 25148 8480 1 13 . 1 1 71 71 GLN HA H 71 4.315 4.315 4.045 0.270 25148 8481 1 13 . 1 1 71 71 GLN C C 71 175.819 175.819 176.853 -1.034 25148 8482 1 13 . 1 1 71 71 GLN CA C 71 57.914 57.914 58.386 -0.472 25148 8483 1 13 . 1 1 71 71 GLN CB C 71 28.307 28.307 28.365 -0.058 25148 8484 1 13 . 1 1 71 71 GLN H H 71 9.097 9.097 8.900 0.197 25148 8485 1 13 . 1 1 72 72 ARG N N 72 116.306 116.306 115.794 0.512 25148 8486 1 13 . 1 1 72 72 ARG HA H 72 4.252 4.252 4.192 0.060 25148 8487 1 13 . 1 1 72 72 ARG C C 72 178.087 178.087 176.079 2.008 25148 8488 1 13 . 1 1 72 72 ARG CA C 72 58.532 58.532 57.632 0.900 25148 8489 1 13 . 1 1 72 72 ARG CB C 72 30.143 30.143 30.874 -0.731 25148 8490 1 13 . 1 1 72 72 ARG H H 72 8.534 8.534 8.214 0.320 25148 8491 1 13 . 1 1 73 73 LEU N N 73 116.734 116.734 114.922 1.812 25148 8492 1 13 . 1 1 73 73 LEU HA H 73 4.621 4.621 4.632 -0.011 25148 8493 1 13 . 1 1 73 73 LEU C C 73 175.946 175.946 175.012 0.934 25148 8494 1 13 . 1 1 73 73 LEU CA C 73 55.250 55.250 55.096 0.154 25148 8495 1 13 . 1 1 73 73 LEU CB C 73 46.960 46.960 44.612 2.348 25148 8496 1 13 . 1 1 73 73 LEU H H 73 7.460 7.460 7.425 0.035 25148 8497 1 13 . 1 1 74 74 GLU N N 74 118.787 118.787 122.069 -3.282 25148 8498 1 13 . 1 1 74 74 GLU HA H 74 5.403 5.403 4.567 0.836 25148 8499 1 13 . 1 1 74 74 GLU C C 74 173.709 173.709 174.559 -0.850 25148 8500 1 13 . 1 1 74 74 GLU CA C 74 54.914 54.914 55.747 -0.833 25148 8501 1 13 . 1 1 74 74 GLU CB C 74 35.053 35.053 33.520 1.533 25148 8502 1 13 . 1 1 74 74 GLU H H 74 7.752 7.752 8.083 -0.331 25148 8503 1 13 . 1 1 75 75 ILE N N 75 119.803 119.803 122.366 -2.563 25148 8504 1 13 . 1 1 75 75 ILE HA H 75 4.507 4.507 4.503 0.004 25148 8505 1 13 . 1 1 75 75 ILE C C 75 172.126 172.126 173.672 -1.546 25148 8506 1 13 . 1 1 75 75 ILE CA C 75 58.664 58.664 60.665 -2.001 25148 8507 1 13 . 1 1 75 75 ILE CB C 75 42.560 42.560 42.120 0.441 25148 8508 1 13 . 1 1 75 75 ILE H H 75 8.975 8.975 8.612 0.363 25148 8509 1 13 . 1 1 76 76 SER N N 76 123.236 123.236 123.591 -0.355 25148 8510 1 13 . 1 1 76 76 SER HA H 76 4.505 4.505 4.995 -0.490 25148 8511 1 13 . 1 1 76 76 SER C C 76 176.145 176.145 175.909 0.236 25148 8512 1 13 . 1 1 76 76 SER CA C 76 58.108 58.108 58.252 -0.144 25148 8513 1 13 . 1 1 76 76 SER CB C 76 65.000 65.000 64.165 0.835 25148 8514 1 13 . 1 1 76 76 SER H H 76 8.810 8.810 8.391 0.419 25148 8515 1 13 . 1 1 77 77 ILE N N 77 120.629 120.629 127.724 -7.095 25148 8516 1 13 . 1 1 77 77 ILE HA H 77 3.935 3.935 3.804 0.131 25148 8517 1 13 . 1 1 77 77 ILE C C 77 175.806 175.806 176.684 -0.878 25148 8518 1 13 . 1 1 77 77 ILE CA C 77 61.928 61.928 63.923 -1.995 25148 8519 1 13 . 1 1 77 77 ILE CB C 77 38.031 38.031 38.388 -0.357 25148 8520 1 13 . 1 1 77 77 ILE H H 77 8.321 8.321 8.150 0.171 25148 8521 1 13 . 1 1 78 78 GLU N N 78 121.032 121.032 117.387 3.645 25148 8522 1 13 . 1 1 78 78 GLU HA H 78 4.082 4.082 4.026 0.056 25148 8523 1 13 . 1 1 78 78 GLU C C 78 179.829 179.829 178.477 1.352 25148 8524 1 13 . 1 1 78 78 GLU CA C 78 60.180 60.180 58.835 1.345 25148 8525 1 13 . 1 1 78 78 GLU CB C 78 28.988 28.988 28.941 0.047 25148 8526 1 13 . 1 1 78 78 GLU H H 78 8.222 8.222 8.305 -0.083 25148 8527 1 13 . 1 1 79 79 GLU N N 79 120.710 120.710 121.181 -0.471 25148 8528 1 13 . 1 1 79 79 GLU HA H 79 4.012 4.012 4.096 -0.084 25148 8529 1 13 . 1 1 79 79 GLU C C 79 180.339 180.339 179.037 1.302 25148 8530 1 13 . 1 1 79 79 GLU CA C 79 59.332 59.332 58.777 0.555 25148 8531 1 13 . 1 1 79 79 GLU CB C 79 29.317 29.317 29.542 -0.225 25148 8532 1 13 . 1 1 79 79 GLU H H 79 7.908 7.908 7.668 0.240 25148 8533 1 13 . 1 1 80 80 ALA N N 80 122.879 122.879 121.908 0.971 25148 8534 1 13 . 1 1 80 80 ALA HA H 80 3.966 3.966 4.090 -0.124 25148 8535 1 13 . 1 1 80 80 ALA C C 80 179.833 179.833 179.925 -0.092 25148 8536 1 13 . 1 1 80 80 ALA CA C 80 55.881 55.881 55.136 0.745 25148 8537 1 13 . 1 1 80 80 ALA CB C 80 18.870 18.870 18.115 0.755 25148 8538 1 13 . 1 1 80 80 ALA H H 80 9.132 9.132 7.993 1.139 25148 8539 1 13 . 1 1 81 81 GLN N N 81 115.829 115.829 116.937 -1.108 25148 8540 1 13 . 1 1 81 81 GLN HA H 81 4.749 4.749 4.318 0.431 25148 8541 1 13 . 1 1 81 81 GLN C C 81 178.126 178.126 178.038 0.088 25148 8542 1 13 . 1 1 81 81 GLN CA C 81 57.682 57.682 57.635 0.047 25148 8543 1 13 . 1 1 81 81 GLN CB C 81 27.307 27.307 28.781 -1.474 25148 8544 1 13 . 1 1 81 81 GLN H H 81 8.709 8.709 7.820 0.889 25148 8545 1 13 . 1 1 82 82 GLY N N 82 105.531 105.531 106.786 -1.255 25148 8546 1 13 . 1 1 82 82 GLY C C 82 174.917 174.917 174.987 -0.070 25148 8547 1 13 . 1 1 82 82 GLY CA C 82 45.915 45.915 46.674 -0.759 25148 8548 1 13 . 1 1 82 82 GLY H H 82 7.479 7.479 8.006 -0.527 25148 8549 1 13 . 1 1 83 83 ILE N N 83 122.828 122.828 113.682 9.146 25148 8550 1 13 . 1 1 83 83 ILE HA H 83 3.970 3.970 4.445 -0.475 25148 8551 1 13 . 1 1 83 83 ILE C C 83 177.209 177.209 175.538 1.671 25148 8552 1 13 . 1 1 83 83 ILE CA C 83 64.305 64.305 61.621 2.683 25148 8553 1 13 . 1 1 83 83 ILE CB C 83 38.452 38.452 40.226 -1.774 25148 8554 1 13 . 1 1 83 83 ILE H H 83 7.634 7.634 7.547 0.087 25148 8555 1 13 . 1 1 84 84 HIS N N 84 118.927 118.927 120.115 -1.188 25148 8556 1 13 . 1 1 84 84 HIS HA H 84 4.713 4.713 4.936 -0.223 25148 8557 1 13 . 1 1 84 84 HIS CA C 84 55.487 55.487 54.485 1.002 25148 8558 1 13 . 1 1 84 84 HIS CB C 84 33.506 33.506 32.399 1.107 25148 8559 1 13 . 1 1 84 84 HIS H H 84 8.155 8.155 8.328 -0.173 25148 8560 1 13 . 1 1 85 85 PRO HA H 85 4.456 4.456 4.535 -0.079 25148 8561 1 13 . 1 1 85 85 PRO C C 85 177.357 177.357 177.349 0.008 25148 8562 1 13 . 1 1 85 85 PRO CA C 85 64.475 64.475 64.107 0.368 25148 8563 1 13 . 1 1 85 85 PRO CB C 85 32.489 32.489 32.096 0.393 25148 8564 1 13 . 1 1 86 86 GLU N N 86 116.314 116.314 117.808 -1.494 25148 8565 1 13 . 1 1 86 86 GLU HA H 86 4.286 4.286 4.123 0.163 25148 8566 1 13 . 1 1 86 86 GLU C C 86 177.624 177.624 177.395 0.229 25148 8567 1 13 . 1 1 86 86 GLU CA C 86 56.619 56.619 57.264 -0.645 25148 8568 1 13 . 1 1 86 86 GLU CB C 86 29.389 29.389 29.695 -0.306 25148 8569 1 13 . 1 1 86 86 GLU H H 86 8.938 8.938 7.787 1.151 25148 8570 1 13 . 1 1 87 87 TYR N N 87 119.773 119.773 120.274 -0.501 25148 8571 1 13 . 1 1 87 87 TYR HA H 87 4.744 4.744 4.223 0.521 25148 8572 1 13 . 1 1 87 87 TYR C C 87 174.533 174.533 176.403 -1.870 25148 8573 1 13 . 1 1 87 87 TYR CA C 87 59.117 59.117 59.270 -0.153 25148 8574 1 13 . 1 1 87 87 TYR CB C 87 38.859 38.859 38.777 0.082 25148 8575 1 13 . 1 1 87 87 TYR H H 87 7.447 7.447 7.379 0.068 25148 8576 1 13 . 1 1 88 88 MET N N 88 118.298 118.298 116.855 1.443 25148 8577 1 13 . 1 1 88 88 MET HA H 88 4.770 4.770 4.727 0.043 25148 8578 1 13 . 1 1 88 88 MET C C 88 175.638 175.638 173.954 1.684 25148 8579 1 13 . 1 1 88 88 MET CA C 88 53.133 53.133 54.650 -1.517 25148 8580 1 13 . 1 1 88 88 MET CB C 88 37.102 37.102 35.510 1.592 25148 8581 1 13 . 1 1 88 88 MET H H 88 9.023 9.023 8.297 0.726 25148 8582 1 13 . 1 1 89 89 VAL N N 89 120.157 120.157 124.409 -4.252 25148 8583 1 13 . 1 1 89 89 VAL HA H 89 3.330 3.330 3.643 -0.313 25148 8584 1 13 . 1 1 89 89 VAL C C 89 177.432 177.432 176.751 0.681 25148 8585 1 13 . 1 1 89 89 VAL CA C 89 65.675 65.675 64.813 0.862 25148 8586 1 13 . 1 1 89 89 VAL CB C 89 31.321 31.321 30.901 0.419 25148 8587 1 13 . 1 1 89 89 VAL H H 89 8.313 8.313 8.636 -0.323 25148 8588 1 13 . 1 1 90 90 GLY N N 90 116.935 116.935 115.895 1.040 25148 8589 1 13 . 1 1 90 90 GLY C C 90 175.196 175.196 174.542 0.654 25148 8590 1 13 . 1 1 90 90 GLY CA C 90 44.685 44.685 44.505 0.180 25148 8591 1 13 . 1 1 90 90 GLY H H 90 8.551 8.551 8.969 -0.418 25148 8592 1 13 . 1 1 91 91 ASP N N 91 121.616 121.616 122.073 -0.457 25148 8593 1 13 . 1 1 91 91 ASP HA H 91 4.790 4.790 4.847 -0.057 25148 8594 1 13 . 1 1 91 91 ASP C C 91 174.431 174.431 175.118 -0.687 25148 8595 1 13 . 1 1 91 91 ASP CA C 91 55.011 55.011 54.523 0.488 25148 8596 1 13 . 1 1 91 91 ASP CB C 91 42.079 42.079 42.788 -0.709 25148 8597 1 13 . 1 1 91 91 ASP H H 91 8.073 8.073 8.251 -0.178 25148 8598 1 13 . 1 1 92 92 VAL N N 92 118.919 118.919 114.248 4.671 25148 8599 1 13 . 1 1 92 92 VAL HA H 92 4.709 4.709 4.844 -0.135 25148 8600 1 13 . 1 1 92 92 VAL C C 92 175.602 175.602 174.349 1.253 25148 8601 1 13 . 1 1 92 92 VAL CA C 92 61.527 61.527 60.272 1.255 25148 8602 1 13 . 1 1 92 92 VAL CB C 92 34.110 34.110 34.901 -0.791 25148 8603 1 13 . 1 1 92 92 VAL H H 92 8.216 8.216 8.044 0.172 25148 8604 1 13 . 1 1 93 93 VAL N N 93 123.922 123.922 124.469 -0.547 25148 8605 1 13 . 1 1 93 93 VAL HA H 93 4.231 4.231 4.227 0.004 25148 8606 1 13 . 1 1 93 93 VAL C C 93 174.105 174.105 174.361 -0.256 25148 8607 1 13 . 1 1 93 93 VAL CA C 93 59.644 59.644 59.368 0.276 25148 8608 1 13 . 1 1 93 93 VAL CB C 93 34.661 34.661 34.957 -0.296 25148 8609 1 13 . 1 1 93 93 VAL H H 93 8.812 8.812 7.868 0.944 25148 8610 1 13 . 1 1 94 94 GLU N N 94 123.605 123.605 128.703 -5.098 25148 8611 1 13 . 1 1 94 94 GLU HA H 94 5.347 5.347 4.950 0.397 25148 8612 1 13 . 1 1 94 94 GLU C C 94 175.708 175.708 175.572 0.136 25148 8613 1 13 . 1 1 94 94 GLU CA C 94 54.979 54.979 55.247 -0.268 25148 8614 1 13 . 1 1 94 94 GLU CB C 94 31.612 31.612 31.621 -0.009 25148 8615 1 13 . 1 1 94 94 GLU H H 94 8.312 8.312 8.430 -0.118 25148 8616 1 13 . 1 1 95 95 ILE N N 95 123.581 123.581 124.124 -0.543 25148 8617 1 13 . 1 1 95 95 ILE HA H 95 4.601 4.601 4.508 0.093 25148 8618 1 13 . 1 1 95 95 ILE C C 95 175.081 175.081 175.382 -0.301 25148 8619 1 13 . 1 1 95 95 ILE CA C 95 58.601 58.601 59.850 -1.249 25148 8620 1 13 . 1 1 95 95 ILE CB C 95 41.727 41.727 42.191 -0.465 25148 8621 1 13 . 1 1 95 95 ILE H H 95 9.045 9.045 8.341 0.704 25148 8622 1 13 . 1 1 96 96 GLU N N 96 128.094 128.094 127.203 0.891 25148 8623 1 13 . 1 1 96 96 GLU HA H 96 4.098 4.098 4.157 -0.059 25148 8624 1 13 . 1 1 96 96 GLU C C 96 176.845 176.845 175.851 0.994 25148 8625 1 13 . 1 1 96 96 GLU CA C 96 57.853 57.853 58.536 -0.683 25148 8626 1 13 . 1 1 96 96 GLU CB C 96 28.323 28.323 29.571 -1.248 25148 8627 1 13 . 1 1 96 96 GLU H H 96 9.256 9.256 8.962 0.294 25148 8628 1 13 . 1 1 97 97 VAL N N 97 118.446 118.446 125.484 -7.038 25148 8629 1 13 . 1 1 97 97 VAL HA H 97 4.568 4.568 4.231 0.337 25148 8630 1 13 . 1 1 97 97 VAL C C 97 175.051 175.051 174.947 0.104 25148 8631 1 13 . 1 1 97 97 VAL CA C 97 59.796 59.796 61.234 -1.438 25148 8632 1 13 . 1 1 97 97 VAL CB C 97 32.399 32.399 33.105 -0.707 25148 8633 1 13 . 1 1 97 97 VAL H H 97 8.609 8.609 8.720 -0.111 25148 8634 1 13 . 1 1 98 98 THR N N 98 119.118 119.118 118.417 0.701 25148 8635 1 13 . 1 1 98 98 THR HA H 98 3.320 3.320 4.005 -0.685 25148 8636 1 13 . 1 1 98 98 THR CA C 98 61.628 61.628 59.373 2.255 25148 8637 1 13 . 1 1 98 98 THR CB C 98 70.031 70.031 69.447 0.584 25148 8638 1 13 . 1 1 98 98 THR H H 98 7.396 7.396 7.419 -0.023 25148 8639 1 13 . 1 1 99 99 PRO HA H 99 4.458 4.458 4.528 -0.070 25148 8640 1 13 . 1 1 99 99 PRO CA C 99 62.348 62.348 62.372 -0.024 25148 8641 1 13 . 1 1 99 99 PRO CB C 99 33.182 33.182 32.661 0.521 25148 8642 1 13 . 1 1 100 100 LYS HA H 100 4.126 4.126 4.182 -0.056 25148 8643 1 13 . 1 1 100 100 LYS CA C 100 58.773 58.773 57.704 1.069 25148 8644 1 13 . 1 1 100 100 LYS CB C 100 32.195 32.195 32.153 0.042 25148 8645 1 13 . 1 1 101 101 ASP HA H 101 4.924 4.924 4.769 0.155 25148 8646 1 13 . 1 1 101 101 ASP C C 101 176.884 176.884 176.686 0.198 25148 8647 1 13 . 1 1 101 101 ASP CA C 101 54.134 54.134 54.063 0.070 25148 8648 1 13 . 1 1 101 101 ASP CB C 101 40.272 40.272 40.742 -0.470 25148 8649 1 13 . 1 1 102 102 PHE N N 102 118.703 118.703 121.240 -2.537 25148 8650 1 13 . 1 1 102 102 PHE HA H 102 4.295 4.295 4.199 0.096 25148 8651 1 13 . 1 1 102 102 PHE C C 102 176.477 176.477 177.262 -0.785 25148 8652 1 13 . 1 1 102 102 PHE CA C 102 60.748 60.748 60.273 0.475 25148 8653 1 13 . 1 1 102 102 PHE CB C 102 39.667 39.667 39.228 0.438 25148 8654 1 13 . 1 1 102 102 PHE H H 102 7.862 7.862 7.745 0.117 25148 8655 1 13 . 1 1 103 103 GLY CA C 103 47.430 47.430 47.173 0.257 25148 8656 1 13 . 1 1 104 104 ARG N N 104 121.819 121.819 121.688 0.131 25148 8657 1 13 . 1 1 104 104 ARG HA H 104 4.176 4.176 4.191 -0.015 25148 8658 1 13 . 1 1 104 104 ARG C C 104 178.912 178.912 178.345 0.567 25148 8659 1 13 . 1 1 104 104 ARG CA C 104 59.235 59.235 58.151 1.084 25148 8660 1 13 . 1 1 104 104 ARG CB C 104 30.000 30.000 30.341 -0.341 25148 8661 1 13 . 1 1 104 104 ARG H H 104 7.809 7.809 7.431 0.378 25148 8662 1 13 . 1 1 105 105 ILE N N 105 120.331 120.331 120.498 -0.167 25148 8663 1 13 . 1 1 105 105 ILE HA H 105 3.836 3.836 3.612 0.224 25148 8664 1 13 . 1 1 105 105 ILE C C 105 179.206 179.206 177.660 1.546 25148 8665 1 13 . 1 1 105 105 ILE CA C 105 63.025 63.025 64.955 -1.930 25148 8666 1 13 . 1 1 105 105 ILE CB C 105 38.127 38.127 37.644 0.483 25148 8667 1 13 . 1 1 105 105 ILE H H 105 7.203 7.203 7.470 -0.267 25148 8668 1 13 . 1 1 106 106 ALA N N 106 124.867 124.867 121.815 3.052 25148 8669 1 13 . 1 1 106 106 ALA HA H 106 3.665 3.665 3.536 0.129 25148 8670 1 13 . 1 1 106 106 ALA C C 106 178.590 178.590 179.058 -0.468 25148 8671 1 13 . 1 1 106 106 ALA CA C 106 54.842 54.842 55.200 -0.358 25148 8672 1 13 . 1 1 106 106 ALA CB C 106 18.659 18.659 17.801 0.858 25148 8673 1 13 . 1 1 106 106 ALA H H 106 8.813 8.813 8.138 0.675 25148 8674 1 13 . 1 1 107 107 ALA N N 107 119.597 119.597 120.736 -1.139 25148 8675 1 13 . 1 1 107 107 ALA HA H 107 4.014 4.014 3.992 0.022 25148 8676 1 13 . 1 1 107 107 ALA C C 107 180.214 180.214 179.544 0.670 25148 8677 1 13 . 1 1 107 107 ALA CA C 107 55.454 55.454 54.775 0.679 25148 8678 1 13 . 1 1 107 107 ALA CB C 107 18.260 18.260 17.989 0.271 25148 8679 1 13 . 1 1 107 107 ALA H H 107 8.012 8.012 7.417 0.595 25148 8680 1 13 . 1 1 108 108 GLN N N 108 116.896 116.896 118.497 -1.601 25148 8681 1 13 . 1 1 108 108 GLN HA H 108 4.054 4.054 3.956 0.098 25148 8682 1 13 . 1 1 108 108 GLN C C 108 178.784 178.784 178.534 0.250 25148 8683 1 13 . 1 1 108 108 GLN CA C 108 58.705 58.705 59.043 -0.338 25148 8684 1 13 . 1 1 108 108 GLN CB C 108 28.647 28.647 28.749 -0.102 25148 8685 1 13 . 1 1 108 108 GLN H H 108 7.498 7.498 8.373 -0.875 25148 8686 1 13 . 1 1 109 109 THR N N 109 117.495 117.495 114.971 2.524 25148 8687 1 13 . 1 1 109 109 THR HA H 109 3.917 3.917 4.317 -0.400 25148 8688 1 13 . 1 1 109 109 THR C C 109 175.732 175.732 175.726 0.006 25148 8689 1 13 . 1 1 109 109 THR CA C 109 66.989 66.989 65.024 1.965 25148 8690 1 13 . 1 1 109 109 THR CB C 109 68.766 68.766 68.750 0.016 25148 8691 1 13 . 1 1 109 109 THR H H 109 8.203 8.203 8.033 0.170 25148 8692 1 13 . 1 1 110 110 ALA N N 110 122.308 122.308 125.092 -2.784 25148 8693 1 13 . 1 1 110 110 ALA HA H 110 3.854 3.854 4.052 -0.198 25148 8694 1 13 . 1 1 110 110 ALA C C 110 178.380 178.380 178.887 -0.507 25148 8695 1 13 . 1 1 110 110 ALA CA C 110 55.903 55.903 54.852 1.051 25148 8696 1 13 . 1 1 110 110 ALA CB C 110 18.524 18.524 18.300 0.224 25148 8697 1 13 . 1 1 110 110 ALA H H 110 8.668 8.668 7.390 1.278 25148 8698 1 13 . 1 1 111 111 LYS N N 111 115.552 115.552 117.756 -2.204 25148 8699 1 13 . 1 1 111 111 LYS HA H 111 3.923 3.923 3.962 -0.039 25148 8700 1 13 . 1 1 111 111 LYS C C 111 179.111 179.111 178.881 0.230 25148 8701 1 13 . 1 1 111 111 LYS CA C 111 59.825 59.825 59.388 0.437 25148 8702 1 13 . 1 1 111 111 LYS CB C 111 32.251 32.251 31.930 0.321 25148 8703 1 13 . 1 1 111 111 LYS H H 111 7.642 7.642 8.488 -0.846 25148 8704 1 13 . 1 1 112 112 GLN N N 112 120.178 120.178 118.533 1.645 25148 8705 1 13 . 1 1 112 112 GLN HA H 112 4.060 4.060 4.140 -0.080 25148 8706 1 13 . 1 1 112 112 GLN C C 112 178.355 178.355 178.225 0.130 25148 8707 1 13 . 1 1 112 112 GLN CA C 112 59.240 59.240 58.178 1.062 25148 8708 1 13 . 1 1 112 112 GLN CB C 112 28.250 28.250 28.597 -0.347 25148 8709 1 13 . 1 1 112 112 GLN H H 112 7.798 7.798 7.661 0.137 25148 8710 1 13 . 1 1 113 113 VAL N N 113 119.799 119.799 120.987 -1.188 25148 8711 1 13 . 1 1 113 113 VAL HA H 113 3.705 3.705 3.757 -0.052 25148 8712 1 13 . 1 1 113 113 VAL C C 113 178.303 178.303 177.846 0.457 25148 8713 1 13 . 1 1 113 113 VAL CA C 113 66.277 66.277 66.561 -0.284 25148 8714 1 13 . 1 1 113 113 VAL CB C 113 31.954 31.954 31.731 0.223 25148 8715 1 13 . 1 1 113 113 VAL H H 113 8.105 8.105 7.594 0.511 25148 8716 1 13 . 1 1 114 114 VAL N N 114 118.265 118.265 116.363 1.902 25148 8717 1 13 . 1 1 114 114 VAL HA H 114 3.392 3.392 3.625 -0.233 25148 8718 1 13 . 1 1 114 114 VAL C C 114 177.360 177.360 177.998 -0.638 25148 8719 1 13 . 1 1 114 114 VAL CA C 114 67.832 67.832 66.893 0.939 25148 8720 1 13 . 1 1 114 114 VAL CB C 114 31.801 31.801 31.052 0.749 25148 8721 1 13 . 1 1 114 114 VAL H H 114 8.180 8.180 8.296 -0.116 25148 8722 1 13 . 1 1 115 115 THR N N 115 113.460 113.460 114.823 -1.363 25148 8723 1 13 . 1 1 115 115 THR HA H 115 3.856 3.856 4.041 -0.185 25148 8724 1 13 . 1 1 115 115 THR C C 115 176.529 176.529 176.618 -0.089 25148 8725 1 13 . 1 1 115 115 THR CA C 115 66.706 66.706 66.318 0.388 25148 8726 1 13 . 1 1 115 115 THR CB C 115 69.008 69.008 68.597 0.411 25148 8727 1 13 . 1 1 115 115 THR H H 115 8.143 8.143 7.627 0.516 25148 8728 1 13 . 1 1 116 116 GLN N N 116 120.129 120.129 120.898 -0.769 25148 8729 1 13 . 1 1 116 116 GLN HA H 116 4.054 4.054 4.114 -0.060 25148 8730 1 13 . 1 1 116 116 GLN C C 116 178.100 178.100 178.293 -0.193 25148 8731 1 13 . 1 1 116 116 GLN CA C 116 58.950 58.950 59.139 -0.189 25148 8732 1 13 . 1 1 116 116 GLN CB C 116 28.244 28.244 28.479 -0.235 25148 8733 1 13 . 1 1 116 116 GLN H H 116 7.936 7.936 7.431 0.505 25148 8734 1 13 . 1 1 117 117 ARG N N 117 117.838 117.838 119.109 -1.271 25148 8735 1 13 . 1 1 117 117 ARG HA H 117 4.174 4.174 4.074 0.100 25148 8736 1 13 . 1 1 117 117 ARG C C 117 179.138 179.138 178.869 0.269 25148 8737 1 13 . 1 1 117 117 ARG CA C 117 57.461 57.461 58.495 -1.034 25148 8738 1 13 . 1 1 117 117 ARG CB C 117 29.548 29.548 29.572 -0.024 25148 8739 1 13 . 1 1 117 117 ARG H H 117 8.240 8.240 8.224 0.016 25148 8740 1 13 . 1 1 118 118 VAL N N 118 120.278 120.278 119.593 0.685 25148 8741 1 13 . 1 1 118 118 VAL HA H 118 3.709 3.709 3.706 0.003 25148 8742 1 13 . 1 1 118 118 VAL C C 118 177.597 177.597 177.963 -0.366 25148 8743 1 13 . 1 1 118 118 VAL CA C 118 66.246 66.246 66.456 -0.210 25148 8744 1 13 . 1 1 118 118 VAL CB C 118 31.785 31.785 30.811 0.974 25148 8745 1 13 . 1 1 118 118 VAL H H 118 8.480 8.480 7.508 0.972 25148 8746 1 13 . 1 1 119 119 ARG N N 119 120.197 120.197 119.631 0.566 25148 8747 1 13 . 1 1 119 119 ARG HA H 119 4.173 4.173 4.016 0.157 25148 8748 1 13 . 1 1 119 119 ARG C C 119 178.864 178.864 178.921 -0.057 25148 8749 1 13 . 1 1 119 119 ARG CA C 119 58.772 58.772 59.737 -0.965 25148 8750 1 13 . 1 1 119 119 ARG CB C 119 29.873 29.873 29.855 0.017 25148 8751 1 13 . 1 1 119 119 ARG H H 119 7.899 7.899 7.602 0.297 25148 8752 1 13 . 1 1 120 120 GLU N N 120 118.768 118.768 119.188 -0.420 25148 8753 1 13 . 1 1 120 120 GLU HA H 120 4.110 4.110 4.022 0.088 25148 8754 1 13 . 1 1 120 120 GLU C C 120 177.823 177.823 178.810 -0.987 25148 8755 1 13 . 1 1 120 120 GLU CA C 120 58.223 58.223 59.376 -1.153 25148 8756 1 13 . 1 1 120 120 GLU CB C 120 29.854 29.854 29.388 0.466 25148 8757 1 13 . 1 1 120 120 GLU H H 120 8.084 8.084 8.146 -0.062 25148 8758 1 13 . 1 1 121 121 ALA N N 121 121.984 121.984 121.855 0.129 25148 8759 1 13 . 1 1 121 121 ALA HA H 121 4.296 4.296 4.052 0.244 25148 8760 1 13 . 1 1 121 121 ALA C C 121 178.586 178.586 180.036 -1.450 25148 8761 1 13 . 1 1 121 121 ALA CA C 121 53.475 53.475 55.143 -1.668 25148 8762 1 13 . 1 1 121 121 ALA CB C 121 18.856 18.856 18.353 0.503 25148 8763 1 13 . 1 1 121 121 ALA H H 121 7.810 7.810 8.176 -0.366 25148 8764 1 13 . 1 1 122 122 GLU N N 122 118.229 118.229 117.158 1.071 25148 8765 1 13 . 1 1 122 122 GLU HA H 122 4.241 4.241 4.021 0.220 25148 8766 1 13 . 1 1 122 122 GLU C C 122 176.839 176.839 178.642 -1.803 25148 8767 1 13 . 1 1 122 122 GLU CA C 122 57.118 57.118 58.459 -1.341 25148 8768 1 13 . 1 1 122 122 GLU CB C 122 30.018 30.018 29.323 0.695 25148 8769 1 13 . 1 1 122 122 GLU H H 122 7.938 7.938 7.893 0.045 25148 8770 1 13 . 1 1 123 123 ARG N N 123 120.601 120.601 119.202 1.399 25148 8771 1 13 . 1 1 123 123 ARG HA H 123 4.348 4.348 4.244 0.104 25148 8772 1 13 . 1 1 123 123 ARG C C 123 176.071 176.071 176.444 -0.373 25148 8773 1 13 . 1 1 123 123 ARG CA C 123 56.510 56.510 56.691 -0.181 25148 8774 1 13 . 1 1 123 123 ARG CB C 123 30.765 30.765 31.060 -0.295 25148 8775 1 13 . 1 1 123 123 ARG H H 123 7.977 7.977 8.156 -0.179 25148 8776 1 14 . 1 1 4 4 GLU HA H 4 4.138 4.138 4.071 0.067 25148 8777 1 14 . 1 1 4 4 GLU C C 4 179.152 179.152 177.878 1.274 25148 8778 1 14 . 1 1 4 4 GLU CA C 4 59.566 59.566 58.099 1.467 25148 8779 1 14 . 1 1 4 4 GLU CB C 4 29.407 29.407 29.712 -0.305 25148 8780 1 14 . 1 1 5 5 LEU N N 5 121.360 121.360 117.292 4.068 25148 8781 1 14 . 1 1 5 5 LEU HA H 5 4.195 4.195 4.034 0.161 25148 8782 1 14 . 1 1 5 5 LEU C C 5 178.179 178.179 178.273 -0.094 25148 8783 1 14 . 1 1 5 5 LEU CA C 5 57.830 57.830 57.601 0.229 25148 8784 1 14 . 1 1 5 5 LEU CB C 5 41.630 41.630 41.260 0.370 25148 8785 1 14 . 1 1 5 5 LEU H H 5 7.877 7.877 7.961 -0.084 25148 8786 1 14 . 1 1 6 6 LEU N N 6 118.058 118.058 120.021 -1.963 25148 8787 1 14 . 1 1 6 6 LEU HA H 6 3.919 3.919 3.836 0.083 25148 8788 1 14 . 1 1 6 6 LEU C C 6 180.274 180.274 179.149 1.125 25148 8789 1 14 . 1 1 6 6 LEU CA C 6 58.221 58.221 57.742 0.479 25148 8790 1 14 . 1 1 6 6 LEU CB C 6 40.684 40.684 41.177 -0.493 25148 8791 1 14 . 1 1 6 6 LEU H H 6 7.685 7.685 7.446 0.239 25148 8792 1 14 . 1 1 7 7 ASP N N 7 120.662 120.662 117.602 3.060 25148 8793 1 14 . 1 1 7 7 ASP HA H 7 4.416 4.416 4.388 0.028 25148 8794 1 14 . 1 1 7 7 ASP C C 7 178.738 178.738 177.909 0.829 25148 8795 1 14 . 1 1 7 7 ASP CA C 7 57.519 57.519 56.892 0.627 25148 8796 1 14 . 1 1 7 7 ASP CB C 7 40.167 40.167 40.805 -0.638 25148 8797 1 14 . 1 1 7 7 ASP H H 7 8.427 8.427 7.809 0.618 25148 8798 1 14 . 1 1 8 8 ALA N N 8 122.612 122.612 123.075 -0.463 25148 8799 1 14 . 1 1 8 8 ALA HA H 8 4.146 4.146 3.924 0.222 25148 8800 1 14 . 1 1 8 8 ALA C C 8 180.787 180.787 179.445 1.342 25148 8801 1 14 . 1 1 8 8 ALA CA C 8 55.165 55.165 55.340 -0.175 25148 8802 1 14 . 1 1 8 8 ALA CB C 8 17.711 17.711 18.648 -0.937 25148 8803 1 14 . 1 1 8 8 ALA H H 8 7.847 7.847 7.674 0.173 25148 8804 1 14 . 1 1 9 9 LEU N N 9 116.977 116.977 117.730 -0.753 25148 8805 1 14 . 1 1 9 9 LEU HA H 9 4.115 4.115 3.840 0.275 25148 8806 1 14 . 1 1 9 9 LEU C C 9 179.510 179.510 179.331 0.179 25148 8807 1 14 . 1 1 9 9 LEU CA C 9 57.468 57.468 58.094 -0.626 25148 8808 1 14 . 1 1 9 9 LEU CB C 9 41.203 41.203 41.603 -0.400 25148 8809 1 14 . 1 1 9 9 LEU H H 9 8.256 8.256 7.974 0.282 25148 8810 1 14 . 1 1 10 10 THR N N 10 118.764 118.764 115.838 2.926 25148 8811 1 14 . 1 1 10 10 THR HA H 10 4.487 4.487 3.840 0.647 25148 8812 1 14 . 1 1 10 10 THR C C 10 176.567 176.567 176.794 -0.227 25148 8813 1 14 . 1 1 10 10 THR CA C 10 68.768 68.768 66.751 2.017 25148 8814 1 14 . 1 1 10 10 THR CB C 10 66.961 66.961 68.657 -1.696 25148 8815 1 14 . 1 1 10 10 THR H H 10 8.218 8.218 7.336 0.882 25148 8816 1 14 . 1 1 11 11 ILE N N 11 122.555 122.555 120.077 2.478 25148 8817 1 14 . 1 1 11 11 ILE HA H 11 3.779 3.779 3.744 0.035 25148 8818 1 14 . 1 1 11 11 ILE C C 11 177.793 177.793 178.117 -0.324 25148 8819 1 14 . 1 1 11 11 ILE CA C 11 64.695 64.695 64.913 -0.218 25148 8820 1 14 . 1 1 11 11 ILE CB C 11 37.856 37.856 37.722 0.134 25148 8821 1 14 . 1 1 11 11 ILE H H 11 7.632 7.632 7.794 -0.162 25148 8822 1 14 . 1 1 12 12 LEU N N 12 120.469 120.469 117.827 2.642 25148 8823 1 14 . 1 1 12 12 LEU HA H 12 4.065 4.065 4.104 -0.039 25148 8824 1 14 . 1 1 12 12 LEU C C 12 179.139 179.139 178.896 0.243 25148 8825 1 14 . 1 1 12 12 LEU CA C 12 57.944 57.944 56.941 1.003 25148 8826 1 14 . 1 1 12 12 LEU CB C 12 42.170 42.170 41.199 0.971 25148 8827 1 14 . 1 1 12 12 LEU H H 12 7.951 7.951 7.759 0.192 25148 8828 1 14 . 1 1 13 13 GLU N N 13 119.669 119.669 118.793 0.876 25148 8829 1 14 . 1 1 13 13 GLU HA H 13 4.183 4.183 4.013 0.170 25148 8830 1 14 . 1 1 13 13 GLU C C 13 179.007 179.007 177.259 1.748 25148 8831 1 14 . 1 1 13 13 GLU CA C 13 59.703 59.703 58.723 0.980 25148 8832 1 14 . 1 1 13 13 GLU CB C 13 30.110 30.110 29.349 0.761 25148 8833 1 14 . 1 1 13 13 GLU H H 13 8.003 8.003 7.818 0.185 25148 8834 1 14 . 1 1 14 14 LYS N N 14 118.935 118.935 117.306 1.629 25148 8835 1 14 . 1 1 14 14 LYS HA H 14 4.124 4.124 4.105 0.019 25148 8836 1 14 . 1 1 14 14 LYS CA C 14 58.847 58.847 57.512 1.335 25148 8837 1 14 . 1 1 14 14 LYS CB C 14 33.053 33.053 32.597 0.456 25148 8838 1 14 . 1 1 14 14 LYS H H 14 7.862 7.862 7.357 0.505 25148 8839 1 14 . 1 1 15 15 GLU HA H 15 3.693 3.693 4.277 -0.584 25148 8840 1 14 . 1 1 15 15 GLU CA C 15 56.688 56.688 56.693 -0.005 25148 8841 1 14 . 1 1 15 15 GLU CB C 15 32.204 32.204 30.194 2.010 25148 8842 1 14 . 1 1 16 16 LYS HA H 16 4.678 4.678 4.322 0.356 25148 8843 1 14 . 1 1 16 16 LYS CA C 16 55.135 55.135 55.744 -0.609 25148 8844 1 14 . 1 1 16 16 LYS CB C 16 34.049 34.049 32.456 1.593 25148 8845 1 14 . 1 1 17 17 GLY CA C 17 46.541 46.541 45.269 1.272 25148 8846 1 14 . 1 1 18 18 ILE N N 18 115.364 115.364 119.790 -4.426 25148 8847 1 14 . 1 1 18 18 ILE HA H 18 4.079 4.079 4.256 -0.177 25148 8848 1 14 . 1 1 18 18 ILE C C 18 174.751 174.751 175.355 -0.604 25148 8849 1 14 . 1 1 18 18 ILE CA C 18 60.333 60.333 59.537 0.796 25148 8850 1 14 . 1 1 18 18 ILE CB C 18 39.044 39.044 37.589 1.455 25148 8851 1 14 . 1 1 18 18 ILE H H 18 8.203 8.203 7.876 0.327 25148 8852 1 14 . 1 1 19 19 SER N N 19 119.891 119.891 119.189 0.702 25148 8853 1 14 . 1 1 19 19 SER HA H 19 4.362 4.362 4.354 0.008 25148 8854 1 14 . 1 1 19 19 SER CA C 19 58.476 58.476 59.142 -0.666 25148 8855 1 14 . 1 1 19 19 SER CB C 19 63.533 63.533 64.364 -0.831 25148 8856 1 14 . 1 1 19 19 SER H H 19 8.253 8.253 8.433 -0.180 25148 8857 1 14 . 1 1 20 20 LYS N N 20 124.782 124.782 126.329 -1.547 25148 8858 1 14 . 1 1 20 20 LYS HA H 20 4.137 4.137 4.057 0.080 25148 8859 1 14 . 1 1 20 20 LYS C C 20 177.889 177.889 177.771 0.118 25148 8860 1 14 . 1 1 20 20 LYS CA C 20 59.485 59.485 58.803 0.681 25148 8861 1 14 . 1 1 20 20 LYS CB C 20 32.711 32.711 32.180 0.531 25148 8862 1 14 . 1 1 20 20 LYS H H 20 8.918 8.918 8.761 0.157 25148 8863 1 14 . 1 1 21 21 GLU N N 21 117.831 117.831 118.640 -0.809 25148 8864 1 14 . 1 1 21 21 GLU HA H 21 3.957 3.957 4.049 -0.092 25148 8865 1 14 . 1 1 21 21 GLU C C 21 178.822 178.822 178.498 0.324 25148 8866 1 14 . 1 1 21 21 GLU CA C 21 59.529 59.529 58.878 0.651 25148 8867 1 14 . 1 1 21 21 GLU CB C 21 29.237 29.237 28.885 0.352 25148 8868 1 14 . 1 1 21 21 GLU H H 21 8.361 8.361 8.703 -0.342 25148 8869 1 14 . 1 1 22 22 ILE N N 22 118.690 118.690 119.682 -0.992 25148 8870 1 14 . 1 1 22 22 ILE HA H 22 3.884 3.884 3.910 -0.026 25148 8871 1 14 . 1 1 22 22 ILE C C 22 179.247 179.247 177.735 1.512 25148 8872 1 14 . 1 1 22 22 ILE CA C 22 63.735 63.735 64.089 -0.354 25148 8873 1 14 . 1 1 22 22 ILE CB C 22 37.415 37.415 38.083 -0.668 25148 8874 1 14 . 1 1 22 22 ILE H H 22 7.353 7.353 7.377 -0.024 25148 8875 1 14 . 1 1 23 23 ILE N N 23 120.880 120.880 120.338 0.542 25148 8876 1 14 . 1 1 23 23 ILE HA H 23 3.733 3.733 3.723 0.010 25148 8877 1 14 . 1 1 23 23 ILE C C 23 177.817 177.817 177.843 -0.026 25148 8878 1 14 . 1 1 23 23 ILE CA C 23 64.172 64.172 63.172 1.000 25148 8879 1 14 . 1 1 23 23 ILE CB C 23 36.473 36.473 36.675 -0.202 25148 8880 1 14 . 1 1 23 23 ILE H H 23 7.571 7.571 7.133 0.438 25148 8881 1 14 . 1 1 24 24 ILE N N 24 121.460 121.460 118.916 2.544 25148 8882 1 14 . 1 1 24 24 ILE HA H 24 3.486 3.486 3.606 -0.120 25148 8883 1 14 . 1 1 24 24 ILE C C 24 177.759 177.759 177.698 0.061 25148 8884 1 14 . 1 1 24 24 ILE CA C 24 66.641 66.641 66.130 0.511 25148 8885 1 14 . 1 1 24 24 ILE CB C 24 37.307 37.307 37.316 -0.008 25148 8886 1 14 . 1 1 24 24 ILE H H 24 8.709 8.709 7.749 0.960 25148 8887 1 14 . 1 1 25 25 GLU N N 25 119.323 119.323 119.194 0.129 25148 8888 1 14 . 1 1 25 25 GLU HA H 25 4.177 4.177 4.360 -0.183 25148 8889 1 14 . 1 1 25 25 GLU C C 25 179.348 179.348 178.831 0.517 25148 8890 1 14 . 1 1 25 25 GLU CA C 25 59.951 59.951 58.851 1.100 25148 8891 1 14 . 1 1 25 25 GLU CB C 25 29.340 29.340 29.235 0.105 25148 8892 1 14 . 1 1 25 25 GLU H H 25 8.048 8.048 7.723 0.325 25148 8893 1 14 . 1 1 26 26 ALA N N 26 122.390 122.390 122.931 -0.541 25148 8894 1 14 . 1 1 26 26 ALA HA H 26 4.325 4.325 4.122 0.203 25148 8895 1 14 . 1 1 26 26 ALA C C 26 181.440 181.440 179.685 1.755 25148 8896 1 14 . 1 1 26 26 ALA CA C 26 54.935 54.935 54.919 0.016 25148 8897 1 14 . 1 1 26 26 ALA CB C 26 17.834 17.834 18.375 -0.541 25148 8898 1 14 . 1 1 26 26 ALA H H 26 7.768 7.768 7.820 -0.052 25148 8899 1 14 . 1 1 27 27 ILE N N 27 122.342 122.342 119.791 2.551 25148 8900 1 14 . 1 1 27 27 ILE HA H 27 3.575 3.575 3.602 -0.027 25148 8901 1 14 . 1 1 27 27 ILE C C 27 177.541 177.541 178.086 -0.545 25148 8902 1 14 . 1 1 27 27 ILE CA C 27 66.536 66.536 65.727 0.809 25148 8903 1 14 . 1 1 27 27 ILE CB C 27 37.886 37.886 37.745 0.142 25148 8904 1 14 . 1 1 27 27 ILE H H 27 8.805 8.805 7.691 1.114 25148 8905 1 14 . 1 1 28 28 GLU N N 28 120.188 120.188 119.433 0.755 25148 8906 1 14 . 1 1 28 28 GLU HA H 28 3.687 3.687 3.913 -0.226 25148 8907 1 14 . 1 1 28 28 GLU C C 28 178.707 178.707 179.106 -0.399 25148 8908 1 14 . 1 1 28 28 GLU CA C 28 61.458 61.458 59.954 1.504 25148 8909 1 14 . 1 1 28 28 GLU CB C 28 29.624 29.624 29.251 0.373 25148 8910 1 14 . 1 1 28 28 GLU H H 28 8.882 8.882 8.000 0.882 25148 8911 1 14 . 1 1 29 29 ALA N N 29 119.293 119.293 121.014 -1.721 25148 8912 1 14 . 1 1 29 29 ALA HA H 29 4.214 4.214 4.249 -0.035 25148 8913 1 14 . 1 1 29 29 ALA C C 29 181.200 181.200 179.512 1.688 25148 8914 1 14 . 1 1 29 29 ALA CA C 29 55.435 55.435 54.651 0.784 25148 8915 1 14 . 1 1 29 29 ALA CB C 29 18.090 18.090 18.188 -0.098 25148 8916 1 14 . 1 1 29 29 ALA H H 29 8.065 8.065 7.794 0.271 25148 8917 1 14 . 1 1 30 30 ALA N N 30 121.729 121.729 122.794 -1.065 25148 8918 1 14 . 1 1 30 30 ALA HA H 30 4.307 4.307 4.167 0.140 25148 8919 1 14 . 1 1 30 30 ALA C C 30 181.315 181.315 179.582 1.733 25148 8920 1 14 . 1 1 30 30 ALA CA C 30 54.594 54.594 54.952 -0.358 25148 8921 1 14 . 1 1 30 30 ALA CB C 30 18.704 18.704 18.349 0.355 25148 8922 1 14 . 1 1 30 30 ALA H H 30 8.099 8.099 7.848 0.251 25148 8923 1 14 . 1 1 31 31 LEU N N 31 120.900 120.900 120.120 0.780 25148 8924 1 14 . 1 1 31 31 LEU HA H 31 4.347 4.347 4.151 0.196 25148 8925 1 14 . 1 1 31 31 LEU C C 31 179.137 179.137 179.242 -0.105 25148 8926 1 14 . 1 1 31 31 LEU CA C 31 57.569 57.569 58.117 -0.548 25148 8927 1 14 . 1 1 31 31 LEU CB C 31 42.353 42.353 41.075 1.278 25148 8928 1 14 . 1 1 31 31 LEU H H 31 8.863 8.863 8.540 0.323 25148 8929 1 14 . 1 1 32 32 ILE N N 32 122.410 122.410 119.072 3.338 25148 8930 1 14 . 1 1 32 32 ILE HA H 32 3.699 3.699 3.705 -0.006 25148 8931 1 14 . 1 1 32 32 ILE C C 32 178.303 178.303 177.862 0.441 25148 8932 1 14 . 1 1 32 32 ILE CA C 32 66.066 66.066 65.350 0.716 25148 8933 1 14 . 1 1 32 32 ILE CB C 32 37.882 37.882 37.945 -0.063 25148 8934 1 14 . 1 1 32 32 ILE H H 32 8.234 8.234 7.864 0.370 25148 8935 1 14 . 1 1 33 33 SER N N 33 114.201 114.201 115.704 -1.503 25148 8936 1 14 . 1 1 33 33 SER HA H 33 4.311 4.311 4.140 0.171 25148 8937 1 14 . 1 1 33 33 SER C C 33 177.012 177.012 176.592 0.420 25148 8938 1 14 . 1 1 33 33 SER CA C 33 61.860 61.860 62.042 -0.182 25148 8939 1 14 . 1 1 33 33 SER CB C 33 62.508 62.508 63.183 -0.675 25148 8940 1 14 . 1 1 33 33 SER H H 33 7.558 7.558 7.857 -0.299 25148 8941 1 14 . 1 1 34 34 ALA N N 34 122.893 122.893 124.013 -1.120 25148 8942 1 14 . 1 1 34 34 ALA HA H 34 4.215 4.215 4.104 0.111 25148 8943 1 14 . 1 1 34 34 ALA C C 34 180.814 180.814 179.833 0.981 25148 8944 1 14 . 1 1 34 34 ALA CA C 34 55.283 55.283 54.936 0.347 25148 8945 1 14 . 1 1 34 34 ALA CB C 34 18.273 18.273 18.265 0.008 25148 8946 1 14 . 1 1 34 34 ALA H H 34 8.409 8.409 8.072 0.337 25148 8947 1 14 . 1 1 35 35 TYR N N 35 120.259 120.259 119.415 0.844 25148 8948 1 14 . 1 1 35 35 TYR HA H 35 4.393 4.393 4.418 -0.025 25148 8949 1 14 . 1 1 35 35 TYR C C 35 177.892 177.892 177.119 0.773 25148 8950 1 14 . 1 1 35 35 TYR CA C 35 63.071 63.071 60.532 2.539 25148 8951 1 14 . 1 1 35 35 TYR CB C 35 38.021 38.021 38.924 -0.903 25148 8952 1 14 . 1 1 35 35 TYR H H 35 8.975 8.975 8.148 0.827 25148 8953 1 14 . 1 1 36 36 LYS N N 36 120.942 120.942 119.838 1.104 25148 8954 1 14 . 1 1 36 36 LYS HA H 36 4.032 4.032 4.081 -0.049 25148 8955 1 14 . 1 1 36 36 LYS C C 36 177.797 177.797 178.048 -0.251 25148 8956 1 14 . 1 1 36 36 LYS CA C 36 59.900 59.900 59.072 0.829 25148 8957 1 14 . 1 1 36 36 LYS CB C 36 32.429 32.429 32.247 0.182 25148 8958 1 14 . 1 1 36 36 LYS H H 36 8.654 8.654 8.011 0.643 25148 8959 1 14 . 1 1 37 37 ARG N N 37 115.139 115.139 116.048 -0.909 25148 8960 1 14 . 1 1 37 37 ARG HA H 37 4.101 4.101 4.111 -0.010 25148 8961 1 14 . 1 1 37 37 ARG C C 37 177.517 177.517 178.164 -0.647 25148 8962 1 14 . 1 1 37 37 ARG CA C 37 58.276 58.276 58.347 -0.071 25148 8963 1 14 . 1 1 37 37 ARG CB C 37 31.014 31.014 29.983 1.031 25148 8964 1 14 . 1 1 37 37 ARG H H 37 8.138 8.138 7.717 0.421 25148 8965 1 14 . 1 1 38 38 ASN N N 38 112.555 112.555 116.942 -4.387 25148 8966 1 14 . 1 1 38 38 ASN HA H 38 4.540 4.540 4.338 0.202 25148 8967 1 14 . 1 1 38 38 ASN C C 38 173.994 173.994 175.375 -1.381 25148 8968 1 14 . 1 1 38 38 ASN CA C 38 54.722 54.722 55.278 -0.556 25148 8969 1 14 . 1 1 38 38 ASN CB C 38 42.077 42.077 39.005 3.072 25148 8970 1 14 . 1 1 38 38 ASN H H 38 7.426 7.426 7.591 -0.165 25148 8971 1 14 . 1 1 39 39 PHE N N 39 116.711 116.711 116.899 -0.188 25148 8972 1 14 . 1 1 39 39 PHE HA H 39 4.569 4.569 4.791 -0.222 25148 8973 1 14 . 1 1 39 39 PHE CA C 39 58.913 58.913 56.264 2.649 25148 8974 1 14 . 1 1 39 39 PHE CB C 39 39.781 39.781 38.374 1.407 25148 8975 1 14 . 1 1 39 39 PHE H H 39 7.959 7.959 7.498 0.461 25148 8976 1 14 . 1 1 40 40 ASN HA H 40 4.018 4.018 4.528 -0.510 25148 8977 1 14 . 1 1 40 40 ASN CA C 40 58.944 58.944 55.625 3.319 25148 8978 1 14 . 1 1 41 41 GLN HA H 41 4.298 4.298 4.488 -0.190 25148 8979 1 14 . 1 1 41 41 GLN C C 41 175.237 175.237 175.635 -0.398 25148 8980 1 14 . 1 1 41 41 GLN CA C 41 57.360 57.360 56.422 0.938 25148 8981 1 14 . 1 1 41 41 GLN CB C 41 28.724 28.724 28.163 0.561 25148 8982 1 14 . 1 1 42 42 ALA N N 42 120.514 120.514 121.446 -0.932 25148 8983 1 14 . 1 1 42 42 ALA HA H 42 4.622 4.622 4.463 0.159 25148 8984 1 14 . 1 1 42 42 ALA C C 42 175.922 175.922 177.038 -1.116 25148 8985 1 14 . 1 1 42 42 ALA CA C 42 51.841 51.841 52.238 -0.397 25148 8986 1 14 . 1 1 42 42 ALA CB C 42 21.576 21.576 19.993 1.583 25148 8987 1 14 . 1 1 42 42 ALA H H 42 7.817 7.817 8.102 -0.285 25148 8988 1 14 . 1 1 43 43 GLN N N 43 117.594 117.594 114.708 2.886 25148 8989 1 14 . 1 1 43 43 GLN HA H 43 4.265 4.265 4.574 -0.309 25148 8990 1 14 . 1 1 43 43 GLN C C 43 174.942 174.942 173.859 1.083 25148 8991 1 14 . 1 1 43 43 GLN CA C 43 57.047 57.047 55.400 1.647 25148 8992 1 14 . 1 1 43 43 GLN CB C 43 30.863 30.863 31.424 -0.561 25148 8993 1 14 . 1 1 43 43 GLN H H 43 7.400 7.400 7.581 -0.181 25148 8994 1 14 . 1 1 44 44 ASN N N 44 120.467 120.467 119.405 1.062 25148 8995 1 14 . 1 1 44 44 ASN HA H 44 5.005 5.005 4.883 0.122 25148 8996 1 14 . 1 1 44 44 ASN C C 44 174.365 174.365 173.971 0.394 25148 8997 1 14 . 1 1 44 44 ASN CA C 44 52.381 52.381 53.265 -0.884 25148 8998 1 14 . 1 1 44 44 ASN CB C 44 38.177 38.177 39.649 -1.472 25148 8999 1 14 . 1 1 44 44 ASN H H 44 9.123 9.123 8.674 0.449 25148 9000 1 14 . 1 1 45 45 VAL N N 45 115.479 115.479 119.260 -3.781 25148 9001 1 14 . 1 1 45 45 VAL HA H 45 5.376 5.376 4.349 1.027 25148 9002 1 14 . 1 1 45 45 VAL C C 45 174.908 174.908 174.002 0.906 25148 9003 1 14 . 1 1 45 45 VAL CA C 45 59.022 59.022 61.005 -1.983 25148 9004 1 14 . 1 1 45 45 VAL CB C 45 35.776 35.776 35.354 0.422 25148 9005 1 14 . 1 1 45 45 VAL H H 45 7.732 7.732 8.282 -0.550 25148 9006 1 14 . 1 1 46 46 ARG N N 46 121.146 121.146 125.410 -4.264 25148 9007 1 14 . 1 1 46 46 ARG HA H 46 4.566 4.566 4.798 -0.232 25148 9008 1 14 . 1 1 46 46 ARG C C 46 173.790 173.790 174.434 -0.644 25148 9009 1 14 . 1 1 46 46 ARG CA C 46 54.762 54.762 53.926 0.836 25148 9010 1 14 . 1 1 46 46 ARG CB C 46 33.946 33.946 31.512 2.434 25148 9011 1 14 . 1 1 46 46 ARG H H 46 8.850 8.850 9.168 -0.318 25148 9012 1 14 . 1 1 47 47 VAL N N 47 122.339 122.339 125.333 -2.994 25148 9013 1 14 . 1 1 47 47 VAL HA H 47 4.741 4.741 4.320 0.421 25148 9014 1 14 . 1 1 47 47 VAL C C 47 173.541 173.541 175.482 -1.941 25148 9015 1 14 . 1 1 47 47 VAL CA C 47 60.893 60.893 62.224 -1.331 25148 9016 1 14 . 1 1 47 47 VAL CB C 47 33.563 33.563 32.956 0.606 25148 9017 1 14 . 1 1 47 47 VAL H H 47 8.444 8.444 8.589 -0.145 25148 9018 1 14 . 1 1 48 48 ASP N N 48 127.701 127.701 127.908 -0.207 25148 9019 1 14 . 1 1 48 48 ASP HA H 48 4.946 4.946 4.960 -0.014 25148 9020 1 14 . 1 1 48 48 ASP C C 48 173.744 173.744 174.087 -0.343 25148 9021 1 14 . 1 1 48 48 ASP CA C 48 52.651 52.651 52.899 -0.248 25148 9022 1 14 . 1 1 48 48 ASP CB C 48 45.225 45.225 43.497 1.728 25148 9023 1 14 . 1 1 48 48 ASP H H 48 9.068 9.068 8.696 0.372 25148 9024 1 14 . 1 1 49 49 LEU N N 49 130.945 130.945 126.315 4.630 25148 9025 1 14 . 1 1 49 49 LEU HA H 49 4.774 4.774 4.635 0.139 25148 9026 1 14 . 1 1 49 49 LEU C C 49 174.531 174.531 175.756 -1.225 25148 9027 1 14 . 1 1 49 49 LEU CA C 49 54.337 54.337 54.336 0.001 25148 9028 1 14 . 1 1 49 49 LEU CB C 49 43.192 43.192 44.196 -1.004 25148 9029 1 14 . 1 1 49 49 LEU H H 49 9.369 9.369 8.615 0.754 25148 9030 1 14 . 1 1 50 50 ASN N N 50 126.268 126.268 122.883 3.385 25148 9031 1 14 . 1 1 50 50 ASN HA H 50 4.629 4.629 5.053 -0.424 25148 9032 1 14 . 1 1 50 50 ASN C C 50 176.602 176.602 175.198 1.404 25148 9033 1 14 . 1 1 50 50 ASN CA C 50 54.048 54.048 52.719 1.329 25148 9034 1 14 . 1 1 50 50 ASN CB C 50 39.891 39.891 39.992 -0.101 25148 9035 1 14 . 1 1 50 50 ASN H H 50 8.672 8.672 8.709 -0.037 25148 9036 1 14 . 1 1 51 51 ARG N N 51 125.897 125.897 124.831 1.066 25148 9037 1 14 . 1 1 51 51 ARG HA H 51 3.789 3.789 4.065 -0.276 25148 9038 1 14 . 1 1 51 51 ARG C C 51 175.681 175.681 176.394 -0.713 25148 9039 1 14 . 1 1 51 51 ARG CA C 51 58.162 58.162 58.466 -0.304 25148 9040 1 14 . 1 1 51 51 ARG CB C 51 29.944 29.944 29.922 0.022 25148 9041 1 14 . 1 1 51 51 ARG H H 51 8.984 8.984 8.785 0.199 25148 9042 1 14 . 1 1 52 52 GLU N N 52 116.733 116.733 117.934 -1.201 25148 9043 1 14 . 1 1 52 52 GLU HA H 52 4.368 4.368 4.173 0.195 25148 9044 1 14 . 1 1 52 52 GLU C C 52 178.049 178.049 177.474 0.575 25148 9045 1 14 . 1 1 52 52 GLU CA C 52 58.048 58.048 58.201 -0.153 25148 9046 1 14 . 1 1 52 52 GLU CB C 52 30.716 30.716 29.052 1.664 25148 9047 1 14 . 1 1 52 52 GLU H H 52 8.541 8.541 8.163 0.378 25148 9048 1 14 . 1 1 53 53 THR N N 53 106.556 106.556 112.530 -5.974 25148 9049 1 14 . 1 1 53 53 THR HA H 53 4.424 4.424 4.481 -0.057 25148 9050 1 14 . 1 1 53 53 THR C C 53 176.352 176.352 174.874 1.478 25148 9051 1 14 . 1 1 53 53 THR CA C 53 61.320 61.320 61.481 -0.161 25148 9052 1 14 . 1 1 53 53 THR CB C 53 71.220 71.220 69.740 1.480 25148 9053 1 14 . 1 1 53 53 THR H H 53 8.085 8.085 7.525 0.560 25148 9054 1 14 . 1 1 54 54 GLY N N 54 111.843 111.843 110.336 1.507 25148 9055 1 14 . 1 1 54 54 GLY C C 54 172.690 172.690 173.860 -1.170 25148 9056 1 14 . 1 1 54 54 GLY CA C 54 45.417 45.417 46.317 -0.900 25148 9057 1 14 . 1 1 54 54 GLY H H 54 8.330 8.330 7.740 0.590 25148 9058 1 14 . 1 1 55 55 SER N N 55 113.844 113.844 113.609 0.235 25148 9059 1 14 . 1 1 55 55 SER HA H 55 4.279 4.279 4.629 -0.350 25148 9060 1 14 . 1 1 55 55 SER C C 55 174.127 174.127 172.982 1.145 25148 9061 1 14 . 1 1 55 55 SER CA C 55 59.229 59.229 57.513 1.716 25148 9062 1 14 . 1 1 55 55 SER CB C 55 63.939 63.939 64.960 -1.021 25148 9063 1 14 . 1 1 55 55 SER H H 55 7.653 7.653 7.532 0.121 25148 9064 1 14 . 1 1 56 56 ILE N N 56 125.286 125.286 119.694 5.592 25148 9065 1 14 . 1 1 56 56 ILE HA H 56 5.082 5.082 4.680 0.402 25148 9066 1 14 . 1 1 56 56 ILE C C 56 175.346 175.346 174.325 1.021 25148 9067 1 14 . 1 1 56 56 ILE CA C 56 59.967 59.967 60.467 -0.500 25148 9068 1 14 . 1 1 56 56 ILE CB C 56 40.165 40.165 42.251 -2.086 25148 9069 1 14 . 1 1 56 56 ILE H H 56 8.478 8.478 8.476 0.002 25148 9070 1 14 . 1 1 57 57 ARG N N 57 126.332 126.332 127.244 -0.912 25148 9071 1 14 . 1 1 57 57 ARG HA H 57 4.740 4.740 4.554 0.186 25148 9072 1 14 . 1 1 57 57 ARG C C 57 173.921 173.921 173.489 0.432 25148 9073 1 14 . 1 1 57 57 ARG CA C 57 54.311 54.311 53.513 0.798 25148 9074 1 14 . 1 1 57 57 ARG CB C 57 35.805 35.805 33.311 2.494 25148 9075 1 14 . 1 1 57 57 ARG H H 57 8.590 8.590 8.480 0.110 25148 9076 1 14 . 1 1 58 58 VAL N N 58 120.987 120.987 123.532 -2.545 25148 9077 1 14 . 1 1 58 58 VAL HA H 58 4.334 4.334 4.050 0.284 25148 9078 1 14 . 1 1 58 58 VAL C C 58 174.204 174.204 174.226 -0.022 25148 9079 1 14 . 1 1 58 58 VAL CA C 58 60.861 60.861 60.871 -0.010 25148 9080 1 14 . 1 1 58 58 VAL CB C 58 33.383 33.383 31.445 1.938 25148 9081 1 14 . 1 1 58 58 VAL H H 58 8.585 8.585 8.246 0.339 25148 9082 1 14 . 1 1 59 59 PHE N N 59 124.913 124.913 126.442 -1.529 25148 9083 1 14 . 1 1 59 59 PHE HA H 59 5.046 5.046 5.338 -0.292 25148 9084 1 14 . 1 1 59 59 PHE C C 59 174.446 174.446 174.352 0.094 25148 9085 1 14 . 1 1 59 59 PHE CA C 59 56.695 56.695 55.323 1.372 25148 9086 1 14 . 1 1 59 59 PHE CB C 59 42.779 42.779 43.167 -0.388 25148 9087 1 14 . 1 1 59 59 PHE H H 59 8.920 8.920 8.395 0.525 25148 9088 1 14 . 1 1 60 60 ALA N N 60 124.035 124.035 123.834 0.201 25148 9089 1 14 . 1 1 60 60 ALA HA H 60 5.102 5.102 4.939 0.163 25148 9090 1 14 . 1 1 60 60 ALA C C 60 176.017 176.017 176.652 -0.635 25148 9091 1 14 . 1 1 60 60 ALA CA C 60 50.083 50.083 50.662 -0.579 25148 9092 1 14 . 1 1 60 60 ALA CB C 60 22.400 22.400 20.314 2.086 25148 9093 1 14 . 1 1 60 60 ALA H H 60 9.457 9.457 8.691 0.766 25148 9094 1 14 . 1 1 61 61 ARG N N 61 121.530 121.530 125.464 -3.934 25148 9095 1 14 . 1 1 61 61 ARG HA H 61 4.958 4.958 4.908 0.050 25148 9096 1 14 . 1 1 61 61 ARG C C 61 176.737 176.737 175.740 0.997 25148 9097 1 14 . 1 1 61 61 ARG CA C 61 55.375 55.375 55.877 -0.502 25148 9098 1 14 . 1 1 61 61 ARG CB C 61 31.230 31.230 31.113 0.117 25148 9099 1 14 . 1 1 61 61 ARG H H 61 8.447 8.447 8.704 -0.257 25148 9100 1 14 . 1 1 62 62 LYS N N 62 124.784 124.784 126.395 -1.611 25148 9101 1 14 . 1 1 62 62 LYS HA H 62 4.709 4.709 4.498 0.211 25148 9102 1 14 . 1 1 62 62 LYS C C 62 173.899 173.899 175.130 -1.231 25148 9103 1 14 . 1 1 62 62 LYS CA C 62 54.812 54.812 54.856 -0.044 25148 9104 1 14 . 1 1 62 62 LYS CB C 62 37.147 37.147 35.481 1.665 25148 9105 1 14 . 1 1 62 62 LYS H H 62 9.137 9.137 7.885 1.252 25148 9106 1 14 . 1 1 63 63 ASP N N 63 122.552 122.552 124.198 -1.646 25148 9107 1 14 . 1 1 63 63 ASP HA H 63 4.877 4.877 4.478 0.399 25148 9108 1 14 . 1 1 63 63 ASP C C 63 175.560 175.560 175.445 0.115 25148 9109 1 14 . 1 1 63 63 ASP CA C 63 54.576 54.576 55.391 -0.814 25148 9110 1 14 . 1 1 63 63 ASP CB C 63 42.841 42.841 41.913 0.928 25148 9111 1 14 . 1 1 63 63 ASP H H 63 8.334 8.334 8.557 -0.223 25148 9112 1 14 . 1 1 64 64 VAL N N 64 123.109 123.109 124.602 -1.493 25148 9113 1 14 . 1 1 64 64 VAL HA H 64 4.557 4.557 5.024 -0.467 25148 9114 1 14 . 1 1 64 64 VAL C C 64 177.260 177.260 174.838 2.422 25148 9115 1 14 . 1 1 64 64 VAL CA C 64 62.268 62.268 61.217 1.051 25148 9116 1 14 . 1 1 64 64 VAL CB C 64 30.348 30.348 31.603 -1.255 25148 9117 1 14 . 1 1 64 64 VAL H H 64 8.693 8.693 7.918 0.775 25148 9118 1 14 . 1 1 65 65 VAL N N 65 122.320 122.320 123.560 -1.240 25148 9119 1 14 . 1 1 65 65 VAL HA H 65 4.939 4.939 4.618 0.321 25148 9120 1 14 . 1 1 65 65 VAL C C 65 174.754 174.754 174.668 0.086 25148 9121 1 14 . 1 1 65 65 VAL CA C 65 59.173 59.173 59.520 -0.347 25148 9122 1 14 . 1 1 65 65 VAL CB C 65 36.289 36.289 35.236 1.053 25148 9123 1 14 . 1 1 65 65 VAL H H 65 8.656 8.656 8.473 0.183 25148 9124 1 14 . 1 1 66 66 ASP N N 66 119.805 119.805 120.348 -0.543 25148 9125 1 14 . 1 1 66 66 ASP HA H 66 4.499 4.499 4.525 -0.026 25148 9126 1 14 . 1 1 66 66 ASP C C 66 176.565 176.565 175.800 0.765 25148 9127 1 14 . 1 1 66 66 ASP CA C 66 57.236 57.236 55.970 1.266 25148 9128 1 14 . 1 1 66 66 ASP CB C 66 41.662 41.662 41.351 0.311 25148 9129 1 14 . 1 1 66 66 ASP H H 66 8.628 8.628 8.618 0.010 25148 9130 1 14 . 1 1 67 67 GLU N N 67 117.604 117.604 119.279 -1.675 25148 9131 1 14 . 1 1 67 67 GLU HA H 67 4.350 4.350 4.451 -0.101 25148 9132 1 14 . 1 1 67 67 GLU C C 67 173.736 173.736 174.684 -0.948 25148 9133 1 14 . 1 1 67 67 GLU CA C 67 55.203 55.203 55.078 0.125 25148 9134 1 14 . 1 1 67 67 GLU CB C 67 32.240 32.240 30.561 1.679 25148 9135 1 14 . 1 1 67 67 GLU H H 67 7.525 7.525 8.123 -0.598 25148 9136 1 14 . 1 1 68 68 VAL N N 68 125.774 125.774 125.083 0.691 25148 9137 1 14 . 1 1 68 68 VAL HA H 68 3.578 3.578 4.028 -0.450 25148 9138 1 14 . 1 1 68 68 VAL C C 68 175.885 175.885 175.726 0.159 25148 9139 1 14 . 1 1 68 68 VAL CA C 68 63.397 63.397 63.308 0.089 25148 9140 1 14 . 1 1 68 68 VAL CB C 68 32.452 32.452 31.537 0.915 25148 9141 1 14 . 1 1 68 68 VAL H H 68 8.573 8.573 8.537 0.036 25148 9142 1 14 . 1 1 69 69 TYR N N 69 129.859 129.859 124.997 4.862 25148 9143 1 14 . 1 1 69 69 TYR HA H 69 4.642 4.642 4.534 0.108 25148 9144 1 14 . 1 1 69 69 TYR C C 69 176.100 176.100 176.108 -0.008 25148 9145 1 14 . 1 1 69 69 TYR CA C 69 59.092 59.092 59.227 -0.135 25148 9146 1 14 . 1 1 69 69 TYR CB C 69 39.830 39.830 40.149 -0.319 25148 9147 1 14 . 1 1 69 69 TYR H H 69 9.801 9.801 8.119 1.682 25148 9148 1 14 . 1 1 70 70 ASP N N 70 120.204 120.204 119.871 0.333 25148 9149 1 14 . 1 1 70 70 ASP HA H 70 4.772 4.772 4.859 -0.087 25148 9150 1 14 . 1 1 70 70 ASP C C 70 176.622 176.622 176.559 0.063 25148 9151 1 14 . 1 1 70 70 ASP CA C 70 52.885 52.885 53.223 -0.338 25148 9152 1 14 . 1 1 70 70 ASP CB C 70 41.878 41.878 40.224 1.654 25148 9153 1 14 . 1 1 70 70 ASP H H 70 8.348 8.348 8.038 0.310 25148 9154 1 14 . 1 1 71 71 GLN N N 71 125.440 125.440 123.693 1.747 25148 9155 1 14 . 1 1 71 71 GLN HA H 71 4.315 4.315 3.967 0.348 25148 9156 1 14 . 1 1 71 71 GLN C C 71 175.819 175.819 176.804 -0.985 25148 9157 1 14 . 1 1 71 71 GLN CA C 71 57.914 57.914 58.840 -0.926 25148 9158 1 14 . 1 1 71 71 GLN CB C 71 28.307 28.307 28.826 -0.519 25148 9159 1 14 . 1 1 71 71 GLN H H 71 9.097 9.097 8.547 0.550 25148 9160 1 14 . 1 1 72 72 ARG N N 72 116.306 116.306 116.339 -0.033 25148 9161 1 14 . 1 1 72 72 ARG HA H 72 4.252 4.252 4.176 0.076 25148 9162 1 14 . 1 1 72 72 ARG C C 72 178.087 178.087 175.646 2.441 25148 9163 1 14 . 1 1 72 72 ARG CA C 72 58.532 58.532 57.081 1.451 25148 9164 1 14 . 1 1 72 72 ARG CB C 72 30.143 30.143 30.091 0.052 25148 9165 1 14 . 1 1 72 72 ARG H H 72 8.534 8.534 8.484 0.050 25148 9166 1 14 . 1 1 73 73 LEU N N 73 116.734 116.734 112.192 4.542 25148 9167 1 14 . 1 1 73 73 LEU HA H 73 4.621 4.621 4.579 0.042 25148 9168 1 14 . 1 1 73 73 LEU C C 73 175.946 175.946 174.901 1.045 25148 9169 1 14 . 1 1 73 73 LEU CA C 73 55.250 55.250 55.694 -0.444 25148 9170 1 14 . 1 1 73 73 LEU CB C 73 46.960 46.960 44.718 2.242 25148 9171 1 14 . 1 1 73 73 LEU H H 73 7.460 7.460 7.657 -0.197 25148 9172 1 14 . 1 1 74 74 GLU N N 74 118.787 118.787 122.978 -4.191 25148 9173 1 14 . 1 1 74 74 GLU HA H 74 5.403 5.403 4.762 0.641 25148 9174 1 14 . 1 1 74 74 GLU C C 74 173.709 173.709 174.249 -0.540 25148 9175 1 14 . 1 1 74 74 GLU CA C 74 54.914 54.914 55.897 -0.983 25148 9176 1 14 . 1 1 74 74 GLU CB C 74 35.053 35.053 33.471 1.582 25148 9177 1 14 . 1 1 74 74 GLU H H 74 7.752 7.752 8.167 -0.415 25148 9178 1 14 . 1 1 75 75 ILE N N 75 119.803 119.803 123.200 -3.397 25148 9179 1 14 . 1 1 75 75 ILE HA H 75 4.507 4.507 4.517 -0.010 25148 9180 1 14 . 1 1 75 75 ILE C C 75 172.126 172.126 174.009 -1.883 25148 9181 1 14 . 1 1 75 75 ILE CA C 75 58.664 58.664 59.693 -1.029 25148 9182 1 14 . 1 1 75 75 ILE CB C 75 42.560 42.560 41.845 0.715 25148 9183 1 14 . 1 1 75 75 ILE H H 75 8.975 8.975 9.218 -0.243 25148 9184 1 14 . 1 1 76 76 SER N N 76 123.236 123.236 123.731 -0.495 25148 9185 1 14 . 1 1 76 76 SER HA H 76 4.505 4.505 4.514 -0.009 25148 9186 1 14 . 1 1 76 76 SER C C 76 176.145 176.145 175.908 0.237 25148 9187 1 14 . 1 1 76 76 SER CA C 76 58.108 58.108 59.080 -0.972 25148 9188 1 14 . 1 1 76 76 SER CB C 76 65.000 65.000 63.799 1.201 25148 9189 1 14 . 1 1 76 76 SER H H 76 8.810 8.810 8.726 0.084 25148 9190 1 14 . 1 1 77 77 ILE N N 77 120.629 120.629 127.730 -7.101 25148 9191 1 14 . 1 1 77 77 ILE HA H 77 3.935 3.935 3.799 0.136 25148 9192 1 14 . 1 1 77 77 ILE C C 77 175.806 175.806 176.796 -0.990 25148 9193 1 14 . 1 1 77 77 ILE CA C 77 61.928 61.928 63.998 -2.070 25148 9194 1 14 . 1 1 77 77 ILE CB C 77 38.031 38.031 38.392 -0.361 25148 9195 1 14 . 1 1 77 77 ILE H H 77 8.321 8.321 8.143 0.178 25148 9196 1 14 . 1 1 78 78 GLU N N 78 121.032 121.032 117.632 3.400 25148 9197 1 14 . 1 1 78 78 GLU HA H 78 4.082 4.082 4.175 -0.093 25148 9198 1 14 . 1 1 78 78 GLU C C 78 179.829 179.829 178.415 1.414 25148 9199 1 14 . 1 1 78 78 GLU CA C 78 60.180 60.180 59.068 1.112 25148 9200 1 14 . 1 1 78 78 GLU CB C 78 28.988 28.988 28.820 0.168 25148 9201 1 14 . 1 1 78 78 GLU H H 78 8.222 8.222 8.330 -0.108 25148 9202 1 14 . 1 1 79 79 GLU N N 79 120.710 120.710 121.255 -0.545 25148 9203 1 14 . 1 1 79 79 GLU HA H 79 4.012 4.012 4.101 -0.089 25148 9204 1 14 . 1 1 79 79 GLU C C 79 180.339 180.339 178.809 1.530 25148 9205 1 14 . 1 1 79 79 GLU CA C 79 59.332 59.332 58.855 0.477 25148 9206 1 14 . 1 1 79 79 GLU CB C 79 29.317 29.317 29.217 0.100 25148 9207 1 14 . 1 1 79 79 GLU H H 79 7.908 7.908 7.436 0.472 25148 9208 1 14 . 1 1 80 80 ALA N N 80 122.879 122.879 121.820 1.059 25148 9209 1 14 . 1 1 80 80 ALA HA H 80 3.966 3.966 4.141 -0.175 25148 9210 1 14 . 1 1 80 80 ALA C C 80 179.833 179.833 179.852 -0.019 25148 9211 1 14 . 1 1 80 80 ALA CA C 80 55.881 55.881 54.990 0.891 25148 9212 1 14 . 1 1 80 80 ALA CB C 80 18.870 18.870 18.183 0.687 25148 9213 1 14 . 1 1 80 80 ALA H H 80 9.132 9.132 7.926 1.206 25148 9214 1 14 . 1 1 81 81 GLN N N 81 115.829 115.829 117.280 -1.451 25148 9215 1 14 . 1 1 81 81 GLN HA H 81 4.749 4.749 4.311 0.438 25148 9216 1 14 . 1 1 81 81 GLN C C 81 178.126 178.126 177.960 0.166 25148 9217 1 14 . 1 1 81 81 GLN CA C 81 57.682 57.682 57.814 -0.132 25148 9218 1 14 . 1 1 81 81 GLN CB C 81 27.307 27.307 28.713 -1.406 25148 9219 1 14 . 1 1 81 81 GLN H H 81 8.709 8.709 7.804 0.905 25148 9220 1 14 . 1 1 82 82 GLY N N 82 105.531 105.531 106.790 -1.259 25148 9221 1 14 . 1 1 82 82 GLY C C 82 174.917 174.917 175.187 -0.270 25148 9222 1 14 . 1 1 82 82 GLY CA C 82 45.915 45.915 46.637 -0.722 25148 9223 1 14 . 1 1 82 82 GLY H H 82 7.479 7.479 7.763 -0.284 25148 9224 1 14 . 1 1 83 83 ILE N N 83 122.828 122.828 114.324 8.504 25148 9225 1 14 . 1 1 83 83 ILE HA H 83 3.970 3.970 4.373 -0.403 25148 9226 1 14 . 1 1 83 83 ILE C C 83 177.209 177.209 175.727 1.482 25148 9227 1 14 . 1 1 83 83 ILE CA C 83 64.305 64.305 61.882 2.423 25148 9228 1 14 . 1 1 83 83 ILE CB C 83 38.452 38.452 39.846 -1.394 25148 9229 1 14 . 1 1 83 83 ILE H H 83 7.634 7.634 7.579 0.055 25148 9230 1 14 . 1 1 84 84 HIS N N 84 118.927 118.927 119.975 -1.048 25148 9231 1 14 . 1 1 84 84 HIS HA H 84 4.713 4.713 4.940 -0.227 25148 9232 1 14 . 1 1 84 84 HIS CA C 84 55.487 55.487 54.366 1.121 25148 9233 1 14 . 1 1 84 84 HIS CB C 84 33.506 33.506 32.336 1.170 25148 9234 1 14 . 1 1 84 84 HIS H H 84 8.155 8.155 8.319 -0.164 25148 9235 1 14 . 1 1 85 85 PRO HA H 85 4.456 4.456 4.508 -0.052 25148 9236 1 14 . 1 1 85 85 PRO C C 85 177.357 177.357 177.283 0.074 25148 9237 1 14 . 1 1 85 85 PRO CA C 85 64.475 64.475 64.050 0.424 25148 9238 1 14 . 1 1 85 85 PRO CB C 85 32.489 32.489 32.070 0.419 25148 9239 1 14 . 1 1 86 86 GLU N N 86 116.314 116.314 116.863 -0.549 25148 9240 1 14 . 1 1 86 86 GLU HA H 86 4.286 4.286 4.159 0.127 25148 9241 1 14 . 1 1 86 86 GLU C C 86 177.624 177.624 177.167 0.457 25148 9242 1 14 . 1 1 86 86 GLU CA C 86 56.619 56.619 56.825 -0.206 25148 9243 1 14 . 1 1 86 86 GLU CB C 86 29.389 29.389 29.428 -0.039 25148 9244 1 14 . 1 1 86 86 GLU H H 86 8.938 8.938 7.868 1.070 25148 9245 1 14 . 1 1 87 87 TYR N N 87 119.773 119.773 120.151 -0.378 25148 9246 1 14 . 1 1 87 87 TYR HA H 87 4.744 4.744 4.211 0.533 25148 9247 1 14 . 1 1 87 87 TYR C C 87 174.533 174.533 176.142 -1.609 25148 9248 1 14 . 1 1 87 87 TYR CA C 87 59.117 59.117 59.369 -0.252 25148 9249 1 14 . 1 1 87 87 TYR CB C 87 38.859 38.859 38.708 0.151 25148 9250 1 14 . 1 1 87 87 TYR H H 87 7.447 7.447 7.386 0.061 25148 9251 1 14 . 1 1 88 88 MET N N 88 118.298 118.298 117.259 1.039 25148 9252 1 14 . 1 1 88 88 MET HA H 88 4.770 4.770 4.720 0.050 25148 9253 1 14 . 1 1 88 88 MET C C 88 175.638 175.638 173.842 1.796 25148 9254 1 14 . 1 1 88 88 MET CA C 88 53.133 53.133 54.640 -1.507 25148 9255 1 14 . 1 1 88 88 MET CB C 88 37.102 37.102 35.319 1.783 25148 9256 1 14 . 1 1 88 88 MET H H 88 9.023 9.023 8.411 0.612 25148 9257 1 14 . 1 1 89 89 VAL N N 89 120.157 120.157 124.081 -3.924 25148 9258 1 14 . 1 1 89 89 VAL HA H 89 3.330 3.330 3.924 -0.594 25148 9259 1 14 . 1 1 89 89 VAL C C 89 177.432 177.432 177.221 0.211 25148 9260 1 14 . 1 1 89 89 VAL CA C 89 65.675 65.675 64.833 0.842 25148 9261 1 14 . 1 1 89 89 VAL CB C 89 31.321 31.321 30.650 0.671 25148 9262 1 14 . 1 1 89 89 VAL H H 89 8.313 8.313 8.560 -0.247 25148 9263 1 14 . 1 1 90 90 GLY N N 90 116.935 116.935 116.611 0.324 25148 9264 1 14 . 1 1 90 90 GLY C C 90 175.196 175.196 174.319 0.877 25148 9265 1 14 . 1 1 90 90 GLY CA C 90 44.685 44.685 44.825 -0.140 25148 9266 1 14 . 1 1 90 90 GLY H H 90 8.551 8.551 9.150 -0.599 25148 9267 1 14 . 1 1 91 91 ASP N N 91 121.616 121.616 121.868 -0.252 25148 9268 1 14 . 1 1 91 91 ASP HA H 91 4.790 4.790 4.946 -0.156 25148 9269 1 14 . 1 1 91 91 ASP C C 91 174.431 174.431 174.985 -0.554 25148 9270 1 14 . 1 1 91 91 ASP CA C 91 55.011 55.011 53.971 1.040 25148 9271 1 14 . 1 1 91 91 ASP CB C 91 42.079 42.079 42.727 -0.648 25148 9272 1 14 . 1 1 91 91 ASP H H 91 8.073 8.073 7.893 0.180 25148 9273 1 14 . 1 1 92 92 VAL N N 92 118.919 118.919 113.541 5.378 25148 9274 1 14 . 1 1 92 92 VAL HA H 92 4.709 4.709 4.755 -0.046 25148 9275 1 14 . 1 1 92 92 VAL C C 92 175.602 175.602 174.288 1.314 25148 9276 1 14 . 1 1 92 92 VAL CA C 92 61.527 61.527 60.153 1.374 25148 9277 1 14 . 1 1 92 92 VAL CB C 92 34.110 34.110 35.173 -1.063 25148 9278 1 14 . 1 1 92 92 VAL H H 92 8.216 8.216 8.017 0.199 25148 9279 1 14 . 1 1 93 93 VAL N N 93 123.922 123.922 121.963 1.959 25148 9280 1 14 . 1 1 93 93 VAL HA H 93 4.231 4.231 4.275 -0.044 25148 9281 1 14 . 1 1 93 93 VAL C C 93 174.105 174.105 174.196 -0.091 25148 9282 1 14 . 1 1 93 93 VAL CA C 93 59.644 59.644 59.694 -0.050 25148 9283 1 14 . 1 1 93 93 VAL CB C 93 34.661 34.661 35.774 -1.113 25148 9284 1 14 . 1 1 93 93 VAL H H 93 8.812 8.812 7.908 0.904 25148 9285 1 14 . 1 1 94 94 GLU N N 94 123.605 123.605 127.859 -4.254 25148 9286 1 14 . 1 1 94 94 GLU HA H 94 5.347 5.347 4.990 0.357 25148 9287 1 14 . 1 1 94 94 GLU C C 94 175.708 175.708 175.487 0.221 25148 9288 1 14 . 1 1 94 94 GLU CA C 94 54.979 54.979 55.191 -0.212 25148 9289 1 14 . 1 1 94 94 GLU CB C 94 31.612 31.612 31.559 0.053 25148 9290 1 14 . 1 1 94 94 GLU H H 94 8.312 8.312 8.495 -0.183 25148 9291 1 14 . 1 1 95 95 ILE N N 95 123.581 123.581 123.986 -0.405 25148 9292 1 14 . 1 1 95 95 ILE HA H 95 4.601 4.601 4.497 0.104 25148 9293 1 14 . 1 1 95 95 ILE C C 95 175.081 175.081 175.826 -0.745 25148 9294 1 14 . 1 1 95 95 ILE CA C 95 58.601 58.601 59.408 -0.807 25148 9295 1 14 . 1 1 95 95 ILE CB C 95 41.727 41.727 41.391 0.336 25148 9296 1 14 . 1 1 95 95 ILE H H 95 9.045 9.045 7.974 1.071 25148 9297 1 14 . 1 1 96 96 GLU N N 96 128.094 128.094 128.341 -0.247 25148 9298 1 14 . 1 1 96 96 GLU HA H 96 4.098 4.098 4.163 -0.065 25148 9299 1 14 . 1 1 96 96 GLU C C 96 176.845 176.845 175.543 1.302 25148 9300 1 14 . 1 1 96 96 GLU CA C 96 57.853 57.853 57.997 -0.144 25148 9301 1 14 . 1 1 96 96 GLU CB C 96 28.323 28.323 28.961 -0.638 25148 9302 1 14 . 1 1 96 96 GLU H H 96 9.256 9.256 8.947 0.309 25148 9303 1 14 . 1 1 97 97 VAL N N 97 118.446 118.446 123.675 -5.229 25148 9304 1 14 . 1 1 97 97 VAL HA H 97 4.568 4.568 4.209 0.359 25148 9305 1 14 . 1 1 97 97 VAL C C 97 175.051 175.051 175.008 0.043 25148 9306 1 14 . 1 1 97 97 VAL CA C 97 59.796 59.796 60.899 -1.103 25148 9307 1 14 . 1 1 97 97 VAL CB C 97 32.399 32.399 33.045 -0.646 25148 9308 1 14 . 1 1 97 97 VAL H H 97 8.609 8.609 8.862 -0.253 25148 9309 1 14 . 1 1 98 98 THR N N 98 119.118 119.118 117.763 1.355 25148 9310 1 14 . 1 1 98 98 THR HA H 98 3.320 3.320 3.902 -0.582 25148 9311 1 14 . 1 1 98 98 THR CA C 98 61.628 61.628 59.419 2.209 25148 9312 1 14 . 1 1 98 98 THR CB C 98 70.031 70.031 69.219 0.812 25148 9313 1 14 . 1 1 98 98 THR H H 98 7.396 7.396 7.460 -0.064 25148 9314 1 14 . 1 1 99 99 PRO HA H 99 4.458 4.458 4.652 -0.194 25148 9315 1 14 . 1 1 99 99 PRO CA C 99 62.348 62.348 62.664 -0.316 25148 9316 1 14 . 1 1 99 99 PRO CB C 99 33.182 33.182 32.620 0.562 25148 9317 1 14 . 1 1 100 100 LYS HA H 100 4.126 4.126 4.191 -0.065 25148 9318 1 14 . 1 1 100 100 LYS CA C 100 58.773 58.773 57.947 0.826 25148 9319 1 14 . 1 1 100 100 LYS CB C 100 32.195 32.195 32.388 -0.193 25148 9320 1 14 . 1 1 101 101 ASP HA H 101 4.924 4.924 4.832 0.092 25148 9321 1 14 . 1 1 101 101 ASP C C 101 176.884 176.884 176.562 0.322 25148 9322 1 14 . 1 1 101 101 ASP CA C 101 54.134 54.134 53.720 0.414 25148 9323 1 14 . 1 1 101 101 ASP CB C 101 40.272 40.272 40.569 -0.297 25148 9324 1 14 . 1 1 102 102 PHE N N 102 118.703 118.703 121.540 -2.837 25148 9325 1 14 . 1 1 102 102 PHE HA H 102 4.295 4.295 4.182 0.113 25148 9326 1 14 . 1 1 102 102 PHE C C 102 176.477 176.477 177.007 -0.530 25148 9327 1 14 . 1 1 102 102 PHE CA C 102 60.748 60.748 60.295 0.452 25148 9328 1 14 . 1 1 102 102 PHE CB C 102 39.667 39.667 39.137 0.530 25148 9329 1 14 . 1 1 102 102 PHE H H 102 7.862 7.862 7.717 0.145 25148 9330 1 14 . 1 1 103 103 GLY CA C 103 47.430 47.430 47.258 0.172 25148 9331 1 14 . 1 1 104 104 ARG N N 104 121.819 121.819 120.640 1.179 25148 9332 1 14 . 1 1 104 104 ARG HA H 104 4.176 4.176 4.152 0.024 25148 9333 1 14 . 1 1 104 104 ARG C C 104 178.912 178.912 178.548 0.364 25148 9334 1 14 . 1 1 104 104 ARG CA C 104 59.235 59.235 58.452 0.784 25148 9335 1 14 . 1 1 104 104 ARG CB C 104 30.000 30.000 30.480 -0.480 25148 9336 1 14 . 1 1 104 104 ARG H H 104 7.809 7.809 7.459 0.350 25148 9337 1 14 . 1 1 105 105 ILE N N 105 120.331 120.331 120.694 -0.363 25148 9338 1 14 . 1 1 105 105 ILE HA H 105 3.836 3.836 3.589 0.247 25148 9339 1 14 . 1 1 105 105 ILE C C 105 179.206 179.206 177.307 1.899 25148 9340 1 14 . 1 1 105 105 ILE CA C 105 63.025 63.025 65.066 -2.041 25148 9341 1 14 . 1 1 105 105 ILE CB C 105 38.127 38.127 37.423 0.703 25148 9342 1 14 . 1 1 105 105 ILE H H 105 7.203 7.203 7.390 -0.187 25148 9343 1 14 . 1 1 106 106 ALA N N 106 124.867 124.867 122.350 2.517 25148 9344 1 14 . 1 1 106 106 ALA HA H 106 3.665 3.665 3.539 0.126 25148 9345 1 14 . 1 1 106 106 ALA C C 106 178.590 178.590 178.925 -0.335 25148 9346 1 14 . 1 1 106 106 ALA CA C 106 54.842 54.842 55.181 -0.339 25148 9347 1 14 . 1 1 106 106 ALA CB C 106 18.659 18.659 17.779 0.881 25148 9348 1 14 . 1 1 106 106 ALA H H 106 8.813 8.813 8.227 0.586 25148 9349 1 14 . 1 1 107 107 ALA N N 107 119.597 119.597 119.597 0.000 25148 9350 1 14 . 1 1 107 107 ALA HA H 107 4.014 4.014 4.004 0.010 25148 9351 1 14 . 1 1 107 107 ALA C C 107 180.214 180.214 179.802 0.412 25148 9352 1 14 . 1 1 107 107 ALA CA C 107 55.454 55.454 54.567 0.887 25148 9353 1 14 . 1 1 107 107 ALA CB C 107 18.260 18.260 18.151 0.109 25148 9354 1 14 . 1 1 107 107 ALA H H 107 8.012 8.012 7.821 0.191 25148 9355 1 14 . 1 1 108 108 GLN N N 108 116.896 116.896 118.943 -2.047 25148 9356 1 14 . 1 1 108 108 GLN HA H 108 4.054 4.054 4.110 -0.056 25148 9357 1 14 . 1 1 108 108 GLN C C 108 178.784 178.784 178.548 0.236 25148 9358 1 14 . 1 1 108 108 GLN CA C 108 58.705 58.705 58.397 0.308 25148 9359 1 14 . 1 1 108 108 GLN CB C 108 28.647 28.647 28.375 0.272 25148 9360 1 14 . 1 1 108 108 GLN H H 108 7.498 7.498 8.043 -0.545 25148 9361 1 14 . 1 1 109 109 THR N N 109 117.495 117.495 116.549 0.946 25148 9362 1 14 . 1 1 109 109 THR HA H 109 3.917 3.917 4.115 -0.198 25148 9363 1 14 . 1 1 109 109 THR C C 109 175.732 175.732 176.146 -0.414 25148 9364 1 14 . 1 1 109 109 THR CA C 109 66.989 66.989 66.048 0.941 25148 9365 1 14 . 1 1 109 109 THR CB C 109 68.766 68.766 68.581 0.185 25148 9366 1 14 . 1 1 109 109 THR H H 109 8.203 8.203 8.480 -0.277 25148 9367 1 14 . 1 1 110 110 ALA N N 110 122.308 122.308 124.970 -2.662 25148 9368 1 14 . 1 1 110 110 ALA HA H 110 3.854 3.854 4.020 -0.166 25148 9369 1 14 . 1 1 110 110 ALA C C 110 178.380 178.380 178.688 -0.308 25148 9370 1 14 . 1 1 110 110 ALA CA C 110 55.903 55.903 55.074 0.829 25148 9371 1 14 . 1 1 110 110 ALA CB C 110 18.524 18.524 18.272 0.252 25148 9372 1 14 . 1 1 110 110 ALA H H 110 8.668 8.668 8.266 0.402 25148 9373 1 14 . 1 1 111 111 LYS N N 111 115.552 115.552 118.413 -2.861 25148 9374 1 14 . 1 1 111 111 LYS HA H 111 3.923 3.923 3.962 -0.039 25148 9375 1 14 . 1 1 111 111 LYS C C 111 179.111 179.111 178.883 0.228 25148 9376 1 14 . 1 1 111 111 LYS CA C 111 59.825 59.825 59.205 0.620 25148 9377 1 14 . 1 1 111 111 LYS CB C 111 32.251 32.251 31.635 0.616 25148 9378 1 14 . 1 1 111 111 LYS H H 111 7.642 7.642 8.358 -0.716 25148 9379 1 14 . 1 1 112 112 GLN N N 112 120.178 120.178 118.292 1.886 25148 9380 1 14 . 1 1 112 112 GLN HA H 112 4.060 4.060 4.139 -0.079 25148 9381 1 14 . 1 1 112 112 GLN C C 112 178.355 178.355 178.222 0.133 25148 9382 1 14 . 1 1 112 112 GLN CA C 112 59.240 59.240 58.194 1.046 25148 9383 1 14 . 1 1 112 112 GLN CB C 112 28.250 28.250 28.583 -0.333 25148 9384 1 14 . 1 1 112 112 GLN H H 112 7.798 7.798 7.655 0.143 25148 9385 1 14 . 1 1 113 113 VAL N N 113 119.799 119.799 121.031 -1.232 25148 9386 1 14 . 1 1 113 113 VAL HA H 113 3.705 3.705 3.799 -0.094 25148 9387 1 14 . 1 1 113 113 VAL C C 113 178.303 178.303 177.981 0.322 25148 9388 1 14 . 1 1 113 113 VAL CA C 113 66.277 66.277 66.441 -0.164 25148 9389 1 14 . 1 1 113 113 VAL CB C 113 31.954 31.954 31.648 0.306 25148 9390 1 14 . 1 1 113 113 VAL H H 113 8.105 8.105 7.610 0.495 25148 9391 1 14 . 1 1 114 114 VAL N N 114 118.265 118.265 117.162 1.103 25148 9392 1 14 . 1 1 114 114 VAL HA H 114 3.392 3.392 3.727 -0.335 25148 9393 1 14 . 1 1 114 114 VAL C C 114 177.360 177.360 178.385 -1.025 25148 9394 1 14 . 1 1 114 114 VAL CA C 114 67.832 67.832 66.814 1.018 25148 9395 1 14 . 1 1 114 114 VAL CB C 114 31.801 31.801 30.323 1.478 25148 9396 1 14 . 1 1 114 114 VAL H H 114 8.180 8.180 8.576 -0.396 25148 9397 1 14 . 1 1 115 115 THR N N 115 113.460 113.460 114.932 -1.472 25148 9398 1 14 . 1 1 115 115 THR HA H 115 3.856 3.856 4.074 -0.218 25148 9399 1 14 . 1 1 115 115 THR C C 115 176.529 176.529 176.719 -0.190 25148 9400 1 14 . 1 1 115 115 THR CA C 115 66.706 66.706 66.355 0.351 25148 9401 1 14 . 1 1 115 115 THR CB C 115 69.008 69.008 68.493 0.515 25148 9402 1 14 . 1 1 115 115 THR H H 115 8.143 8.143 7.696 0.447 25148 9403 1 14 . 1 1 116 116 GLN N N 116 120.129 120.129 121.038 -0.909 25148 9404 1 14 . 1 1 116 116 GLN HA H 116 4.054 4.054 3.992 0.062 25148 9405 1 14 . 1 1 116 116 GLN C C 116 178.100 178.100 178.173 -0.073 25148 9406 1 14 . 1 1 116 116 GLN CA C 116 58.950 58.950 59.714 -0.764 25148 9407 1 14 . 1 1 116 116 GLN CB C 116 28.244 28.244 28.532 -0.288 25148 9408 1 14 . 1 1 116 116 GLN H H 116 7.936 7.936 7.448 0.488 25148 9409 1 14 . 1 1 117 117 ARG N N 117 117.838 117.838 119.216 -1.378 25148 9410 1 14 . 1 1 117 117 ARG HA H 117 4.174 4.174 4.062 0.112 25148 9411 1 14 . 1 1 117 117 ARG C C 117 179.138 179.138 178.892 0.246 25148 9412 1 14 . 1 1 117 117 ARG CA C 117 57.461 57.461 58.511 -1.050 25148 9413 1 14 . 1 1 117 117 ARG CB C 117 29.548 29.548 29.285 0.263 25148 9414 1 14 . 1 1 117 117 ARG H H 117 8.240 8.240 8.163 0.077 25148 9415 1 14 . 1 1 118 118 VAL N N 118 120.278 120.278 118.995 1.283 25148 9416 1 14 . 1 1 118 118 VAL HA H 118 3.709 3.709 3.689 0.020 25148 9417 1 14 . 1 1 118 118 VAL C C 118 177.597 177.597 177.480 0.117 25148 9418 1 14 . 1 1 118 118 VAL CA C 118 66.246 66.246 66.444 -0.198 25148 9419 1 14 . 1 1 118 118 VAL CB C 118 31.785 31.785 30.957 0.828 25148 9420 1 14 . 1 1 118 118 VAL H H 118 8.480 8.480 7.485 0.995 25148 9421 1 14 . 1 1 119 119 ARG N N 119 120.197 120.197 118.418 1.779 25148 9422 1 14 . 1 1 119 119 ARG HA H 119 4.173 4.173 4.102 0.071 25148 9423 1 14 . 1 1 119 119 ARG C C 119 178.864 178.864 178.601 0.263 25148 9424 1 14 . 1 1 119 119 ARG CA C 119 58.772 58.772 58.956 -0.184 25148 9425 1 14 . 1 1 119 119 ARG CB C 119 29.873 29.873 29.461 0.412 25148 9426 1 14 . 1 1 119 119 ARG H H 119 7.899 7.899 7.536 0.363 25148 9427 1 14 . 1 1 120 120 GLU N N 120 118.768 118.768 120.118 -1.350 25148 9428 1 14 . 1 1 120 120 GLU HA H 120 4.110 4.110 4.125 -0.015 25148 9429 1 14 . 1 1 120 120 GLU C C 120 177.823 177.823 178.761 -0.938 25148 9430 1 14 . 1 1 120 120 GLU CA C 120 58.223 58.223 58.825 -0.603 25148 9431 1 14 . 1 1 120 120 GLU CB C 120 29.854 29.854 29.305 0.549 25148 9432 1 14 . 1 1 120 120 GLU H H 120 8.084 8.084 8.634 -0.550 25148 9433 1 14 . 1 1 121 121 ALA N N 121 121.984 121.984 120.816 1.168 25148 9434 1 14 . 1 1 121 121 ALA HA H 121 4.296 4.296 4.184 0.112 25148 9435 1 14 . 1 1 121 121 ALA C C 121 178.586 178.586 179.855 -1.269 25148 9436 1 14 . 1 1 121 121 ALA CA C 121 53.475 53.475 54.578 -1.103 25148 9437 1 14 . 1 1 121 121 ALA CB C 121 18.856 18.856 18.348 0.508 25148 9438 1 14 . 1 1 121 121 ALA H H 121 7.810 7.810 8.105 -0.295 25148 9439 1 14 . 1 1 122 122 GLU N N 122 118.229 118.229 118.347 -0.118 25148 9440 1 14 . 1 1 122 122 GLU HA H 122 4.241 4.241 4.180 0.061 25148 9441 1 14 . 1 1 122 122 GLU C C 122 176.839 176.839 178.658 -1.819 25148 9442 1 14 . 1 1 122 122 GLU CA C 122 57.118 57.118 57.864 -0.746 25148 9443 1 14 . 1 1 122 122 GLU CB C 122 30.018 30.018 29.555 0.463 25148 9444 1 14 . 1 1 122 122 GLU H H 122 7.938 7.938 7.683 0.255 25148 9445 1 14 . 1 1 123 123 ARG N N 123 120.601 120.601 118.770 1.831 25148 9446 1 14 . 1 1 123 123 ARG HA H 123 4.348 4.348 4.149 0.199 25148 9447 1 14 . 1 1 123 123 ARG C C 123 176.071 176.071 177.191 -1.120 25148 9448 1 14 . 1 1 123 123 ARG CA C 123 56.510 56.510 57.635 -1.125 25148 9449 1 14 . 1 1 123 123 ARG CB C 123 30.765 30.765 30.398 0.367 25148 9450 1 14 . 1 1 123 123 ARG H H 123 7.977 7.977 7.681 0.296 25148 9451 1 15 . 1 1 4 4 GLU HA H 4 4.138 4.138 3.956 0.182 25148 9452 1 15 . 1 1 4 4 GLU C C 4 179.152 179.152 177.899 1.253 25148 9453 1 15 . 1 1 4 4 GLU CA C 4 59.566 59.566 59.259 0.307 25148 9454 1 15 . 1 1 4 4 GLU CB C 4 29.407 29.407 29.573 -0.166 25148 9455 1 15 . 1 1 5 5 LEU N N 5 121.360 121.360 115.722 5.638 25148 9456 1 15 . 1 1 5 5 LEU HA H 5 4.195 4.195 4.077 0.118 25148 9457 1 15 . 1 1 5 5 LEU C C 5 178.179 178.179 178.453 -0.274 25148 9458 1 15 . 1 1 5 5 LEU CA C 5 57.830 57.830 57.438 0.392 25148 9459 1 15 . 1 1 5 5 LEU CB C 5 41.630 41.630 41.336 0.294 25148 9460 1 15 . 1 1 5 5 LEU H H 5 7.877 7.877 7.816 0.061 25148 9461 1 15 . 1 1 6 6 LEU N N 6 118.058 118.058 118.374 -0.316 25148 9462 1 15 . 1 1 6 6 LEU HA H 6 3.919 3.919 3.942 -0.023 25148 9463 1 15 . 1 1 6 6 LEU C C 6 180.274 180.274 179.109 1.165 25148 9464 1 15 . 1 1 6 6 LEU CA C 6 58.221 58.221 57.748 0.473 25148 9465 1 15 . 1 1 6 6 LEU CB C 6 40.684 40.684 41.259 -0.575 25148 9466 1 15 . 1 1 6 6 LEU H H 6 7.685 7.685 8.039 -0.354 25148 9467 1 15 . 1 1 7 7 ASP N N 7 120.662 120.662 118.759 1.903 25148 9468 1 15 . 1 1 7 7 ASP HA H 7 4.416 4.416 4.389 0.027 25148 9469 1 15 . 1 1 7 7 ASP C C 7 178.738 178.738 177.807 0.931 25148 9470 1 15 . 1 1 7 7 ASP CA C 7 57.519 57.519 56.738 0.781 25148 9471 1 15 . 1 1 7 7 ASP CB C 7 40.167 40.167 41.131 -0.964 25148 9472 1 15 . 1 1 7 7 ASP H H 7 8.427 8.427 7.629 0.798 25148 9473 1 15 . 1 1 8 8 ALA N N 8 122.612 122.612 123.651 -1.039 25148 9474 1 15 . 1 1 8 8 ALA HA H 8 4.146 4.146 3.974 0.172 25148 9475 1 15 . 1 1 8 8 ALA C C 8 180.787 180.787 179.631 1.156 25148 9476 1 15 . 1 1 8 8 ALA CA C 8 55.165 55.165 55.309 -0.144 25148 9477 1 15 . 1 1 8 8 ALA CB C 8 17.711 17.711 18.456 -0.744 25148 9478 1 15 . 1 1 8 8 ALA H H 8 7.847 7.847 7.775 0.072 25148 9479 1 15 . 1 1 9 9 LEU N N 9 116.977 116.977 117.305 -0.328 25148 9480 1 15 . 1 1 9 9 LEU HA H 9 4.115 4.115 3.873 0.242 25148 9481 1 15 . 1 1 9 9 LEU C C 9 179.510 179.510 179.396 0.114 25148 9482 1 15 . 1 1 9 9 LEU CA C 9 57.468 57.468 57.927 -0.459 25148 9483 1 15 . 1 1 9 9 LEU CB C 9 41.203 41.203 41.627 -0.423 25148 9484 1 15 . 1 1 9 9 LEU H H 9 8.256 8.256 7.589 0.667 25148 9485 1 15 . 1 1 10 10 THR N N 10 118.764 118.764 115.754 3.010 25148 9486 1 15 . 1 1 10 10 THR HA H 10 4.487 4.487 3.933 0.554 25148 9487 1 15 . 1 1 10 10 THR C C 10 176.567 176.567 177.236 -0.669 25148 9488 1 15 . 1 1 10 10 THR CA C 10 68.768 68.768 66.495 2.273 25148 9489 1 15 . 1 1 10 10 THR CB C 10 66.961 66.961 68.697 -1.736 25148 9490 1 15 . 1 1 10 10 THR H H 10 8.218 8.218 7.281 0.937 25148 9491 1 15 . 1 1 11 11 ILE N N 11 122.555 122.555 121.613 0.942 25148 9492 1 15 . 1 1 11 11 ILE HA H 11 3.779 3.779 3.735 0.044 25148 9493 1 15 . 1 1 11 11 ILE C C 11 177.793 177.793 177.903 -0.110 25148 9494 1 15 . 1 1 11 11 ILE CA C 11 64.695 64.695 65.199 -0.504 25148 9495 1 15 . 1 1 11 11 ILE CB C 11 37.856 37.856 37.659 0.197 25148 9496 1 15 . 1 1 11 11 ILE H H 11 7.632 7.632 7.958 -0.326 25148 9497 1 15 . 1 1 12 12 LEU N N 12 120.469 120.469 117.963 2.506 25148 9498 1 15 . 1 1 12 12 LEU HA H 12 4.065 4.065 4.042 0.023 25148 9499 1 15 . 1 1 12 12 LEU C C 12 179.139 179.139 179.004 0.135 25148 9500 1 15 . 1 1 12 12 LEU CA C 12 57.944 57.944 57.224 0.720 25148 9501 1 15 . 1 1 12 12 LEU CB C 12 42.170 42.170 40.894 1.276 25148 9502 1 15 . 1 1 12 12 LEU H H 12 7.951 7.951 7.367 0.584 25148 9503 1 15 . 1 1 13 13 GLU N N 13 119.669 119.669 119.351 0.318 25148 9504 1 15 . 1 1 13 13 GLU HA H 13 4.183 4.183 3.999 0.184 25148 9505 1 15 . 1 1 13 13 GLU C C 13 179.007 179.007 177.461 1.546 25148 9506 1 15 . 1 1 13 13 GLU CA C 13 59.703 59.703 58.691 1.012 25148 9507 1 15 . 1 1 13 13 GLU CB C 13 30.110 30.110 29.182 0.928 25148 9508 1 15 . 1 1 13 13 GLU H H 13 8.003 8.003 7.981 0.022 25148 9509 1 15 . 1 1 14 14 LYS N N 14 118.935 118.935 117.444 1.491 25148 9510 1 15 . 1 1 14 14 LYS HA H 14 4.124 4.124 4.041 0.083 25148 9511 1 15 . 1 1 14 14 LYS CA C 14 58.847 58.847 57.677 1.170 25148 9512 1 15 . 1 1 14 14 LYS CB C 14 33.053 33.053 32.666 0.388 25148 9513 1 15 . 1 1 14 14 LYS H H 14 7.862 7.862 7.330 0.532 25148 9514 1 15 . 1 1 15 15 GLU HA H 15 3.693 3.693 4.331 -0.638 25148 9515 1 15 . 1 1 15 15 GLU CA C 15 56.688 56.688 55.979 0.709 25148 9516 1 15 . 1 1 15 15 GLU CB C 15 32.204 32.204 30.982 1.222 25148 9517 1 15 . 1 1 16 16 LYS HA H 16 4.678 4.678 4.264 0.414 25148 9518 1 15 . 1 1 16 16 LYS CA C 16 55.135 55.135 56.756 -1.621 25148 9519 1 15 . 1 1 16 16 LYS CB C 16 34.049 34.049 33.062 0.987 25148 9520 1 15 . 1 1 17 17 GLY CA C 17 46.541 46.541 45.666 0.875 25148 9521 1 15 . 1 1 18 18 ILE N N 18 115.364 115.364 118.978 -3.614 25148 9522 1 15 . 1 1 18 18 ILE HA H 18 4.079 4.079 4.378 -0.299 25148 9523 1 15 . 1 1 18 18 ILE C C 18 174.751 174.751 175.619 -0.868 25148 9524 1 15 . 1 1 18 18 ILE CA C 18 60.333 60.333 59.372 0.961 25148 9525 1 15 . 1 1 18 18 ILE CB C 18 39.044 39.044 39.603 -0.559 25148 9526 1 15 . 1 1 18 18 ILE H H 18 8.203 8.203 7.929 0.274 25148 9527 1 15 . 1 1 19 19 SER N N 19 119.891 119.891 119.130 0.761 25148 9528 1 15 . 1 1 19 19 SER HA H 19 4.362 4.362 4.771 -0.409 25148 9529 1 15 . 1 1 19 19 SER CA C 19 58.476 58.476 57.423 1.053 25148 9530 1 15 . 1 1 19 19 SER CB C 19 63.533 63.533 63.777 -0.244 25148 9531 1 15 . 1 1 19 19 SER H H 19 8.253 8.253 8.528 -0.275 25148 9532 1 15 . 1 1 20 20 LYS N N 20 124.782 124.782 125.978 -1.196 25148 9533 1 15 . 1 1 20 20 LYS HA H 20 4.137 4.137 4.144 -0.007 25148 9534 1 15 . 1 1 20 20 LYS C C 20 177.889 177.889 177.511 0.378 25148 9535 1 15 . 1 1 20 20 LYS CA C 20 59.485 59.485 58.635 0.850 25148 9536 1 15 . 1 1 20 20 LYS CB C 20 32.711 32.711 32.363 0.348 25148 9537 1 15 . 1 1 20 20 LYS H H 20 8.918 8.918 8.886 0.032 25148 9538 1 15 . 1 1 21 21 GLU N N 21 117.831 117.831 118.298 -0.467 25148 9539 1 15 . 1 1 21 21 GLU HA H 21 3.957 3.957 4.053 -0.096 25148 9540 1 15 . 1 1 21 21 GLU C C 21 178.822 178.822 178.801 0.021 25148 9541 1 15 . 1 1 21 21 GLU CA C 21 59.529 59.529 59.132 0.397 25148 9542 1 15 . 1 1 21 21 GLU CB C 21 29.237 29.237 29.245 -0.008 25148 9543 1 15 . 1 1 21 21 GLU H H 21 8.361 8.361 8.649 -0.288 25148 9544 1 15 . 1 1 22 22 ILE N N 22 118.690 118.690 118.713 -0.023 25148 9545 1 15 . 1 1 22 22 ILE HA H 22 3.884 3.884 3.876 0.008 25148 9546 1 15 . 1 1 22 22 ILE C C 22 179.247 179.247 177.777 1.470 25148 9547 1 15 . 1 1 22 22 ILE CA C 22 63.735 63.735 64.200 -0.465 25148 9548 1 15 . 1 1 22 22 ILE CB C 22 37.415 37.415 38.148 -0.733 25148 9549 1 15 . 1 1 22 22 ILE H H 22 7.353 7.353 7.324 0.029 25148 9550 1 15 . 1 1 23 23 ILE N N 23 120.880 120.880 120.658 0.222 25148 9551 1 15 . 1 1 23 23 ILE HA H 23 3.733 3.733 3.659 0.074 25148 9552 1 15 . 1 1 23 23 ILE C C 23 177.817 177.817 178.031 -0.214 25148 9553 1 15 . 1 1 23 23 ILE CA C 23 64.172 64.172 63.993 0.179 25148 9554 1 15 . 1 1 23 23 ILE CB C 23 36.473 36.473 36.700 -0.227 25148 9555 1 15 . 1 1 23 23 ILE H H 23 7.571 7.571 7.171 0.400 25148 9556 1 15 . 1 1 24 24 ILE N N 24 121.460 121.460 118.859 2.601 25148 9557 1 15 . 1 1 24 24 ILE HA H 24 3.486 3.486 3.585 -0.099 25148 9558 1 15 . 1 1 24 24 ILE C C 24 177.759 177.759 177.763 -0.004 25148 9559 1 15 . 1 1 24 24 ILE CA C 24 66.641 66.641 66.047 0.594 25148 9560 1 15 . 1 1 24 24 ILE CB C 24 37.307 37.307 37.427 -0.120 25148 9561 1 15 . 1 1 24 24 ILE H H 24 8.709 8.709 7.800 0.909 25148 9562 1 15 . 1 1 25 25 GLU N N 25 119.323 119.323 118.462 0.861 25148 9563 1 15 . 1 1 25 25 GLU HA H 25 4.177 4.177 4.013 0.164 25148 9564 1 15 . 1 1 25 25 GLU C C 25 179.348 179.348 178.733 0.615 25148 9565 1 15 . 1 1 25 25 GLU CA C 25 59.951 59.951 59.115 0.836 25148 9566 1 15 . 1 1 25 25 GLU CB C 25 29.340 29.340 29.137 0.202 25148 9567 1 15 . 1 1 25 25 GLU H H 25 8.048 8.048 7.840 0.208 25148 9568 1 15 . 1 1 26 26 ALA N N 26 122.390 122.390 122.484 -0.094 25148 9569 1 15 . 1 1 26 26 ALA HA H 26 4.325 4.325 4.129 0.196 25148 9570 1 15 . 1 1 26 26 ALA C C 26 181.440 181.440 179.771 1.669 25148 9571 1 15 . 1 1 26 26 ALA CA C 26 54.935 54.935 54.812 0.123 25148 9572 1 15 . 1 1 26 26 ALA CB C 26 17.834 17.834 18.288 -0.454 25148 9573 1 15 . 1 1 26 26 ALA H H 26 7.768 7.768 7.785 -0.017 25148 9574 1 15 . 1 1 27 27 ILE N N 27 122.342 122.342 119.675 2.667 25148 9575 1 15 . 1 1 27 27 ILE HA H 27 3.575 3.575 3.648 -0.073 25148 9576 1 15 . 1 1 27 27 ILE C C 27 177.541 177.541 177.755 -0.214 25148 9577 1 15 . 1 1 27 27 ILE CA C 27 66.536 66.536 65.543 0.994 25148 9578 1 15 . 1 1 27 27 ILE CB C 27 37.886 37.886 38.012 -0.126 25148 9579 1 15 . 1 1 27 27 ILE H H 27 8.805 8.805 7.483 1.322 25148 9580 1 15 . 1 1 28 28 GLU N N 28 120.188 120.188 119.750 0.438 25148 9581 1 15 . 1 1 28 28 GLU HA H 28 3.687 3.687 3.966 -0.279 25148 9582 1 15 . 1 1 28 28 GLU C C 28 178.707 178.707 178.895 -0.188 25148 9583 1 15 . 1 1 28 28 GLU CA C 28 61.458 61.458 59.526 1.932 25148 9584 1 15 . 1 1 28 28 GLU CB C 28 29.624 29.624 28.925 0.699 25148 9585 1 15 . 1 1 28 28 GLU H H 28 8.882 8.882 7.781 1.101 25148 9586 1 15 . 1 1 29 29 ALA N N 29 119.293 119.293 121.435 -2.142 25148 9587 1 15 . 1 1 29 29 ALA HA H 29 4.214 4.214 3.987 0.227 25148 9588 1 15 . 1 1 29 29 ALA C C 29 181.200 181.200 179.298 1.902 25148 9589 1 15 . 1 1 29 29 ALA CA C 29 55.435 55.435 54.883 0.552 25148 9590 1 15 . 1 1 29 29 ALA CB C 29 18.090 18.090 18.290 -0.200 25148 9591 1 15 . 1 1 29 29 ALA H H 29 8.065 8.065 8.253 -0.188 25148 9592 1 15 . 1 1 30 30 ALA N N 30 121.729 121.729 121.839 -0.110 25148 9593 1 15 . 1 1 30 30 ALA HA H 30 4.307 4.307 4.178 0.129 25148 9594 1 15 . 1 1 30 30 ALA C C 30 181.315 181.315 179.528 1.787 25148 9595 1 15 . 1 1 30 30 ALA CA C 30 54.594 54.594 54.693 -0.099 25148 9596 1 15 . 1 1 30 30 ALA CB C 30 18.704 18.704 18.346 0.358 25148 9597 1 15 . 1 1 30 30 ALA H H 30 8.099 8.099 7.376 0.723 25148 9598 1 15 . 1 1 31 31 LEU N N 31 120.900 120.900 120.700 0.200 25148 9599 1 15 . 1 1 31 31 LEU HA H 31 4.347 4.347 4.151 0.196 25148 9600 1 15 . 1 1 31 31 LEU C C 31 179.137 179.137 179.250 -0.113 25148 9601 1 15 . 1 1 31 31 LEU CA C 31 57.569 57.569 58.057 -0.488 25148 9602 1 15 . 1 1 31 31 LEU CB C 31 42.353 42.353 40.929 1.424 25148 9603 1 15 . 1 1 31 31 LEU H H 31 8.863 8.863 7.677 1.186 25148 9604 1 15 . 1 1 32 32 ILE N N 32 122.410 122.410 118.926 3.484 25148 9605 1 15 . 1 1 32 32 ILE HA H 32 3.699 3.699 3.666 0.033 25148 9606 1 15 . 1 1 32 32 ILE C C 32 178.303 178.303 177.885 0.418 25148 9607 1 15 . 1 1 32 32 ILE CA C 32 66.066 66.066 65.437 0.629 25148 9608 1 15 . 1 1 32 32 ILE CB C 32 37.882 37.882 37.835 0.047 25148 9609 1 15 . 1 1 32 32 ILE H H 32 8.234 8.234 8.295 -0.061 25148 9610 1 15 . 1 1 33 33 SER N N 33 114.201 114.201 115.541 -1.340 25148 9611 1 15 . 1 1 33 33 SER HA H 33 4.311 4.311 4.192 0.119 25148 9612 1 15 . 1 1 33 33 SER C C 33 177.012 177.012 176.773 0.239 25148 9613 1 15 . 1 1 33 33 SER CA C 33 61.860 61.860 61.602 0.258 25148 9614 1 15 . 1 1 33 33 SER CB C 33 62.508 62.508 63.264 -0.756 25148 9615 1 15 . 1 1 33 33 SER H H 33 7.558 7.558 7.642 -0.084 25148 9616 1 15 . 1 1 34 34 ALA N N 34 122.893 122.893 124.935 -2.042 25148 9617 1 15 . 1 1 34 34 ALA HA H 34 4.215 4.215 4.084 0.131 25148 9618 1 15 . 1 1 34 34 ALA C C 34 180.814 180.814 179.355 1.459 25148 9619 1 15 . 1 1 34 34 ALA CA C 34 55.283 55.283 55.004 0.279 25148 9620 1 15 . 1 1 34 34 ALA CB C 34 18.273 18.273 18.211 0.062 25148 9621 1 15 . 1 1 34 34 ALA H H 34 8.409 8.409 8.325 0.084 25148 9622 1 15 . 1 1 35 35 TYR N N 35 120.259 120.259 119.136 1.123 25148 9623 1 15 . 1 1 35 35 TYR HA H 35 4.393 4.393 4.282 0.111 25148 9624 1 15 . 1 1 35 35 TYR C C 35 177.892 177.892 178.325 -0.433 25148 9625 1 15 . 1 1 35 35 TYR CA C 35 63.071 63.071 61.194 1.877 25148 9626 1 15 . 1 1 35 35 TYR CB C 35 38.021 38.021 38.756 -0.735 25148 9627 1 15 . 1 1 35 35 TYR H H 35 8.975 8.975 8.547 0.428 25148 9628 1 15 . 1 1 36 36 LYS N N 36 120.942 120.942 119.965 0.977 25148 9629 1 15 . 1 1 36 36 LYS HA H 36 4.032 4.032 4.034 -0.002 25148 9630 1 15 . 1 1 36 36 LYS C C 36 177.797 177.797 179.099 -1.302 25148 9631 1 15 . 1 1 36 36 LYS CA C 36 59.900 59.900 59.393 0.507 25148 9632 1 15 . 1 1 36 36 LYS CB C 36 32.429 32.429 32.231 0.198 25148 9633 1 15 . 1 1 36 36 LYS H H 36 8.654 8.654 8.063 0.591 25148 9634 1 15 . 1 1 37 37 ARG N N 37 115.139 115.139 117.769 -2.630 25148 9635 1 15 . 1 1 37 37 ARG HA H 37 4.101 4.101 4.071 0.030 25148 9636 1 15 . 1 1 37 37 ARG C C 37 177.517 177.517 177.971 -0.454 25148 9637 1 15 . 1 1 37 37 ARG CA C 37 58.276 58.276 58.415 -0.139 25148 9638 1 15 . 1 1 37 37 ARG CB C 37 31.014 31.014 29.497 1.517 25148 9639 1 15 . 1 1 37 37 ARG H H 37 8.138 8.138 7.807 0.331 25148 9640 1 15 . 1 1 38 38 ASN N N 38 112.555 112.555 116.073 -3.518 25148 9641 1 15 . 1 1 38 38 ASN HA H 38 4.540 4.540 4.284 0.256 25148 9642 1 15 . 1 1 38 38 ASN C C 38 173.994 173.994 174.862 -0.868 25148 9643 1 15 . 1 1 38 38 ASN CA C 38 54.722 54.722 54.800 -0.078 25148 9644 1 15 . 1 1 38 38 ASN CB C 38 42.077 42.077 39.467 2.610 25148 9645 1 15 . 1 1 38 38 ASN H H 38 7.426 7.426 7.602 -0.176 25148 9646 1 15 . 1 1 39 39 PHE N N 39 116.711 116.711 116.950 -0.239 25148 9647 1 15 . 1 1 39 39 PHE HA H 39 4.569 4.569 4.665 -0.096 25148 9648 1 15 . 1 1 39 39 PHE CA C 39 58.913 58.913 56.712 2.201 25148 9649 1 15 . 1 1 39 39 PHE CB C 39 39.781 39.781 38.767 1.014 25148 9650 1 15 . 1 1 39 39 PHE H H 39 7.959 7.959 7.572 0.387 25148 9651 1 15 . 1 1 40 40 ASN HA H 40 4.018 4.018 4.570 -0.552 25148 9652 1 15 . 1 1 40 40 ASN CA C 40 58.944 58.944 55.172 3.772 25148 9653 1 15 . 1 1 41 41 GLN HA H 41 4.298 4.298 4.466 -0.168 25148 9654 1 15 . 1 1 41 41 GLN C C 41 175.237 175.237 175.691 -0.454 25148 9655 1 15 . 1 1 41 41 GLN CA C 41 57.360 57.360 56.512 0.848 25148 9656 1 15 . 1 1 41 41 GLN CB C 41 28.724 28.724 28.069 0.655 25148 9657 1 15 . 1 1 42 42 ALA N N 42 120.514 120.514 121.616 -1.102 25148 9658 1 15 . 1 1 42 42 ALA HA H 42 4.622 4.622 4.438 0.184 25148 9659 1 15 . 1 1 42 42 ALA C C 42 175.922 175.922 176.850 -0.928 25148 9660 1 15 . 1 1 42 42 ALA CA C 42 51.841 51.841 52.117 -0.276 25148 9661 1 15 . 1 1 42 42 ALA CB C 42 21.576 21.576 20.066 1.510 25148 9662 1 15 . 1 1 42 42 ALA H H 42 7.817 7.817 8.080 -0.263 25148 9663 1 15 . 1 1 43 43 GLN N N 43 117.594 117.594 115.869 1.725 25148 9664 1 15 . 1 1 43 43 GLN HA H 43 4.265 4.265 4.403 -0.138 25148 9665 1 15 . 1 1 43 43 GLN C C 43 174.942 174.942 173.734 1.208 25148 9666 1 15 . 1 1 43 43 GLN CA C 43 57.047 57.047 55.324 1.723 25148 9667 1 15 . 1 1 43 43 GLN CB C 43 30.863 30.863 31.522 -0.659 25148 9668 1 15 . 1 1 43 43 GLN H H 43 7.400 7.400 7.538 -0.138 25148 9669 1 15 . 1 1 44 44 ASN N N 44 120.467 120.467 120.776 -0.309 25148 9670 1 15 . 1 1 44 44 ASN HA H 44 5.005 5.005 4.639 0.366 25148 9671 1 15 . 1 1 44 44 ASN C C 44 174.365 174.365 174.108 0.257 25148 9672 1 15 . 1 1 44 44 ASN CA C 44 52.381 52.381 53.147 -0.766 25148 9673 1 15 . 1 1 44 44 ASN CB C 44 38.177 38.177 39.043 -0.866 25148 9674 1 15 . 1 1 44 44 ASN H H 44 9.123 9.123 8.569 0.554 25148 9675 1 15 . 1 1 45 45 VAL N N 45 115.479 115.479 117.155 -1.676 25148 9676 1 15 . 1 1 45 45 VAL HA H 45 5.376 5.376 4.290 1.086 25148 9677 1 15 . 1 1 45 45 VAL C C 45 174.908 174.908 174.163 0.745 25148 9678 1 15 . 1 1 45 45 VAL CA C 45 59.022 59.022 61.594 -2.572 25148 9679 1 15 . 1 1 45 45 VAL CB C 45 35.776 35.776 35.190 0.586 25148 9680 1 15 . 1 1 45 45 VAL H H 45 7.732 7.732 8.206 -0.474 25148 9681 1 15 . 1 1 46 46 ARG N N 46 121.146 121.146 126.097 -4.951 25148 9682 1 15 . 1 1 46 46 ARG HA H 46 4.566 4.566 4.789 -0.223 25148 9683 1 15 . 1 1 46 46 ARG C C 46 173.790 173.790 174.471 -0.681 25148 9684 1 15 . 1 1 46 46 ARG CA C 46 54.762 54.762 54.978 -0.216 25148 9685 1 15 . 1 1 46 46 ARG CB C 46 33.946 33.946 32.754 1.192 25148 9686 1 15 . 1 1 46 46 ARG H H 46 8.850 8.850 8.989 -0.139 25148 9687 1 15 . 1 1 47 47 VAL N N 47 122.339 122.339 124.634 -2.295 25148 9688 1 15 . 1 1 47 47 VAL HA H 47 4.741 4.741 4.894 -0.153 25148 9689 1 15 . 1 1 47 47 VAL C C 47 173.541 173.541 175.750 -2.209 25148 9690 1 15 . 1 1 47 47 VAL CA C 47 60.893 60.893 60.391 0.502 25148 9691 1 15 . 1 1 47 47 VAL CB C 47 33.563 33.563 33.295 0.268 25148 9692 1 15 . 1 1 47 47 VAL H H 47 8.444 8.444 8.470 -0.026 25148 9693 1 15 . 1 1 48 48 ASP N N 48 127.701 127.701 125.277 2.424 25148 9694 1 15 . 1 1 48 48 ASP HA H 48 4.946 4.946 4.896 0.050 25148 9695 1 15 . 1 1 48 48 ASP C C 48 173.744 173.744 174.665 -0.921 25148 9696 1 15 . 1 1 48 48 ASP CA C 48 52.651 52.651 53.235 -0.584 25148 9697 1 15 . 1 1 48 48 ASP CB C 48 45.225 45.225 43.633 1.592 25148 9698 1 15 . 1 1 48 48 ASP H H 48 9.068 9.068 8.350 0.718 25148 9699 1 15 . 1 1 49 49 LEU N N 49 130.945 130.945 127.020 3.925 25148 9700 1 15 . 1 1 49 49 LEU HA H 49 4.774 4.774 4.780 -0.006 25148 9701 1 15 . 1 1 49 49 LEU C C 49 174.531 174.531 175.512 -0.981 25148 9702 1 15 . 1 1 49 49 LEU CA C 49 54.337 54.337 54.335 0.002 25148 9703 1 15 . 1 1 49 49 LEU CB C 49 43.192 43.192 42.577 0.615 25148 9704 1 15 . 1 1 49 49 LEU H H 49 9.369 9.369 8.253 1.116 25148 9705 1 15 . 1 1 50 50 ASN N N 50 126.268 126.268 127.225 -0.957 25148 9706 1 15 . 1 1 50 50 ASN HA H 50 4.629 4.629 4.915 -0.286 25148 9707 1 15 . 1 1 50 50 ASN C C 50 176.602 176.602 175.603 0.999 25148 9708 1 15 . 1 1 50 50 ASN CA C 50 54.048 54.048 52.341 1.707 25148 9709 1 15 . 1 1 50 50 ASN CB C 50 39.891 39.891 38.747 1.144 25148 9710 1 15 . 1 1 50 50 ASN H H 50 8.672 8.672 8.912 -0.240 25148 9711 1 15 . 1 1 51 51 ARG N N 51 125.897 125.897 124.704 1.193 25148 9712 1 15 . 1 1 51 51 ARG HA H 51 3.789 3.789 4.284 -0.495 25148 9713 1 15 . 1 1 51 51 ARG C C 51 175.681 175.681 175.969 -0.288 25148 9714 1 15 . 1 1 51 51 ARG CA C 51 58.162 58.162 58.426 -0.264 25148 9715 1 15 . 1 1 51 51 ARG CB C 51 29.944 29.944 29.549 0.395 25148 9716 1 15 . 1 1 51 51 ARG H H 51 8.984 8.984 8.592 0.392 25148 9717 1 15 . 1 1 52 52 GLU N N 52 116.733 116.733 118.643 -1.910 25148 9718 1 15 . 1 1 52 52 GLU HA H 52 4.368 4.368 4.217 0.151 25148 9719 1 15 . 1 1 52 52 GLU C C 52 178.049 178.049 177.308 0.741 25148 9720 1 15 . 1 1 52 52 GLU CA C 52 58.048 58.048 58.046 0.002 25148 9721 1 15 . 1 1 52 52 GLU CB C 52 30.716 30.716 29.439 1.277 25148 9722 1 15 . 1 1 52 52 GLU H H 52 8.541 8.541 8.277 0.264 25148 9723 1 15 . 1 1 53 53 THR N N 53 106.556 106.556 112.144 -5.588 25148 9724 1 15 . 1 1 53 53 THR HA H 53 4.424 4.424 4.487 -0.063 25148 9725 1 15 . 1 1 53 53 THR C C 53 176.352 176.352 174.515 1.837 25148 9726 1 15 . 1 1 53 53 THR CA C 53 61.320 61.320 60.777 0.543 25148 9727 1 15 . 1 1 53 53 THR CB C 53 71.220 71.220 69.364 1.856 25148 9728 1 15 . 1 1 53 53 THR H H 53 8.085 8.085 7.538 0.547 25148 9729 1 15 . 1 1 54 54 GLY N N 54 111.843 111.843 110.414 1.429 25148 9730 1 15 . 1 1 54 54 GLY C C 54 172.690 172.690 174.598 -1.908 25148 9731 1 15 . 1 1 54 54 GLY CA C 54 45.417 45.417 46.260 -0.843 25148 9732 1 15 . 1 1 54 54 GLY H H 54 8.330 8.330 7.698 0.632 25148 9733 1 15 . 1 1 55 55 SER N N 55 113.844 113.844 114.416 -0.572 25148 9734 1 15 . 1 1 55 55 SER HA H 55 4.279 4.279 4.691 -0.412 25148 9735 1 15 . 1 1 55 55 SER C C 55 174.127 174.127 173.105 1.022 25148 9736 1 15 . 1 1 55 55 SER CA C 55 59.229 59.229 58.469 0.760 25148 9737 1 15 . 1 1 55 55 SER CB C 55 63.939 63.939 65.778 -1.839 25148 9738 1 15 . 1 1 55 55 SER H H 55 7.653 7.653 7.565 0.088 25148 9739 1 15 . 1 1 56 56 ILE N N 56 125.286 125.286 120.869 4.417 25148 9740 1 15 . 1 1 56 56 ILE HA H 56 5.082 5.082 4.756 0.326 25148 9741 1 15 . 1 1 56 56 ILE C C 56 175.346 175.346 174.434 0.912 25148 9742 1 15 . 1 1 56 56 ILE CA C 56 59.967 59.967 60.282 -0.315 25148 9743 1 15 . 1 1 56 56 ILE CB C 56 40.165 40.165 42.238 -2.073 25148 9744 1 15 . 1 1 56 56 ILE H H 56 8.478 8.478 8.418 0.060 25148 9745 1 15 . 1 1 57 57 ARG N N 57 126.332 126.332 128.007 -1.675 25148 9746 1 15 . 1 1 57 57 ARG HA H 57 4.740 4.740 4.618 0.122 25148 9747 1 15 . 1 1 57 57 ARG C C 57 173.921 173.921 173.788 0.133 25148 9748 1 15 . 1 1 57 57 ARG CA C 57 54.311 54.311 53.478 0.833 25148 9749 1 15 . 1 1 57 57 ARG CB C 57 35.805 35.805 32.817 2.988 25148 9750 1 15 . 1 1 57 57 ARG H H 57 8.590 8.590 8.179 0.411 25148 9751 1 15 . 1 1 58 58 VAL N N 58 120.987 120.987 123.231 -2.244 25148 9752 1 15 . 1 1 58 58 VAL HA H 58 4.334 4.334 3.980 0.354 25148 9753 1 15 . 1 1 58 58 VAL C C 58 174.204 174.204 173.929 0.275 25148 9754 1 15 . 1 1 58 58 VAL CA C 58 60.861 60.861 61.616 -0.755 25148 9755 1 15 . 1 1 58 58 VAL CB C 58 33.383 33.383 31.711 1.672 25148 9756 1 15 . 1 1 58 58 VAL H H 58 8.585 8.585 8.303 0.282 25148 9757 1 15 . 1 1 59 59 PHE N N 59 124.913 124.913 126.439 -1.526 25148 9758 1 15 . 1 1 59 59 PHE HA H 59 5.046 5.046 5.336 -0.290 25148 9759 1 15 . 1 1 59 59 PHE C C 59 174.446 174.446 174.241 0.205 25148 9760 1 15 . 1 1 59 59 PHE CA C 59 56.695 56.695 55.113 1.582 25148 9761 1 15 . 1 1 59 59 PHE CB C 59 42.779 42.779 42.921 -0.142 25148 9762 1 15 . 1 1 59 59 PHE H H 59 8.920 8.920 8.833 0.087 25148 9763 1 15 . 1 1 60 60 ALA N N 60 124.035 124.035 124.210 -0.175 25148 9764 1 15 . 1 1 60 60 ALA HA H 60 5.102 5.102 4.792 0.310 25148 9765 1 15 . 1 1 60 60 ALA C C 60 176.017 176.017 176.739 -0.722 25148 9766 1 15 . 1 1 60 60 ALA CA C 60 50.083 50.083 50.670 -0.588 25148 9767 1 15 . 1 1 60 60 ALA CB C 60 22.400 22.400 20.406 1.994 25148 9768 1 15 . 1 1 60 60 ALA H H 60 9.457 9.457 8.731 0.726 25148 9769 1 15 . 1 1 61 61 ARG N N 61 121.530 121.530 124.962 -3.432 25148 9770 1 15 . 1 1 61 61 ARG HA H 61 4.958 4.958 4.849 0.109 25148 9771 1 15 . 1 1 61 61 ARG C C 61 176.737 176.737 175.819 0.918 25148 9772 1 15 . 1 1 61 61 ARG CA C 61 55.375 55.375 55.776 -0.401 25148 9773 1 15 . 1 1 61 61 ARG CB C 61 31.230 31.230 30.831 0.399 25148 9774 1 15 . 1 1 61 61 ARG H H 61 8.447 8.447 8.787 -0.340 25148 9775 1 15 . 1 1 62 62 LYS N N 62 124.784 124.784 125.228 -0.444 25148 9776 1 15 . 1 1 62 62 LYS HA H 62 4.709 4.709 4.461 0.248 25148 9777 1 15 . 1 1 62 62 LYS C C 62 173.899 173.899 174.926 -1.027 25148 9778 1 15 . 1 1 62 62 LYS CA C 62 54.812 54.812 55.059 -0.247 25148 9779 1 15 . 1 1 62 62 LYS CB C 62 37.147 37.147 35.457 1.690 25148 9780 1 15 . 1 1 62 62 LYS H H 62 9.137 9.137 8.162 0.975 25148 9781 1 15 . 1 1 63 63 ASP N N 63 122.552 122.552 124.115 -1.563 25148 9782 1 15 . 1 1 63 63 ASP HA H 63 4.877 4.877 4.590 0.287 25148 9783 1 15 . 1 1 63 63 ASP C C 63 175.560 175.560 176.029 -0.469 25148 9784 1 15 . 1 1 63 63 ASP CA C 63 54.576 54.576 55.549 -0.973 25148 9785 1 15 . 1 1 63 63 ASP CB C 63 42.841 42.841 41.525 1.316 25148 9786 1 15 . 1 1 63 63 ASP H H 63 8.334 8.334 8.572 -0.238 25148 9787 1 15 . 1 1 64 64 VAL N N 64 123.109 123.109 126.701 -3.592 25148 9788 1 15 . 1 1 64 64 VAL HA H 64 4.557 4.557 4.637 -0.080 25148 9789 1 15 . 1 1 64 64 VAL C C 64 177.260 177.260 174.846 2.414 25148 9790 1 15 . 1 1 64 64 VAL CA C 64 62.268 62.268 62.253 0.015 25148 9791 1 15 . 1 1 64 64 VAL CB C 64 30.348 30.348 31.565 -1.217 25148 9792 1 15 . 1 1 64 64 VAL H H 64 8.693 8.693 8.016 0.677 25148 9793 1 15 . 1 1 65 65 VAL N N 65 122.320 122.320 123.127 -0.807 25148 9794 1 15 . 1 1 65 65 VAL HA H 65 4.939 4.939 4.513 0.426 25148 9795 1 15 . 1 1 65 65 VAL C C 65 174.754 174.754 174.516 0.238 25148 9796 1 15 . 1 1 65 65 VAL CA C 65 59.173 59.173 59.966 -0.793 25148 9797 1 15 . 1 1 65 65 VAL CB C 65 36.289 36.289 35.340 0.949 25148 9798 1 15 . 1 1 65 65 VAL H H 65 8.656 8.656 8.002 0.654 25148 9799 1 15 . 1 1 66 66 ASP N N 66 119.805 119.805 121.423 -1.618 25148 9800 1 15 . 1 1 66 66 ASP HA H 66 4.499 4.499 4.366 0.133 25148 9801 1 15 . 1 1 66 66 ASP C C 66 176.565 176.565 175.891 0.674 25148 9802 1 15 . 1 1 66 66 ASP CA C 66 57.236 57.236 56.078 1.158 25148 9803 1 15 . 1 1 66 66 ASP CB C 66 41.662 41.662 41.118 0.544 25148 9804 1 15 . 1 1 66 66 ASP H H 66 8.628 8.628 8.596 0.032 25148 9805 1 15 . 1 1 67 67 GLU N N 67 117.604 117.604 118.367 -0.763 25148 9806 1 15 . 1 1 67 67 GLU HA H 67 4.350 4.350 4.550 -0.200 25148 9807 1 15 . 1 1 67 67 GLU C C 67 173.736 173.736 175.399 -1.663 25148 9808 1 15 . 1 1 67 67 GLU CA C 67 55.203 55.203 54.761 0.442 25148 9809 1 15 . 1 1 67 67 GLU CB C 67 32.240 32.240 31.883 0.357 25148 9810 1 15 . 1 1 67 67 GLU H H 67 7.525 7.525 7.937 -0.412 25148 9811 1 15 . 1 1 68 68 VAL N N 68 125.774 125.774 124.183 1.591 25148 9812 1 15 . 1 1 68 68 VAL HA H 68 3.578 3.578 4.142 -0.564 25148 9813 1 15 . 1 1 68 68 VAL C C 68 175.885 175.885 176.007 -0.122 25148 9814 1 15 . 1 1 68 68 VAL CA C 68 63.397 63.397 64.278 -0.881 25148 9815 1 15 . 1 1 68 68 VAL CB C 68 32.452 32.452 31.990 0.462 25148 9816 1 15 . 1 1 68 68 VAL H H 68 8.573 8.573 8.567 0.006 25148 9817 1 15 . 1 1 69 69 TYR N N 69 129.859 129.859 124.992 4.867 25148 9818 1 15 . 1 1 69 69 TYR HA H 69 4.642 4.642 4.568 0.074 25148 9819 1 15 . 1 1 69 69 TYR C C 69 176.100 176.100 175.536 0.564 25148 9820 1 15 . 1 1 69 69 TYR CA C 69 59.092 59.092 57.985 1.107 25148 9821 1 15 . 1 1 69 69 TYR CB C 69 39.830 39.830 39.938 -0.107 25148 9822 1 15 . 1 1 69 69 TYR H H 69 9.801 9.801 8.447 1.354 25148 9823 1 15 . 1 1 70 70 ASP N N 70 120.204 120.204 119.491 0.713 25148 9824 1 15 . 1 1 70 70 ASP HA H 70 4.772 4.772 4.888 -0.116 25148 9825 1 15 . 1 1 70 70 ASP C C 70 176.622 176.622 176.756 -0.134 25148 9826 1 15 . 1 1 70 70 ASP CA C 70 52.885 52.885 53.222 -0.337 25148 9827 1 15 . 1 1 70 70 ASP CB C 70 41.878 41.878 40.494 1.384 25148 9828 1 15 . 1 1 70 70 ASP H H 70 8.348 8.348 8.066 0.282 25148 9829 1 15 . 1 1 71 71 GLN N N 71 125.440 125.440 121.427 4.013 25148 9830 1 15 . 1 1 71 71 GLN HA H 71 4.315 4.315 4.020 0.295 25148 9831 1 15 . 1 1 71 71 GLN C C 71 175.819 175.819 176.796 -0.977 25148 9832 1 15 . 1 1 71 71 GLN CA C 71 57.914 57.914 58.438 -0.524 25148 9833 1 15 . 1 1 71 71 GLN CB C 71 28.307 28.307 28.316 -0.009 25148 9834 1 15 . 1 1 71 71 GLN H H 71 9.097 9.097 8.774 0.323 25148 9835 1 15 . 1 1 72 72 ARG N N 72 116.306 116.306 115.314 0.992 25148 9836 1 15 . 1 1 72 72 ARG HA H 72 4.252 4.252 4.137 0.115 25148 9837 1 15 . 1 1 72 72 ARG C C 72 178.087 178.087 175.809 2.278 25148 9838 1 15 . 1 1 72 72 ARG CA C 72 58.532 58.532 57.227 1.305 25148 9839 1 15 . 1 1 72 72 ARG CB C 72 30.143 30.143 30.551 -0.408 25148 9840 1 15 . 1 1 72 72 ARG H H 72 8.534 8.534 8.251 0.283 25148 9841 1 15 . 1 1 73 73 LEU N N 73 116.734 116.734 113.765 2.969 25148 9842 1 15 . 1 1 73 73 LEU HA H 73 4.621 4.621 4.597 0.024 25148 9843 1 15 . 1 1 73 73 LEU C C 73 175.946 175.946 174.939 1.007 25148 9844 1 15 . 1 1 73 73 LEU CA C 73 55.250 55.250 55.344 -0.094 25148 9845 1 15 . 1 1 73 73 LEU CB C 73 46.960 46.960 44.817 2.143 25148 9846 1 15 . 1 1 73 73 LEU H H 73 7.460 7.460 7.503 -0.043 25148 9847 1 15 . 1 1 74 74 GLU N N 74 118.787 118.787 123.209 -4.422 25148 9848 1 15 . 1 1 74 74 GLU HA H 74 5.403 5.403 4.710 0.693 25148 9849 1 15 . 1 1 74 74 GLU C C 74 173.709 173.709 174.170 -0.461 25148 9850 1 15 . 1 1 74 74 GLU CA C 74 54.914 54.914 55.593 -0.679 25148 9851 1 15 . 1 1 74 74 GLU CB C 74 35.053 35.053 33.359 1.694 25148 9852 1 15 . 1 1 74 74 GLU H H 74 7.752 7.752 8.092 -0.340 25148 9853 1 15 . 1 1 75 75 ILE N N 75 119.803 119.803 122.594 -2.791 25148 9854 1 15 . 1 1 75 75 ILE HA H 75 4.507 4.507 4.434 0.073 25148 9855 1 15 . 1 1 75 75 ILE C C 75 172.126 172.126 173.962 -1.836 25148 9856 1 15 . 1 1 75 75 ILE CA C 75 58.664 58.664 60.177 -1.513 25148 9857 1 15 . 1 1 75 75 ILE CB C 75 42.560 42.560 41.819 0.741 25148 9858 1 15 . 1 1 75 75 ILE H H 75 8.975 8.975 9.009 -0.034 25148 9859 1 15 . 1 1 76 76 SER N N 76 123.236 123.236 123.694 -0.458 25148 9860 1 15 . 1 1 76 76 SER HA H 76 4.505 4.505 4.617 -0.112 25148 9861 1 15 . 1 1 76 76 SER C C 76 176.145 176.145 175.856 0.289 25148 9862 1 15 . 1 1 76 76 SER CA C 76 58.108 58.108 58.502 -0.394 25148 9863 1 15 . 1 1 76 76 SER CB C 76 65.000 65.000 63.941 1.060 25148 9864 1 15 . 1 1 76 76 SER H H 76 8.810 8.810 8.724 0.086 25148 9865 1 15 . 1 1 77 77 ILE N N 77 120.629 120.629 127.492 -6.863 25148 9866 1 15 . 1 1 77 77 ILE HA H 77 3.935 3.935 3.775 0.160 25148 9867 1 15 . 1 1 77 77 ILE C C 77 175.806 175.806 176.748 -0.942 25148 9868 1 15 . 1 1 77 77 ILE CA C 77 61.928 61.928 63.875 -1.947 25148 9869 1 15 . 1 1 77 77 ILE CB C 77 38.031 38.031 38.316 -0.285 25148 9870 1 15 . 1 1 77 77 ILE H H 77 8.321 8.321 8.173 0.148 25148 9871 1 15 . 1 1 78 78 GLU N N 78 121.032 121.032 117.374 3.658 25148 9872 1 15 . 1 1 78 78 GLU HA H 78 4.082 4.082 4.006 0.076 25148 9873 1 15 . 1 1 78 78 GLU C C 78 179.829 179.829 178.480 1.349 25148 9874 1 15 . 1 1 78 78 GLU CA C 78 60.180 60.180 58.913 1.267 25148 9875 1 15 . 1 1 78 78 GLU CB C 78 28.988 28.988 28.900 0.088 25148 9876 1 15 . 1 1 78 78 GLU H H 78 8.222 8.222 8.179 0.043 25148 9877 1 15 . 1 1 79 79 GLU N N 79 120.710 120.710 121.190 -0.480 25148 9878 1 15 . 1 1 79 79 GLU HA H 79 4.012 4.012 4.093 -0.081 25148 9879 1 15 . 1 1 79 79 GLU C C 79 180.339 180.339 178.979 1.360 25148 9880 1 15 . 1 1 79 79 GLU CA C 79 59.332 59.332 58.754 0.578 25148 9881 1 15 . 1 1 79 79 GLU CB C 79 29.317 29.317 29.250 0.067 25148 9882 1 15 . 1 1 79 79 GLU H H 79 7.908 7.908 7.676 0.232 25148 9883 1 15 . 1 1 80 80 ALA N N 80 122.879 122.879 121.875 1.004 25148 9884 1 15 . 1 1 80 80 ALA HA H 80 3.966 3.966 4.136 -0.170 25148 9885 1 15 . 1 1 80 80 ALA C C 80 179.833 179.833 179.965 -0.132 25148 9886 1 15 . 1 1 80 80 ALA CA C 80 55.881 55.881 55.025 0.856 25148 9887 1 15 . 1 1 80 80 ALA CB C 80 18.870 18.870 18.065 0.805 25148 9888 1 15 . 1 1 80 80 ALA H H 80 9.132 9.132 7.936 1.196 25148 9889 1 15 . 1 1 81 81 GLN N N 81 115.829 115.829 116.793 -0.964 25148 9890 1 15 . 1 1 81 81 GLN HA H 81 4.749 4.749 4.314 0.435 25148 9891 1 15 . 1 1 81 81 GLN C C 81 178.126 178.126 178.014 0.112 25148 9892 1 15 . 1 1 81 81 GLN CA C 81 57.682 57.682 58.025 -0.343 25148 9893 1 15 . 1 1 81 81 GLN CB C 81 27.307 27.307 28.623 -1.316 25148 9894 1 15 . 1 1 81 81 GLN H H 81 8.709 8.709 7.802 0.907 25148 9895 1 15 . 1 1 82 82 GLY N N 82 105.531 105.531 106.679 -1.148 25148 9896 1 15 . 1 1 82 82 GLY C C 82 174.917 174.917 175.032 -0.115 25148 9897 1 15 . 1 1 82 82 GLY CA C 82 45.915 45.915 46.527 -0.612 25148 9898 1 15 . 1 1 82 82 GLY H H 82 7.479 7.479 8.023 -0.544 25148 9899 1 15 . 1 1 83 83 ILE N N 83 122.828 122.828 113.734 9.094 25148 9900 1 15 . 1 1 83 83 ILE HA H 83 3.970 3.970 4.440 -0.470 25148 9901 1 15 . 1 1 83 83 ILE C C 83 177.209 177.209 175.553 1.656 25148 9902 1 15 . 1 1 83 83 ILE CA C 83 64.305 64.305 61.642 2.663 25148 9903 1 15 . 1 1 83 83 ILE CB C 83 38.452 38.452 40.218 -1.766 25148 9904 1 15 . 1 1 83 83 ILE H H 83 7.634 7.634 7.558 0.076 25148 9905 1 15 . 1 1 84 84 HIS N N 84 118.927 118.927 120.069 -1.142 25148 9906 1 15 . 1 1 84 84 HIS HA H 84 4.713 4.713 4.936 -0.223 25148 9907 1 15 . 1 1 84 84 HIS CA C 84 55.487 55.487 54.453 1.034 25148 9908 1 15 . 1 1 84 84 HIS CB C 84 33.506 33.506 32.339 1.167 25148 9909 1 15 . 1 1 84 84 HIS H H 84 8.155 8.155 8.421 -0.266 25148 9910 1 15 . 1 1 85 85 PRO HA H 85 4.456 4.456 4.617 -0.161 25148 9911 1 15 . 1 1 85 85 PRO C C 85 177.357 177.357 177.248 0.109 25148 9912 1 15 . 1 1 85 85 PRO CA C 85 64.475 64.475 64.071 0.404 25148 9913 1 15 . 1 1 85 85 PRO CB C 85 32.489 32.489 32.101 0.388 25148 9914 1 15 . 1 1 86 86 GLU N N 86 116.314 116.314 117.563 -1.249 25148 9915 1 15 . 1 1 86 86 GLU HA H 86 4.286 4.286 4.179 0.107 25148 9916 1 15 . 1 1 86 86 GLU C C 86 177.624 177.624 177.289 0.335 25148 9917 1 15 . 1 1 86 86 GLU CA C 86 56.619 56.619 56.762 -0.143 25148 9918 1 15 . 1 1 86 86 GLU CB C 86 29.389 29.389 29.555 -0.166 25148 9919 1 15 . 1 1 86 86 GLU H H 86 8.938 8.938 7.806 1.132 25148 9920 1 15 . 1 1 87 87 TYR N N 87 119.773 119.773 120.281 -0.508 25148 9921 1 15 . 1 1 87 87 TYR HA H 87 4.744 4.744 4.171 0.573 25148 9922 1 15 . 1 1 87 87 TYR C C 87 174.533 174.533 176.149 -1.616 25148 9923 1 15 . 1 1 87 87 TYR CA C 87 59.117 59.117 59.416 -0.299 25148 9924 1 15 . 1 1 87 87 TYR CB C 87 38.859 38.859 38.706 0.153 25148 9925 1 15 . 1 1 87 87 TYR H H 87 7.447 7.447 7.348 0.099 25148 9926 1 15 . 1 1 88 88 MET N N 88 118.298 118.298 117.376 0.922 25148 9927 1 15 . 1 1 88 88 MET HA H 88 4.770 4.770 4.668 0.102 25148 9928 1 15 . 1 1 88 88 MET C C 88 175.638 175.638 173.843 1.795 25148 9929 1 15 . 1 1 88 88 MET CA C 88 53.133 53.133 54.469 -1.336 25148 9930 1 15 . 1 1 88 88 MET CB C 88 37.102 37.102 35.572 1.530 25148 9931 1 15 . 1 1 88 88 MET H H 88 9.023 9.023 8.313 0.710 25148 9932 1 15 . 1 1 89 89 VAL N N 89 120.157 120.157 124.340 -4.183 25148 9933 1 15 . 1 1 89 89 VAL HA H 89 3.330 3.330 3.968 -0.638 25148 9934 1 15 . 1 1 89 89 VAL C C 89 177.432 177.432 177.310 0.122 25148 9935 1 15 . 1 1 89 89 VAL CA C 89 65.675 65.675 63.574 2.101 25148 9936 1 15 . 1 1 89 89 VAL CB C 89 31.321 31.321 30.488 0.833 25148 9937 1 15 . 1 1 89 89 VAL H H 89 8.313 8.313 8.556 -0.243 25148 9938 1 15 . 1 1 90 90 GLY N N 90 116.935 116.935 116.236 0.699 25148 9939 1 15 . 1 1 90 90 GLY C C 90 175.196 175.196 174.206 0.990 25148 9940 1 15 . 1 1 90 90 GLY CA C 90 44.685 44.685 44.797 -0.112 25148 9941 1 15 . 1 1 90 90 GLY H H 90 8.551 8.551 9.055 -0.504 25148 9942 1 15 . 1 1 91 91 ASP N N 91 121.616 121.616 121.837 -0.221 25148 9943 1 15 . 1 1 91 91 ASP HA H 91 4.790 4.790 4.933 -0.143 25148 9944 1 15 . 1 1 91 91 ASP C C 91 174.431 174.431 174.888 -0.457 25148 9945 1 15 . 1 1 91 91 ASP CA C 91 55.011 55.011 53.873 1.138 25148 9946 1 15 . 1 1 91 91 ASP CB C 91 42.079 42.079 42.715 -0.636 25148 9947 1 15 . 1 1 91 91 ASP H H 91 8.073 8.073 7.989 0.084 25148 9948 1 15 . 1 1 92 92 VAL N N 92 118.919 118.919 114.822 4.097 25148 9949 1 15 . 1 1 92 92 VAL HA H 92 4.709 4.709 4.978 -0.269 25148 9950 1 15 . 1 1 92 92 VAL C C 92 175.602 175.602 174.399 1.203 25148 9951 1 15 . 1 1 92 92 VAL CA C 92 61.527 61.527 60.027 1.500 25148 9952 1 15 . 1 1 92 92 VAL CB C 92 34.110 34.110 34.989 -0.879 25148 9953 1 15 . 1 1 92 92 VAL H H 92 8.216 8.216 8.090 0.126 25148 9954 1 15 . 1 1 93 93 VAL N N 93 123.922 123.922 123.000 0.922 25148 9955 1 15 . 1 1 93 93 VAL HA H 93 4.231 4.231 4.308 -0.077 25148 9956 1 15 . 1 1 93 93 VAL C C 93 174.105 174.105 174.230 -0.125 25148 9957 1 15 . 1 1 93 93 VAL CA C 93 59.644 59.644 59.861 -0.217 25148 9958 1 15 . 1 1 93 93 VAL CB C 93 34.661 34.661 35.538 -0.876 25148 9959 1 15 . 1 1 93 93 VAL H H 93 8.812 8.812 7.962 0.850 25148 9960 1 15 . 1 1 94 94 GLU N N 94 123.605 123.605 128.128 -4.523 25148 9961 1 15 . 1 1 94 94 GLU HA H 94 5.347 5.347 5.165 0.182 25148 9962 1 15 . 1 1 94 94 GLU C C 94 175.708 175.708 175.541 0.167 25148 9963 1 15 . 1 1 94 94 GLU CA C 94 54.979 54.979 55.081 -0.102 25148 9964 1 15 . 1 1 94 94 GLU CB C 94 31.612 31.612 31.927 -0.315 25148 9965 1 15 . 1 1 94 94 GLU H H 94 8.312 8.312 8.534 -0.222 25148 9966 1 15 . 1 1 95 95 ILE N N 95 123.581 123.581 124.129 -0.548 25148 9967 1 15 . 1 1 95 95 ILE HA H 95 4.601 4.601 4.469 0.132 25148 9968 1 15 . 1 1 95 95 ILE C C 95 175.081 175.081 175.452 -0.371 25148 9969 1 15 . 1 1 95 95 ILE CA C 95 58.601 58.601 59.848 -1.247 25148 9970 1 15 . 1 1 95 95 ILE CB C 95 41.727 41.727 42.209 -0.482 25148 9971 1 15 . 1 1 95 95 ILE H H 95 9.045 9.045 8.220 0.825 25148 9972 1 15 . 1 1 96 96 GLU N N 96 128.094 128.094 127.008 1.086 25148 9973 1 15 . 1 1 96 96 GLU HA H 96 4.098 4.098 4.317 -0.219 25148 9974 1 15 . 1 1 96 96 GLU C C 96 176.845 176.845 175.911 0.934 25148 9975 1 15 . 1 1 96 96 GLU CA C 96 57.853 57.853 58.511 -0.658 25148 9976 1 15 . 1 1 96 96 GLU CB C 96 28.323 28.323 29.627 -1.304 25148 9977 1 15 . 1 1 96 96 GLU H H 96 9.256 9.256 8.924 0.332 25148 9978 1 15 . 1 1 97 97 VAL N N 97 118.446 118.446 125.809 -7.363 25148 9979 1 15 . 1 1 97 97 VAL HA H 97 4.568 4.568 4.263 0.305 25148 9980 1 15 . 1 1 97 97 VAL C C 97 175.051 175.051 174.738 0.313 25148 9981 1 15 . 1 1 97 97 VAL CA C 97 59.796 59.796 60.792 -0.996 25148 9982 1 15 . 1 1 97 97 VAL CB C 97 32.399 32.399 33.261 -0.862 25148 9983 1 15 . 1 1 97 97 VAL H H 97 8.609 8.609 8.781 -0.172 25148 9984 1 15 . 1 1 98 98 THR N N 98 119.118 119.118 118.302 0.816 25148 9985 1 15 . 1 1 98 98 THR HA H 98 3.320 3.320 3.844 -0.524 25148 9986 1 15 . 1 1 98 98 THR CA C 98 61.628 61.628 60.712 0.916 25148 9987 1 15 . 1 1 98 98 THR CB C 98 70.031 70.031 69.115 0.916 25148 9988 1 15 . 1 1 98 98 THR H H 98 7.396 7.396 7.261 0.135 25148 9989 1 15 . 1 1 99 99 PRO HA H 99 4.458 4.458 4.632 -0.174 25148 9990 1 15 . 1 1 99 99 PRO CA C 99 62.348 62.348 62.501 -0.153 25148 9991 1 15 . 1 1 99 99 PRO CB C 99 33.182 33.182 32.558 0.624 25148 9992 1 15 . 1 1 100 100 LYS HA H 100 4.126 4.126 4.208 -0.082 25148 9993 1 15 . 1 1 100 100 LYS CA C 100 58.773 58.773 57.800 0.973 25148 9994 1 15 . 1 1 100 100 LYS CB C 100 32.195 32.195 32.126 0.070 25148 9995 1 15 . 1 1 101 101 ASP HA H 101 4.924 4.924 4.758 0.166 25148 9996 1 15 . 1 1 101 101 ASP C C 101 176.884 176.884 176.640 0.244 25148 9997 1 15 . 1 1 101 101 ASP CA C 101 54.134 54.134 53.378 0.756 25148 9998 1 15 . 1 1 101 101 ASP CB C 101 40.272 40.272 40.816 -0.545 25148 9999 1 15 . 1 1 102 102 PHE N N 102 118.703 118.703 121.045 -2.342 25148 10000 1 15 . 1 1 102 102 PHE HA H 102 4.295 4.295 4.208 0.087 25148 10001 1 15 . 1 1 102 102 PHE C C 102 176.477 176.477 177.294 -0.817 25148 10002 1 15 . 1 1 102 102 PHE CA C 102 60.748 60.748 60.052 0.696 25148 10003 1 15 . 1 1 102 102 PHE CB C 102 39.667 39.667 39.238 0.429 25148 10004 1 15 . 1 1 102 102 PHE H H 102 7.862 7.862 7.724 0.138 25148 10005 1 15 . 1 1 103 103 GLY CA C 103 47.430 47.430 47.278 0.152 25148 10006 1 15 . 1 1 104 104 ARG N N 104 121.819 121.819 120.604 1.215 25148 10007 1 15 . 1 1 104 104 ARG HA H 104 4.176 4.176 4.136 0.040 25148 10008 1 15 . 1 1 104 104 ARG C C 104 178.912 178.912 178.500 0.412 25148 10009 1 15 . 1 1 104 104 ARG CA C 104 59.235 59.235 58.524 0.711 25148 10010 1 15 . 1 1 104 104 ARG CB C 104 30.000 30.000 30.402 -0.402 25148 10011 1 15 . 1 1 104 104 ARG H H 104 7.809 7.809 7.444 0.365 25148 10012 1 15 . 1 1 105 105 ILE N N 105 120.331 120.331 120.661 -0.330 25148 10013 1 15 . 1 1 105 105 ILE HA H 105 3.836 3.836 3.500 0.336 25148 10014 1 15 . 1 1 105 105 ILE C C 105 179.206 179.206 177.432 1.774 25148 10015 1 15 . 1 1 105 105 ILE CA C 105 63.025 63.025 65.285 -2.260 25148 10016 1 15 . 1 1 105 105 ILE CB C 105 38.127 38.127 37.397 0.730 25148 10017 1 15 . 1 1 105 105 ILE H H 105 7.203 7.203 7.445 -0.242 25148 10018 1 15 . 1 1 106 106 ALA N N 106 124.867 124.867 122.119 2.748 25148 10019 1 15 . 1 1 106 106 ALA HA H 106 3.665 3.665 3.534 0.131 25148 10020 1 15 . 1 1 106 106 ALA C C 106 178.590 178.590 179.055 -0.465 25148 10021 1 15 . 1 1 106 106 ALA CA C 106 54.842 54.842 55.271 -0.429 25148 10022 1 15 . 1 1 106 106 ALA CB C 106 18.659 18.659 17.773 0.886 25148 10023 1 15 . 1 1 106 106 ALA H H 106 8.813 8.813 8.168 0.645 25148 10024 1 15 . 1 1 107 107 ALA N N 107 119.597 119.597 119.943 -0.346 25148 10025 1 15 . 1 1 107 107 ALA HA H 107 4.014 4.014 4.055 -0.041 25148 10026 1 15 . 1 1 107 107 ALA C C 107 180.214 180.214 179.612 0.602 25148 10027 1 15 . 1 1 107 107 ALA CA C 107 55.454 55.454 54.539 0.915 25148 10028 1 15 . 1 1 107 107 ALA CB C 107 18.260 18.260 18.107 0.153 25148 10029 1 15 . 1 1 107 107 ALA H H 107 8.012 8.012 7.534 0.478 25148 10030 1 15 . 1 1 108 108 GLN N N 108 116.896 116.896 118.285 -1.389 25148 10031 1 15 . 1 1 108 108 GLN HA H 108 4.054 4.054 4.041 0.013 25148 10032 1 15 . 1 1 108 108 GLN C C 108 178.784 178.784 178.097 0.687 25148 10033 1 15 . 1 1 108 108 GLN CA C 108 58.705 58.705 58.982 -0.277 25148 10034 1 15 . 1 1 108 108 GLN CB C 108 28.647 28.647 28.822 -0.175 25148 10035 1 15 . 1 1 108 108 GLN H H 108 7.498 7.498 8.399 -0.901 25148 10036 1 15 . 1 1 109 109 THR N N 109 117.495 117.495 115.259 2.236 25148 10037 1 15 . 1 1 109 109 THR HA H 109 3.917 3.917 4.460 -0.543 25148 10038 1 15 . 1 1 109 109 THR C C 109 175.732 175.732 176.107 -0.375 25148 10039 1 15 . 1 1 109 109 THR CA C 109 66.989 66.989 65.323 1.667 25148 10040 1 15 . 1 1 109 109 THR CB C 109 68.766 68.766 68.486 0.280 25148 10041 1 15 . 1 1 109 109 THR H H 109 8.203 8.203 8.263 -0.060 25148 10042 1 15 . 1 1 110 110 ALA N N 110 122.308 122.308 124.956 -2.648 25148 10043 1 15 . 1 1 110 110 ALA HA H 110 3.854 3.854 4.048 -0.194 25148 10044 1 15 . 1 1 110 110 ALA C C 110 178.380 178.380 178.793 -0.413 25148 10045 1 15 . 1 1 110 110 ALA CA C 110 55.903 55.903 54.931 0.972 25148 10046 1 15 . 1 1 110 110 ALA CB C 110 18.524 18.524 18.301 0.223 25148 10047 1 15 . 1 1 110 110 ALA H H 110 8.668 8.668 7.764 0.904 25148 10048 1 15 . 1 1 111 111 LYS N N 111 115.552 115.552 117.701 -2.149 25148 10049 1 15 . 1 1 111 111 LYS HA H 111 3.923 3.923 4.024 -0.101 25148 10050 1 15 . 1 1 111 111 LYS C C 111 179.111 179.111 178.774 0.337 25148 10051 1 15 . 1 1 111 111 LYS CA C 111 59.825 59.825 59.120 0.705 25148 10052 1 15 . 1 1 111 111 LYS CB C 111 32.251 32.251 31.996 0.255 25148 10053 1 15 . 1 1 111 111 LYS H H 111 7.642 7.642 7.980 -0.338 25148 10054 1 15 . 1 1 112 112 GLN N N 112 120.178 120.178 118.230 1.948 25148 10055 1 15 . 1 1 112 112 GLN HA H 112 4.060 4.060 4.175 -0.115 25148 10056 1 15 . 1 1 112 112 GLN C C 112 178.355 178.355 177.992 0.363 25148 10057 1 15 . 1 1 112 112 GLN CA C 112 59.240 59.240 58.003 1.237 25148 10058 1 15 . 1 1 112 112 GLN CB C 112 28.250 28.250 28.588 -0.338 25148 10059 1 15 . 1 1 112 112 GLN H H 112 7.798 7.798 7.571 0.227 25148 10060 1 15 . 1 1 113 113 VAL N N 113 119.799 119.799 120.460 -0.661 25148 10061 1 15 . 1 1 113 113 VAL HA H 113 3.705 3.705 3.747 -0.042 25148 10062 1 15 . 1 1 113 113 VAL C C 113 178.303 178.303 177.992 0.311 25148 10063 1 15 . 1 1 113 113 VAL CA C 113 66.277 66.277 65.312 0.965 25148 10064 1 15 . 1 1 113 113 VAL CB C 113 31.954 31.954 31.308 0.646 25148 10065 1 15 . 1 1 113 113 VAL H H 113 8.105 8.105 7.492 0.613 25148 10066 1 15 . 1 1 114 114 VAL N N 114 118.265 118.265 116.474 1.791 25148 10067 1 15 . 1 1 114 114 VAL HA H 114 3.392 3.392 3.674 -0.282 25148 10068 1 15 . 1 1 114 114 VAL C C 114 177.360 177.360 177.730 -0.370 25148 10069 1 15 . 1 1 114 114 VAL CA C 114 67.832 67.832 66.795 1.037 25148 10070 1 15 . 1 1 114 114 VAL CB C 114 31.801 31.801 30.670 1.131 25148 10071 1 15 . 1 1 114 114 VAL H H 114 8.180 8.180 7.933 0.247 25148 10072 1 15 . 1 1 115 115 THR N N 115 113.460 113.460 115.584 -2.124 25148 10073 1 15 . 1 1 115 115 THR HA H 115 3.856 3.856 3.903 -0.047 25148 10074 1 15 . 1 1 115 115 THR C C 115 176.529 176.529 176.867 -0.338 25148 10075 1 15 . 1 1 115 115 THR CA C 115 66.706 66.706 67.009 -0.303 25148 10076 1 15 . 1 1 115 115 THR CB C 115 69.008 69.008 68.283 0.725 25148 10077 1 15 . 1 1 115 115 THR H H 115 8.143 8.143 7.784 0.359 25148 10078 1 15 . 1 1 116 116 GLN N N 116 120.129 120.129 119.837 0.292 25148 10079 1 15 . 1 1 116 116 GLN HA H 116 4.054 4.054 4.088 -0.034 25148 10080 1 15 . 1 1 116 116 GLN C C 116 178.100 178.100 178.487 -0.387 25148 10081 1 15 . 1 1 116 116 GLN CA C 116 58.950 58.950 58.971 -0.021 25148 10082 1 15 . 1 1 116 116 GLN CB C 116 28.244 28.244 28.484 -0.240 25148 10083 1 15 . 1 1 116 116 GLN H H 116 7.936 7.936 7.481 0.455 25148 10084 1 15 . 1 1 117 117 ARG N N 117 117.838 117.838 119.704 -1.866 25148 10085 1 15 . 1 1 117 117 ARG HA H 117 4.174 4.174 4.113 0.061 25148 10086 1 15 . 1 1 117 117 ARG C C 117 179.138 179.138 178.808 0.330 25148 10087 1 15 . 1 1 117 117 ARG CA C 117 57.461 57.461 58.052 -0.591 25148 10088 1 15 . 1 1 117 117 ARG CB C 117 29.548 29.548 29.245 0.303 25148 10089 1 15 . 1 1 117 117 ARG H H 117 8.240 8.240 7.540 0.700 25148 10090 1 15 . 1 1 118 118 VAL N N 118 120.278 120.278 119.771 0.507 25148 10091 1 15 . 1 1 118 118 VAL HA H 118 3.709 3.709 3.633 0.076 25148 10092 1 15 . 1 1 118 118 VAL C C 118 177.597 177.597 177.573 0.024 25148 10093 1 15 . 1 1 118 118 VAL CA C 118 66.246 66.246 66.833 -0.587 25148 10094 1 15 . 1 1 118 118 VAL CB C 118 31.785 31.785 30.929 0.856 25148 10095 1 15 . 1 1 118 118 VAL H H 118 8.480 8.480 8.215 0.265 25148 10096 1 15 . 1 1 119 119 ARG N N 119 120.197 120.197 117.623 2.574 25148 10097 1 15 . 1 1 119 119 ARG HA H 119 4.173 4.173 4.229 -0.056 25148 10098 1 15 . 1 1 119 119 ARG C C 119 178.864 178.864 178.823 0.041 25148 10099 1 15 . 1 1 119 119 ARG CA C 119 58.772 58.772 58.889 -0.117 25148 10100 1 15 . 1 1 119 119 ARG CB C 119 29.873 29.873 29.659 0.214 25148 10101 1 15 . 1 1 119 119 ARG H H 119 7.899 7.899 7.405 0.494 25148 10102 1 15 . 1 1 120 120 GLU N N 120 118.768 118.768 120.345 -1.577 25148 10103 1 15 . 1 1 120 120 GLU HA H 120 4.110 4.110 4.113 -0.003 25148 10104 1 15 . 1 1 120 120 GLU C C 120 177.823 177.823 178.642 -0.819 25148 10105 1 15 . 1 1 120 120 GLU CA C 120 58.223 58.223 59.019 -0.796 25148 10106 1 15 . 1 1 120 120 GLU CB C 120 29.854 29.854 29.564 0.290 25148 10107 1 15 . 1 1 120 120 GLU H H 120 8.084 8.084 8.089 -0.005 25148 10108 1 15 . 1 1 121 121 ALA N N 121 121.984 121.984 122.175 -0.191 25148 10109 1 15 . 1 1 121 121 ALA HA H 121 4.296 4.296 3.955 0.341 25148 10110 1 15 . 1 1 121 121 ALA C C 121 178.586 178.586 180.053 -1.467 25148 10111 1 15 . 1 1 121 121 ALA CA C 121 53.475 53.475 55.380 -1.905 25148 10112 1 15 . 1 1 121 121 ALA CB C 121 18.856 18.856 18.451 0.405 25148 10113 1 15 . 1 1 121 121 ALA H H 121 7.810 7.810 8.462 -0.652 25148 10114 1 15 . 1 1 122 122 GLU N N 122 118.229 118.229 118.415 -0.186 25148 10115 1 15 . 1 1 122 122 GLU HA H 122 4.241 4.241 4.302 -0.061 25148 10116 1 15 . 1 1 122 122 GLU C C 122 176.839 176.839 178.689 -1.850 25148 10117 1 15 . 1 1 122 122 GLU CA C 122 57.118 57.118 58.395 -1.277 25148 10118 1 15 . 1 1 122 122 GLU CB C 122 30.018 30.018 28.947 1.071 25148 10119 1 15 . 1 1 122 122 GLU H H 122 7.938 7.938 7.795 0.143 25148 10120 1 15 . 1 1 123 123 ARG N N 123 120.601 120.601 119.715 0.886 25148 10121 1 15 . 1 1 123 123 ARG HA H 123 4.348 4.348 4.245 0.103 25148 10122 1 15 . 1 1 123 123 ARG C C 123 176.071 176.071 177.600 -1.529 25148 10123 1 15 . 1 1 123 123 ARG CA C 123 56.510 56.510 56.855 -0.345 25148 10124 1 15 . 1 1 123 123 ARG CB C 123 30.765 30.765 30.253 0.512 25148 10125 1 15 . 1 1 123 123 ARG H H 123 7.977 7.977 7.777 0.200 25148 10126 1 16 . 1 1 4 4 GLU HA H 4 4.138 4.138 4.049 0.089 25148 10127 1 16 . 1 1 4 4 GLU C C 4 179.152 179.152 177.470 1.682 25148 10128 1 16 . 1 1 4 4 GLU CA C 4 59.566 59.566 59.219 0.347 25148 10129 1 16 . 1 1 4 4 GLU CB C 4 29.407 29.407 29.192 0.215 25148 10130 1 16 . 1 1 5 5 LEU N N 5 121.360 121.360 117.516 3.844 25148 10131 1 16 . 1 1 5 5 LEU HA H 5 4.195 4.195 4.007 0.188 25148 10132 1 16 . 1 1 5 5 LEU C C 5 178.179 178.179 178.237 -0.058 25148 10133 1 16 . 1 1 5 5 LEU CA C 5 57.830 57.830 57.432 0.398 25148 10134 1 16 . 1 1 5 5 LEU CB C 5 41.630 41.630 41.293 0.337 25148 10135 1 16 . 1 1 5 5 LEU H H 5 7.877 7.877 7.689 0.188 25148 10136 1 16 . 1 1 6 6 LEU N N 6 118.058 118.058 118.855 -0.797 25148 10137 1 16 . 1 1 6 6 LEU HA H 6 3.919 3.919 3.807 0.112 25148 10138 1 16 . 1 1 6 6 LEU C C 6 180.274 180.274 179.105 1.169 25148 10139 1 16 . 1 1 6 6 LEU CA C 6 58.221 58.221 57.818 0.403 25148 10140 1 16 . 1 1 6 6 LEU CB C 6 40.684 40.684 41.031 -0.347 25148 10141 1 16 . 1 1 6 6 LEU H H 6 7.685 7.685 7.839 -0.154 25148 10142 1 16 . 1 1 7 7 ASP N N 7 120.662 120.662 117.530 3.132 25148 10143 1 16 . 1 1 7 7 ASP HA H 7 4.416 4.416 4.361 0.055 25148 10144 1 16 . 1 1 7 7 ASP C C 7 178.738 178.738 177.556 1.182 25148 10145 1 16 . 1 1 7 7 ASP CA C 7 57.519 57.519 56.931 0.588 25148 10146 1 16 . 1 1 7 7 ASP CB C 7 40.167 40.167 40.993 -0.826 25148 10147 1 16 . 1 1 7 7 ASP H H 7 8.427 8.427 7.845 0.582 25148 10148 1 16 . 1 1 8 8 ALA N N 8 122.612 122.612 122.987 -0.375 25148 10149 1 16 . 1 1 8 8 ALA HA H 8 4.146 4.146 3.964 0.182 25148 10150 1 16 . 1 1 8 8 ALA C C 8 180.787 180.787 179.474 1.313 25148 10151 1 16 . 1 1 8 8 ALA CA C 8 55.165 55.165 55.120 0.045 25148 10152 1 16 . 1 1 8 8 ALA CB C 8 17.711 17.711 18.552 -0.841 25148 10153 1 16 . 1 1 8 8 ALA H H 8 7.847 7.847 7.499 0.348 25148 10154 1 16 . 1 1 9 9 LEU N N 9 116.977 116.977 117.922 -0.945 25148 10155 1 16 . 1 1 9 9 LEU HA H 9 4.115 4.115 3.834 0.281 25148 10156 1 16 . 1 1 9 9 LEU C C 9 179.510 179.510 179.338 0.172 25148 10157 1 16 . 1 1 9 9 LEU CA C 9 57.468 57.468 57.997 -0.529 25148 10158 1 16 . 1 1 9 9 LEU CB C 9 41.203 41.203 41.602 -0.400 25148 10159 1 16 . 1 1 9 9 LEU H H 9 8.256 8.256 7.612 0.644 25148 10160 1 16 . 1 1 10 10 THR N N 10 118.764 118.764 115.571 3.193 25148 10161 1 16 . 1 1 10 10 THR HA H 10 4.487 4.487 3.894 0.593 25148 10162 1 16 . 1 1 10 10 THR C C 10 176.567 176.567 177.286 -0.719 25148 10163 1 16 . 1 1 10 10 THR CA C 10 68.768 68.768 66.505 2.263 25148 10164 1 16 . 1 1 10 10 THR CB C 10 66.961 66.961 68.657 -1.696 25148 10165 1 16 . 1 1 10 10 THR H H 10 8.218 8.218 7.381 0.837 25148 10166 1 16 . 1 1 11 11 ILE N N 11 122.555 122.555 121.052 1.503 25148 10167 1 16 . 1 1 11 11 ILE HA H 11 3.779 3.779 3.677 0.102 25148 10168 1 16 . 1 1 11 11 ILE C C 11 177.793 177.793 177.763 0.030 25148 10169 1 16 . 1 1 11 11 ILE CA C 11 64.695 64.695 64.979 -0.284 25148 10170 1 16 . 1 1 11 11 ILE CB C 11 37.856 37.856 37.462 0.394 25148 10171 1 16 . 1 1 11 11 ILE H H 11 7.632 7.632 7.720 -0.088 25148 10172 1 16 . 1 1 12 12 LEU N N 12 120.469 120.469 118.782 1.687 25148 10173 1 16 . 1 1 12 12 LEU HA H 12 4.065 4.065 4.019 0.046 25148 10174 1 16 . 1 1 12 12 LEU C C 12 179.139 179.139 178.780 0.359 25148 10175 1 16 . 1 1 12 12 LEU CA C 12 57.944 57.944 57.070 0.874 25148 10176 1 16 . 1 1 12 12 LEU CB C 12 42.170 42.170 40.915 1.255 25148 10177 1 16 . 1 1 12 12 LEU H H 12 7.951 7.951 7.762 0.189 25148 10178 1 16 . 1 1 13 13 GLU N N 13 119.669 119.669 119.337 0.332 25148 10179 1 16 . 1 1 13 13 GLU HA H 13 4.183 4.183 4.005 0.178 25148 10180 1 16 . 1 1 13 13 GLU C C 13 179.007 179.007 177.470 1.537 25148 10181 1 16 . 1 1 13 13 GLU CA C 13 59.703 59.703 58.917 0.786 25148 10182 1 16 . 1 1 13 13 GLU CB C 13 30.110 30.110 29.202 0.908 25148 10183 1 16 . 1 1 13 13 GLU H H 13 8.003 8.003 7.904 0.099 25148 10184 1 16 . 1 1 14 14 LYS N N 14 118.935 118.935 117.592 1.343 25148 10185 1 16 . 1 1 14 14 LYS HA H 14 4.124 4.124 4.115 0.009 25148 10186 1 16 . 1 1 14 14 LYS CA C 14 58.847 58.847 57.353 1.494 25148 10187 1 16 . 1 1 14 14 LYS CB C 14 33.053 33.053 32.697 0.356 25148 10188 1 16 . 1 1 14 14 LYS H H 14 7.862 7.862 7.308 0.554 25148 10189 1 16 . 1 1 15 15 GLU HA H 15 3.693 3.693 4.186 -0.493 25148 10190 1 16 . 1 1 15 15 GLU CA C 15 56.688 56.688 56.616 0.072 25148 10191 1 16 . 1 1 15 15 GLU CB C 15 32.204 32.204 30.335 1.869 25148 10192 1 16 . 1 1 16 16 LYS HA H 16 4.678 4.678 4.447 0.231 25148 10193 1 16 . 1 1 16 16 LYS CA C 16 55.135 55.135 56.031 -0.896 25148 10194 1 16 . 1 1 16 16 LYS CB C 16 34.049 34.049 33.990 0.059 25148 10195 1 16 . 1 1 17 17 GLY CA C 17 46.541 46.541 45.612 0.929 25148 10196 1 16 . 1 1 18 18 ILE N N 18 115.364 115.364 115.154 0.210 25148 10197 1 16 . 1 1 18 18 ILE HA H 18 4.079 4.079 4.599 -0.520 25148 10198 1 16 . 1 1 18 18 ILE C C 18 174.751 174.751 174.038 0.713 25148 10199 1 16 . 1 1 18 18 ILE CA C 18 60.333 60.333 58.545 1.788 25148 10200 1 16 . 1 1 18 18 ILE CB C 18 39.044 39.044 40.821 -1.777 25148 10201 1 16 . 1 1 18 18 ILE H H 18 8.203 8.203 7.406 0.797 25148 10202 1 16 . 1 1 19 19 SER N N 19 119.891 119.891 115.707 4.184 25148 10203 1 16 . 1 1 19 19 SER HA H 19 4.362 4.362 4.862 -0.500 25148 10204 1 16 . 1 1 19 19 SER CA C 19 58.476 58.476 56.885 1.591 25148 10205 1 16 . 1 1 19 19 SER CB C 19 63.533 63.533 64.683 -1.149 25148 10206 1 16 . 1 1 19 19 SER H H 19 8.253 8.253 8.328 -0.075 25148 10207 1 16 . 1 1 20 20 LYS N N 20 124.782 124.782 126.501 -1.719 25148 10208 1 16 . 1 1 20 20 LYS HA H 20 4.137 4.137 4.109 0.028 25148 10209 1 16 . 1 1 20 20 LYS C C 20 177.889 177.889 177.710 0.179 25148 10210 1 16 . 1 1 20 20 LYS CA C 20 59.485 59.485 58.635 0.850 25148 10211 1 16 . 1 1 20 20 LYS CB C 20 32.711 32.711 31.962 0.749 25148 10212 1 16 . 1 1 20 20 LYS H H 20 8.918 8.918 8.922 -0.004 25148 10213 1 16 . 1 1 21 21 GLU N N 21 117.831 117.831 119.246 -1.415 25148 10214 1 16 . 1 1 21 21 GLU HA H 21 3.957 3.957 4.038 -0.081 25148 10215 1 16 . 1 1 21 21 GLU C C 21 178.822 178.822 178.595 0.227 25148 10216 1 16 . 1 1 21 21 GLU CA C 21 59.529 59.529 58.740 0.789 25148 10217 1 16 . 1 1 21 21 GLU CB C 21 29.237 29.237 29.121 0.116 25148 10218 1 16 . 1 1 21 21 GLU H H 21 8.361 8.361 7.792 0.569 25148 10219 1 16 . 1 1 22 22 ILE N N 22 118.690 118.690 119.120 -0.430 25148 10220 1 16 . 1 1 22 22 ILE HA H 22 3.884 3.884 3.937 -0.053 25148 10221 1 16 . 1 1 22 22 ILE C C 22 179.247 179.247 178.136 1.111 25148 10222 1 16 . 1 1 22 22 ILE CA C 22 63.735 63.735 63.800 -0.065 25148 10223 1 16 . 1 1 22 22 ILE CB C 22 37.415 37.415 38.119 -0.704 25148 10224 1 16 . 1 1 22 22 ILE H H 22 7.353 7.353 7.444 -0.091 25148 10225 1 16 . 1 1 23 23 ILE N N 23 120.880 120.880 121.655 -0.775 25148 10226 1 16 . 1 1 23 23 ILE HA H 23 3.733 3.733 3.717 0.016 25148 10227 1 16 . 1 1 23 23 ILE C C 23 177.817 177.817 177.637 0.180 25148 10228 1 16 . 1 1 23 23 ILE CA C 23 64.172 64.172 63.575 0.597 25148 10229 1 16 . 1 1 23 23 ILE CB C 23 36.473 36.473 36.702 -0.229 25148 10230 1 16 . 1 1 23 23 ILE H H 23 7.571 7.571 7.562 0.009 25148 10231 1 16 . 1 1 24 24 ILE N N 24 121.460 121.460 119.870 1.590 25148 10232 1 16 . 1 1 24 24 ILE HA H 24 3.486 3.486 3.576 -0.090 25148 10233 1 16 . 1 1 24 24 ILE C C 24 177.759 177.759 177.855 -0.096 25148 10234 1 16 . 1 1 24 24 ILE CA C 24 66.641 66.641 66.088 0.553 25148 10235 1 16 . 1 1 24 24 ILE CB C 24 37.307 37.307 37.394 -0.087 25148 10236 1 16 . 1 1 24 24 ILE H H 24 8.709 8.709 7.762 0.947 25148 10237 1 16 . 1 1 25 25 GLU N N 25 119.323 119.323 117.789 1.534 25148 10238 1 16 . 1 1 25 25 GLU HA H 25 4.177 4.177 4.031 0.146 25148 10239 1 16 . 1 1 25 25 GLU C C 25 179.348 179.348 178.765 0.583 25148 10240 1 16 . 1 1 25 25 GLU CA C 25 59.951 59.951 59.231 0.720 25148 10241 1 16 . 1 1 25 25 GLU CB C 25 29.340 29.340 28.899 0.441 25148 10242 1 16 . 1 1 25 25 GLU H H 25 8.048 8.048 8.191 -0.143 25148 10243 1 16 . 1 1 26 26 ALA N N 26 122.390 122.390 122.483 -0.093 25148 10244 1 16 . 1 1 26 26 ALA HA H 26 4.325 4.325 4.147 0.178 25148 10245 1 16 . 1 1 26 26 ALA C C 26 181.440 181.440 179.770 1.670 25148 10246 1 16 . 1 1 26 26 ALA CA C 26 54.935 54.935 54.757 0.178 25148 10247 1 16 . 1 1 26 26 ALA CB C 26 17.834 17.834 18.351 -0.517 25148 10248 1 16 . 1 1 26 26 ALA H H 26 7.768 7.768 7.795 -0.027 25148 10249 1 16 . 1 1 27 27 ILE N N 27 122.342 122.342 120.143 2.199 25148 10250 1 16 . 1 1 27 27 ILE HA H 27 3.575 3.575 3.614 -0.039 25148 10251 1 16 . 1 1 27 27 ILE C C 27 177.541 177.541 177.738 -0.197 25148 10252 1 16 . 1 1 27 27 ILE CA C 27 66.536 66.536 65.856 0.680 25148 10253 1 16 . 1 1 27 27 ILE CB C 27 37.886 37.886 37.947 -0.061 25148 10254 1 16 . 1 1 27 27 ILE H H 27 8.805 8.805 7.844 0.961 25148 10255 1 16 . 1 1 28 28 GLU N N 28 120.188 120.188 119.374 0.814 25148 10256 1 16 . 1 1 28 28 GLU HA H 28 3.687 3.687 3.968 -0.281 25148 10257 1 16 . 1 1 28 28 GLU C C 28 178.707 178.707 178.890 -0.183 25148 10258 1 16 . 1 1 28 28 GLU CA C 28 61.458 61.458 59.568 1.890 25148 10259 1 16 . 1 1 28 28 GLU CB C 28 29.624 29.624 28.873 0.751 25148 10260 1 16 . 1 1 28 28 GLU H H 28 8.882 8.882 7.828 1.054 25148 10261 1 16 . 1 1 29 29 ALA N N 29 119.293 119.293 121.651 -2.358 25148 10262 1 16 . 1 1 29 29 ALA HA H 29 4.214 4.214 4.103 0.111 25148 10263 1 16 . 1 1 29 29 ALA C C 29 181.200 181.200 179.708 1.492 25148 10264 1 16 . 1 1 29 29 ALA CA C 29 55.435 55.435 54.698 0.737 25148 10265 1 16 . 1 1 29 29 ALA CB C 29 18.090 18.090 17.971 0.119 25148 10266 1 16 . 1 1 29 29 ALA H H 29 8.065 8.065 7.827 0.238 25148 10267 1 16 . 1 1 30 30 ALA N N 30 121.729 121.729 121.972 -0.243 25148 10268 1 16 . 1 1 30 30 ALA HA H 30 4.307 4.307 4.146 0.161 25148 10269 1 16 . 1 1 30 30 ALA C C 30 181.315 181.315 179.523 1.792 25148 10270 1 16 . 1 1 30 30 ALA CA C 30 54.594 54.594 54.662 -0.068 25148 10271 1 16 . 1 1 30 30 ALA CB C 30 18.704 18.704 18.377 0.328 25148 10272 1 16 . 1 1 30 30 ALA H H 30 8.099 8.099 7.670 0.429 25148 10273 1 16 . 1 1 31 31 LEU N N 31 120.900 120.900 120.946 -0.046 25148 10274 1 16 . 1 1 31 31 LEU HA H 31 4.347 4.347 4.045 0.302 25148 10275 1 16 . 1 1 31 31 LEU C C 31 179.137 179.137 179.220 -0.083 25148 10276 1 16 . 1 1 31 31 LEU CA C 31 57.569 57.569 59.255 -1.686 25148 10277 1 16 . 1 1 31 31 LEU CB C 31 42.353 42.353 41.947 0.406 25148 10278 1 16 . 1 1 31 31 LEU H H 31 8.863 8.863 7.846 1.017 25148 10279 1 16 . 1 1 32 32 ILE N N 32 122.410 122.410 118.266 4.144 25148 10280 1 16 . 1 1 32 32 ILE HA H 32 3.699 3.699 3.676 0.023 25148 10281 1 16 . 1 1 32 32 ILE C C 32 178.303 178.303 177.626 0.677 25148 10282 1 16 . 1 1 32 32 ILE CA C 32 66.066 66.066 65.260 0.806 25148 10283 1 16 . 1 1 32 32 ILE CB C 32 37.882 37.882 37.915 -0.033 25148 10284 1 16 . 1 1 32 32 ILE H H 32 8.234 8.234 8.297 -0.063 25148 10285 1 16 . 1 1 33 33 SER N N 33 114.201 114.201 115.454 -1.253 25148 10286 1 16 . 1 1 33 33 SER HA H 33 4.311 4.311 4.198 0.113 25148 10287 1 16 . 1 1 33 33 SER C C 33 177.012 177.012 176.660 0.352 25148 10288 1 16 . 1 1 33 33 SER CA C 33 61.860 61.860 61.633 0.228 25148 10289 1 16 . 1 1 33 33 SER CB C 33 62.508 62.508 63.150 -0.642 25148 10290 1 16 . 1 1 33 33 SER H H 33 7.558 7.558 7.699 -0.141 25148 10291 1 16 . 1 1 34 34 ALA N N 34 122.893 122.893 124.261 -1.368 25148 10292 1 16 . 1 1 34 34 ALA HA H 34 4.215 4.215 4.160 0.055 25148 10293 1 16 . 1 1 34 34 ALA C C 34 180.814 180.814 179.759 1.055 25148 10294 1 16 . 1 1 34 34 ALA CA C 34 55.283 55.283 54.768 0.515 25148 10295 1 16 . 1 1 34 34 ALA CB C 34 18.273 18.273 18.372 -0.099 25148 10296 1 16 . 1 1 34 34 ALA H H 34 8.409 8.409 8.230 0.179 25148 10297 1 16 . 1 1 35 35 TYR N N 35 120.259 120.259 119.833 0.426 25148 10298 1 16 . 1 1 35 35 TYR HA H 35 4.393 4.393 4.419 -0.026 25148 10299 1 16 . 1 1 35 35 TYR C C 35 177.892 177.892 177.647 0.245 25148 10300 1 16 . 1 1 35 35 TYR CA C 35 63.071 63.071 60.399 2.672 25148 10301 1 16 . 1 1 35 35 TYR CB C 35 38.021 38.021 39.001 -0.980 25148 10302 1 16 . 1 1 35 35 TYR H H 35 8.975 8.975 8.374 0.601 25148 10303 1 16 . 1 1 36 36 LYS N N 36 120.942 120.942 121.184 -0.242 25148 10304 1 16 . 1 1 36 36 LYS HA H 36 4.032 4.032 4.069 -0.037 25148 10305 1 16 . 1 1 36 36 LYS C C 36 177.797 177.797 178.949 -1.152 25148 10306 1 16 . 1 1 36 36 LYS CA C 36 59.900 59.900 59.313 0.587 25148 10307 1 16 . 1 1 36 36 LYS CB C 36 32.429 32.429 32.168 0.261 25148 10308 1 16 . 1 1 36 36 LYS H H 36 8.654 8.654 8.178 0.476 25148 10309 1 16 . 1 1 37 37 ARG N N 37 115.139 115.139 117.482 -2.343 25148 10310 1 16 . 1 1 37 37 ARG HA H 37 4.101 4.101 4.036 0.065 25148 10311 1 16 . 1 1 37 37 ARG C C 37 177.517 177.517 178.113 -0.596 25148 10312 1 16 . 1 1 37 37 ARG CA C 37 58.276 58.276 58.684 -0.409 25148 10313 1 16 . 1 1 37 37 ARG CB C 37 31.014 31.014 29.839 1.175 25148 10314 1 16 . 1 1 37 37 ARG H H 37 8.138 8.138 7.705 0.433 25148 10315 1 16 . 1 1 38 38 ASN N N 38 112.555 112.555 116.400 -3.845 25148 10316 1 16 . 1 1 38 38 ASN HA H 38 4.540 4.540 4.233 0.307 25148 10317 1 16 . 1 1 38 38 ASN C C 38 173.994 173.994 174.929 -0.935 25148 10318 1 16 . 1 1 38 38 ASN CA C 38 54.722 54.722 55.050 -0.328 25148 10319 1 16 . 1 1 38 38 ASN CB C 38 42.077 42.077 38.942 3.135 25148 10320 1 16 . 1 1 38 38 ASN H H 38 7.426 7.426 7.545 -0.119 25148 10321 1 16 . 1 1 39 39 PHE N N 39 116.711 116.711 116.772 -0.061 25148 10322 1 16 . 1 1 39 39 PHE HA H 39 4.569 4.569 4.723 -0.154 25148 10323 1 16 . 1 1 39 39 PHE CA C 39 58.913 58.913 56.584 2.329 25148 10324 1 16 . 1 1 39 39 PHE CB C 39 39.781 39.781 38.765 1.016 25148 10325 1 16 . 1 1 39 39 PHE H H 39 7.959 7.959 7.624 0.335 25148 10326 1 16 . 1 1 40 40 ASN HA H 40 4.018 4.018 4.503 -0.485 25148 10327 1 16 . 1 1 40 40 ASN CA C 40 58.944 58.944 55.729 3.215 25148 10328 1 16 . 1 1 41 41 GLN HA H 41 4.298 4.298 4.415 -0.117 25148 10329 1 16 . 1 1 41 41 GLN C C 41 175.237 175.237 175.739 -0.502 25148 10330 1 16 . 1 1 41 41 GLN CA C 41 57.360 57.360 56.858 0.502 25148 10331 1 16 . 1 1 41 41 GLN CB C 41 28.724 28.724 27.739 0.985 25148 10332 1 16 . 1 1 42 42 ALA N N 42 120.514 120.514 122.003 -1.489 25148 10333 1 16 . 1 1 42 42 ALA HA H 42 4.622 4.622 4.411 0.211 25148 10334 1 16 . 1 1 42 42 ALA C C 42 175.922 175.922 176.471 -0.549 25148 10335 1 16 . 1 1 42 42 ALA CA C 42 51.841 51.841 52.142 -0.301 25148 10336 1 16 . 1 1 42 42 ALA CB C 42 21.576 21.576 20.220 1.356 25148 10337 1 16 . 1 1 42 42 ALA H H 42 7.817 7.817 8.102 -0.285 25148 10338 1 16 . 1 1 43 43 GLN N N 43 117.594 117.594 114.974 2.620 25148 10339 1 16 . 1 1 43 43 GLN HA H 43 4.265 4.265 4.526 -0.261 25148 10340 1 16 . 1 1 43 43 GLN C C 43 174.942 174.942 173.564 1.378 25148 10341 1 16 . 1 1 43 43 GLN CA C 43 57.047 57.047 55.306 1.741 25148 10342 1 16 . 1 1 43 43 GLN CB C 43 30.863 30.863 31.602 -0.739 25148 10343 1 16 . 1 1 43 43 GLN H H 43 7.400 7.400 7.517 -0.117 25148 10344 1 16 . 1 1 44 44 ASN N N 44 120.467 120.467 119.842 0.625 25148 10345 1 16 . 1 1 44 44 ASN HA H 44 5.005 5.005 4.728 0.277 25148 10346 1 16 . 1 1 44 44 ASN C C 44 174.365 174.365 174.210 0.155 25148 10347 1 16 . 1 1 44 44 ASN CA C 44 52.381 52.381 52.730 -0.349 25148 10348 1 16 . 1 1 44 44 ASN CB C 44 38.177 38.177 39.164 -0.987 25148 10349 1 16 . 1 1 44 44 ASN H H 44 9.123 9.123 8.570 0.553 25148 10350 1 16 . 1 1 45 45 VAL N N 45 115.479 115.479 116.044 -0.565 25148 10351 1 16 . 1 1 45 45 VAL HA H 45 5.376 5.376 4.260 1.116 25148 10352 1 16 . 1 1 45 45 VAL C C 45 174.908 174.908 173.667 1.241 25148 10353 1 16 . 1 1 45 45 VAL CA C 45 59.022 59.022 62.418 -3.396 25148 10354 1 16 . 1 1 45 45 VAL CB C 45 35.776 35.776 34.985 0.791 25148 10355 1 16 . 1 1 45 45 VAL H H 45 7.732 7.732 8.111 -0.379 25148 10356 1 16 . 1 1 46 46 ARG N N 46 121.146 121.146 125.869 -4.723 25148 10357 1 16 . 1 1 46 46 ARG HA H 46 4.566 4.566 4.862 -0.296 25148 10358 1 16 . 1 1 46 46 ARG C C 46 173.790 173.790 174.322 -0.532 25148 10359 1 16 . 1 1 46 46 ARG CA C 46 54.762 54.762 53.928 0.834 25148 10360 1 16 . 1 1 46 46 ARG CB C 46 33.946 33.946 32.113 1.833 25148 10361 1 16 . 1 1 46 46 ARG H H 46 8.850 8.850 9.128 -0.278 25148 10362 1 16 . 1 1 47 47 VAL N N 47 122.339 122.339 125.060 -2.721 25148 10363 1 16 . 1 1 47 47 VAL HA H 47 4.741 4.741 4.554 0.187 25148 10364 1 16 . 1 1 47 47 VAL C C 47 173.541 173.541 175.969 -2.428 25148 10365 1 16 . 1 1 47 47 VAL CA C 47 60.893 60.893 61.455 -0.562 25148 10366 1 16 . 1 1 47 47 VAL CB C 47 33.563 33.563 33.049 0.514 25148 10367 1 16 . 1 1 47 47 VAL H H 47 8.444 8.444 8.546 -0.102 25148 10368 1 16 . 1 1 48 48 ASP N N 48 127.701 127.701 126.290 1.411 25148 10369 1 16 . 1 1 48 48 ASP HA H 48 4.946 4.946 4.921 0.025 25148 10370 1 16 . 1 1 48 48 ASP C C 48 173.744 173.744 174.617 -0.873 25148 10371 1 16 . 1 1 48 48 ASP CA C 48 52.651 52.651 52.998 -0.347 25148 10372 1 16 . 1 1 48 48 ASP CB C 48 45.225 45.225 43.924 1.301 25148 10373 1 16 . 1 1 48 48 ASP H H 48 9.068 9.068 8.553 0.515 25148 10374 1 16 . 1 1 49 49 LEU N N 49 130.945 130.945 127.053 3.892 25148 10375 1 16 . 1 1 49 49 LEU HA H 49 4.774 4.774 4.590 0.184 25148 10376 1 16 . 1 1 49 49 LEU C C 49 174.531 174.531 175.708 -1.177 25148 10377 1 16 . 1 1 49 49 LEU CA C 49 54.337 54.337 54.483 -0.146 25148 10378 1 16 . 1 1 49 49 LEU CB C 49 43.192 43.192 43.704 -0.512 25148 10379 1 16 . 1 1 49 49 LEU H H 49 9.369 9.369 7.981 1.388 25148 10380 1 16 . 1 1 50 50 ASN N N 50 126.268 126.268 122.998 3.270 25148 10381 1 16 . 1 1 50 50 ASN HA H 50 4.629 4.629 5.029 -0.400 25148 10382 1 16 . 1 1 50 50 ASN C C 50 176.602 176.602 175.232 1.370 25148 10383 1 16 . 1 1 50 50 ASN CA C 50 54.048 54.048 52.743 1.305 25148 10384 1 16 . 1 1 50 50 ASN CB C 50 39.891 39.891 39.963 -0.072 25148 10385 1 16 . 1 1 50 50 ASN H H 50 8.672 8.672 8.457 0.215 25148 10386 1 16 . 1 1 51 51 ARG N N 51 125.897 125.897 124.065 1.832 25148 10387 1 16 . 1 1 51 51 ARG HA H 51 3.789 3.789 4.212 -0.423 25148 10388 1 16 . 1 1 51 51 ARG C C 51 175.681 175.681 176.239 -0.558 25148 10389 1 16 . 1 1 51 51 ARG CA C 51 58.162 58.162 58.523 -0.361 25148 10390 1 16 . 1 1 51 51 ARG CB C 51 29.944 29.944 29.854 0.090 25148 10391 1 16 . 1 1 51 51 ARG H H 51 8.984 8.984 8.803 0.181 25148 10392 1 16 . 1 1 52 52 GLU N N 52 116.733 116.733 117.544 -0.811 25148 10393 1 16 . 1 1 52 52 GLU HA H 52 4.368 4.368 4.128 0.240 25148 10394 1 16 . 1 1 52 52 GLU C C 52 178.049 178.049 177.275 0.774 25148 10395 1 16 . 1 1 52 52 GLU CA C 52 58.048 58.048 58.337 -0.289 25148 10396 1 16 . 1 1 52 52 GLU CB C 52 30.716 30.716 29.183 1.533 25148 10397 1 16 . 1 1 52 52 GLU H H 52 8.541 8.541 8.278 0.263 25148 10398 1 16 . 1 1 53 53 THR N N 53 106.556 106.556 111.996 -5.440 25148 10399 1 16 . 1 1 53 53 THR HA H 53 4.424 4.424 4.537 -0.113 25148 10400 1 16 . 1 1 53 53 THR C C 53 176.352 176.352 174.812 1.540 25148 10401 1 16 . 1 1 53 53 THR CA C 53 61.320 61.320 60.827 0.493 25148 10402 1 16 . 1 1 53 53 THR CB C 53 71.220 71.220 69.890 1.330 25148 10403 1 16 . 1 1 53 53 THR H H 53 8.085 8.085 7.596 0.489 25148 10404 1 16 . 1 1 54 54 GLY N N 54 111.843 111.843 110.165 1.678 25148 10405 1 16 . 1 1 54 54 GLY C C 54 172.690 172.690 174.438 -1.748 25148 10406 1 16 . 1 1 54 54 GLY CA C 54 45.417 45.417 46.267 -0.850 25148 10407 1 16 . 1 1 54 54 GLY H H 54 8.330 8.330 7.627 0.703 25148 10408 1 16 . 1 1 55 55 SER N N 55 113.844 113.844 114.004 -0.160 25148 10409 1 16 . 1 1 55 55 SER HA H 55 4.279 4.279 4.639 -0.360 25148 10410 1 16 . 1 1 55 55 SER C C 55 174.127 174.127 173.135 0.992 25148 10411 1 16 . 1 1 55 55 SER CA C 55 59.229 59.229 57.905 1.324 25148 10412 1 16 . 1 1 55 55 SER CB C 55 63.939 63.939 65.364 -1.425 25148 10413 1 16 . 1 1 55 55 SER H H 55 7.653 7.653 7.604 0.049 25148 10414 1 16 . 1 1 56 56 ILE N N 56 125.286 125.286 119.842 5.444 25148 10415 1 16 . 1 1 56 56 ILE HA H 56 5.082 5.082 4.592 0.490 25148 10416 1 16 . 1 1 56 56 ILE C C 56 175.346 175.346 174.224 1.122 25148 10417 1 16 . 1 1 56 56 ILE CA C 56 59.967 59.967 60.534 -0.567 25148 10418 1 16 . 1 1 56 56 ILE CB C 56 40.165 40.165 42.203 -2.038 25148 10419 1 16 . 1 1 56 56 ILE H H 56 8.478 8.478 8.458 0.020 25148 10420 1 16 . 1 1 57 57 ARG N N 57 126.332 126.332 127.332 -1.000 25148 10421 1 16 . 1 1 57 57 ARG HA H 57 4.740 4.740 4.605 0.135 25148 10422 1 16 . 1 1 57 57 ARG C C 57 173.921 173.921 173.646 0.275 25148 10423 1 16 . 1 1 57 57 ARG CA C 57 54.311 54.311 53.833 0.478 25148 10424 1 16 . 1 1 57 57 ARG CB C 57 35.805 35.805 33.256 2.549 25148 10425 1 16 . 1 1 57 57 ARG H H 57 8.590 8.590 8.271 0.319 25148 10426 1 16 . 1 1 58 58 VAL N N 58 120.987 120.987 123.089 -2.102 25148 10427 1 16 . 1 1 58 58 VAL HA H 58 4.334 4.334 4.017 0.317 25148 10428 1 16 . 1 1 58 58 VAL C C 58 174.204 174.204 174.012 0.192 25148 10429 1 16 . 1 1 58 58 VAL CA C 58 60.861 60.861 61.659 -0.798 25148 10430 1 16 . 1 1 58 58 VAL CB C 58 33.383 33.383 32.178 1.205 25148 10431 1 16 . 1 1 58 58 VAL H H 58 8.585 8.585 8.223 0.362 25148 10432 1 16 . 1 1 59 59 PHE N N 59 124.913 124.913 126.438 -1.525 25148 10433 1 16 . 1 1 59 59 PHE HA H 59 5.046 5.046 5.409 -0.363 25148 10434 1 16 . 1 1 59 59 PHE C C 59 174.446 174.446 174.413 0.033 25148 10435 1 16 . 1 1 59 59 PHE CA C 59 56.695 56.695 55.206 1.489 25148 10436 1 16 . 1 1 59 59 PHE CB C 59 42.779 42.779 43.349 -0.570 25148 10437 1 16 . 1 1 59 59 PHE H H 59 8.920 8.920 8.551 0.369 25148 10438 1 16 . 1 1 60 60 ALA N N 60 124.035 124.035 123.336 0.699 25148 10439 1 16 . 1 1 60 60 ALA HA H 60 5.102 5.102 4.804 0.298 25148 10440 1 16 . 1 1 60 60 ALA C C 60 176.017 176.017 176.846 -0.829 25148 10441 1 16 . 1 1 60 60 ALA CA C 60 50.083 50.083 50.700 -0.617 25148 10442 1 16 . 1 1 60 60 ALA CB C 60 22.400 22.400 20.288 2.112 25148 10443 1 16 . 1 1 60 60 ALA H H 60 9.457 9.457 8.714 0.743 25148 10444 1 16 . 1 1 61 61 ARG N N 61 121.530 121.530 125.212 -3.682 25148 10445 1 16 . 1 1 61 61 ARG HA H 61 4.958 4.958 4.749 0.209 25148 10446 1 16 . 1 1 61 61 ARG C C 61 176.737 176.737 175.767 0.970 25148 10447 1 16 . 1 1 61 61 ARG CA C 61 55.375 55.375 55.977 -0.602 25148 10448 1 16 . 1 1 61 61 ARG CB C 61 31.230 31.230 30.650 0.580 25148 10449 1 16 . 1 1 61 61 ARG H H 61 8.447 8.447 8.739 -0.292 25148 10450 1 16 . 1 1 62 62 LYS N N 62 124.784 124.784 125.281 -0.497 25148 10451 1 16 . 1 1 62 62 LYS HA H 62 4.709 4.709 4.463 0.246 25148 10452 1 16 . 1 1 62 62 LYS C C 62 173.899 173.899 175.007 -1.108 25148 10453 1 16 . 1 1 62 62 LYS CA C 62 54.812 54.812 55.089 -0.277 25148 10454 1 16 . 1 1 62 62 LYS CB C 62 37.147 37.147 35.472 1.675 25148 10455 1 16 . 1 1 62 62 LYS H H 62 9.137 9.137 8.141 0.996 25148 10456 1 16 . 1 1 63 63 ASP N N 63 122.552 122.552 124.970 -2.418 25148 10457 1 16 . 1 1 63 63 ASP HA H 63 4.877 4.877 4.631 0.246 25148 10458 1 16 . 1 1 63 63 ASP C C 63 175.560 175.560 176.339 -0.779 25148 10459 1 16 . 1 1 63 63 ASP CA C 63 54.576 54.576 54.838 -0.262 25148 10460 1 16 . 1 1 63 63 ASP CB C 63 42.841 42.841 41.333 1.508 25148 10461 1 16 . 1 1 63 63 ASP H H 63 8.334 8.334 8.816 -0.482 25148 10462 1 16 . 1 1 64 64 VAL N N 64 123.109 123.109 127.142 -4.033 25148 10463 1 16 . 1 1 64 64 VAL HA H 64 4.557 4.557 4.569 -0.012 25148 10464 1 16 . 1 1 64 64 VAL C C 64 177.260 177.260 175.278 1.982 25148 10465 1 16 . 1 1 64 64 VAL CA C 64 62.268 62.268 63.028 -0.760 25148 10466 1 16 . 1 1 64 64 VAL CB C 64 30.348 30.348 31.374 -1.026 25148 10467 1 16 . 1 1 64 64 VAL H H 64 8.693 8.693 8.059 0.634 25148 10468 1 16 . 1 1 65 65 VAL N N 65 122.320 122.320 123.739 -1.419 25148 10469 1 16 . 1 1 65 65 VAL HA H 65 4.939 4.939 4.549 0.390 25148 10470 1 16 . 1 1 65 65 VAL C C 65 174.754 174.754 174.783 -0.029 25148 10471 1 16 . 1 1 65 65 VAL CA C 65 59.173 59.173 59.819 -0.646 25148 10472 1 16 . 1 1 65 65 VAL CB C 65 36.289 36.289 35.021 1.268 25148 10473 1 16 . 1 1 65 65 VAL H H 65 8.656 8.656 8.644 0.012 25148 10474 1 16 . 1 1 66 66 ASP N N 66 119.805 119.805 121.789 -1.984 25148 10475 1 16 . 1 1 66 66 ASP HA H 66 4.499 4.499 4.383 0.116 25148 10476 1 16 . 1 1 66 66 ASP C C 66 176.565 176.565 176.401 0.164 25148 10477 1 16 . 1 1 66 66 ASP CA C 66 57.236 57.236 56.934 0.302 25148 10478 1 16 . 1 1 66 66 ASP CB C 66 41.662 41.662 41.173 0.489 25148 10479 1 16 . 1 1 66 66 ASP H H 66 8.628 8.628 8.812 -0.184 25148 10480 1 16 . 1 1 67 67 GLU N N 67 117.604 117.604 116.174 1.430 25148 10481 1 16 . 1 1 67 67 GLU HA H 67 4.350 4.350 4.457 -0.107 25148 10482 1 16 . 1 1 67 67 GLU C C 67 173.736 173.736 175.275 -1.539 25148 10483 1 16 . 1 1 67 67 GLU CA C 67 55.203 55.203 54.678 0.524 25148 10484 1 16 . 1 1 67 67 GLU CB C 67 32.240 32.240 32.795 -0.555 25148 10485 1 16 . 1 1 67 67 GLU H H 67 7.525 7.525 7.903 -0.378 25148 10486 1 16 . 1 1 68 68 VAL N N 68 125.774 125.774 122.963 2.811 25148 10487 1 16 . 1 1 68 68 VAL HA H 68 3.578 3.578 3.847 -0.269 25148 10488 1 16 . 1 1 68 68 VAL C C 68 175.885 175.885 175.532 0.353 25148 10489 1 16 . 1 1 68 68 VAL CA C 68 63.397 63.397 64.232 -0.835 25148 10490 1 16 . 1 1 68 68 VAL CB C 68 32.452 32.452 31.651 0.801 25148 10491 1 16 . 1 1 68 68 VAL H H 68 8.573 8.573 8.413 0.160 25148 10492 1 16 . 1 1 69 69 TYR N N 69 129.859 129.859 126.901 2.958 25148 10493 1 16 . 1 1 69 69 TYR HA H 69 4.642 4.642 4.567 0.075 25148 10494 1 16 . 1 1 69 69 TYR C C 69 176.100 176.100 175.526 0.574 25148 10495 1 16 . 1 1 69 69 TYR CA C 69 59.092 59.092 59.469 -0.377 25148 10496 1 16 . 1 1 69 69 TYR CB C 69 39.830 39.830 40.143 -0.313 25148 10497 1 16 . 1 1 69 69 TYR H H 69 9.801 9.801 8.569 1.232 25148 10498 1 16 . 1 1 70 70 ASP N N 70 120.204 120.204 120.157 0.047 25148 10499 1 16 . 1 1 70 70 ASP HA H 70 4.772 4.772 4.879 -0.107 25148 10500 1 16 . 1 1 70 70 ASP C C 70 176.622 176.622 175.832 0.790 25148 10501 1 16 . 1 1 70 70 ASP CA C 70 52.885 52.885 53.322 -0.437 25148 10502 1 16 . 1 1 70 70 ASP CB C 70 41.878 41.878 41.749 0.129 25148 10503 1 16 . 1 1 70 70 ASP H H 70 8.348 8.348 8.067 0.281 25148 10504 1 16 . 1 1 71 71 GLN N N 71 125.440 125.440 125.453 -0.013 25148 10505 1 16 . 1 1 71 71 GLN HA H 71 4.315 4.315 4.148 0.167 25148 10506 1 16 . 1 1 71 71 GLN C C 71 175.819 175.819 176.702 -0.883 25148 10507 1 16 . 1 1 71 71 GLN CA C 71 57.914 57.914 57.811 0.103 25148 10508 1 16 . 1 1 71 71 GLN CB C 71 28.307 28.307 28.974 -0.666 25148 10509 1 16 . 1 1 71 71 GLN H H 71 9.097 9.097 8.763 0.334 25148 10510 1 16 . 1 1 72 72 ARG N N 72 116.306 116.306 116.134 0.172 25148 10511 1 16 . 1 1 72 72 ARG HA H 72 4.252 4.252 4.158 0.094 25148 10512 1 16 . 1 1 72 72 ARG C C 72 178.087 178.087 175.253 2.834 25148 10513 1 16 . 1 1 72 72 ARG CA C 72 58.532 58.532 57.515 1.017 25148 10514 1 16 . 1 1 72 72 ARG CB C 72 30.143 30.143 30.843 -0.700 25148 10515 1 16 . 1 1 72 72 ARG H H 72 8.534 8.534 8.138 0.396 25148 10516 1 16 . 1 1 73 73 LEU N N 73 116.734 116.734 113.270 3.464 25148 10517 1 16 . 1 1 73 73 LEU HA H 73 4.621 4.621 4.651 -0.030 25148 10518 1 16 . 1 1 73 73 LEU C C 73 175.946 175.946 174.897 1.049 25148 10519 1 16 . 1 1 73 73 LEU CA C 73 55.250 55.250 55.445 -0.195 25148 10520 1 16 . 1 1 73 73 LEU CB C 73 46.960 46.960 44.127 2.833 25148 10521 1 16 . 1 1 73 73 LEU H H 73 7.460 7.460 7.200 0.260 25148 10522 1 16 . 1 1 74 74 GLU N N 74 118.787 118.787 122.088 -3.301 25148 10523 1 16 . 1 1 74 74 GLU HA H 74 5.403 5.403 4.721 0.682 25148 10524 1 16 . 1 1 74 74 GLU C C 74 173.709 173.709 174.541 -0.832 25148 10525 1 16 . 1 1 74 74 GLU CA C 74 54.914 54.914 55.730 -0.816 25148 10526 1 16 . 1 1 74 74 GLU CB C 74 35.053 35.053 33.328 1.725 25148 10527 1 16 . 1 1 74 74 GLU H H 74 7.752 7.752 8.016 -0.264 25148 10528 1 16 . 1 1 75 75 ILE N N 75 119.803 119.803 121.900 -2.097 25148 10529 1 16 . 1 1 75 75 ILE HA H 75 4.507 4.507 4.386 0.121 25148 10530 1 16 . 1 1 75 75 ILE C C 75 172.126 172.126 174.073 -1.947 25148 10531 1 16 . 1 1 75 75 ILE CA C 75 58.664 58.664 60.541 -1.877 25148 10532 1 16 . 1 1 75 75 ILE CB C 75 42.560 42.560 41.826 0.734 25148 10533 1 16 . 1 1 75 75 ILE H H 75 8.975 8.975 8.600 0.375 25148 10534 1 16 . 1 1 76 76 SER N N 76 123.236 123.236 124.330 -1.094 25148 10535 1 16 . 1 1 76 76 SER HA H 76 4.505 4.505 4.853 -0.348 25148 10536 1 16 . 1 1 76 76 SER C C 76 176.145 176.145 176.112 0.033 25148 10537 1 16 . 1 1 76 76 SER CA C 76 58.108 58.108 58.632 -0.524 25148 10538 1 16 . 1 1 76 76 SER CB C 76 65.000 65.000 63.580 1.420 25148 10539 1 16 . 1 1 76 76 SER H H 76 8.810 8.810 8.692 0.118 25148 10540 1 16 . 1 1 77 77 ILE N N 77 120.629 120.629 126.802 -6.173 25148 10541 1 16 . 1 1 77 77 ILE HA H 77 3.935 3.935 3.763 0.172 25148 10542 1 16 . 1 1 77 77 ILE C C 77 175.806 175.806 176.827 -1.021 25148 10543 1 16 . 1 1 77 77 ILE CA C 77 61.928 61.928 63.729 -1.801 25148 10544 1 16 . 1 1 77 77 ILE CB C 77 38.031 38.031 38.270 -0.239 25148 10545 1 16 . 1 1 77 77 ILE H H 77 8.321 8.321 8.093 0.228 25148 10546 1 16 . 1 1 78 78 GLU N N 78 121.032 121.032 117.210 3.822 25148 10547 1 16 . 1 1 78 78 GLU HA H 78 4.082 4.082 3.994 0.088 25148 10548 1 16 . 1 1 78 78 GLU C C 78 179.829 179.829 178.306 1.523 25148 10549 1 16 . 1 1 78 78 GLU CA C 78 60.180 60.180 59.250 0.930 25148 10550 1 16 . 1 1 78 78 GLU CB C 78 28.988 28.988 28.711 0.277 25148 10551 1 16 . 1 1 78 78 GLU H H 78 8.222 8.222 8.480 -0.258 25148 10552 1 16 . 1 1 79 79 GLU N N 79 120.710 120.710 121.238 -0.528 25148 10553 1 16 . 1 1 79 79 GLU HA H 79 4.012 4.012 4.109 -0.097 25148 10554 1 16 . 1 1 79 79 GLU C C 79 180.339 180.339 178.968 1.371 25148 10555 1 16 . 1 1 79 79 GLU CA C 79 59.332 59.332 58.651 0.681 25148 10556 1 16 . 1 1 79 79 GLU CB C 79 29.317 29.317 29.223 0.094 25148 10557 1 16 . 1 1 79 79 GLU H H 79 7.908 7.908 7.659 0.249 25148 10558 1 16 . 1 1 80 80 ALA N N 80 122.879 122.879 122.017 0.862 25148 10559 1 16 . 1 1 80 80 ALA HA H 80 3.966 3.966 4.116 -0.150 25148 10560 1 16 . 1 1 80 80 ALA C C 80 179.833 179.833 179.968 -0.135 25148 10561 1 16 . 1 1 80 80 ALA CA C 80 55.881 55.881 55.001 0.880 25148 10562 1 16 . 1 1 80 80 ALA CB C 80 18.870 18.870 18.052 0.818 25148 10563 1 16 . 1 1 80 80 ALA H H 80 9.132 9.132 7.993 1.139 25148 10564 1 16 . 1 1 81 81 GLN N N 81 115.829 115.829 116.623 -0.794 25148 10565 1 16 . 1 1 81 81 GLN HA H 81 4.749 4.749 4.338 0.411 25148 10566 1 16 . 1 1 81 81 GLN C C 81 178.126 178.126 178.028 0.098 25148 10567 1 16 . 1 1 81 81 GLN CA C 81 57.682 57.682 58.011 -0.329 25148 10568 1 16 . 1 1 81 81 GLN CB C 81 27.307 27.307 28.656 -1.349 25148 10569 1 16 . 1 1 81 81 GLN H H 81 8.709 8.709 7.777 0.932 25148 10570 1 16 . 1 1 82 82 GLY N N 82 105.531 105.531 106.750 -1.219 25148 10571 1 16 . 1 1 82 82 GLY C C 82 174.917 174.917 175.014 -0.097 25148 10572 1 16 . 1 1 82 82 GLY CA C 82 45.915 45.915 46.545 -0.630 25148 10573 1 16 . 1 1 82 82 GLY H H 82 7.479 7.479 8.026 -0.547 25148 10574 1 16 . 1 1 83 83 ILE N N 83 122.828 122.828 113.767 9.061 25148 10575 1 16 . 1 1 83 83 ILE HA H 83 3.970 3.970 4.447 -0.477 25148 10576 1 16 . 1 1 83 83 ILE C C 83 177.209 177.209 175.571 1.638 25148 10577 1 16 . 1 1 83 83 ILE CA C 83 64.305 64.305 61.667 2.638 25148 10578 1 16 . 1 1 83 83 ILE CB C 83 38.452 38.452 40.210 -1.758 25148 10579 1 16 . 1 1 83 83 ILE H H 83 7.634 7.634 7.537 0.097 25148 10580 1 16 . 1 1 84 84 HIS N N 84 118.927 118.927 120.011 -1.084 25148 10581 1 16 . 1 1 84 84 HIS HA H 84 4.713 4.713 4.962 -0.249 25148 10582 1 16 . 1 1 84 84 HIS CA C 84 55.487 55.487 54.529 0.958 25148 10583 1 16 . 1 1 84 84 HIS CB C 84 33.506 33.506 32.475 1.031 25148 10584 1 16 . 1 1 84 84 HIS H H 84 8.155 8.155 8.404 -0.249 25148 10585 1 16 . 1 1 85 85 PRO HA H 85 4.456 4.456 4.586 -0.130 25148 10586 1 16 . 1 1 85 85 PRO C C 85 177.357 177.357 177.303 0.054 25148 10587 1 16 . 1 1 85 85 PRO CA C 85 64.475 64.475 64.132 0.343 25148 10588 1 16 . 1 1 85 85 PRO CB C 85 32.489 32.489 32.165 0.324 25148 10589 1 16 . 1 1 86 86 GLU N N 86 116.314 116.314 116.791 -0.477 25148 10590 1 16 . 1 1 86 86 GLU HA H 86 4.286 4.286 4.075 0.211 25148 10591 1 16 . 1 1 86 86 GLU C C 86 177.624 177.624 177.121 0.503 25148 10592 1 16 . 1 1 86 86 GLU CA C 86 56.619 56.619 57.136 -0.517 25148 10593 1 16 . 1 1 86 86 GLU CB C 86 29.389 29.389 28.983 0.406 25148 10594 1 16 . 1 1 86 86 GLU H H 86 8.938 8.938 7.930 1.008 25148 10595 1 16 . 1 1 87 87 TYR N N 87 119.773 119.773 120.078 -0.305 25148 10596 1 16 . 1 1 87 87 TYR HA H 87 4.744 4.744 4.199 0.545 25148 10597 1 16 . 1 1 87 87 TYR C C 87 174.533 174.533 176.206 -1.673 25148 10598 1 16 . 1 1 87 87 TYR CA C 87 59.117 59.117 59.378 -0.261 25148 10599 1 16 . 1 1 87 87 TYR CB C 87 38.859 38.859 39.001 -0.142 25148 10600 1 16 . 1 1 87 87 TYR H H 87 7.447 7.447 7.331 0.116 25148 10601 1 16 . 1 1 88 88 MET N N 88 118.298 118.298 116.956 1.342 25148 10602 1 16 . 1 1 88 88 MET HA H 88 4.770 4.770 4.658 0.112 25148 10603 1 16 . 1 1 88 88 MET C C 88 175.638 175.638 174.291 1.347 25148 10604 1 16 . 1 1 88 88 MET CA C 88 53.133 53.133 54.298 -1.165 25148 10605 1 16 . 1 1 88 88 MET CB C 88 37.102 37.102 35.930 1.172 25148 10606 1 16 . 1 1 88 88 MET H H 88 9.023 9.023 8.154 0.869 25148 10607 1 16 . 1 1 89 89 VAL N N 89 120.157 120.157 124.319 -4.162 25148 10608 1 16 . 1 1 89 89 VAL HA H 89 3.330 3.330 3.763 -0.433 25148 10609 1 16 . 1 1 89 89 VAL C C 89 177.432 177.432 177.237 0.195 25148 10610 1 16 . 1 1 89 89 VAL CA C 89 65.675 65.675 63.590 2.085 25148 10611 1 16 . 1 1 89 89 VAL CB C 89 31.321 31.321 30.240 1.081 25148 10612 1 16 . 1 1 89 89 VAL H H 89 8.313 8.313 8.601 -0.288 25148 10613 1 16 . 1 1 90 90 GLY N N 90 116.935 116.935 116.424 0.511 25148 10614 1 16 . 1 1 90 90 GLY C C 90 175.196 175.196 174.280 0.916 25148 10615 1 16 . 1 1 90 90 GLY CA C 90 44.685 44.685 44.849 -0.164 25148 10616 1 16 . 1 1 90 90 GLY H H 90 8.551 8.551 8.833 -0.282 25148 10617 1 16 . 1 1 91 91 ASP N N 91 121.616 121.616 122.511 -0.895 25148 10618 1 16 . 1 1 91 91 ASP HA H 91 4.790 4.790 4.953 -0.163 25148 10619 1 16 . 1 1 91 91 ASP C C 91 174.431 174.431 174.932 -0.501 25148 10620 1 16 . 1 1 91 91 ASP CA C 91 55.011 55.011 53.897 1.114 25148 10621 1 16 . 1 1 91 91 ASP CB C 91 42.079 42.079 42.979 -0.900 25148 10622 1 16 . 1 1 91 91 ASP H H 91 8.073 8.073 8.159 -0.086 25148 10623 1 16 . 1 1 92 92 VAL N N 92 118.919 118.919 114.246 4.673 25148 10624 1 16 . 1 1 92 92 VAL HA H 92 4.709 4.709 4.882 -0.173 25148 10625 1 16 . 1 1 92 92 VAL C C 92 175.602 175.602 174.465 1.137 25148 10626 1 16 . 1 1 92 92 VAL CA C 92 61.527 61.527 60.065 1.462 25148 10627 1 16 . 1 1 92 92 VAL CB C 92 34.110 34.110 34.799 -0.689 25148 10628 1 16 . 1 1 92 92 VAL H H 92 8.216 8.216 8.159 0.057 25148 10629 1 16 . 1 1 93 93 VAL N N 93 123.922 123.922 124.073 -0.151 25148 10630 1 16 . 1 1 93 93 VAL HA H 93 4.231 4.231 4.173 0.058 25148 10631 1 16 . 1 1 93 93 VAL C C 93 174.105 174.105 174.322 -0.217 25148 10632 1 16 . 1 1 93 93 VAL CA C 93 59.644 59.644 59.280 0.364 25148 10633 1 16 . 1 1 93 93 VAL CB C 93 34.661 34.661 35.140 -0.479 25148 10634 1 16 . 1 1 93 93 VAL H H 93 8.812 8.812 7.993 0.819 25148 10635 1 16 . 1 1 94 94 GLU N N 94 123.605 123.605 128.644 -5.039 25148 10636 1 16 . 1 1 94 94 GLU HA H 94 5.347 5.347 5.050 0.297 25148 10637 1 16 . 1 1 94 94 GLU C C 94 175.708 175.708 175.549 0.159 25148 10638 1 16 . 1 1 94 94 GLU CA C 94 54.979 54.979 55.079 -0.100 25148 10639 1 16 . 1 1 94 94 GLU CB C 94 31.612 31.612 31.204 0.408 25148 10640 1 16 . 1 1 94 94 GLU H H 94 8.312 8.312 8.177 0.135 25148 10641 1 16 . 1 1 95 95 ILE N N 95 123.581 123.581 124.993 -1.412 25148 10642 1 16 . 1 1 95 95 ILE HA H 95 4.601 4.601 4.506 0.095 25148 10643 1 16 . 1 1 95 95 ILE C C 95 175.081 175.081 176.199 -1.118 25148 10644 1 16 . 1 1 95 95 ILE CA C 95 58.601 58.601 59.843 -1.242 25148 10645 1 16 . 1 1 95 95 ILE CB C 95 41.727 41.727 41.064 0.663 25148 10646 1 16 . 1 1 95 95 ILE H H 95 9.045 9.045 7.966 1.079 25148 10647 1 16 . 1 1 96 96 GLU N N 96 128.094 128.094 126.915 1.179 25148 10648 1 16 . 1 1 96 96 GLU HA H 96 4.098 4.098 4.173 -0.075 25148 10649 1 16 . 1 1 96 96 GLU C C 96 176.845 176.845 175.988 0.857 25148 10650 1 16 . 1 1 96 96 GLU CA C 96 57.853 57.853 58.475 -0.622 25148 10651 1 16 . 1 1 96 96 GLU CB C 96 28.323 28.323 29.424 -1.101 25148 10652 1 16 . 1 1 96 96 GLU H H 96 9.256 9.256 8.984 0.272 25148 10653 1 16 . 1 1 97 97 VAL N N 97 118.446 118.446 124.190 -5.744 25148 10654 1 16 . 1 1 97 97 VAL HA H 97 4.568 4.568 4.239 0.329 25148 10655 1 16 . 1 1 97 97 VAL C C 97 175.051 175.051 175.077 -0.026 25148 10656 1 16 . 1 1 97 97 VAL CA C 97 59.796 59.796 61.065 -1.269 25148 10657 1 16 . 1 1 97 97 VAL CB C 97 32.399 32.399 32.938 -0.540 25148 10658 1 16 . 1 1 97 97 VAL H H 97 8.609 8.609 8.881 -0.272 25148 10659 1 16 . 1 1 98 98 THR N N 98 119.118 119.118 117.427 1.691 25148 10660 1 16 . 1 1 98 98 THR HA H 98 3.320 3.320 3.948 -0.628 25148 10661 1 16 . 1 1 98 98 THR CA C 98 61.628 61.628 59.250 2.378 25148 10662 1 16 . 1 1 98 98 THR CB C 98 70.031 70.031 69.261 0.770 25148 10663 1 16 . 1 1 98 98 THR H H 98 7.396 7.396 7.520 -0.124 25148 10664 1 16 . 1 1 99 99 PRO HA H 99 4.458 4.458 4.655 -0.197 25148 10665 1 16 . 1 1 99 99 PRO CA C 99 62.348 62.348 62.514 -0.167 25148 10666 1 16 . 1 1 99 99 PRO CB C 99 33.182 33.182 32.577 0.605 25148 10667 1 16 . 1 1 100 100 LYS HA H 100 4.126 4.126 4.099 0.027 25148 10668 1 16 . 1 1 100 100 LYS CA C 100 58.773 58.773 58.251 0.522 25148 10669 1 16 . 1 1 100 100 LYS CB C 100 32.195 32.195 32.194 0.001 25148 10670 1 16 . 1 1 101 101 ASP HA H 101 4.924 4.924 4.793 0.131 25148 10671 1 16 . 1 1 101 101 ASP C C 101 176.884 176.884 176.265 0.619 25148 10672 1 16 . 1 1 101 101 ASP CA C 101 54.134 54.134 52.999 1.135 25148 10673 1 16 . 1 1 101 101 ASP CB C 101 40.272 40.272 40.709 -0.437 25148 10674 1 16 . 1 1 102 102 PHE N N 102 118.703 118.703 121.163 -2.460 25148 10675 1 16 . 1 1 102 102 PHE HA H 102 4.295 4.295 4.218 0.077 25148 10676 1 16 . 1 1 102 102 PHE C C 102 176.477 176.477 177.172 -0.695 25148 10677 1 16 . 1 1 102 102 PHE CA C 102 60.748 60.748 60.025 0.723 25148 10678 1 16 . 1 1 102 102 PHE CB C 102 39.667 39.667 39.244 0.423 25148 10679 1 16 . 1 1 102 102 PHE H H 102 7.862 7.862 7.695 0.167 25148 10680 1 16 . 1 1 103 103 GLY CA C 103 47.430 47.430 47.325 0.105 25148 10681 1 16 . 1 1 104 104 ARG N N 104 121.819 121.819 121.082 0.737 25148 10682 1 16 . 1 1 104 104 ARG HA H 104 4.176 4.176 4.203 -0.027 25148 10683 1 16 . 1 1 104 104 ARG C C 104 178.912 178.912 178.709 0.203 25148 10684 1 16 . 1 1 104 104 ARG CA C 104 59.235 59.235 57.558 1.677 25148 10685 1 16 . 1 1 104 104 ARG CB C 104 30.000 30.000 29.907 0.094 25148 10686 1 16 . 1 1 104 104 ARG H H 104 7.809 7.809 7.575 0.234 25148 10687 1 16 . 1 1 105 105 ILE N N 105 120.331 120.331 120.349 -0.018 25148 10688 1 16 . 1 1 105 105 ILE HA H 105 3.836 3.836 3.551 0.285 25148 10689 1 16 . 1 1 105 105 ILE C C 105 179.206 179.206 177.395 1.811 25148 10690 1 16 . 1 1 105 105 ILE CA C 105 63.025 63.025 64.892 -1.867 25148 10691 1 16 . 1 1 105 105 ILE CB C 105 38.127 38.127 37.159 0.968 25148 10692 1 16 . 1 1 105 105 ILE H H 105 7.203 7.203 7.402 -0.199 25148 10693 1 16 . 1 1 106 106 ALA N N 106 124.867 124.867 122.457 2.410 25148 10694 1 16 . 1 1 106 106 ALA HA H 106 3.665 3.665 3.572 0.093 25148 10695 1 16 . 1 1 106 106 ALA C C 106 178.590 178.590 178.883 -0.293 25148 10696 1 16 . 1 1 106 106 ALA CA C 106 54.842 54.842 55.396 -0.554 25148 10697 1 16 . 1 1 106 106 ALA CB C 106 18.659 18.659 17.677 0.982 25148 10698 1 16 . 1 1 106 106 ALA H H 106 8.813 8.813 8.299 0.514 25148 10699 1 16 . 1 1 107 107 ALA N N 107 119.597 119.597 120.352 -0.755 25148 10700 1 16 . 1 1 107 107 ALA HA H 107 4.014 4.014 4.005 0.009 25148 10701 1 16 . 1 1 107 107 ALA C C 107 180.214 180.214 179.684 0.530 25148 10702 1 16 . 1 1 107 107 ALA CA C 107 55.454 55.454 54.752 0.702 25148 10703 1 16 . 1 1 107 107 ALA CB C 107 18.260 18.260 18.043 0.217 25148 10704 1 16 . 1 1 107 107 ALA H H 107 8.012 8.012 7.719 0.293 25148 10705 1 16 . 1 1 108 108 GLN N N 108 116.896 116.896 118.085 -1.189 25148 10706 1 16 . 1 1 108 108 GLN HA H 108 4.054 4.054 4.037 0.017 25148 10707 1 16 . 1 1 108 108 GLN C C 108 178.784 178.784 178.403 0.381 25148 10708 1 16 . 1 1 108 108 GLN CA C 108 58.705 58.705 58.924 -0.219 25148 10709 1 16 . 1 1 108 108 GLN CB C 108 28.647 28.647 28.728 -0.081 25148 10710 1 16 . 1 1 108 108 GLN H H 108 7.498 7.498 7.808 -0.310 25148 10711 1 16 . 1 1 109 109 THR N N 109 117.495 117.495 116.050 1.445 25148 10712 1 16 . 1 1 109 109 THR HA H 109 3.917 3.917 4.301 -0.384 25148 10713 1 16 . 1 1 109 109 THR C C 109 175.732 175.732 176.116 -0.384 25148 10714 1 16 . 1 1 109 109 THR CA C 109 66.989 66.989 65.920 1.069 25148 10715 1 16 . 1 1 109 109 THR CB C 109 68.766 68.766 68.929 -0.163 25148 10716 1 16 . 1 1 109 109 THR H H 109 8.203 8.203 8.124 0.079 25148 10717 1 16 . 1 1 110 110 ALA N N 110 122.308 122.308 124.521 -2.213 25148 10718 1 16 . 1 1 110 110 ALA HA H 110 3.854 3.854 4.072 -0.218 25148 10719 1 16 . 1 1 110 110 ALA C C 110 178.380 178.380 178.861 -0.481 25148 10720 1 16 . 1 1 110 110 ALA CA C 110 55.903 55.903 55.067 0.836 25148 10721 1 16 . 1 1 110 110 ALA CB C 110 18.524 18.524 18.390 0.134 25148 10722 1 16 . 1 1 110 110 ALA H H 110 8.668 8.668 8.402 0.266 25148 10723 1 16 . 1 1 111 111 LYS N N 111 115.552 115.552 118.152 -2.600 25148 10724 1 16 . 1 1 111 111 LYS HA H 111 3.923 3.923 3.979 -0.056 25148 10725 1 16 . 1 1 111 111 LYS C C 111 179.111 179.111 178.318 0.793 25148 10726 1 16 . 1 1 111 111 LYS CA C 111 59.825 59.825 59.142 0.683 25148 10727 1 16 . 1 1 111 111 LYS CB C 111 32.251 32.251 31.741 0.510 25148 10728 1 16 . 1 1 111 111 LYS H H 111 7.642 7.642 8.348 -0.706 25148 10729 1 16 . 1 1 112 112 GLN N N 112 120.178 120.178 118.122 2.056 25148 10730 1 16 . 1 1 112 112 GLN HA H 112 4.060 4.060 4.119 -0.059 25148 10731 1 16 . 1 1 112 112 GLN C C 112 178.355 178.355 178.405 -0.050 25148 10732 1 16 . 1 1 112 112 GLN CA C 112 59.240 59.240 58.166 1.073 25148 10733 1 16 . 1 1 112 112 GLN CB C 112 28.250 28.250 28.496 -0.246 25148 10734 1 16 . 1 1 112 112 GLN H H 112 7.798 7.798 7.593 0.205 25148 10735 1 16 . 1 1 113 113 VAL N N 113 119.799 119.799 121.120 -1.321 25148 10736 1 16 . 1 1 113 113 VAL HA H 113 3.705 3.705 4.057 -0.352 25148 10737 1 16 . 1 1 113 113 VAL C C 113 178.303 178.303 178.295 0.008 25148 10738 1 16 . 1 1 113 113 VAL CA C 113 66.277 66.277 65.938 0.339 25148 10739 1 16 . 1 1 113 113 VAL CB C 113 31.954 31.954 31.855 0.099 25148 10740 1 16 . 1 1 113 113 VAL H H 113 8.105 8.105 7.622 0.483 25148 10741 1 16 . 1 1 114 114 VAL N N 114 118.265 118.265 116.563 1.702 25148 10742 1 16 . 1 1 114 114 VAL HA H 114 3.392 3.392 3.621 -0.229 25148 10743 1 16 . 1 1 114 114 VAL C C 114 177.360 177.360 177.738 -0.378 25148 10744 1 16 . 1 1 114 114 VAL CA C 114 67.832 67.832 67.080 0.752 25148 10745 1 16 . 1 1 114 114 VAL CB C 114 31.801 31.801 31.289 0.512 25148 10746 1 16 . 1 1 114 114 VAL H H 114 8.180 8.180 7.928 0.252 25148 10747 1 16 . 1 1 115 115 THR N N 115 113.460 113.460 115.055 -1.595 25148 10748 1 16 . 1 1 115 115 THR HA H 115 3.856 3.856 4.027 -0.171 25148 10749 1 16 . 1 1 115 115 THR C C 115 176.529 176.529 176.694 -0.165 25148 10750 1 16 . 1 1 115 115 THR CA C 115 66.706 66.706 66.171 0.535 25148 10751 1 16 . 1 1 115 115 THR CB C 115 69.008 69.008 68.563 0.445 25148 10752 1 16 . 1 1 115 115 THR H H 115 8.143 8.143 7.567 0.576 25148 10753 1 16 . 1 1 116 116 GLN N N 116 120.129 120.129 121.192 -1.063 25148 10754 1 16 . 1 1 116 116 GLN HA H 116 4.054 4.054 4.087 -0.033 25148 10755 1 16 . 1 1 116 116 GLN C C 116 178.100 178.100 178.383 -0.283 25148 10756 1 16 . 1 1 116 116 GLN CA C 116 58.950 58.950 59.324 -0.374 25148 10757 1 16 . 1 1 116 116 GLN CB C 116 28.244 28.244 28.520 -0.276 25148 10758 1 16 . 1 1 116 116 GLN H H 116 7.936 7.936 7.340 0.596 25148 10759 1 16 . 1 1 117 117 ARG N N 117 117.838 117.838 119.493 -1.655 25148 10760 1 16 . 1 1 117 117 ARG HA H 117 4.174 4.174 4.070 0.104 25148 10761 1 16 . 1 1 117 117 ARG C C 117 179.138 179.138 178.612 0.526 25148 10762 1 16 . 1 1 117 117 ARG CA C 117 57.461 57.461 58.370 -0.909 25148 10763 1 16 . 1 1 117 117 ARG CB C 117 29.548 29.548 29.371 0.177 25148 10764 1 16 . 1 1 117 117 ARG H H 117 8.240 8.240 8.409 -0.169 25148 10765 1 16 . 1 1 118 118 VAL N N 118 120.278 120.278 119.277 1.001 25148 10766 1 16 . 1 1 118 118 VAL HA H 118 3.709 3.709 3.682 0.027 25148 10767 1 16 . 1 1 118 118 VAL C C 118 177.597 177.597 178.217 -0.620 25148 10768 1 16 . 1 1 118 118 VAL CA C 118 66.246 66.246 66.544 -0.298 25148 10769 1 16 . 1 1 118 118 VAL CB C 118 31.785 31.785 31.032 0.753 25148 10770 1 16 . 1 1 118 118 VAL H H 118 8.480 8.480 7.557 0.923 25148 10771 1 16 . 1 1 119 119 ARG N N 119 120.197 120.197 119.007 1.190 25148 10772 1 16 . 1 1 119 119 ARG HA H 119 4.173 4.173 4.147 0.026 25148 10773 1 16 . 1 1 119 119 ARG C C 119 178.864 178.864 179.224 -0.360 25148 10774 1 16 . 1 1 119 119 ARG CA C 119 58.772 58.772 59.143 -0.371 25148 10775 1 16 . 1 1 119 119 ARG CB C 119 29.873 29.873 30.102 -0.229 25148 10776 1 16 . 1 1 119 119 ARG H H 119 7.899 7.899 7.668 0.231 25148 10777 1 16 . 1 1 120 120 GLU N N 120 118.768 118.768 120.387 -1.619 25148 10778 1 16 . 1 1 120 120 GLU HA H 120 4.110 4.110 4.003 0.107 25148 10779 1 16 . 1 1 120 120 GLU C C 120 177.823 177.823 178.798 -0.975 25148 10780 1 16 . 1 1 120 120 GLU CA C 120 58.223 58.223 59.350 -1.127 25148 10781 1 16 . 1 1 120 120 GLU CB C 120 29.854 29.854 29.568 0.286 25148 10782 1 16 . 1 1 120 120 GLU H H 120 8.084 8.084 7.791 0.293 25148 10783 1 16 . 1 1 121 121 ALA N N 121 121.984 121.984 121.324 0.660 25148 10784 1 16 . 1 1 121 121 ALA HA H 121 4.296 4.296 3.995 0.301 25148 10785 1 16 . 1 1 121 121 ALA C C 121 178.586 178.586 179.844 -1.258 25148 10786 1 16 . 1 1 121 121 ALA CA C 121 53.475 53.475 55.096 -1.621 25148 10787 1 16 . 1 1 121 121 ALA CB C 121 18.856 18.856 18.320 0.536 25148 10788 1 16 . 1 1 121 121 ALA H H 121 7.810 7.810 8.285 -0.475 25148 10789 1 16 . 1 1 122 122 GLU N N 122 118.229 118.229 116.361 1.868 25148 10790 1 16 . 1 1 122 122 GLU HA H 122 4.241 4.241 4.083 0.158 25148 10791 1 16 . 1 1 122 122 GLU C C 122 176.839 176.839 178.494 -1.655 25148 10792 1 16 . 1 1 122 122 GLU CA C 122 57.118 57.118 57.780 -0.662 25148 10793 1 16 . 1 1 122 122 GLU CB C 122 30.018 30.018 29.732 0.286 25148 10794 1 16 . 1 1 122 122 GLU H H 122 7.938 7.938 7.671 0.267 25148 10795 1 16 . 1 1 123 123 ARG N N 123 120.601 120.601 119.193 1.408 25148 10796 1 16 . 1 1 123 123 ARG HA H 123 4.348 4.348 4.168 0.180 25148 10797 1 16 . 1 1 123 123 ARG C C 123 176.071 176.071 176.541 -0.470 25148 10798 1 16 . 1 1 123 123 ARG CA C 123 56.510 56.510 56.405 0.105 25148 10799 1 16 . 1 1 123 123 ARG CB C 123 30.765 30.765 30.888 -0.123 25148 10800 1 16 . 1 1 123 123 ARG H H 123 7.977 7.977 7.743 0.234 25148 10801 1 17 . 1 1 4 4 GLU HA H 4 4.138 4.138 4.115 0.023 25148 10802 1 17 . 1 1 4 4 GLU C C 4 179.152 179.152 177.809 1.343 25148 10803 1 17 . 1 1 4 4 GLU CA C 4 59.566 59.566 58.803 0.763 25148 10804 1 17 . 1 1 4 4 GLU CB C 4 29.407 29.407 29.238 0.169 25148 10805 1 17 . 1 1 5 5 LEU N N 5 121.360 121.360 116.989 4.371 25148 10806 1 17 . 1 1 5 5 LEU HA H 5 4.195 4.195 4.031 0.164 25148 10807 1 17 . 1 1 5 5 LEU C C 5 178.179 178.179 178.120 0.059 25148 10808 1 17 . 1 1 5 5 LEU CA C 5 57.830 57.830 57.517 0.314 25148 10809 1 17 . 1 1 5 5 LEU CB C 5 41.630 41.630 41.383 0.248 25148 10810 1 17 . 1 1 5 5 LEU H H 5 7.877 7.877 7.998 -0.121 25148 10811 1 17 . 1 1 6 6 LEU N N 6 118.058 118.058 118.995 -0.937 25148 10812 1 17 . 1 1 6 6 LEU HA H 6 3.919 3.919 3.906 0.013 25148 10813 1 17 . 1 1 6 6 LEU C C 6 180.274 180.274 179.083 1.191 25148 10814 1 17 . 1 1 6 6 LEU CA C 6 58.221 58.221 57.525 0.696 25148 10815 1 17 . 1 1 6 6 LEU CB C 6 40.684 40.684 41.269 -0.585 25148 10816 1 17 . 1 1 6 6 LEU H H 6 7.685 7.685 7.465 0.220 25148 10817 1 17 . 1 1 7 7 ASP N N 7 120.662 120.662 118.392 2.270 25148 10818 1 17 . 1 1 7 7 ASP HA H 7 4.416 4.416 4.435 -0.019 25148 10819 1 17 . 1 1 7 7 ASP C C 7 178.738 178.738 177.668 1.070 25148 10820 1 17 . 1 1 7 7 ASP CA C 7 57.519 57.519 56.423 1.096 25148 10821 1 17 . 1 1 7 7 ASP CB C 7 40.167 40.167 40.805 -0.638 25148 10822 1 17 . 1 1 7 7 ASP H H 7 8.427 8.427 7.722 0.705 25148 10823 1 17 . 1 1 8 8 ALA N N 8 122.612 122.612 122.830 -0.218 25148 10824 1 17 . 1 1 8 8 ALA HA H 8 4.146 4.146 3.959 0.187 25148 10825 1 17 . 1 1 8 8 ALA C C 8 180.787 180.787 179.541 1.246 25148 10826 1 17 . 1 1 8 8 ALA CA C 8 55.165 55.165 55.268 -0.103 25148 10827 1 17 . 1 1 8 8 ALA CB C 8 17.711 17.711 18.591 -0.880 25148 10828 1 17 . 1 1 8 8 ALA H H 8 7.847 7.847 7.445 0.402 25148 10829 1 17 . 1 1 9 9 LEU N N 9 116.977 116.977 117.408 -0.431 25148 10830 1 17 . 1 1 9 9 LEU HA H 9 4.115 4.115 3.895 0.220 25148 10831 1 17 . 1 1 9 9 LEU C C 9 179.510 179.510 179.301 0.209 25148 10832 1 17 . 1 1 9 9 LEU CA C 9 57.468 57.468 57.829 -0.361 25148 10833 1 17 . 1 1 9 9 LEU CB C 9 41.203 41.203 41.641 -0.438 25148 10834 1 17 . 1 1 9 9 LEU H H 9 8.256 8.256 7.603 0.653 25148 10835 1 17 . 1 1 10 10 THR N N 10 118.764 118.764 116.261 2.503 25148 10836 1 17 . 1 1 10 10 THR HA H 10 4.487 4.487 3.842 0.645 25148 10837 1 17 . 1 1 10 10 THR C C 10 176.567 176.567 176.800 -0.233 25148 10838 1 17 . 1 1 10 10 THR CA C 10 68.768 68.768 66.791 1.977 25148 10839 1 17 . 1 1 10 10 THR CB C 10 66.961 66.961 68.659 -1.698 25148 10840 1 17 . 1 1 10 10 THR H H 10 8.218 8.218 7.348 0.870 25148 10841 1 17 . 1 1 11 11 ILE N N 11 122.555 122.555 120.179 2.376 25148 10842 1 17 . 1 1 11 11 ILE HA H 11 3.779 3.779 3.732 0.047 25148 10843 1 17 . 1 1 11 11 ILE C C 11 177.793 177.793 178.049 -0.256 25148 10844 1 17 . 1 1 11 11 ILE CA C 11 64.695 64.695 64.858 -0.163 25148 10845 1 17 . 1 1 11 11 ILE CB C 11 37.856 37.856 37.615 0.241 25148 10846 1 17 . 1 1 11 11 ILE H H 11 7.632 7.632 7.814 -0.182 25148 10847 1 17 . 1 1 12 12 LEU N N 12 120.469 120.469 117.641 2.828 25148 10848 1 17 . 1 1 12 12 LEU HA H 12 4.065 4.065 4.134 -0.069 25148 10849 1 17 . 1 1 12 12 LEU C C 12 179.139 179.139 178.942 0.197 25148 10850 1 17 . 1 1 12 12 LEU CA C 12 57.944 57.944 57.022 0.922 25148 10851 1 17 . 1 1 12 12 LEU CB C 12 42.170 42.170 41.208 0.962 25148 10852 1 17 . 1 1 12 12 LEU H H 12 7.951 7.951 7.671 0.280 25148 10853 1 17 . 1 1 13 13 GLU N N 13 119.669 119.669 119.484 0.185 25148 10854 1 17 . 1 1 13 13 GLU HA H 13 4.183 4.183 4.050 0.133 25148 10855 1 17 . 1 1 13 13 GLU C C 13 179.007 179.007 177.328 1.679 25148 10856 1 17 . 1 1 13 13 GLU CA C 13 59.703 59.703 58.620 1.083 25148 10857 1 17 . 1 1 13 13 GLU CB C 13 30.110 30.110 29.164 0.946 25148 10858 1 17 . 1 1 13 13 GLU H H 13 8.003 8.003 7.810 0.193 25148 10859 1 17 . 1 1 14 14 LYS N N 14 118.935 118.935 117.622 1.313 25148 10860 1 17 . 1 1 14 14 LYS HA H 14 4.124 4.124 4.077 0.047 25148 10861 1 17 . 1 1 14 14 LYS CA C 14 58.847 58.847 57.784 1.063 25148 10862 1 17 . 1 1 14 14 LYS CB C 14 33.053 33.053 32.571 0.482 25148 10863 1 17 . 1 1 14 14 LYS H H 14 7.862 7.862 7.318 0.544 25148 10864 1 17 . 1 1 15 15 GLU HA H 15 3.693 3.693 4.307 -0.614 25148 10865 1 17 . 1 1 15 15 GLU CA C 15 56.688 56.688 55.884 0.804 25148 10866 1 17 . 1 1 15 15 GLU CB C 15 32.204 32.204 30.182 2.022 25148 10867 1 17 . 1 1 16 16 LYS HA H 16 4.678 4.678 4.414 0.264 25148 10868 1 17 . 1 1 16 16 LYS CA C 16 55.135 55.135 55.726 -0.591 25148 10869 1 17 . 1 1 16 16 LYS CB C 16 34.049 34.049 33.140 0.909 25148 10870 1 17 . 1 1 17 17 GLY CA C 17 46.541 46.541 45.215 1.326 25148 10871 1 17 . 1 1 18 18 ILE N N 18 115.364 115.364 120.910 -5.546 25148 10872 1 17 . 1 1 18 18 ILE HA H 18 4.079 4.079 4.218 -0.139 25148 10873 1 17 . 1 1 18 18 ILE C C 18 174.751 174.751 175.246 -0.495 25148 10874 1 17 . 1 1 18 18 ILE CA C 18 60.333 60.333 60.087 0.246 25148 10875 1 17 . 1 1 18 18 ILE CB C 18 39.044 39.044 37.925 1.119 25148 10876 1 17 . 1 1 18 18 ILE H H 18 8.203 8.203 7.770 0.433 25148 10877 1 17 . 1 1 19 19 SER N N 19 119.891 119.891 122.470 -2.579 25148 10878 1 17 . 1 1 19 19 SER HA H 19 4.362 4.362 4.573 -0.211 25148 10879 1 17 . 1 1 19 19 SER CA C 19 58.476 58.476 58.174 0.302 25148 10880 1 17 . 1 1 19 19 SER CB C 19 63.533 63.533 63.902 -0.369 25148 10881 1 17 . 1 1 19 19 SER H H 19 8.253 8.253 8.714 -0.461 25148 10882 1 17 . 1 1 20 20 LYS N N 20 124.782 124.782 127.340 -2.558 25148 10883 1 17 . 1 1 20 20 LYS HA H 20 4.137 4.137 4.160 -0.023 25148 10884 1 17 . 1 1 20 20 LYS C C 20 177.889 177.889 177.462 0.427 25148 10885 1 17 . 1 1 20 20 LYS CA C 20 59.485 59.485 58.927 0.558 25148 10886 1 17 . 1 1 20 20 LYS CB C 20 32.711 32.711 32.231 0.480 25148 10887 1 17 . 1 1 20 20 LYS H H 20 8.918 8.918 8.987 -0.069 25148 10888 1 17 . 1 1 21 21 GLU N N 21 117.831 117.831 118.654 -0.823 25148 10889 1 17 . 1 1 21 21 GLU HA H 21 3.957 3.957 4.067 -0.110 25148 10890 1 17 . 1 1 21 21 GLU C C 21 178.822 178.822 178.819 0.003 25148 10891 1 17 . 1 1 21 21 GLU CA C 21 59.529 59.529 59.259 0.270 25148 10892 1 17 . 1 1 21 21 GLU CB C 21 29.237 29.237 29.244 -0.007 25148 10893 1 17 . 1 1 21 21 GLU H H 21 8.361 8.361 8.597 -0.236 25148 10894 1 17 . 1 1 22 22 ILE N N 22 118.690 118.690 118.041 0.649 25148 10895 1 17 . 1 1 22 22 ILE HA H 22 3.884 3.884 3.911 -0.027 25148 10896 1 17 . 1 1 22 22 ILE C C 22 179.247 179.247 177.542 1.705 25148 10897 1 17 . 1 1 22 22 ILE CA C 22 63.735 63.735 63.845 -0.110 25148 10898 1 17 . 1 1 22 22 ILE CB C 22 37.415 37.415 37.920 -0.505 25148 10899 1 17 . 1 1 22 22 ILE H H 22 7.353 7.353 7.454 -0.101 25148 10900 1 17 . 1 1 23 23 ILE N N 23 120.880 120.880 120.850 0.030 25148 10901 1 17 . 1 1 23 23 ILE HA H 23 3.733 3.733 3.738 -0.005 25148 10902 1 17 . 1 1 23 23 ILE C C 23 177.817 177.817 177.881 -0.064 25148 10903 1 17 . 1 1 23 23 ILE CA C 23 64.172 64.172 63.414 0.758 25148 10904 1 17 . 1 1 23 23 ILE CB C 23 36.473 36.473 36.976 -0.503 25148 10905 1 17 . 1 1 23 23 ILE H H 23 7.571 7.571 7.436 0.135 25148 10906 1 17 . 1 1 24 24 ILE N N 24 121.460 121.460 119.837 1.623 25148 10907 1 17 . 1 1 24 24 ILE HA H 24 3.486 3.486 3.563 -0.077 25148 10908 1 17 . 1 1 24 24 ILE C C 24 177.759 177.759 177.893 -0.134 25148 10909 1 17 . 1 1 24 24 ILE CA C 24 66.641 66.641 66.235 0.406 25148 10910 1 17 . 1 1 24 24 ILE CB C 24 37.307 37.307 37.432 -0.125 25148 10911 1 17 . 1 1 24 24 ILE H H 24 8.709 8.709 8.199 0.510 25148 10912 1 17 . 1 1 25 25 GLU N N 25 119.323 119.323 117.954 1.369 25148 10913 1 17 . 1 1 25 25 GLU HA H 25 4.177 4.177 4.046 0.131 25148 10914 1 17 . 1 1 25 25 GLU C C 25 179.348 179.348 178.752 0.596 25148 10915 1 17 . 1 1 25 25 GLU CA C 25 59.951 59.951 59.352 0.599 25148 10916 1 17 . 1 1 25 25 GLU CB C 25 29.340 29.340 29.035 0.305 25148 10917 1 17 . 1 1 25 25 GLU H H 25 8.048 8.048 8.008 0.040 25148 10918 1 17 . 1 1 26 26 ALA N N 26 122.390 122.390 122.111 0.279 25148 10919 1 17 . 1 1 26 26 ALA HA H 26 4.325 4.325 4.132 0.193 25148 10920 1 17 . 1 1 26 26 ALA C C 26 181.440 181.440 179.543 1.897 25148 10921 1 17 . 1 1 26 26 ALA CA C 26 54.935 54.935 54.690 0.246 25148 10922 1 17 . 1 1 26 26 ALA CB C 26 17.834 17.834 18.402 -0.568 25148 10923 1 17 . 1 1 26 26 ALA H H 26 7.768 7.768 7.853 -0.085 25148 10924 1 17 . 1 1 27 27 ILE N N 27 122.342 122.342 120.109 2.233 25148 10925 1 17 . 1 1 27 27 ILE HA H 27 3.575 3.575 3.661 -0.086 25148 10926 1 17 . 1 1 27 27 ILE C C 27 177.541 177.541 177.725 -0.184 25148 10927 1 17 . 1 1 27 27 ILE CA C 27 66.536 66.536 65.705 0.831 25148 10928 1 17 . 1 1 27 27 ILE CB C 27 37.886 37.886 38.157 -0.271 25148 10929 1 17 . 1 1 27 27 ILE H H 27 8.805 8.805 7.642 1.163 25148 10930 1 17 . 1 1 28 28 GLU N N 28 120.188 120.188 119.739 0.449 25148 10931 1 17 . 1 1 28 28 GLU HA H 28 3.687 3.687 3.986 -0.299 25148 10932 1 17 . 1 1 28 28 GLU C C 28 178.707 178.707 178.846 -0.139 25148 10933 1 17 . 1 1 28 28 GLU CA C 28 61.458 61.458 59.639 1.819 25148 10934 1 17 . 1 1 28 28 GLU CB C 28 29.624 29.624 28.731 0.893 25148 10935 1 17 . 1 1 28 28 GLU H H 28 8.882 8.882 7.894 0.988 25148 10936 1 17 . 1 1 29 29 ALA N N 29 119.293 119.293 121.633 -2.340 25148 10937 1 17 . 1 1 29 29 ALA HA H 29 4.214 4.214 4.008 0.206 25148 10938 1 17 . 1 1 29 29 ALA C C 29 181.200 181.200 179.314 1.886 25148 10939 1 17 . 1 1 29 29 ALA CA C 29 55.435 55.435 54.970 0.465 25148 10940 1 17 . 1 1 29 29 ALA CB C 29 18.090 18.090 18.323 -0.233 25148 10941 1 17 . 1 1 29 29 ALA H H 29 8.065 8.065 7.929 0.136 25148 10942 1 17 . 1 1 30 30 ALA N N 30 121.729 121.729 121.899 -0.170 25148 10943 1 17 . 1 1 30 30 ALA HA H 30 4.307 4.307 4.192 0.115 25148 10944 1 17 . 1 1 30 30 ALA C C 30 181.315 181.315 179.565 1.750 25148 10945 1 17 . 1 1 30 30 ALA CA C 30 54.594 54.594 54.735 -0.141 25148 10946 1 17 . 1 1 30 30 ALA CB C 30 18.704 18.704 18.259 0.445 25148 10947 1 17 . 1 1 30 30 ALA H H 30 8.099 8.099 7.236 0.863 25148 10948 1 17 . 1 1 31 31 LEU N N 31 120.900 120.900 120.624 0.276 25148 10949 1 17 . 1 1 31 31 LEU HA H 31 4.347 4.347 4.146 0.201 25148 10950 1 17 . 1 1 31 31 LEU C C 31 179.137 179.137 179.271 -0.134 25148 10951 1 17 . 1 1 31 31 LEU CA C 31 57.569 57.569 58.099 -0.530 25148 10952 1 17 . 1 1 31 31 LEU CB C 31 42.353 42.353 40.949 1.405 25148 10953 1 17 . 1 1 31 31 LEU H H 31 8.863 8.863 7.764 1.099 25148 10954 1 17 . 1 1 32 32 ILE N N 32 122.410 122.410 118.835 3.575 25148 10955 1 17 . 1 1 32 32 ILE HA H 32 3.699 3.699 3.694 0.005 25148 10956 1 17 . 1 1 32 32 ILE C C 32 178.303 178.303 177.972 0.331 25148 10957 1 17 . 1 1 32 32 ILE CA C 32 66.066 66.066 65.296 0.770 25148 10958 1 17 . 1 1 32 32 ILE CB C 32 37.882 37.882 37.935 -0.053 25148 10959 1 17 . 1 1 32 32 ILE H H 32 8.234 8.234 8.062 0.172 25148 10960 1 17 . 1 1 33 33 SER N N 33 114.201 114.201 115.733 -1.532 25148 10961 1 17 . 1 1 33 33 SER HA H 33 4.311 4.311 4.195 0.116 25148 10962 1 17 . 1 1 33 33 SER C C 33 177.012 177.012 176.781 0.231 25148 10963 1 17 . 1 1 33 33 SER CA C 33 61.860 61.860 61.982 -0.122 25148 10964 1 17 . 1 1 33 33 SER CB C 33 62.508 62.508 63.386 -0.878 25148 10965 1 17 . 1 1 33 33 SER H H 33 7.558 7.558 7.661 -0.103 25148 10966 1 17 . 1 1 34 34 ALA N N 34 122.893 122.893 124.865 -1.972 25148 10967 1 17 . 1 1 34 34 ALA HA H 34 4.215 4.215 4.076 0.139 25148 10968 1 17 . 1 1 34 34 ALA C C 34 180.814 180.814 179.454 1.360 25148 10969 1 17 . 1 1 34 34 ALA CA C 34 55.283 55.283 55.064 0.219 25148 10970 1 17 . 1 1 34 34 ALA CB C 34 18.273 18.273 18.217 0.056 25148 10971 1 17 . 1 1 34 34 ALA H H 34 8.409 8.409 8.376 0.033 25148 10972 1 17 . 1 1 35 35 TYR N N 35 120.259 120.259 118.727 1.532 25148 10973 1 17 . 1 1 35 35 TYR HA H 35 4.393 4.393 4.300 0.093 25148 10974 1 17 . 1 1 35 35 TYR C C 35 177.892 177.892 177.601 0.291 25148 10975 1 17 . 1 1 35 35 TYR CA C 35 63.071 63.071 60.969 2.102 25148 10976 1 17 . 1 1 35 35 TYR CB C 35 38.021 38.021 38.781 -0.760 25148 10977 1 17 . 1 1 35 35 TYR H H 35 8.975 8.975 8.292 0.683 25148 10978 1 17 . 1 1 36 36 LYS N N 36 120.942 120.942 119.832 1.110 25148 10979 1 17 . 1 1 36 36 LYS HA H 36 4.032 4.032 4.061 -0.029 25148 10980 1 17 . 1 1 36 36 LYS C C 36 177.797 177.797 179.269 -1.472 25148 10981 1 17 . 1 1 36 36 LYS CA C 36 59.900 59.900 59.057 0.843 25148 10982 1 17 . 1 1 36 36 LYS CB C 36 32.429 32.429 32.313 0.116 25148 10983 1 17 . 1 1 36 36 LYS H H 36 8.654 8.654 7.909 0.745 25148 10984 1 17 . 1 1 37 37 ARG N N 37 115.139 115.139 117.906 -2.767 25148 10985 1 17 . 1 1 37 37 ARG HA H 37 4.101 4.101 4.066 0.035 25148 10986 1 17 . 1 1 37 37 ARG C C 37 177.517 177.517 177.850 -0.333 25148 10987 1 17 . 1 1 37 37 ARG CA C 37 58.276 58.276 58.644 -0.368 25148 10988 1 17 . 1 1 37 37 ARG CB C 37 31.014 31.014 29.763 1.251 25148 10989 1 17 . 1 1 37 37 ARG H H 37 8.138 8.138 8.055 0.083 25148 10990 1 17 . 1 1 38 38 ASN N N 38 112.555 112.555 115.752 -3.197 25148 10991 1 17 . 1 1 38 38 ASN HA H 38 4.540 4.540 4.338 0.202 25148 10992 1 17 . 1 1 38 38 ASN C C 38 173.994 173.994 174.930 -0.936 25148 10993 1 17 . 1 1 38 38 ASN CA C 38 54.722 54.722 54.888 -0.166 25148 10994 1 17 . 1 1 38 38 ASN CB C 38 42.077 42.077 39.491 2.586 25148 10995 1 17 . 1 1 38 38 ASN H H 38 7.426 7.426 7.410 0.016 25148 10996 1 17 . 1 1 39 39 PHE N N 39 116.711 116.711 117.538 -0.827 25148 10997 1 17 . 1 1 39 39 PHE HA H 39 4.569 4.569 4.666 -0.097 25148 10998 1 17 . 1 1 39 39 PHE CA C 39 58.913 58.913 56.484 2.429 25148 10999 1 17 . 1 1 39 39 PHE CB C 39 39.781 39.781 38.788 0.993 25148 11000 1 17 . 1 1 39 39 PHE H H 39 7.959 7.959 7.489 0.470 25148 11001 1 17 . 1 1 40 40 ASN HA H 40 4.018 4.018 4.592 -0.574 25148 11002 1 17 . 1 1 40 40 ASN CA C 40 58.944 58.944 55.272 3.672 25148 11003 1 17 . 1 1 41 41 GLN HA H 41 4.298 4.298 4.456 -0.158 25148 11004 1 17 . 1 1 41 41 GLN C C 41 175.237 175.237 175.634 -0.397 25148 11005 1 17 . 1 1 41 41 GLN CA C 41 57.360 57.360 56.431 0.929 25148 11006 1 17 . 1 1 41 41 GLN CB C 41 28.724 28.724 28.174 0.550 25148 11007 1 17 . 1 1 42 42 ALA N N 42 120.514 120.514 121.027 -0.513 25148 11008 1 17 . 1 1 42 42 ALA HA H 42 4.622 4.622 4.395 0.227 25148 11009 1 17 . 1 1 42 42 ALA C C 42 175.922 175.922 176.235 -0.313 25148 11010 1 17 . 1 1 42 42 ALA CA C 42 51.841 51.841 52.414 -0.573 25148 11011 1 17 . 1 1 42 42 ALA CB C 42 21.576 21.576 20.187 1.389 25148 11012 1 17 . 1 1 42 42 ALA H H 42 7.817 7.817 8.104 -0.287 25148 11013 1 17 . 1 1 43 43 GLN N N 43 117.594 117.594 116.626 0.968 25148 11014 1 17 . 1 1 43 43 GLN HA H 43 4.265 4.265 4.352 -0.087 25148 11015 1 17 . 1 1 43 43 GLN C C 43 174.942 174.942 173.628 1.314 25148 11016 1 17 . 1 1 43 43 GLN CA C 43 57.047 57.047 55.507 1.540 25148 11017 1 17 . 1 1 43 43 GLN CB C 43 30.863 30.863 31.307 -0.444 25148 11018 1 17 . 1 1 43 43 GLN H H 43 7.400 7.400 7.460 -0.060 25148 11019 1 17 . 1 1 44 44 ASN N N 44 120.467 120.467 121.974 -1.507 25148 11020 1 17 . 1 1 44 44 ASN HA H 44 5.005 5.005 4.612 0.393 25148 11021 1 17 . 1 1 44 44 ASN C C 44 174.365 174.365 174.258 0.107 25148 11022 1 17 . 1 1 44 44 ASN CA C 44 52.381 52.381 53.565 -1.184 25148 11023 1 17 . 1 1 44 44 ASN CB C 44 38.177 38.177 39.250 -1.073 25148 11024 1 17 . 1 1 44 44 ASN H H 44 9.123 9.123 8.550 0.573 25148 11025 1 17 . 1 1 45 45 VAL N N 45 115.479 115.479 117.324 -1.845 25148 11026 1 17 . 1 1 45 45 VAL HA H 45 5.376 5.376 4.290 1.086 25148 11027 1 17 . 1 1 45 45 VAL C C 45 174.908 174.908 173.320 1.588 25148 11028 1 17 . 1 1 45 45 VAL CA C 45 59.022 59.022 62.148 -3.127 25148 11029 1 17 . 1 1 45 45 VAL CB C 45 35.776 35.776 34.980 0.796 25148 11030 1 17 . 1 1 45 45 VAL H H 45 7.732 7.732 8.133 -0.401 25148 11031 1 17 . 1 1 46 46 ARG N N 46 121.146 121.146 124.742 -3.596 25148 11032 1 17 . 1 1 46 46 ARG HA H 46 4.566 4.566 4.859 -0.293 25148 11033 1 17 . 1 1 46 46 ARG C C 46 173.790 173.790 174.839 -1.049 25148 11034 1 17 . 1 1 46 46 ARG CA C 46 54.762 54.762 54.825 -0.063 25148 11035 1 17 . 1 1 46 46 ARG CB C 46 33.946 33.946 32.701 1.245 25148 11036 1 17 . 1 1 46 46 ARG H H 46 8.850 8.850 8.996 -0.146 25148 11037 1 17 . 1 1 47 47 VAL N N 47 122.339 122.339 125.942 -3.603 25148 11038 1 17 . 1 1 47 47 VAL HA H 47 4.741 4.741 4.330 0.411 25148 11039 1 17 . 1 1 47 47 VAL C C 47 173.541 173.541 175.223 -1.682 25148 11040 1 17 . 1 1 47 47 VAL CA C 47 60.893 60.893 61.970 -1.077 25148 11041 1 17 . 1 1 47 47 VAL CB C 47 33.563 33.563 33.018 0.545 25148 11042 1 17 . 1 1 47 47 VAL H H 47 8.444 8.444 8.538 -0.094 25148 11043 1 17 . 1 1 48 48 ASP N N 48 127.701 127.701 127.473 0.228 25148 11044 1 17 . 1 1 48 48 ASP HA H 48 4.946 4.946 4.980 -0.034 25148 11045 1 17 . 1 1 48 48 ASP C C 48 173.744 173.744 174.627 -0.883 25148 11046 1 17 . 1 1 48 48 ASP CA C 48 52.651 52.651 52.993 -0.342 25148 11047 1 17 . 1 1 48 48 ASP CB C 48 45.225 45.225 44.058 1.167 25148 11048 1 17 . 1 1 48 48 ASP H H 48 9.068 9.068 8.568 0.500 25148 11049 1 17 . 1 1 49 49 LEU N N 49 130.945 130.945 126.354 4.591 25148 11050 1 17 . 1 1 49 49 LEU HA H 49 4.774 4.774 4.695 0.079 25148 11051 1 17 . 1 1 49 49 LEU C C 49 174.531 174.531 175.624 -1.093 25148 11052 1 17 . 1 1 49 49 LEU CA C 49 54.337 54.337 54.244 0.093 25148 11053 1 17 . 1 1 49 49 LEU CB C 49 43.192 43.192 44.145 -0.953 25148 11054 1 17 . 1 1 49 49 LEU H H 49 9.369 9.369 8.598 0.771 25148 11055 1 17 . 1 1 50 50 ASN N N 50 126.268 126.268 122.954 3.314 25148 11056 1 17 . 1 1 50 50 ASN HA H 50 4.629 4.629 5.055 -0.426 25148 11057 1 17 . 1 1 50 50 ASN C C 50 176.602 176.602 175.203 1.399 25148 11058 1 17 . 1 1 50 50 ASN CA C 50 54.048 54.048 52.856 1.192 25148 11059 1 17 . 1 1 50 50 ASN CB C 50 39.891 39.891 40.015 -0.124 25148 11060 1 17 . 1 1 50 50 ASN H H 50 8.672 8.672 8.566 0.106 25148 11061 1 17 . 1 1 51 51 ARG N N 51 125.897 125.897 124.016 1.881 25148 11062 1 17 . 1 1 51 51 ARG HA H 51 3.789 3.789 4.232 -0.443 25148 11063 1 17 . 1 1 51 51 ARG C C 51 175.681 175.681 176.242 -0.561 25148 11064 1 17 . 1 1 51 51 ARG CA C 51 58.162 58.162 58.469 -0.307 25148 11065 1 17 . 1 1 51 51 ARG CB C 51 29.944 29.944 29.864 0.080 25148 11066 1 17 . 1 1 51 51 ARG H H 51 8.984 8.984 8.816 0.168 25148 11067 1 17 . 1 1 52 52 GLU N N 52 116.733 116.733 118.800 -2.067 25148 11068 1 17 . 1 1 52 52 GLU HA H 52 4.368 4.368 4.190 0.178 25148 11069 1 17 . 1 1 52 52 GLU C C 52 178.049 178.049 177.457 0.592 25148 11070 1 17 . 1 1 52 52 GLU CA C 52 58.048 58.048 58.150 -0.102 25148 11071 1 17 . 1 1 52 52 GLU CB C 52 30.716 30.716 29.420 1.296 25148 11072 1 17 . 1 1 52 52 GLU H H 52 8.541 8.541 8.301 0.240 25148 11073 1 17 . 1 1 53 53 THR N N 53 106.556 106.556 112.415 -5.859 25148 11074 1 17 . 1 1 53 53 THR HA H 53 4.424 4.424 4.516 -0.092 25148 11075 1 17 . 1 1 53 53 THR C C 53 176.352 176.352 174.422 1.930 25148 11076 1 17 . 1 1 53 53 THR CA C 53 61.320 61.320 60.699 0.621 25148 11077 1 17 . 1 1 53 53 THR CB C 53 71.220 71.220 69.359 1.861 25148 11078 1 17 . 1 1 53 53 THR H H 53 8.085 8.085 7.543 0.542 25148 11079 1 17 . 1 1 54 54 GLY N N 54 111.843 111.843 109.842 2.001 25148 11080 1 17 . 1 1 54 54 GLY C C 54 172.690 172.690 174.229 -1.539 25148 11081 1 17 . 1 1 54 54 GLY CA C 54 45.417 45.417 46.210 -0.793 25148 11082 1 17 . 1 1 54 54 GLY H H 54 8.330 8.330 7.705 0.625 25148 11083 1 17 . 1 1 55 55 SER N N 55 113.844 113.844 114.120 -0.276 25148 11084 1 17 . 1 1 55 55 SER HA H 55 4.279 4.279 4.704 -0.425 25148 11085 1 17 . 1 1 55 55 SER C C 55 174.127 174.127 172.877 1.250 25148 11086 1 17 . 1 1 55 55 SER CA C 55 59.229 59.229 57.826 1.403 25148 11087 1 17 . 1 1 55 55 SER CB C 55 63.939 63.939 65.084 -1.145 25148 11088 1 17 . 1 1 55 55 SER H H 55 7.653 7.653 7.528 0.125 25148 11089 1 17 . 1 1 56 56 ILE N N 56 125.286 125.286 120.094 5.192 25148 11090 1 17 . 1 1 56 56 ILE HA H 56 5.082 5.082 4.716 0.366 25148 11091 1 17 . 1 1 56 56 ILE C C 56 175.346 175.346 174.327 1.019 25148 11092 1 17 . 1 1 56 56 ILE CA C 56 59.967 59.967 60.276 -0.309 25148 11093 1 17 . 1 1 56 56 ILE CB C 56 40.165 40.165 42.369 -2.204 25148 11094 1 17 . 1 1 56 56 ILE H H 56 8.478 8.478 8.427 0.051 25148 11095 1 17 . 1 1 57 57 ARG N N 57 126.332 126.332 126.615 -0.283 25148 11096 1 17 . 1 1 57 57 ARG HA H 57 4.740 4.740 4.551 0.189 25148 11097 1 17 . 1 1 57 57 ARG C C 57 173.921 173.921 173.576 0.345 25148 11098 1 17 . 1 1 57 57 ARG CA C 57 54.311 54.311 53.912 0.399 25148 11099 1 17 . 1 1 57 57 ARG CB C 57 35.805 35.805 33.206 2.599 25148 11100 1 17 . 1 1 57 57 ARG H H 57 8.590 8.590 8.435 0.155 25148 11101 1 17 . 1 1 58 58 VAL N N 58 120.987 120.987 123.324 -2.337 25148 11102 1 17 . 1 1 58 58 VAL HA H 58 4.334 4.334 4.043 0.291 25148 11103 1 17 . 1 1 58 58 VAL C C 58 174.204 174.204 173.974 0.230 25148 11104 1 17 . 1 1 58 58 VAL CA C 58 60.861 60.861 61.665 -0.804 25148 11105 1 17 . 1 1 58 58 VAL CB C 58 33.383 33.383 31.643 1.740 25148 11106 1 17 . 1 1 58 58 VAL H H 58 8.585 8.585 8.274 0.311 25148 11107 1 17 . 1 1 59 59 PHE N N 59 124.913 124.913 126.366 -1.453 25148 11108 1 17 . 1 1 59 59 PHE HA H 59 5.046 5.046 5.394 -0.348 25148 11109 1 17 . 1 1 59 59 PHE C C 59 174.446 174.446 174.091 0.355 25148 11110 1 17 . 1 1 59 59 PHE CA C 59 56.695 56.695 55.218 1.477 25148 11111 1 17 . 1 1 59 59 PHE CB C 59 42.779 42.779 43.281 -0.502 25148 11112 1 17 . 1 1 59 59 PHE H H 59 8.920 8.920 8.520 0.400 25148 11113 1 17 . 1 1 60 60 ALA N N 60 124.035 124.035 122.865 1.170 25148 11114 1 17 . 1 1 60 60 ALA HA H 60 5.102 5.102 4.845 0.257 25148 11115 1 17 . 1 1 60 60 ALA C C 60 176.017 176.017 176.152 -0.135 25148 11116 1 17 . 1 1 60 60 ALA CA C 60 50.083 50.083 50.432 -0.349 25148 11117 1 17 . 1 1 60 60 ALA CB C 60 22.400 22.400 21.158 1.242 25148 11118 1 17 . 1 1 60 60 ALA H H 60 9.457 9.457 8.735 0.722 25148 11119 1 17 . 1 1 61 61 ARG N N 61 121.530 121.530 124.371 -2.841 25148 11120 1 17 . 1 1 61 61 ARG HA H 61 4.958 4.958 4.863 0.095 25148 11121 1 17 . 1 1 61 61 ARG C C 61 176.737 176.737 175.748 0.989 25148 11122 1 17 . 1 1 61 61 ARG CA C 61 55.375 55.375 55.764 -0.389 25148 11123 1 17 . 1 1 61 61 ARG CB C 61 31.230 31.230 30.588 0.642 25148 11124 1 17 . 1 1 61 61 ARG H H 61 8.447 8.447 8.815 -0.368 25148 11125 1 17 . 1 1 62 62 LYS N N 62 124.784 124.784 126.165 -1.381 25148 11126 1 17 . 1 1 62 62 LYS HA H 62 4.709 4.709 4.434 0.275 25148 11127 1 17 . 1 1 62 62 LYS C C 62 173.899 173.899 175.050 -1.151 25148 11128 1 17 . 1 1 62 62 LYS CA C 62 54.812 54.812 55.403 -0.591 25148 11129 1 17 . 1 1 62 62 LYS CB C 62 37.147 37.147 34.765 2.382 25148 11130 1 17 . 1 1 62 62 LYS H H 62 9.137 9.137 8.009 1.128 25148 11131 1 17 . 1 1 63 63 ASP N N 63 122.552 122.552 124.945 -2.393 25148 11132 1 17 . 1 1 63 63 ASP HA H 63 4.877 4.877 4.649 0.228 25148 11133 1 17 . 1 1 63 63 ASP C C 63 175.560 175.560 176.401 -0.841 25148 11134 1 17 . 1 1 63 63 ASP CA C 63 54.576 54.576 54.478 0.098 25148 11135 1 17 . 1 1 63 63 ASP CB C 63 42.841 42.841 41.439 1.402 25148 11136 1 17 . 1 1 63 63 ASP H H 63 8.334 8.334 8.748 -0.414 25148 11137 1 17 . 1 1 64 64 VAL N N 64 123.109 123.109 127.769 -4.660 25148 11138 1 17 . 1 1 64 64 VAL HA H 64 4.557 4.557 4.530 0.027 25148 11139 1 17 . 1 1 64 64 VAL C C 64 177.260 177.260 175.578 1.682 25148 11140 1 17 . 1 1 64 64 VAL CA C 64 62.268 62.268 63.152 -0.884 25148 11141 1 17 . 1 1 64 64 VAL CB C 64 30.348 30.348 30.911 -0.563 25148 11142 1 17 . 1 1 64 64 VAL H H 64 8.693 8.693 8.077 0.616 25148 11143 1 17 . 1 1 65 65 VAL N N 65 122.320 122.320 123.138 -0.818 25148 11144 1 17 . 1 1 65 65 VAL HA H 65 4.939 4.939 4.634 0.305 25148 11145 1 17 . 1 1 65 65 VAL C C 65 174.754 174.754 174.966 -0.212 25148 11146 1 17 . 1 1 65 65 VAL CA C 65 59.173 59.173 59.797 -0.624 25148 11147 1 17 . 1 1 65 65 VAL CB C 65 36.289 36.289 35.526 0.763 25148 11148 1 17 . 1 1 65 65 VAL H H 65 8.656 8.656 8.605 0.051 25148 11149 1 17 . 1 1 66 66 ASP N N 66 119.805 119.805 122.281 -2.476 25148 11150 1 17 . 1 1 66 66 ASP HA H 66 4.499 4.499 4.378 0.121 25148 11151 1 17 . 1 1 66 66 ASP C C 66 176.565 176.565 175.954 0.611 25148 11152 1 17 . 1 1 66 66 ASP CA C 66 57.236 57.236 56.481 0.755 25148 11153 1 17 . 1 1 66 66 ASP CB C 66 41.662 41.662 41.173 0.489 25148 11154 1 17 . 1 1 66 66 ASP H H 66 8.628 8.628 8.844 -0.216 25148 11155 1 17 . 1 1 67 67 GLU N N 67 117.604 117.604 117.600 0.004 25148 11156 1 17 . 1 1 67 67 GLU HA H 67 4.350 4.350 4.394 -0.044 25148 11157 1 17 . 1 1 67 67 GLU C C 67 173.736 173.736 175.263 -1.527 25148 11158 1 17 . 1 1 67 67 GLU CA C 67 55.203 55.203 55.089 0.114 25148 11159 1 17 . 1 1 67 67 GLU CB C 67 32.240 32.240 32.327 -0.087 25148 11160 1 17 . 1 1 67 67 GLU H H 67 7.525 7.525 7.800 -0.275 25148 11161 1 17 . 1 1 68 68 VAL N N 68 125.774 125.774 123.254 2.520 25148 11162 1 17 . 1 1 68 68 VAL HA H 68 3.578 3.578 3.893 -0.315 25148 11163 1 17 . 1 1 68 68 VAL C C 68 175.885 175.885 175.587 0.298 25148 11164 1 17 . 1 1 68 68 VAL CA C 68 63.397 63.397 63.788 -0.391 25148 11165 1 17 . 1 1 68 68 VAL CB C 68 32.452 32.452 31.221 1.230 25148 11166 1 17 . 1 1 68 68 VAL H H 68 8.573 8.573 8.396 0.177 25148 11167 1 17 . 1 1 69 69 TYR N N 69 129.859 129.859 126.221 3.638 25148 11168 1 17 . 1 1 69 69 TYR HA H 69 4.642 4.642 4.590 0.052 25148 11169 1 17 . 1 1 69 69 TYR C C 69 176.100 176.100 175.618 0.482 25148 11170 1 17 . 1 1 69 69 TYR CA C 69 59.092 59.092 59.286 -0.194 25148 11171 1 17 . 1 1 69 69 TYR CB C 69 39.830 39.830 40.583 -0.753 25148 11172 1 17 . 1 1 69 69 TYR H H 69 9.801 9.801 8.407 1.394 25148 11173 1 17 . 1 1 70 70 ASP N N 70 120.204 120.204 120.246 -0.042 25148 11174 1 17 . 1 1 70 70 ASP HA H 70 4.772 4.772 4.872 -0.100 25148 11175 1 17 . 1 1 70 70 ASP C C 70 176.622 176.622 176.131 0.491 25148 11176 1 17 . 1 1 70 70 ASP CA C 70 52.885 52.885 53.701 -0.816 25148 11177 1 17 . 1 1 70 70 ASP CB C 70 41.878 41.878 41.270 0.608 25148 11178 1 17 . 1 1 70 70 ASP H H 70 8.348 8.348 7.742 0.606 25148 11179 1 17 . 1 1 71 71 GLN N N 71 125.440 125.440 124.869 0.571 25148 11180 1 17 . 1 1 71 71 GLN HA H 71 4.315 4.315 3.997 0.318 25148 11181 1 17 . 1 1 71 71 GLN C C 71 175.819 175.819 176.791 -0.972 25148 11182 1 17 . 1 1 71 71 GLN CA C 71 57.914 57.914 58.434 -0.520 25148 11183 1 17 . 1 1 71 71 GLN CB C 71 28.307 28.307 28.696 -0.389 25148 11184 1 17 . 1 1 71 71 GLN H H 71 9.097 9.097 8.839 0.258 25148 11185 1 17 . 1 1 72 72 ARG N N 72 116.306 116.306 116.243 0.063 25148 11186 1 17 . 1 1 72 72 ARG HA H 72 4.252 4.252 4.181 0.071 25148 11187 1 17 . 1 1 72 72 ARG C C 72 178.087 178.087 176.147 1.940 25148 11188 1 17 . 1 1 72 72 ARG CA C 72 58.532 58.532 57.591 0.941 25148 11189 1 17 . 1 1 72 72 ARG CB C 72 30.143 30.143 30.688 -0.545 25148 11190 1 17 . 1 1 72 72 ARG H H 72 8.534 8.534 8.262 0.272 25148 11191 1 17 . 1 1 73 73 LEU N N 73 116.734 116.734 114.275 2.459 25148 11192 1 17 . 1 1 73 73 LEU HA H 73 4.621 4.621 4.669 -0.048 25148 11193 1 17 . 1 1 73 73 LEU C C 73 175.946 175.946 175.132 0.814 25148 11194 1 17 . 1 1 73 73 LEU CA C 73 55.250 55.250 55.249 0.001 25148 11195 1 17 . 1 1 73 73 LEU CB C 73 46.960 46.960 44.883 2.077 25148 11196 1 17 . 1 1 73 73 LEU H H 73 7.460 7.460 7.395 0.065 25148 11197 1 17 . 1 1 74 74 GLU N N 74 118.787 118.787 121.786 -2.999 25148 11198 1 17 . 1 1 74 74 GLU HA H 74 5.403 5.403 4.620 0.783 25148 11199 1 17 . 1 1 74 74 GLU C C 74 173.709 173.709 174.502 -0.793 25148 11200 1 17 . 1 1 74 74 GLU CA C 74 54.914 54.914 55.811 -0.897 25148 11201 1 17 . 1 1 74 74 GLU CB C 74 35.053 35.053 33.583 1.470 25148 11202 1 17 . 1 1 74 74 GLU H H 74 7.752 7.752 8.079 -0.327 25148 11203 1 17 . 1 1 75 75 ILE N N 75 119.803 119.803 122.695 -2.892 25148 11204 1 17 . 1 1 75 75 ILE HA H 75 4.507 4.507 4.481 0.026 25148 11205 1 17 . 1 1 75 75 ILE C C 75 172.126 172.126 173.708 -1.582 25148 11206 1 17 . 1 1 75 75 ILE CA C 75 58.664 58.664 60.098 -1.434 25148 11207 1 17 . 1 1 75 75 ILE CB C 75 42.560 42.560 42.026 0.534 25148 11208 1 17 . 1 1 75 75 ILE H H 75 8.975 8.975 8.514 0.461 25148 11209 1 17 . 1 1 76 76 SER N N 76 123.236 123.236 124.354 -1.118 25148 11210 1 17 . 1 1 76 76 SER HA H 76 4.505 4.505 5.051 -0.546 25148 11211 1 17 . 1 1 76 76 SER C C 76 176.145 176.145 175.801 0.344 25148 11212 1 17 . 1 1 76 76 SER CA C 76 58.108 58.108 57.872 0.236 25148 11213 1 17 . 1 1 76 76 SER CB C 76 65.000 65.000 64.540 0.460 25148 11214 1 17 . 1 1 76 76 SER H H 76 8.810 8.810 8.475 0.335 25148 11215 1 17 . 1 1 77 77 ILE N N 77 120.629 120.629 125.010 -4.381 25148 11216 1 17 . 1 1 77 77 ILE HA H 77 3.935 3.935 3.718 0.217 25148 11217 1 17 . 1 1 77 77 ILE C C 77 175.806 175.806 177.001 -1.195 25148 11218 1 17 . 1 1 77 77 ILE CA C 77 61.928 61.928 63.352 -1.424 25148 11219 1 17 . 1 1 77 77 ILE CB C 77 38.031 38.031 38.077 -0.046 25148 11220 1 17 . 1 1 77 77 ILE H H 77 8.321 8.321 8.102 0.219 25148 11221 1 17 . 1 1 78 78 GLU N N 78 121.032 121.032 118.188 2.844 25148 11222 1 17 . 1 1 78 78 GLU HA H 78 4.082 4.082 3.991 0.091 25148 11223 1 17 . 1 1 78 78 GLU C C 78 179.829 179.829 178.472 1.357 25148 11224 1 17 . 1 1 78 78 GLU CA C 78 60.180 60.180 59.259 0.921 25148 11225 1 17 . 1 1 78 78 GLU CB C 78 28.988 28.988 28.927 0.062 25148 11226 1 17 . 1 1 78 78 GLU H H 78 8.222 8.222 8.233 -0.011 25148 11227 1 17 . 1 1 79 79 GLU N N 79 120.710 120.710 120.666 0.044 25148 11228 1 17 . 1 1 79 79 GLU HA H 79 4.012 4.012 4.005 0.007 25148 11229 1 17 . 1 1 79 79 GLU C C 79 180.339 180.339 178.767 1.572 25148 11230 1 17 . 1 1 79 79 GLU CA C 79 59.332 59.332 59.015 0.317 25148 11231 1 17 . 1 1 79 79 GLU CB C 79 29.317 29.317 29.655 -0.338 25148 11232 1 17 . 1 1 79 79 GLU H H 79 7.908 7.908 7.898 0.010 25148 11233 1 17 . 1 1 80 80 ALA N N 80 122.879 122.879 120.915 1.964 25148 11234 1 17 . 1 1 80 80 ALA HA H 80 3.966 3.966 4.018 -0.052 25148 11235 1 17 . 1 1 80 80 ALA C C 80 179.833 179.833 180.088 -0.255 25148 11236 1 17 . 1 1 80 80 ALA CA C 80 55.881 55.881 55.310 0.571 25148 11237 1 17 . 1 1 80 80 ALA CB C 80 18.870 18.870 18.175 0.695 25148 11238 1 17 . 1 1 80 80 ALA H H 80 9.132 9.132 8.016 1.116 25148 11239 1 17 . 1 1 81 81 GLN N N 81 115.829 115.829 116.595 -0.766 25148 11240 1 17 . 1 1 81 81 GLN HA H 81 4.749 4.749 4.333 0.416 25148 11241 1 17 . 1 1 81 81 GLN C C 81 178.126 178.126 177.930 0.196 25148 11242 1 17 . 1 1 81 81 GLN CA C 81 57.682 57.682 57.672 0.010 25148 11243 1 17 . 1 1 81 81 GLN CB C 81 27.307 27.307 28.641 -1.334 25148 11244 1 17 . 1 1 81 81 GLN H H 81 8.709 8.709 7.859 0.850 25148 11245 1 17 . 1 1 82 82 GLY N N 82 105.531 105.531 106.972 -1.441 25148 11246 1 17 . 1 1 82 82 GLY C C 82 174.917 174.917 174.991 -0.074 25148 11247 1 17 . 1 1 82 82 GLY CA C 82 45.915 45.915 46.743 -0.828 25148 11248 1 17 . 1 1 82 82 GLY H H 82 7.479 7.479 7.906 -0.427 25148 11249 1 17 . 1 1 83 83 ILE N N 83 122.828 122.828 113.829 8.999 25148 11250 1 17 . 1 1 83 83 ILE HA H 83 3.970 3.970 4.439 -0.469 25148 11251 1 17 . 1 1 83 83 ILE C C 83 177.209 177.209 175.591 1.618 25148 11252 1 17 . 1 1 83 83 ILE CA C 83 64.305 64.305 61.676 2.629 25148 11253 1 17 . 1 1 83 83 ILE CB C 83 38.452 38.452 40.159 -1.707 25148 11254 1 17 . 1 1 83 83 ILE H H 83 7.634 7.634 7.515 0.119 25148 11255 1 17 . 1 1 84 84 HIS N N 84 118.927 118.927 119.988 -1.061 25148 11256 1 17 . 1 1 84 84 HIS HA H 84 4.713 4.713 4.956 -0.243 25148 11257 1 17 . 1 1 84 84 HIS CA C 84 55.487 55.487 54.744 0.743 25148 11258 1 17 . 1 1 84 84 HIS CB C 84 33.506 33.506 32.732 0.774 25148 11259 1 17 . 1 1 84 84 HIS H H 84 8.155 8.155 8.300 -0.145 25148 11260 1 17 . 1 1 85 85 PRO HA H 85 4.456 4.456 4.484 -0.028 25148 11261 1 17 . 1 1 85 85 PRO C C 85 177.357 177.357 177.375 -0.018 25148 11262 1 17 . 1 1 85 85 PRO CA C 85 64.475 64.475 64.157 0.318 25148 11263 1 17 . 1 1 85 85 PRO CB C 85 32.489 32.489 32.159 0.330 25148 11264 1 17 . 1 1 86 86 GLU N N 86 116.314 116.314 116.782 -0.468 25148 11265 1 17 . 1 1 86 86 GLU HA H 86 4.286 4.286 4.089 0.197 25148 11266 1 17 . 1 1 86 86 GLU C C 86 177.624 177.624 177.124 0.500 25148 11267 1 17 . 1 1 86 86 GLU CA C 86 56.619 56.619 57.201 -0.582 25148 11268 1 17 . 1 1 86 86 GLU CB C 86 29.389 29.389 29.027 0.362 25148 11269 1 17 . 1 1 86 86 GLU H H 86 8.938 8.938 7.998 0.940 25148 11270 1 17 . 1 1 87 87 TYR N N 87 119.773 119.773 119.555 0.218 25148 11271 1 17 . 1 1 87 87 TYR HA H 87 4.744 4.744 4.245 0.499 25148 11272 1 17 . 1 1 87 87 TYR C C 87 174.533 174.533 176.259 -1.726 25148 11273 1 17 . 1 1 87 87 TYR CA C 87 59.117 59.117 59.300 -0.183 25148 11274 1 17 . 1 1 87 87 TYR CB C 87 38.859 38.859 39.116 -0.257 25148 11275 1 17 . 1 1 87 87 TYR H H 87 7.447 7.447 7.394 0.053 25148 11276 1 17 . 1 1 88 88 MET N N 88 118.298 118.298 117.432 0.866 25148 11277 1 17 . 1 1 88 88 MET HA H 88 4.770 4.770 4.655 0.115 25148 11278 1 17 . 1 1 88 88 MET C C 88 175.638 175.638 174.241 1.397 25148 11279 1 17 . 1 1 88 88 MET CA C 88 53.133 53.133 54.201 -1.068 25148 11280 1 17 . 1 1 88 88 MET CB C 88 37.102 37.102 35.902 1.200 25148 11281 1 17 . 1 1 88 88 MET H H 88 9.023 9.023 8.172 0.851 25148 11282 1 17 . 1 1 89 89 VAL N N 89 120.157 120.157 124.022 -3.865 25148 11283 1 17 . 1 1 89 89 VAL HA H 89 3.330 3.330 3.795 -0.465 25148 11284 1 17 . 1 1 89 89 VAL C C 89 177.432 177.432 177.283 0.149 25148 11285 1 17 . 1 1 89 89 VAL CA C 89 65.675 65.675 63.563 2.112 25148 11286 1 17 . 1 1 89 89 VAL CB C 89 31.321 31.321 30.282 1.038 25148 11287 1 17 . 1 1 89 89 VAL H H 89 8.313 8.313 8.594 -0.281 25148 11288 1 17 . 1 1 90 90 GLY N N 90 116.935 116.935 116.224 0.711 25148 11289 1 17 . 1 1 90 90 GLY C C 90 175.196 175.196 174.251 0.945 25148 11290 1 17 . 1 1 90 90 GLY CA C 90 44.685 44.685 44.859 -0.174 25148 11291 1 17 . 1 1 90 90 GLY H H 90 8.551 8.551 8.792 -0.241 25148 11292 1 17 . 1 1 91 91 ASP N N 91 121.616 121.616 121.252 0.364 25148 11293 1 17 . 1 1 91 91 ASP HA H 91 4.790 4.790 4.927 -0.137 25148 11294 1 17 . 1 1 91 91 ASP C C 91 174.431 174.431 174.547 -0.116 25148 11295 1 17 . 1 1 91 91 ASP CA C 91 55.011 55.011 53.261 1.750 25148 11296 1 17 . 1 1 91 91 ASP CB C 91 42.079 42.079 42.508 -0.429 25148 11297 1 17 . 1 1 91 91 ASP H H 91 8.073 8.073 8.112 -0.039 25148 11298 1 17 . 1 1 92 92 VAL N N 92 118.919 118.919 113.784 5.135 25148 11299 1 17 . 1 1 92 92 VAL HA H 92 4.709 4.709 4.966 -0.257 25148 11300 1 17 . 1 1 92 92 VAL C C 92 175.602 175.602 173.859 1.743 25148 11301 1 17 . 1 1 92 92 VAL CA C 92 61.527 61.527 59.582 1.945 25148 11302 1 17 . 1 1 92 92 VAL CB C 92 34.110 34.110 34.747 -0.637 25148 11303 1 17 . 1 1 92 92 VAL H H 92 8.216 8.216 8.156 0.060 25148 11304 1 17 . 1 1 93 93 VAL N N 93 123.922 123.922 121.919 2.003 25148 11305 1 17 . 1 1 93 93 VAL HA H 93 4.231 4.231 4.189 0.042 25148 11306 1 17 . 1 1 93 93 VAL C C 93 174.105 174.105 174.002 0.103 25148 11307 1 17 . 1 1 93 93 VAL CA C 93 59.644 59.644 59.841 -0.197 25148 11308 1 17 . 1 1 93 93 VAL CB C 93 34.661 34.661 35.345 -0.684 25148 11309 1 17 . 1 1 93 93 VAL H H 93 8.812 8.812 7.894 0.918 25148 11310 1 17 . 1 1 94 94 GLU N N 94 123.605 123.605 128.399 -4.794 25148 11311 1 17 . 1 1 94 94 GLU HA H 94 5.347 5.347 5.131 0.216 25148 11312 1 17 . 1 1 94 94 GLU C C 94 175.708 175.708 175.666 0.042 25148 11313 1 17 . 1 1 94 94 GLU CA C 94 54.979 54.979 55.300 -0.321 25148 11314 1 17 . 1 1 94 94 GLU CB C 94 31.612 31.612 30.804 0.808 25148 11315 1 17 . 1 1 94 94 GLU H H 94 8.312 8.312 8.193 0.119 25148 11316 1 17 . 1 1 95 95 ILE N N 95 123.581 123.581 124.679 -1.098 25148 11317 1 17 . 1 1 95 95 ILE HA H 95 4.601 4.601 4.411 0.190 25148 11318 1 17 . 1 1 95 95 ILE C C 95 175.081 175.081 175.602 -0.521 25148 11319 1 17 . 1 1 95 95 ILE CA C 95 58.601 58.601 59.559 -0.959 25148 11320 1 17 . 1 1 95 95 ILE CB C 95 41.727 41.727 40.777 0.950 25148 11321 1 17 . 1 1 95 95 ILE H H 95 9.045 9.045 8.039 1.006 25148 11322 1 17 . 1 1 96 96 GLU N N 96 128.094 128.094 127.173 0.921 25148 11323 1 17 . 1 1 96 96 GLU HA H 96 4.098 4.098 4.400 -0.302 25148 11324 1 17 . 1 1 96 96 GLU C C 96 176.845 176.845 175.866 0.979 25148 11325 1 17 . 1 1 96 96 GLU CA C 96 57.853 57.853 58.128 -0.275 25148 11326 1 17 . 1 1 96 96 GLU CB C 96 28.323 28.323 29.382 -1.059 25148 11327 1 17 . 1 1 96 96 GLU H H 96 9.256 9.256 8.875 0.381 25148 11328 1 17 . 1 1 97 97 VAL N N 97 118.446 118.446 123.775 -5.329 25148 11329 1 17 . 1 1 97 97 VAL HA H 97 4.568 4.568 4.252 0.316 25148 11330 1 17 . 1 1 97 97 VAL C C 97 175.051 175.051 175.007 0.044 25148 11331 1 17 . 1 1 97 97 VAL CA C 97 59.796 59.796 61.154 -1.358 25148 11332 1 17 . 1 1 97 97 VAL CB C 97 32.399 32.399 33.645 -1.246 25148 11333 1 17 . 1 1 97 97 VAL H H 97 8.609 8.609 8.791 -0.182 25148 11334 1 17 . 1 1 98 98 THR N N 98 119.118 119.118 117.021 2.097 25148 11335 1 17 . 1 1 98 98 THR HA H 98 3.320 3.320 4.003 -0.683 25148 11336 1 17 . 1 1 98 98 THR CA C 98 61.628 61.628 58.857 2.771 25148 11337 1 17 . 1 1 98 98 THR CB C 98 70.031 70.031 69.135 0.896 25148 11338 1 17 . 1 1 98 98 THR H H 98 7.396 7.396 7.554 -0.158 25148 11339 1 17 . 1 1 99 99 PRO HA H 99 4.458 4.458 4.552 -0.094 25148 11340 1 17 . 1 1 99 99 PRO CA C 99 62.348 62.348 62.522 -0.174 25148 11341 1 17 . 1 1 99 99 PRO CB C 99 33.182 33.182 32.600 0.582 25148 11342 1 17 . 1 1 100 100 LYS HA H 100 4.126 4.126 4.184 -0.058 25148 11343 1 17 . 1 1 100 100 LYS CA C 100 58.773 58.773 57.696 1.077 25148 11344 1 17 . 1 1 100 100 LYS CB C 100 32.195 32.195 32.057 0.138 25148 11345 1 17 . 1 1 101 101 ASP HA H 101 4.924 4.924 4.764 0.160 25148 11346 1 17 . 1 1 101 101 ASP C C 101 176.884 176.884 176.615 0.269 25148 11347 1 17 . 1 1 101 101 ASP CA C 101 54.134 54.134 53.072 1.062 25148 11348 1 17 . 1 1 101 101 ASP CB C 101 40.272 40.272 40.724 -0.452 25148 11349 1 17 . 1 1 102 102 PHE N N 102 118.703 118.703 121.193 -2.490 25148 11350 1 17 . 1 1 102 102 PHE HA H 102 4.295 4.295 4.201 0.094 25148 11351 1 17 . 1 1 102 102 PHE C C 102 176.477 176.477 177.126 -0.649 25148 11352 1 17 . 1 1 102 102 PHE CA C 102 60.748 60.748 59.944 0.804 25148 11353 1 17 . 1 1 102 102 PHE CB C 102 39.667 39.667 39.198 0.469 25148 11354 1 17 . 1 1 102 102 PHE H H 102 7.862 7.862 7.697 0.165 25148 11355 1 17 . 1 1 103 103 GLY CA C 103 47.430 47.430 47.228 0.202 25148 11356 1 17 . 1 1 104 104 ARG N N 104 121.819 121.819 120.929 0.890 25148 11357 1 17 . 1 1 104 104 ARG HA H 104 4.176 4.176 4.185 -0.009 25148 11358 1 17 . 1 1 104 104 ARG C C 104 178.912 178.912 178.436 0.476 25148 11359 1 17 . 1 1 104 104 ARG CA C 104 59.235 59.235 58.244 0.991 25148 11360 1 17 . 1 1 104 104 ARG CB C 104 30.000 30.000 29.745 0.255 25148 11361 1 17 . 1 1 104 104 ARG H H 104 7.809 7.809 7.403 0.406 25148 11362 1 17 . 1 1 105 105 ILE N N 105 120.331 120.331 121.705 -1.374 25148 11363 1 17 . 1 1 105 105 ILE HA H 105 3.836 3.836 3.689 0.147 25148 11364 1 17 . 1 1 105 105 ILE C C 105 179.206 179.206 177.868 1.338 25148 11365 1 17 . 1 1 105 105 ILE CA C 105 63.025 63.025 64.720 -1.695 25148 11366 1 17 . 1 1 105 105 ILE CB C 105 38.127 38.127 37.451 0.676 25148 11367 1 17 . 1 1 105 105 ILE H H 105 7.203 7.203 7.480 -0.277 25148 11368 1 17 . 1 1 106 106 ALA N N 106 124.867 124.867 121.669 3.198 25148 11369 1 17 . 1 1 106 106 ALA HA H 106 3.665 3.665 3.577 0.088 25148 11370 1 17 . 1 1 106 106 ALA C C 106 178.590 178.590 179.006 -0.416 25148 11371 1 17 . 1 1 106 106 ALA CA C 106 54.842 54.842 55.105 -0.263 25148 11372 1 17 . 1 1 106 106 ALA CB C 106 18.659 18.659 17.765 0.894 25148 11373 1 17 . 1 1 106 106 ALA H H 106 8.813 8.813 8.146 0.667 25148 11374 1 17 . 1 1 107 107 ALA N N 107 119.597 119.597 120.702 -1.105 25148 11375 1 17 . 1 1 107 107 ALA HA H 107 4.014 4.014 4.017 -0.003 25148 11376 1 17 . 1 1 107 107 ALA C C 107 180.214 180.214 179.488 0.726 25148 11377 1 17 . 1 1 107 107 ALA CA C 107 55.454 55.454 54.677 0.777 25148 11378 1 17 . 1 1 107 107 ALA CB C 107 18.260 18.260 18.129 0.131 25148 11379 1 17 . 1 1 107 107 ALA H H 107 8.012 8.012 7.515 0.497 25148 11380 1 17 . 1 1 108 108 GLN N N 108 116.896 116.896 118.374 -1.478 25148 11381 1 17 . 1 1 108 108 GLN HA H 108 4.054 4.054 4.002 0.052 25148 11382 1 17 . 1 1 108 108 GLN C C 108 178.784 178.784 178.381 0.403 25148 11383 1 17 . 1 1 108 108 GLN CA C 108 58.705 58.705 59.041 -0.336 25148 11384 1 17 . 1 1 108 108 GLN CB C 108 28.647 28.647 28.780 -0.133 25148 11385 1 17 . 1 1 108 108 GLN H H 108 7.498 7.498 8.282 -0.784 25148 11386 1 17 . 1 1 109 109 THR N N 109 117.495 117.495 116.001 1.494 25148 11387 1 17 . 1 1 109 109 THR HA H 109 3.917 3.917 4.116 -0.199 25148 11388 1 17 . 1 1 109 109 THR C C 109 175.732 175.732 175.877 -0.145 25148 11389 1 17 . 1 1 109 109 THR CA C 109 66.989 66.989 66.073 0.916 25148 11390 1 17 . 1 1 109 109 THR CB C 109 68.766 68.766 68.529 0.237 25148 11391 1 17 . 1 1 109 109 THR H H 109 8.203 8.203 8.272 -0.069 25148 11392 1 17 . 1 1 110 110 ALA N N 110 122.308 122.308 125.049 -2.741 25148 11393 1 17 . 1 1 110 110 ALA HA H 110 3.854 3.854 4.017 -0.163 25148 11394 1 17 . 1 1 110 110 ALA C C 110 178.380 178.380 178.842 -0.462 25148 11395 1 17 . 1 1 110 110 ALA CA C 110 55.903 55.903 55.011 0.892 25148 11396 1 17 . 1 1 110 110 ALA CB C 110 18.524 18.524 18.296 0.228 25148 11397 1 17 . 1 1 110 110 ALA H H 110 8.668 8.668 7.878 0.790 25148 11398 1 17 . 1 1 111 111 LYS N N 111 115.552 115.552 118.246 -2.694 25148 11399 1 17 . 1 1 111 111 LYS HA H 111 3.923 3.923 3.958 -0.035 25148 11400 1 17 . 1 1 111 111 LYS C C 111 179.111 179.111 178.871 0.240 25148 11401 1 17 . 1 1 111 111 LYS CA C 111 59.825 59.825 59.372 0.453 25148 11402 1 17 . 1 1 111 111 LYS CB C 111 32.251 32.251 31.657 0.594 25148 11403 1 17 . 1 1 111 111 LYS H H 111 7.642 7.642 8.495 -0.853 25148 11404 1 17 . 1 1 112 112 GLN N N 112 120.178 120.178 118.863 1.315 25148 11405 1 17 . 1 1 112 112 GLN HA H 112 4.060 4.060 4.093 -0.033 25148 11406 1 17 . 1 1 112 112 GLN C C 112 178.355 178.355 178.374 -0.019 25148 11407 1 17 . 1 1 112 112 GLN CA C 112 59.240 59.240 58.229 1.011 25148 11408 1 17 . 1 1 112 112 GLN CB C 112 28.250 28.250 28.405 -0.155 25148 11409 1 17 . 1 1 112 112 GLN H H 112 7.798 7.798 7.682 0.116 25148 11410 1 17 . 1 1 113 113 VAL N N 113 119.799 119.799 120.894 -1.095 25148 11411 1 17 . 1 1 113 113 VAL HA H 113 3.705 3.705 3.693 0.012 25148 11412 1 17 . 1 1 113 113 VAL C C 113 178.303 178.303 177.660 0.643 25148 11413 1 17 . 1 1 113 113 VAL CA C 113 66.277 66.277 66.635 -0.358 25148 11414 1 17 . 1 1 113 113 VAL CB C 113 31.954 31.954 32.090 -0.136 25148 11415 1 17 . 1 1 113 113 VAL H H 113 8.105 8.105 7.441 0.664 25148 11416 1 17 . 1 1 114 114 VAL N N 114 118.265 118.265 116.721 1.544 25148 11417 1 17 . 1 1 114 114 VAL HA H 114 3.392 3.392 3.612 -0.220 25148 11418 1 17 . 1 1 114 114 VAL C C 114 177.360 177.360 177.836 -0.476 25148 11419 1 17 . 1 1 114 114 VAL CA C 114 67.832 67.832 66.703 1.129 25148 11420 1 17 . 1 1 114 114 VAL CB C 114 31.801 31.801 31.360 0.441 25148 11421 1 17 . 1 1 114 114 VAL H H 114 8.180 8.180 8.412 -0.232 25148 11422 1 17 . 1 1 115 115 THR N N 115 113.460 113.460 114.297 -0.837 25148 11423 1 17 . 1 1 115 115 THR HA H 115 3.856 3.856 4.072 -0.216 25148 11424 1 17 . 1 1 115 115 THR C C 115 176.529 176.529 176.436 0.093 25148 11425 1 17 . 1 1 115 115 THR CA C 115 66.706 66.706 66.017 0.689 25148 11426 1 17 . 1 1 115 115 THR CB C 115 69.008 69.008 68.431 0.577 25148 11427 1 17 . 1 1 115 115 THR H H 115 8.143 8.143 7.837 0.306 25148 11428 1 17 . 1 1 116 116 GLN N N 116 120.129 120.129 121.069 -0.940 25148 11429 1 17 . 1 1 116 116 GLN HA H 116 4.054 4.054 4.064 -0.010 25148 11430 1 17 . 1 1 116 116 GLN C C 116 178.100 178.100 178.344 -0.244 25148 11431 1 17 . 1 1 116 116 GLN CA C 116 58.950 58.950 59.257 -0.307 25148 11432 1 17 . 1 1 116 116 GLN CB C 116 28.244 28.244 28.601 -0.357 25148 11433 1 17 . 1 1 116 116 GLN H H 116 7.936 7.936 7.544 0.392 25148 11434 1 17 . 1 1 117 117 ARG N N 117 117.838 117.838 119.229 -1.391 25148 11435 1 17 . 1 1 117 117 ARG HA H 117 4.174 4.174 4.066 0.108 25148 11436 1 17 . 1 1 117 117 ARG C C 117 179.138 179.138 178.729 0.409 25148 11437 1 17 . 1 1 117 117 ARG CA C 117 57.461 57.461 58.184 -0.724 25148 11438 1 17 . 1 1 117 117 ARG CB C 117 29.548 29.548 29.294 0.254 25148 11439 1 17 . 1 1 117 117 ARG H H 117 8.240 8.240 8.089 0.150 25148 11440 1 17 . 1 1 118 118 VAL N N 118 120.278 120.278 119.470 0.808 25148 11441 1 17 . 1 1 118 118 VAL HA H 118 3.709 3.709 3.668 0.041 25148 11442 1 17 . 1 1 118 118 VAL C C 118 177.597 177.597 177.937 -0.340 25148 11443 1 17 . 1 1 118 118 VAL CA C 118 66.246 66.246 66.477 -0.231 25148 11444 1 17 . 1 1 118 118 VAL CB C 118 31.785 31.785 30.935 0.850 25148 11445 1 17 . 1 1 118 118 VAL H H 118 8.480 8.480 7.545 0.935 25148 11446 1 17 . 1 1 119 119 ARG N N 119 120.197 120.197 119.712 0.485 25148 11447 1 17 . 1 1 119 119 ARG HA H 119 4.173 4.173 4.215 -0.042 25148 11448 1 17 . 1 1 119 119 ARG C C 119 178.864 178.864 179.237 -0.373 25148 11449 1 17 . 1 1 119 119 ARG CA C 119 58.772 58.772 59.670 -0.898 25148 11450 1 17 . 1 1 119 119 ARG CB C 119 29.873 29.873 29.957 -0.084 25148 11451 1 17 . 1 1 119 119 ARG H H 119 7.899 7.899 7.749 0.150 25148 11452 1 17 . 1 1 120 120 GLU N N 120 118.768 118.768 119.255 -0.487 25148 11453 1 17 . 1 1 120 120 GLU HA H 120 4.110 4.110 4.060 0.050 25148 11454 1 17 . 1 1 120 120 GLU C C 120 177.823 177.823 178.804 -0.981 25148 11455 1 17 . 1 1 120 120 GLU CA C 120 58.223 58.223 59.011 -0.788 25148 11456 1 17 . 1 1 120 120 GLU CB C 120 29.854 29.854 29.515 0.339 25148 11457 1 17 . 1 1 120 120 GLU H H 120 8.084 8.084 7.663 0.420 25148 11458 1 17 . 1 1 121 121 ALA N N 121 121.984 121.984 121.424 0.560 25148 11459 1 17 . 1 1 121 121 ALA HA H 121 4.296 4.296 4.112 0.184 25148 11460 1 17 . 1 1 121 121 ALA C C 121 178.586 178.586 180.064 -1.478 25148 11461 1 17 . 1 1 121 121 ALA CA C 121 53.475 53.475 54.982 -1.507 25148 11462 1 17 . 1 1 121 121 ALA CB C 121 18.856 18.856 18.390 0.466 25148 11463 1 17 . 1 1 121 121 ALA H H 121 7.810 7.810 8.111 -0.301 25148 11464 1 17 . 1 1 122 122 GLU N N 122 118.229 118.229 116.853 1.376 25148 11465 1 17 . 1 1 122 122 GLU HA H 122 4.241 4.241 4.057 0.184 25148 11466 1 17 . 1 1 122 122 GLU C C 122 176.839 176.839 178.713 -1.874 25148 11467 1 17 . 1 1 122 122 GLU CA C 122 57.118 57.118 58.130 -1.012 25148 11468 1 17 . 1 1 122 122 GLU CB C 122 30.018 30.018 29.410 0.608 25148 11469 1 17 . 1 1 122 122 GLU H H 122 7.938 7.938 8.124 -0.186 25148 11470 1 17 . 1 1 123 123 ARG N N 123 120.601 120.601 119.917 0.684 25148 11471 1 17 . 1 1 123 123 ARG HA H 123 4.348 4.348 4.142 0.206 25148 11472 1 17 . 1 1 123 123 ARG C C 123 176.071 176.071 176.501 -0.430 25148 11473 1 17 . 1 1 123 123 ARG CA C 123 56.510 56.510 57.409 -0.899 25148 11474 1 17 . 1 1 123 123 ARG CB C 123 30.765 30.765 30.589 0.176 25148 11475 1 17 . 1 1 123 123 ARG H H 123 7.977 7.977 8.147 -0.170 25148 11476 1 18 . 1 1 4 4 GLU HA H 4 4.138 4.138 3.978 0.160 25148 11477 1 18 . 1 1 4 4 GLU C C 4 179.152 179.152 177.727 1.425 25148 11478 1 18 . 1 1 4 4 GLU CA C 4 59.566 59.566 59.670 -0.104 25148 11479 1 18 . 1 1 4 4 GLU CB C 4 29.407 29.407 29.465 -0.058 25148 11480 1 18 . 1 1 5 5 LEU N N 5 121.360 121.360 116.822 4.538 25148 11481 1 18 . 1 1 5 5 LEU HA H 5 4.195 4.195 4.025 0.170 25148 11482 1 18 . 1 1 5 5 LEU C C 5 178.179 178.179 178.273 -0.094 25148 11483 1 18 . 1 1 5 5 LEU CA C 5 57.830 57.830 57.597 0.233 25148 11484 1 18 . 1 1 5 5 LEU CB C 5 41.630 41.630 41.387 0.243 25148 11485 1 18 . 1 1 5 5 LEU H H 5 7.877 7.877 7.924 -0.047 25148 11486 1 18 . 1 1 6 6 LEU N N 6 118.058 118.058 119.014 -0.956 25148 11487 1 18 . 1 1 6 6 LEU HA H 6 3.919 3.919 3.985 -0.066 25148 11488 1 18 . 1 1 6 6 LEU C C 6 180.274 180.274 179.115 1.159 25148 11489 1 18 . 1 1 6 6 LEU CA C 6 58.221 58.221 57.713 0.508 25148 11490 1 18 . 1 1 6 6 LEU CB C 6 40.684 40.684 41.217 -0.533 25148 11491 1 18 . 1 1 6 6 LEU H H 6 7.685 7.685 7.821 -0.136 25148 11492 1 18 . 1 1 7 7 ASP N N 7 120.662 120.662 118.538 2.124 25148 11493 1 18 . 1 1 7 7 ASP HA H 7 4.416 4.416 4.354 0.062 25148 11494 1 18 . 1 1 7 7 ASP C C 7 178.738 178.738 177.927 0.811 25148 11495 1 18 . 1 1 7 7 ASP CA C 7 57.519 57.519 57.003 0.516 25148 11496 1 18 . 1 1 7 7 ASP CB C 7 40.167 40.167 40.837 -0.670 25148 11497 1 18 . 1 1 7 7 ASP H H 7 8.427 8.427 7.508 0.919 25148 11498 1 18 . 1 1 8 8 ALA N N 8 122.612 122.612 122.856 -0.244 25148 11499 1 18 . 1 1 8 8 ALA HA H 8 4.146 4.146 4.069 0.077 25148 11500 1 18 . 1 1 8 8 ALA C C 8 180.787 180.787 179.772 1.015 25148 11501 1 18 . 1 1 8 8 ALA CA C 8 55.165 55.165 55.245 -0.080 25148 11502 1 18 . 1 1 8 8 ALA CB C 8 17.711 17.711 18.387 -0.676 25148 11503 1 18 . 1 1 8 8 ALA H H 8 7.847 7.847 7.842 0.005 25148 11504 1 18 . 1 1 9 9 LEU N N 9 116.977 116.977 116.865 0.112 25148 11505 1 18 . 1 1 9 9 LEU HA H 9 4.115 4.115 3.931 0.184 25148 11506 1 18 . 1 1 9 9 LEU C C 9 179.510 179.510 179.170 0.340 25148 11507 1 18 . 1 1 9 9 LEU CA C 9 57.468 57.468 57.519 -0.051 25148 11508 1 18 . 1 1 9 9 LEU CB C 9 41.203 41.203 41.643 -0.440 25148 11509 1 18 . 1 1 9 9 LEU H H 9 8.256 8.256 7.682 0.574 25148 11510 1 18 . 1 1 10 10 THR N N 10 118.764 118.764 114.836 3.928 25148 11511 1 18 . 1 1 10 10 THR HA H 10 4.487 4.487 4.097 0.390 25148 11512 1 18 . 1 1 10 10 THR C C 10 176.567 176.567 176.845 -0.278 25148 11513 1 18 . 1 1 10 10 THR CA C 10 68.768 68.768 66.293 2.475 25148 11514 1 18 . 1 1 10 10 THR CB C 10 66.961 66.961 68.709 -1.748 25148 11515 1 18 . 1 1 10 10 THR H H 10 8.218 8.218 7.336 0.882 25148 11516 1 18 . 1 1 11 11 ILE N N 11 122.555 122.555 122.400 0.155 25148 11517 1 18 . 1 1 11 11 ILE HA H 11 3.779 3.779 3.646 0.133 25148 11518 1 18 . 1 1 11 11 ILE C C 11 177.793 177.793 177.862 -0.069 25148 11519 1 18 . 1 1 11 11 ILE CA C 11 64.695 64.695 65.462 -0.767 25148 11520 1 18 . 1 1 11 11 ILE CB C 11 37.856 37.856 37.430 0.426 25148 11521 1 18 . 1 1 11 11 ILE H H 11 7.632 7.632 7.905 -0.273 25148 11522 1 18 . 1 1 12 12 LEU N N 12 120.469 120.469 118.652 1.817 25148 11523 1 18 . 1 1 12 12 LEU HA H 12 4.065 4.065 3.956 0.109 25148 11524 1 18 . 1 1 12 12 LEU C C 12 179.139 179.139 178.775 0.364 25148 11525 1 18 . 1 1 12 12 LEU CA C 12 57.944 57.944 57.318 0.626 25148 11526 1 18 . 1 1 12 12 LEU CB C 12 42.170 42.170 40.767 1.403 25148 11527 1 18 . 1 1 12 12 LEU H H 12 7.951 7.951 7.685 0.266 25148 11528 1 18 . 1 1 13 13 GLU N N 13 119.669 119.669 118.911 0.758 25148 11529 1 18 . 1 1 13 13 GLU HA H 13 4.183 4.183 3.966 0.217 25148 11530 1 18 . 1 1 13 13 GLU C C 13 179.007 179.007 177.718 1.289 25148 11531 1 18 . 1 1 13 13 GLU CA C 13 59.703 59.703 58.854 0.849 25148 11532 1 18 . 1 1 13 13 GLU CB C 13 30.110 30.110 28.924 1.186 25148 11533 1 18 . 1 1 13 13 GLU H H 13 8.003 8.003 8.380 -0.377 25148 11534 1 18 . 1 1 14 14 LYS N N 14 118.935 118.935 118.540 0.395 25148 11535 1 18 . 1 1 14 14 LYS HA H 14 4.124 4.124 4.027 0.097 25148 11536 1 18 . 1 1 14 14 LYS CA C 14 58.847 58.847 57.967 0.880 25148 11537 1 18 . 1 1 14 14 LYS CB C 14 33.053 33.053 32.520 0.533 25148 11538 1 18 . 1 1 14 14 LYS H H 14 7.862 7.862 7.683 0.179 25148 11539 1 18 . 1 1 15 15 GLU HA H 15 3.693 3.693 4.383 -0.690 25148 11540 1 18 . 1 1 15 15 GLU CA C 15 56.688 56.688 55.767 0.920 25148 11541 1 18 . 1 1 15 15 GLU CB C 15 32.204 32.204 30.452 1.752 25148 11542 1 18 . 1 1 16 16 LYS HA H 16 4.678 4.678 4.416 0.262 25148 11543 1 18 . 1 1 16 16 LYS CA C 16 55.135 55.135 55.550 -0.415 25148 11544 1 18 . 1 1 16 16 LYS CB C 16 34.049 34.049 33.338 0.711 25148 11545 1 18 . 1 1 17 17 GLY CA C 17 46.541 46.541 45.509 1.032 25148 11546 1 18 . 1 1 18 18 ILE N N 18 115.364 115.364 121.254 -5.890 25148 11547 1 18 . 1 1 18 18 ILE HA H 18 4.079 4.079 4.185 -0.106 25148 11548 1 18 . 1 1 18 18 ILE C C 18 174.751 174.751 175.429 -0.678 25148 11549 1 18 . 1 1 18 18 ILE CA C 18 60.333 60.333 60.005 0.328 25148 11550 1 18 . 1 1 18 18 ILE CB C 18 39.044 39.044 36.944 2.100 25148 11551 1 18 . 1 1 18 18 ILE H H 18 8.203 8.203 7.808 0.395 25148 11552 1 18 . 1 1 19 19 SER N N 19 119.891 119.891 121.508 -1.617 25148 11553 1 18 . 1 1 19 19 SER HA H 19 4.362 4.362 4.363 -0.001 25148 11554 1 18 . 1 1 19 19 SER CA C 19 58.476 58.476 59.061 -0.585 25148 11555 1 18 . 1 1 19 19 SER CB C 19 63.533 63.533 63.752 -0.219 25148 11556 1 18 . 1 1 19 19 SER H H 19 8.253 8.253 8.460 -0.207 25148 11557 1 18 . 1 1 20 20 LYS N N 20 124.782 124.782 127.878 -3.096 25148 11558 1 18 . 1 1 20 20 LYS HA H 20 4.137 4.137 4.119 0.018 25148 11559 1 18 . 1 1 20 20 LYS C C 20 177.889 177.889 177.710 0.179 25148 11560 1 18 . 1 1 20 20 LYS CA C 20 59.485 59.485 58.936 0.549 25148 11561 1 18 . 1 1 20 20 LYS CB C 20 32.711 32.711 32.227 0.484 25148 11562 1 18 . 1 1 20 20 LYS H H 20 8.918 8.918 8.766 0.152 25148 11563 1 18 . 1 1 21 21 GLU N N 21 117.831 117.831 118.294 -0.463 25148 11564 1 18 . 1 1 21 21 GLU HA H 21 3.957 3.957 4.062 -0.105 25148 11565 1 18 . 1 1 21 21 GLU C C 21 178.822 178.822 178.647 0.175 25148 11566 1 18 . 1 1 21 21 GLU CA C 21 59.529 59.529 59.086 0.443 25148 11567 1 18 . 1 1 21 21 GLU CB C 21 29.237 29.237 29.234 0.003 25148 11568 1 18 . 1 1 21 21 GLU H H 21 8.361 8.361 8.568 -0.207 25148 11569 1 18 . 1 1 22 22 ILE N N 22 118.690 118.690 118.167 0.523 25148 11570 1 18 . 1 1 22 22 ILE HA H 22 3.884 3.884 3.950 -0.066 25148 11571 1 18 . 1 1 22 22 ILE C C 22 179.247 179.247 177.663 1.584 25148 11572 1 18 . 1 1 22 22 ILE CA C 22 63.735 63.735 63.824 -0.089 25148 11573 1 18 . 1 1 22 22 ILE CB C 22 37.415 37.415 38.140 -0.725 25148 11574 1 18 . 1 1 22 22 ILE H H 22 7.353 7.353 7.344 0.009 25148 11575 1 18 . 1 1 23 23 ILE N N 23 120.880 120.880 120.645 0.235 25148 11576 1 18 . 1 1 23 23 ILE HA H 23 3.733 3.733 3.752 -0.019 25148 11577 1 18 . 1 1 23 23 ILE C C 23 177.817 177.817 178.111 -0.294 25148 11578 1 18 . 1 1 23 23 ILE CA C 23 64.172 64.172 63.725 0.447 25148 11579 1 18 . 1 1 23 23 ILE CB C 23 36.473 36.473 36.854 -0.381 25148 11580 1 18 . 1 1 23 23 ILE H H 23 7.571 7.571 7.062 0.509 25148 11581 1 18 . 1 1 24 24 ILE N N 24 121.460 121.460 118.712 2.748 25148 11582 1 18 . 1 1 24 24 ILE HA H 24 3.486 3.486 3.613 -0.127 25148 11583 1 18 . 1 1 24 24 ILE C C 24 177.759 177.759 177.702 0.057 25148 11584 1 18 . 1 1 24 24 ILE CA C 24 66.641 66.641 65.933 0.708 25148 11585 1 18 . 1 1 24 24 ILE CB C 24 37.307 37.307 37.390 -0.083 25148 11586 1 18 . 1 1 24 24 ILE H H 24 8.709 8.709 7.757 0.952 25148 11587 1 18 . 1 1 25 25 GLU N N 25 119.323 119.323 118.682 0.641 25148 11588 1 18 . 1 1 25 25 GLU HA H 25 4.177 4.177 3.930 0.247 25148 11589 1 18 . 1 1 25 25 GLU C C 25 179.348 179.348 178.552 0.796 25148 11590 1 18 . 1 1 25 25 GLU CA C 25 59.951 59.951 59.180 0.771 25148 11591 1 18 . 1 1 25 25 GLU CB C 25 29.340 29.340 29.203 0.137 25148 11592 1 18 . 1 1 25 25 GLU H H 25 8.048 8.048 7.678 0.370 25148 11593 1 18 . 1 1 26 26 ALA N N 26 122.390 122.390 122.721 -0.331 25148 11594 1 18 . 1 1 26 26 ALA HA H 26 4.325 4.325 4.110 0.215 25148 11595 1 18 . 1 1 26 26 ALA C C 26 181.440 181.440 179.753 1.687 25148 11596 1 18 . 1 1 26 26 ALA CA C 26 54.935 54.935 54.926 0.009 25148 11597 1 18 . 1 1 26 26 ALA CB C 26 17.834 17.834 18.274 -0.440 25148 11598 1 18 . 1 1 26 26 ALA H H 26 7.768 7.768 7.841 -0.073 25148 11599 1 18 . 1 1 27 27 ILE N N 27 122.342 122.342 119.605 2.737 25148 11600 1 18 . 1 1 27 27 ILE HA H 27 3.575 3.575 3.625 -0.050 25148 11601 1 18 . 1 1 27 27 ILE C C 27 177.541 177.541 178.100 -0.559 25148 11602 1 18 . 1 1 27 27 ILE CA C 27 66.536 66.536 65.513 1.023 25148 11603 1 18 . 1 1 27 27 ILE CB C 27 37.886 37.886 37.749 0.137 25148 11604 1 18 . 1 1 27 27 ILE H H 27 8.805 8.805 7.561 1.244 25148 11605 1 18 . 1 1 28 28 GLU N N 28 120.188 120.188 119.334 0.854 25148 11606 1 18 . 1 1 28 28 GLU HA H 28 3.687 3.687 3.906 -0.219 25148 11607 1 18 . 1 1 28 28 GLU C C 28 178.707 178.707 179.026 -0.319 25148 11608 1 18 . 1 1 28 28 GLU CA C 28 61.458 61.458 59.815 1.643 25148 11609 1 18 . 1 1 28 28 GLU CB C 28 29.624 29.624 29.233 0.391 25148 11610 1 18 . 1 1 28 28 GLU H H 28 8.882 8.882 7.709 1.173 25148 11611 1 18 . 1 1 29 29 ALA N N 29 119.293 119.293 121.091 -1.798 25148 11612 1 18 . 1 1 29 29 ALA HA H 29 4.214 4.214 4.138 0.076 25148 11613 1 18 . 1 1 29 29 ALA C C 29 181.200 181.200 179.643 1.557 25148 11614 1 18 . 1 1 29 29 ALA CA C 29 55.435 55.435 54.875 0.560 25148 11615 1 18 . 1 1 29 29 ALA CB C 29 18.090 18.090 18.092 -0.002 25148 11616 1 18 . 1 1 29 29 ALA H H 29 8.065 8.065 7.970 0.095 25148 11617 1 18 . 1 1 30 30 ALA N N 30 121.729 121.729 121.436 0.293 25148 11618 1 18 . 1 1 30 30 ALA HA H 30 4.307 4.307 4.178 0.129 25148 11619 1 18 . 1 1 30 30 ALA C C 30 181.315 181.315 179.700 1.615 25148 11620 1 18 . 1 1 30 30 ALA CA C 30 54.594 54.594 54.635 -0.041 25148 11621 1 18 . 1 1 30 30 ALA CB C 30 18.704 18.704 18.441 0.263 25148 11622 1 18 . 1 1 30 30 ALA H H 30 8.099 8.099 7.594 0.505 25148 11623 1 18 . 1 1 31 31 LEU N N 31 120.900 120.900 121.085 -0.185 25148 11624 1 18 . 1 1 31 31 LEU HA H 31 4.347 4.347 4.127 0.220 25148 11625 1 18 . 1 1 31 31 LEU C C 31 179.137 179.137 178.911 0.226 25148 11626 1 18 . 1 1 31 31 LEU CA C 31 57.569 57.569 59.006 -1.437 25148 11627 1 18 . 1 1 31 31 LEU CB C 31 42.353 42.353 42.204 0.149 25148 11628 1 18 . 1 1 31 31 LEU H H 31 8.863 8.863 7.993 0.870 25148 11629 1 18 . 1 1 32 32 ILE N N 32 122.410 122.410 119.085 3.325 25148 11630 1 18 . 1 1 32 32 ILE HA H 32 3.699 3.699 3.627 0.072 25148 11631 1 18 . 1 1 32 32 ILE C C 32 178.303 178.303 177.612 0.691 25148 11632 1 18 . 1 1 32 32 ILE CA C 32 66.066 66.066 65.435 0.631 25148 11633 1 18 . 1 1 32 32 ILE CB C 32 37.882 37.882 37.971 -0.089 25148 11634 1 18 . 1 1 32 32 ILE H H 32 8.234 8.234 8.408 -0.174 25148 11635 1 18 . 1 1 33 33 SER N N 33 114.201 114.201 115.410 -1.209 25148 11636 1 18 . 1 1 33 33 SER HA H 33 4.311 4.311 4.122 0.189 25148 11637 1 18 . 1 1 33 33 SER C C 33 177.012 177.012 176.529 0.483 25148 11638 1 18 . 1 1 33 33 SER CA C 33 61.860 61.860 62.099 -0.239 25148 11639 1 18 . 1 1 33 33 SER CB C 33 62.508 62.508 63.105 -0.597 25148 11640 1 18 . 1 1 33 33 SER H H 33 7.558 7.558 7.770 -0.212 25148 11641 1 18 . 1 1 34 34 ALA N N 34 122.893 122.893 123.826 -0.933 25148 11642 1 18 . 1 1 34 34 ALA HA H 34 4.215 4.215 4.101 0.114 25148 11643 1 18 . 1 1 34 34 ALA C C 34 180.814 180.814 180.025 0.789 25148 11644 1 18 . 1 1 34 34 ALA CA C 34 55.283 55.283 54.901 0.382 25148 11645 1 18 . 1 1 34 34 ALA CB C 34 18.273 18.273 18.225 0.048 25148 11646 1 18 . 1 1 34 34 ALA H H 34 8.409 8.409 7.592 0.817 25148 11647 1 18 . 1 1 35 35 TYR N N 35 120.259 120.259 120.328 -0.069 25148 11648 1 18 . 1 1 35 35 TYR HA H 35 4.393 4.393 4.301 0.092 25148 11649 1 18 . 1 1 35 35 TYR C C 35 177.892 177.892 177.932 -0.040 25148 11650 1 18 . 1 1 35 35 TYR CA C 35 63.071 63.071 60.932 2.139 25148 11651 1 18 . 1 1 35 35 TYR CB C 35 38.021 38.021 38.673 -0.652 25148 11652 1 18 . 1 1 35 35 TYR H H 35 8.975 8.975 8.360 0.615 25148 11653 1 18 . 1 1 36 36 LYS N N 36 120.942 120.942 120.313 0.629 25148 11654 1 18 . 1 1 36 36 LYS HA H 36 4.032 4.032 4.030 0.002 25148 11655 1 18 . 1 1 36 36 LYS C C 36 177.797 177.797 177.729 0.068 25148 11656 1 18 . 1 1 36 36 LYS CA C 36 59.900 59.900 59.126 0.774 25148 11657 1 18 . 1 1 36 36 LYS CB C 36 32.429 32.429 32.212 0.217 25148 11658 1 18 . 1 1 36 36 LYS H H 36 8.654 8.654 8.132 0.522 25148 11659 1 18 . 1 1 37 37 ARG N N 37 115.139 115.139 114.898 0.241 25148 11660 1 18 . 1 1 37 37 ARG HA H 37 4.101 4.101 4.095 0.006 25148 11661 1 18 . 1 1 37 37 ARG C C 37 177.517 177.517 178.294 -0.777 25148 11662 1 18 . 1 1 37 37 ARG CA C 37 58.276 58.276 57.884 0.392 25148 11663 1 18 . 1 1 37 37 ARG CB C 37 31.014 31.014 29.701 1.313 25148 11664 1 18 . 1 1 37 37 ARG H H 37 8.138 8.138 7.624 0.514 25148 11665 1 18 . 1 1 38 38 ASN N N 38 112.555 112.555 116.698 -4.143 25148 11666 1 18 . 1 1 38 38 ASN HA H 38 4.540 4.540 4.323 0.217 25148 11667 1 18 . 1 1 38 38 ASN C C 38 173.994 173.994 175.303 -1.309 25148 11668 1 18 . 1 1 38 38 ASN CA C 38 54.722 54.722 55.319 -0.597 25148 11669 1 18 . 1 1 38 38 ASN CB C 38 42.077 42.077 39.327 2.750 25148 11670 1 18 . 1 1 38 38 ASN H H 38 7.426 7.426 7.784 -0.358 25148 11671 1 18 . 1 1 39 39 PHE N N 39 116.711 116.711 117.256 -0.545 25148 11672 1 18 . 1 1 39 39 PHE HA H 39 4.569 4.569 4.761 -0.192 25148 11673 1 18 . 1 1 39 39 PHE CA C 39 58.913 58.913 56.591 2.322 25148 11674 1 18 . 1 1 39 39 PHE CB C 39 39.781 39.781 38.980 0.800 25148 11675 1 18 . 1 1 39 39 PHE H H 39 7.959 7.959 7.386 0.573 25148 11676 1 18 . 1 1 40 40 ASN HA H 40 4.018 4.018 4.591 -0.573 25148 11677 1 18 . 1 1 40 40 ASN CA C 40 58.944 58.944 54.789 4.155 25148 11678 1 18 . 1 1 41 41 GLN HA H 41 4.298 4.298 4.457 -0.159 25148 11679 1 18 . 1 1 41 41 GLN C C 41 175.237 175.237 176.235 -0.998 25148 11680 1 18 . 1 1 41 41 GLN CA C 41 57.360 57.360 56.584 0.776 25148 11681 1 18 . 1 1 41 41 GLN CB C 41 28.724 28.724 28.025 0.699 25148 11682 1 18 . 1 1 42 42 ALA N N 42 120.514 120.514 123.085 -2.571 25148 11683 1 18 . 1 1 42 42 ALA HA H 42 4.622 4.622 4.419 0.203 25148 11684 1 18 . 1 1 42 42 ALA C C 42 175.922 175.922 176.760 -0.838 25148 11685 1 18 . 1 1 42 42 ALA CA C 42 51.841 51.841 52.330 -0.489 25148 11686 1 18 . 1 1 42 42 ALA CB C 42 21.576 21.576 20.162 1.414 25148 11687 1 18 . 1 1 42 42 ALA H H 42 7.817 7.817 8.143 -0.326 25148 11688 1 18 . 1 1 43 43 GLN N N 43 117.594 117.594 114.700 2.894 25148 11689 1 18 . 1 1 43 43 GLN HA H 43 4.265 4.265 4.677 -0.412 25148 11690 1 18 . 1 1 43 43 GLN C C 43 174.942 174.942 173.590 1.352 25148 11691 1 18 . 1 1 43 43 GLN CA C 43 57.047 57.047 55.195 1.852 25148 11692 1 18 . 1 1 43 43 GLN CB C 43 30.863 30.863 31.569 -0.706 25148 11693 1 18 . 1 1 43 43 GLN H H 43 7.400 7.400 7.563 -0.163 25148 11694 1 18 . 1 1 44 44 ASN N N 44 120.467 120.467 118.715 1.752 25148 11695 1 18 . 1 1 44 44 ASN HA H 44 5.005 5.005 4.769 0.236 25148 11696 1 18 . 1 1 44 44 ASN C C 44 174.365 174.365 174.450 -0.085 25148 11697 1 18 . 1 1 44 44 ASN CA C 44 52.381 52.381 53.880 -1.499 25148 11698 1 18 . 1 1 44 44 ASN CB C 44 38.177 38.177 39.482 -1.305 25148 11699 1 18 . 1 1 44 44 ASN H H 44 9.123 9.123 8.501 0.622 25148 11700 1 18 . 1 1 45 45 VAL N N 45 115.479 115.479 118.285 -2.806 25148 11701 1 18 . 1 1 45 45 VAL HA H 45 5.376 5.376 4.460 0.916 25148 11702 1 18 . 1 1 45 45 VAL C C 45 174.908 174.908 173.909 0.999 25148 11703 1 18 . 1 1 45 45 VAL CA C 45 59.022 59.022 61.195 -2.173 25148 11704 1 18 . 1 1 45 45 VAL CB C 45 35.776 35.776 35.500 0.276 25148 11705 1 18 . 1 1 45 45 VAL H H 45 7.732 7.732 8.146 -0.414 25148 11706 1 18 . 1 1 46 46 ARG N N 46 121.146 121.146 125.193 -4.047 25148 11707 1 18 . 1 1 46 46 ARG HA H 46 4.566 4.566 4.797 -0.231 25148 11708 1 18 . 1 1 46 46 ARG C C 46 173.790 173.790 174.202 -0.412 25148 11709 1 18 . 1 1 46 46 ARG CA C 46 54.762 54.762 54.663 0.099 25148 11710 1 18 . 1 1 46 46 ARG CB C 46 33.946 33.946 31.319 2.627 25148 11711 1 18 . 1 1 46 46 ARG H H 46 8.850 8.850 8.979 -0.129 25148 11712 1 18 . 1 1 47 47 VAL N N 47 122.339 122.339 125.167 -2.828 25148 11713 1 18 . 1 1 47 47 VAL HA H 47 4.741 4.741 4.311 0.430 25148 11714 1 18 . 1 1 47 47 VAL C C 47 173.541 173.541 175.755 -2.214 25148 11715 1 18 . 1 1 47 47 VAL CA C 47 60.893 60.893 62.420 -1.527 25148 11716 1 18 . 1 1 47 47 VAL CB C 47 33.563 33.563 32.485 1.078 25148 11717 1 18 . 1 1 47 47 VAL H H 47 8.444 8.444 8.527 -0.083 25148 11718 1 18 . 1 1 48 48 ASP N N 48 127.701 127.701 125.880 1.821 25148 11719 1 18 . 1 1 48 48 ASP HA H 48 4.946 4.946 4.937 0.009 25148 11720 1 18 . 1 1 48 48 ASP C C 48 173.744 173.744 174.691 -0.947 25148 11721 1 18 . 1 1 48 48 ASP CA C 48 52.651 52.651 53.147 -0.496 25148 11722 1 18 . 1 1 48 48 ASP CB C 48 45.225 45.225 43.109 2.116 25148 11723 1 18 . 1 1 48 48 ASP H H 48 9.068 9.068 8.452 0.616 25148 11724 1 18 . 1 1 49 49 LEU N N 49 130.945 130.945 125.524 5.421 25148 11725 1 18 . 1 1 49 49 LEU HA H 49 4.774 4.774 4.755 0.019 25148 11726 1 18 . 1 1 49 49 LEU C C 49 174.531 174.531 175.491 -0.960 25148 11727 1 18 . 1 1 49 49 LEU CA C 49 54.337 54.337 54.249 0.088 25148 11728 1 18 . 1 1 49 49 LEU CB C 49 43.192 43.192 44.268 -1.076 25148 11729 1 18 . 1 1 49 49 LEU H H 49 9.369 9.369 8.604 0.765 25148 11730 1 18 . 1 1 50 50 ASN N N 50 126.268 126.268 123.354 2.914 25148 11731 1 18 . 1 1 50 50 ASN HA H 50 4.629 4.629 5.055 -0.426 25148 11732 1 18 . 1 1 50 50 ASN C C 50 176.602 176.602 175.377 1.225 25148 11733 1 18 . 1 1 50 50 ASN CA C 50 54.048 54.048 52.466 1.582 25148 11734 1 18 . 1 1 50 50 ASN CB C 50 39.891 39.891 39.209 0.682 25148 11735 1 18 . 1 1 50 50 ASN H H 50 8.672 8.672 9.030 -0.358 25148 11736 1 18 . 1 1 51 51 ARG N N 51 125.897 125.897 124.261 1.636 25148 11737 1 18 . 1 1 51 51 ARG HA H 51 3.789 3.789 4.216 -0.427 25148 11738 1 18 . 1 1 51 51 ARG C C 51 175.681 175.681 176.250 -0.569 25148 11739 1 18 . 1 1 51 51 ARG CA C 51 58.162 58.162 58.524 -0.362 25148 11740 1 18 . 1 1 51 51 ARG CB C 51 29.944 29.944 29.776 0.168 25148 11741 1 18 . 1 1 51 51 ARG H H 51 8.984 8.984 8.740 0.244 25148 11742 1 18 . 1 1 52 52 GLU N N 52 116.733 116.733 119.848 -3.115 25148 11743 1 18 . 1 1 52 52 GLU HA H 52 4.368 4.368 4.204 0.164 25148 11744 1 18 . 1 1 52 52 GLU C C 52 178.049 178.049 177.256 0.793 25148 11745 1 18 . 1 1 52 52 GLU CA C 52 58.048 58.048 58.018 0.030 25148 11746 1 18 . 1 1 52 52 GLU CB C 52 30.716 30.716 29.500 1.216 25148 11747 1 18 . 1 1 52 52 GLU H H 52 8.541 8.541 8.497 0.044 25148 11748 1 18 . 1 1 53 53 THR N N 53 106.556 106.556 108.854 -2.298 25148 11749 1 18 . 1 1 53 53 THR HA H 53 4.424 4.424 4.516 -0.092 25148 11750 1 18 . 1 1 53 53 THR C C 53 176.352 176.352 175.234 1.118 25148 11751 1 18 . 1 1 53 53 THR CA C 53 61.320 61.320 60.777 0.543 25148 11752 1 18 . 1 1 53 53 THR CB C 53 71.220 71.220 69.486 1.734 25148 11753 1 18 . 1 1 53 53 THR H H 53 8.085 8.085 7.578 0.507 25148 11754 1 18 . 1 1 54 54 GLY N N 54 111.843 111.843 110.832 1.011 25148 11755 1 18 . 1 1 54 54 GLY C C 54 172.690 172.690 174.532 -1.842 25148 11756 1 18 . 1 1 54 54 GLY CA C 54 45.417 45.417 46.289 -0.872 25148 11757 1 18 . 1 1 54 54 GLY H H 54 8.330 8.330 7.713 0.617 25148 11758 1 18 . 1 1 55 55 SER N N 55 113.844 113.844 114.292 -0.448 25148 11759 1 18 . 1 1 55 55 SER HA H 55 4.279 4.279 4.723 -0.444 25148 11760 1 18 . 1 1 55 55 SER C C 55 174.127 174.127 173.295 0.832 25148 11761 1 18 . 1 1 55 55 SER CA C 55 59.229 59.229 58.262 0.967 25148 11762 1 18 . 1 1 55 55 SER CB C 55 63.939 63.939 65.625 -1.686 25148 11763 1 18 . 1 1 55 55 SER H H 55 7.653 7.653 7.737 -0.084 25148 11764 1 18 . 1 1 56 56 ILE N N 56 125.286 125.286 120.816 4.470 25148 11765 1 18 . 1 1 56 56 ILE HA H 56 5.082 5.082 4.435 0.647 25148 11766 1 18 . 1 1 56 56 ILE C C 56 175.346 175.346 174.756 0.590 25148 11767 1 18 . 1 1 56 56 ILE CA C 56 59.967 59.967 60.014 -0.047 25148 11768 1 18 . 1 1 56 56 ILE CB C 56 40.165 40.165 41.757 -1.592 25148 11769 1 18 . 1 1 56 56 ILE H H 56 8.478 8.478 8.475 0.003 25148 11770 1 18 . 1 1 57 57 ARG N N 57 126.332 126.332 125.576 0.756 25148 11771 1 18 . 1 1 57 57 ARG HA H 57 4.740 4.740 4.545 0.195 25148 11772 1 18 . 1 1 57 57 ARG C C 57 173.921 173.921 173.676 0.245 25148 11773 1 18 . 1 1 57 57 ARG CA C 57 54.311 54.311 53.914 0.397 25148 11774 1 18 . 1 1 57 57 ARG CB C 57 35.805 35.805 34.139 1.667 25148 11775 1 18 . 1 1 57 57 ARG H H 57 8.590 8.590 8.306 0.284 25148 11776 1 18 . 1 1 58 58 VAL N N 58 120.987 120.987 122.028 -1.041 25148 11777 1 18 . 1 1 58 58 VAL HA H 58 4.334 4.334 4.146 0.188 25148 11778 1 18 . 1 1 58 58 VAL C C 58 174.204 174.204 174.023 0.181 25148 11779 1 18 . 1 1 58 58 VAL CA C 58 60.861 60.861 61.334 -0.473 25148 11780 1 18 . 1 1 58 58 VAL CB C 58 33.383 33.383 32.508 0.875 25148 11781 1 18 . 1 1 58 58 VAL H H 58 8.585 8.585 8.155 0.430 25148 11782 1 18 . 1 1 59 59 PHE N N 59 124.913 124.913 126.206 -1.293 25148 11783 1 18 . 1 1 59 59 PHE HA H 59 5.046 5.046 5.389 -0.343 25148 11784 1 18 . 1 1 59 59 PHE C C 59 174.446 174.446 174.404 0.042 25148 11785 1 18 . 1 1 59 59 PHE CA C 59 56.695 56.695 55.205 1.490 25148 11786 1 18 . 1 1 59 59 PHE CB C 59 42.779 42.779 43.319 -0.540 25148 11787 1 18 . 1 1 59 59 PHE H H 59 8.920 8.920 8.244 0.676 25148 11788 1 18 . 1 1 60 60 ALA N N 60 124.035 124.035 123.086 0.949 25148 11789 1 18 . 1 1 60 60 ALA HA H 60 5.102 5.102 4.834 0.268 25148 11790 1 18 . 1 1 60 60 ALA C C 60 176.017 176.017 176.455 -0.438 25148 11791 1 18 . 1 1 60 60 ALA CA C 60 50.083 50.083 50.587 -0.504 25148 11792 1 18 . 1 1 60 60 ALA CB C 60 22.400 22.400 20.467 1.933 25148 11793 1 18 . 1 1 60 60 ALA H H 60 9.457 9.457 8.672 0.785 25148 11794 1 18 . 1 1 61 61 ARG N N 61 121.530 121.530 125.218 -3.688 25148 11795 1 18 . 1 1 61 61 ARG HA H 61 4.958 4.958 4.684 0.274 25148 11796 1 18 . 1 1 61 61 ARG C C 61 176.737 176.737 175.814 0.923 25148 11797 1 18 . 1 1 61 61 ARG CA C 61 55.375 55.375 56.357 -0.982 25148 11798 1 18 . 1 1 61 61 ARG CB C 61 31.230 31.230 30.991 0.239 25148 11799 1 18 . 1 1 61 61 ARG H H 61 8.447 8.447 8.713 -0.266 25148 11800 1 18 . 1 1 62 62 LYS N N 62 124.784 124.784 125.460 -0.676 25148 11801 1 18 . 1 1 62 62 LYS HA H 62 4.709 4.709 4.498 0.211 25148 11802 1 18 . 1 1 62 62 LYS C C 62 173.899 173.899 174.612 -0.713 25148 11803 1 18 . 1 1 62 62 LYS CA C 62 54.812 54.812 55.098 -0.286 25148 11804 1 18 . 1 1 62 62 LYS CB C 62 37.147 37.147 35.971 1.176 25148 11805 1 18 . 1 1 62 62 LYS H H 62 9.137 9.137 8.158 0.979 25148 11806 1 18 . 1 1 63 63 ASP N N 63 122.552 122.552 124.798 -2.246 25148 11807 1 18 . 1 1 63 63 ASP HA H 63 4.877 4.877 4.813 0.064 25148 11808 1 18 . 1 1 63 63 ASP C C 63 175.560 175.560 176.742 -1.182 25148 11809 1 18 . 1 1 63 63 ASP CA C 63 54.576 54.576 54.316 0.260 25148 11810 1 18 . 1 1 63 63 ASP CB C 63 42.841 42.841 41.367 1.474 25148 11811 1 18 . 1 1 63 63 ASP H H 63 8.334 8.334 8.839 -0.505 25148 11812 1 18 . 1 1 64 64 VAL N N 64 123.109 123.109 127.130 -4.021 25148 11813 1 18 . 1 1 64 64 VAL HA H 64 4.557 4.557 4.398 0.159 25148 11814 1 18 . 1 1 64 64 VAL C C 64 177.260 177.260 175.573 1.687 25148 11815 1 18 . 1 1 64 64 VAL CA C 64 62.268 62.268 63.691 -1.423 25148 11816 1 18 . 1 1 64 64 VAL CB C 64 30.348 30.348 31.352 -1.004 25148 11817 1 18 . 1 1 64 64 VAL H H 64 8.693 8.693 8.658 0.035 25148 11818 1 18 . 1 1 65 65 VAL N N 65 122.320 122.320 121.542 0.778 25148 11819 1 18 . 1 1 65 65 VAL HA H 65 4.939 4.939 4.644 0.295 25148 11820 1 18 . 1 1 65 65 VAL C C 65 174.754 174.754 174.732 0.022 25148 11821 1 18 . 1 1 65 65 VAL CA C 65 59.173 59.173 59.341 -0.168 25148 11822 1 18 . 1 1 65 65 VAL CB C 65 36.289 36.289 35.575 0.714 25148 11823 1 18 . 1 1 65 65 VAL H H 65 8.656 8.656 8.573 0.083 25148 11824 1 18 . 1 1 66 66 ASP N N 66 119.805 119.805 120.744 -0.939 25148 11825 1 18 . 1 1 66 66 ASP HA H 66 4.499 4.499 4.323 0.176 25148 11826 1 18 . 1 1 66 66 ASP C C 66 176.565 176.565 175.662 0.903 25148 11827 1 18 . 1 1 66 66 ASP CA C 66 57.236 57.236 56.690 0.546 25148 11828 1 18 . 1 1 66 66 ASP CB C 66 41.662 41.662 41.396 0.266 25148 11829 1 18 . 1 1 66 66 ASP H H 66 8.628 8.628 8.726 -0.098 25148 11830 1 18 . 1 1 67 67 GLU N N 67 117.604 117.604 114.783 2.821 25148 11831 1 18 . 1 1 67 67 GLU HA H 67 4.350 4.350 4.306 0.044 25148 11832 1 18 . 1 1 67 67 GLU C C 67 173.736 173.736 174.167 -0.431 25148 11833 1 18 . 1 1 67 67 GLU CA C 67 55.203 55.203 54.410 0.793 25148 11834 1 18 . 1 1 67 67 GLU CB C 67 32.240 32.240 33.130 -0.890 25148 11835 1 18 . 1 1 67 67 GLU H H 67 7.525 7.525 7.482 0.043 25148 11836 1 18 . 1 1 68 68 VAL N N 68 125.774 125.774 122.509 3.265 25148 11837 1 18 . 1 1 68 68 VAL HA H 68 3.578 3.578 3.646 -0.068 25148 11838 1 18 . 1 1 68 68 VAL C C 68 175.885 175.885 175.485 0.400 25148 11839 1 18 . 1 1 68 68 VAL CA C 68 63.397 63.397 64.410 -1.013 25148 11840 1 18 . 1 1 68 68 VAL CB C 68 32.452 32.452 31.403 1.049 25148 11841 1 18 . 1 1 68 68 VAL H H 68 8.573 8.573 8.392 0.181 25148 11842 1 18 . 1 1 69 69 TYR N N 69 129.859 129.859 126.219 3.640 25148 11843 1 18 . 1 1 69 69 TYR HA H 69 4.642 4.642 4.630 0.012 25148 11844 1 18 . 1 1 69 69 TYR C C 69 176.100 176.100 175.775 0.325 25148 11845 1 18 . 1 1 69 69 TYR CA C 69 59.092 59.092 57.321 1.771 25148 11846 1 18 . 1 1 69 69 TYR CB C 69 39.830 39.830 39.907 -0.077 25148 11847 1 18 . 1 1 69 69 TYR H H 69 9.801 9.801 8.185 1.616 25148 11848 1 18 . 1 1 70 70 ASP N N 70 120.204 120.204 120.589 -0.385 25148 11849 1 18 . 1 1 70 70 ASP HA H 70 4.772 4.772 4.934 -0.162 25148 11850 1 18 . 1 1 70 70 ASP C C 70 176.622 176.622 176.385 0.237 25148 11851 1 18 . 1 1 70 70 ASP CA C 70 52.885 52.885 53.007 -0.122 25148 11852 1 18 . 1 1 70 70 ASP CB C 70 41.878 41.878 40.469 1.409 25148 11853 1 18 . 1 1 70 70 ASP H H 70 8.348 8.348 7.716 0.632 25148 11854 1 18 . 1 1 71 71 GLN N N 71 125.440 125.440 122.176 3.264 25148 11855 1 18 . 1 1 71 71 GLN HA H 71 4.315 4.315 3.971 0.344 25148 11856 1 18 . 1 1 71 71 GLN C C 71 175.819 175.819 176.918 -1.099 25148 11857 1 18 . 1 1 71 71 GLN CA C 71 57.914 57.914 58.623 -0.709 25148 11858 1 18 . 1 1 71 71 GLN CB C 71 28.307 28.307 28.535 -0.228 25148 11859 1 18 . 1 1 71 71 GLN H H 71 9.097 9.097 8.647 0.450 25148 11860 1 18 . 1 1 72 72 ARG N N 72 116.306 116.306 116.465 -0.159 25148 11861 1 18 . 1 1 72 72 ARG HA H 72 4.252 4.252 4.175 0.077 25148 11862 1 18 . 1 1 72 72 ARG C C 72 178.087 178.087 175.646 2.441 25148 11863 1 18 . 1 1 72 72 ARG CA C 72 58.532 58.532 57.151 1.381 25148 11864 1 18 . 1 1 72 72 ARG CB C 72 30.143 30.143 30.598 -0.455 25148 11865 1 18 . 1 1 72 72 ARG H H 72 8.534 8.534 8.343 0.191 25148 11866 1 18 . 1 1 73 73 LEU N N 73 116.734 116.734 111.559 5.175 25148 11867 1 18 . 1 1 73 73 LEU HA H 73 4.621 4.621 4.626 -0.005 25148 11868 1 18 . 1 1 73 73 LEU C C 73 175.946 175.946 174.966 0.980 25148 11869 1 18 . 1 1 73 73 LEU CA C 73 55.250 55.250 55.136 0.114 25148 11870 1 18 . 1 1 73 73 LEU CB C 73 46.960 46.960 44.118 2.842 25148 11871 1 18 . 1 1 73 73 LEU H H 73 7.460 7.460 7.476 -0.016 25148 11872 1 18 . 1 1 74 74 GLU N N 74 118.787 118.787 121.818 -3.031 25148 11873 1 18 . 1 1 74 74 GLU HA H 74 5.403 5.403 4.619 0.784 25148 11874 1 18 . 1 1 74 74 GLU C C 74 173.709 173.709 173.901 -0.192 25148 11875 1 18 . 1 1 74 74 GLU CA C 74 54.914 54.914 56.370 -1.456 25148 11876 1 18 . 1 1 74 74 GLU CB C 74 35.053 35.053 34.011 1.042 25148 11877 1 18 . 1 1 74 74 GLU H H 74 7.752 7.752 8.245 -0.493 25148 11878 1 18 . 1 1 75 75 ILE N N 75 119.803 119.803 119.982 -0.179 25148 11879 1 18 . 1 1 75 75 ILE HA H 75 4.507 4.507 4.459 0.048 25148 11880 1 18 . 1 1 75 75 ILE C C 75 172.126 172.126 173.678 -1.552 25148 11881 1 18 . 1 1 75 75 ILE CA C 75 58.664 58.664 59.941 -1.277 25148 11882 1 18 . 1 1 75 75 ILE CB C 75 42.560 42.560 41.790 0.770 25148 11883 1 18 . 1 1 75 75 ILE H H 75 8.975 8.975 8.318 0.657 25148 11884 1 18 . 1 1 76 76 SER N N 76 123.236 123.236 124.484 -1.248 25148 11885 1 18 . 1 1 76 76 SER HA H 76 4.505 4.505 4.740 -0.235 25148 11886 1 18 . 1 1 76 76 SER C C 76 176.145 176.145 176.023 0.122 25148 11887 1 18 . 1 1 76 76 SER CA C 76 58.108 58.108 59.623 -1.515 25148 11888 1 18 . 1 1 76 76 SER CB C 76 65.000 65.000 63.856 1.144 25148 11889 1 18 . 1 1 76 76 SER H H 76 8.810 8.810 8.747 0.063 25148 11890 1 18 . 1 1 77 77 ILE N N 77 120.629 120.629 126.178 -5.549 25148 11891 1 18 . 1 1 77 77 ILE HA H 77 3.935 3.935 3.731 0.204 25148 11892 1 18 . 1 1 77 77 ILE C C 77 175.806 175.806 176.856 -1.050 25148 11893 1 18 . 1 1 77 77 ILE CA C 77 61.928 61.928 63.803 -1.875 25148 11894 1 18 . 1 1 77 77 ILE CB C 77 38.031 38.031 38.245 -0.214 25148 11895 1 18 . 1 1 77 77 ILE H H 77 8.321 8.321 8.353 -0.032 25148 11896 1 18 . 1 1 78 78 GLU N N 78 121.032 121.032 117.450 3.582 25148 11897 1 18 . 1 1 78 78 GLU HA H 78 4.082 4.082 3.991 0.091 25148 11898 1 18 . 1 1 78 78 GLU C C 78 179.829 179.829 178.303 1.526 25148 11899 1 18 . 1 1 78 78 GLU CA C 78 60.180 60.180 59.151 1.030 25148 11900 1 18 . 1 1 78 78 GLU CB C 78 28.988 28.988 28.742 0.246 25148 11901 1 18 . 1 1 78 78 GLU H H 78 8.222 8.222 8.515 -0.293 25148 11902 1 18 . 1 1 79 79 GLU N N 79 120.710 120.710 121.154 -0.444 25148 11903 1 18 . 1 1 79 79 GLU HA H 79 4.012 4.012 4.098 -0.086 25148 11904 1 18 . 1 1 79 79 GLU C C 79 180.339 180.339 179.026 1.313 25148 11905 1 18 . 1 1 79 79 GLU CA C 79 59.332 59.332 58.797 0.535 25148 11906 1 18 . 1 1 79 79 GLU CB C 79 29.317 29.317 29.479 -0.162 25148 11907 1 18 . 1 1 79 79 GLU H H 79 7.908 7.908 7.563 0.345 25148 11908 1 18 . 1 1 80 80 ALA N N 80 122.879 122.879 121.934 0.945 25148 11909 1 18 . 1 1 80 80 ALA HA H 80 3.966 3.966 4.116 -0.150 25148 11910 1 18 . 1 1 80 80 ALA C C 80 179.833 179.833 179.959 -0.126 25148 11911 1 18 . 1 1 80 80 ALA CA C 80 55.881 55.881 55.074 0.807 25148 11912 1 18 . 1 1 80 80 ALA CB C 80 18.870 18.870 18.058 0.812 25148 11913 1 18 . 1 1 80 80 ALA H H 80 9.132 9.132 7.985 1.147 25148 11914 1 18 . 1 1 81 81 GLN N N 81 115.829 115.829 116.611 -0.782 25148 11915 1 18 . 1 1 81 81 GLN HA H 81 4.749 4.749 4.330 0.419 25148 11916 1 18 . 1 1 81 81 GLN C C 81 178.126 178.126 177.995 0.131 25148 11917 1 18 . 1 1 81 81 GLN CA C 81 57.682 57.682 57.955 -0.273 25148 11918 1 18 . 1 1 81 81 GLN CB C 81 27.307 27.307 28.646 -1.339 25148 11919 1 18 . 1 1 81 81 GLN H H 81 8.709 8.709 7.788 0.921 25148 11920 1 18 . 1 1 82 82 GLY N N 82 105.531 105.531 106.761 -1.230 25148 11921 1 18 . 1 1 82 82 GLY C C 82 174.917 174.917 175.007 -0.090 25148 11922 1 18 . 1 1 82 82 GLY CA C 82 45.915 45.915 46.506 -0.591 25148 11923 1 18 . 1 1 82 82 GLY H H 82 7.479 7.479 8.049 -0.570 25148 11924 1 18 . 1 1 83 83 ILE N N 83 122.828 122.828 113.819 9.009 25148 11925 1 18 . 1 1 83 83 ILE HA H 83 3.970 3.970 4.444 -0.474 25148 11926 1 18 . 1 1 83 83 ILE C C 83 177.209 177.209 175.519 1.690 25148 11927 1 18 . 1 1 83 83 ILE CA C 83 64.305 64.305 61.629 2.676 25148 11928 1 18 . 1 1 83 83 ILE CB C 83 38.452 38.452 40.207 -1.755 25148 11929 1 18 . 1 1 83 83 ILE H H 83 7.634 7.634 7.534 0.100 25148 11930 1 18 . 1 1 84 84 HIS N N 84 118.927 118.927 120.051 -1.124 25148 11931 1 18 . 1 1 84 84 HIS HA H 84 4.713 4.713 4.941 -0.228 25148 11932 1 18 . 1 1 84 84 HIS CA C 84 55.487 55.487 54.403 1.084 25148 11933 1 18 . 1 1 84 84 HIS CB C 84 33.506 33.506 32.252 1.254 25148 11934 1 18 . 1 1 84 84 HIS H H 84 8.155 8.155 8.392 -0.237 25148 11935 1 18 . 1 1 85 85 PRO HA H 85 4.456 4.456 4.641 -0.185 25148 11936 1 18 . 1 1 85 85 PRO C C 85 177.357 177.357 177.265 0.092 25148 11937 1 18 . 1 1 85 85 PRO CA C 85 64.475 64.475 64.099 0.376 25148 11938 1 18 . 1 1 85 85 PRO CB C 85 32.489 32.489 32.120 0.369 25148 11939 1 18 . 1 1 86 86 GLU N N 86 116.314 116.314 117.682 -1.368 25148 11940 1 18 . 1 1 86 86 GLU HA H 86 4.286 4.286 4.114 0.172 25148 11941 1 18 . 1 1 86 86 GLU C C 86 177.624 177.624 177.329 0.295 25148 11942 1 18 . 1 1 86 86 GLU CA C 86 56.619 56.619 57.186 -0.567 25148 11943 1 18 . 1 1 86 86 GLU CB C 86 29.389 29.389 29.670 -0.281 25148 11944 1 18 . 1 1 86 86 GLU H H 86 8.938 8.938 7.740 1.198 25148 11945 1 18 . 1 1 87 87 TYR N N 87 119.773 119.773 120.280 -0.507 25148 11946 1 18 . 1 1 87 87 TYR HA H 87 4.744 4.744 4.208 0.536 25148 11947 1 18 . 1 1 87 87 TYR C C 87 174.533 174.533 176.441 -1.908 25148 11948 1 18 . 1 1 87 87 TYR CA C 87 59.117 59.117 59.392 -0.275 25148 11949 1 18 . 1 1 87 87 TYR CB C 87 38.859 38.859 38.786 0.073 25148 11950 1 18 . 1 1 87 87 TYR H H 87 7.447 7.447 7.388 0.059 25148 11951 1 18 . 1 1 88 88 MET N N 88 118.298 118.298 117.143 1.155 25148 11952 1 18 . 1 1 88 88 MET HA H 88 4.770 4.770 4.712 0.058 25148 11953 1 18 . 1 1 88 88 MET C C 88 175.638 175.638 173.880 1.758 25148 11954 1 18 . 1 1 88 88 MET CA C 88 53.133 53.133 54.742 -1.609 25148 11955 1 18 . 1 1 88 88 MET CB C 88 37.102 37.102 35.295 1.807 25148 11956 1 18 . 1 1 88 88 MET H H 88 9.023 9.023 8.373 0.650 25148 11957 1 18 . 1 1 89 89 VAL N N 89 120.157 120.157 124.474 -4.317 25148 11958 1 18 . 1 1 89 89 VAL HA H 89 3.330 3.330 3.665 -0.335 25148 11959 1 18 . 1 1 89 89 VAL C C 89 177.432 177.432 176.911 0.521 25148 11960 1 18 . 1 1 89 89 VAL CA C 89 65.675 65.675 65.043 0.632 25148 11961 1 18 . 1 1 89 89 VAL CB C 89 31.321 31.321 30.577 0.744 25148 11962 1 18 . 1 1 89 89 VAL H H 89 8.313 8.313 8.611 -0.298 25148 11963 1 18 . 1 1 90 90 GLY N N 90 116.935 116.935 116.529 0.406 25148 11964 1 18 . 1 1 90 90 GLY C C 90 175.196 175.196 174.175 1.021 25148 11965 1 18 . 1 1 90 90 GLY CA C 90 44.685 44.685 44.810 -0.125 25148 11966 1 18 . 1 1 90 90 GLY H H 90 8.551 8.551 8.972 -0.421 25148 11967 1 18 . 1 1 91 91 ASP N N 91 121.616 121.616 121.984 -0.368 25148 11968 1 18 . 1 1 91 91 ASP HA H 91 4.790 4.790 5.024 -0.234 25148 11969 1 18 . 1 1 91 91 ASP C C 91 174.431 174.431 174.986 -0.555 25148 11970 1 18 . 1 1 91 91 ASP CA C 91 55.011 55.011 52.645 2.366 25148 11971 1 18 . 1 1 91 91 ASP CB C 91 42.079 42.079 42.799 -0.720 25148 11972 1 18 . 1 1 91 91 ASP H H 91 8.073 8.073 8.001 0.072 25148 11973 1 18 . 1 1 92 92 VAL N N 92 118.919 118.919 114.769 4.150 25148 11974 1 18 . 1 1 92 92 VAL HA H 92 4.709 4.709 5.101 -0.392 25148 11975 1 18 . 1 1 92 92 VAL C C 92 175.602 175.602 174.214 1.388 25148 11976 1 18 . 1 1 92 92 VAL CA C 92 61.527 61.527 59.634 1.893 25148 11977 1 18 . 1 1 92 92 VAL CB C 92 34.110 34.110 35.125 -1.015 25148 11978 1 18 . 1 1 92 92 VAL H H 92 8.216 8.216 8.105 0.111 25148 11979 1 18 . 1 1 93 93 VAL N N 93 123.922 123.922 122.229 1.693 25148 11980 1 18 . 1 1 93 93 VAL HA H 93 4.231 4.231 4.241 -0.010 25148 11981 1 18 . 1 1 93 93 VAL C C 93 174.105 174.105 174.098 0.007 25148 11982 1 18 . 1 1 93 93 VAL CA C 93 59.644 59.644 59.030 0.614 25148 11983 1 18 . 1 1 93 93 VAL CB C 93 34.661 34.661 35.613 -0.952 25148 11984 1 18 . 1 1 93 93 VAL H H 93 8.812 8.812 8.085 0.727 25148 11985 1 18 . 1 1 94 94 GLU N N 94 123.605 123.605 128.256 -4.651 25148 11986 1 18 . 1 1 94 94 GLU HA H 94 5.347 5.347 4.884 0.463 25148 11987 1 18 . 1 1 94 94 GLU C C 94 175.708 175.708 175.551 0.157 25148 11988 1 18 . 1 1 94 94 GLU CA C 94 54.979 54.979 55.354 -0.375 25148 11989 1 18 . 1 1 94 94 GLU CB C 94 31.612 31.612 30.710 0.902 25148 11990 1 18 . 1 1 94 94 GLU H H 94 8.312 8.312 8.424 -0.112 25148 11991 1 18 . 1 1 95 95 ILE N N 95 123.581 123.581 124.908 -1.327 25148 11992 1 18 . 1 1 95 95 ILE HA H 95 4.601 4.601 4.477 0.124 25148 11993 1 18 . 1 1 95 95 ILE C C 95 175.081 175.081 175.513 -0.432 25148 11994 1 18 . 1 1 95 95 ILE CA C 95 58.601 58.601 59.551 -0.950 25148 11995 1 18 . 1 1 95 95 ILE CB C 95 41.727 41.727 40.827 0.900 25148 11996 1 18 . 1 1 95 95 ILE H H 95 9.045 9.045 7.990 1.055 25148 11997 1 18 . 1 1 96 96 GLU N N 96 128.094 128.094 127.858 0.236 25148 11998 1 18 . 1 1 96 96 GLU HA H 96 4.098 4.098 4.004 0.094 25148 11999 1 18 . 1 1 96 96 GLU C C 96 176.845 176.845 175.594 1.251 25148 12000 1 18 . 1 1 96 96 GLU CA C 96 57.853 57.853 57.991 -0.138 25148 12001 1 18 . 1 1 96 96 GLU CB C 96 28.323 28.323 29.334 -1.011 25148 12002 1 18 . 1 1 96 96 GLU H H 96 9.256 9.256 8.908 0.348 25148 12003 1 18 . 1 1 97 97 VAL N N 97 118.446 118.446 124.136 -5.690 25148 12004 1 18 . 1 1 97 97 VAL HA H 97 4.568 4.568 4.178 0.390 25148 12005 1 18 . 1 1 97 97 VAL C C 97 175.051 175.051 173.953 1.098 25148 12006 1 18 . 1 1 97 97 VAL CA C 97 59.796 59.796 60.593 -0.797 25148 12007 1 18 . 1 1 97 97 VAL CB C 97 32.399 32.399 33.984 -1.585 25148 12008 1 18 . 1 1 97 97 VAL H H 97 8.609 8.609 8.709 -0.100 25148 12009 1 18 . 1 1 98 98 THR N N 98 119.118 119.118 116.665 2.453 25148 12010 1 18 . 1 1 98 98 THR HA H 98 3.320 3.320 3.857 -0.537 25148 12011 1 18 . 1 1 98 98 THR CA C 98 61.628 61.628 59.724 1.904 25148 12012 1 18 . 1 1 98 98 THR CB C 98 70.031 70.031 69.177 0.854 25148 12013 1 18 . 1 1 98 98 THR H H 98 7.396 7.396 7.233 0.163 25148 12014 1 18 . 1 1 99 99 PRO HA H 99 4.458 4.458 4.647 -0.189 25148 12015 1 18 . 1 1 99 99 PRO CA C 99 62.348 62.348 62.486 -0.138 25148 12016 1 18 . 1 1 99 99 PRO CB C 99 33.182 33.182 32.706 0.476 25148 12017 1 18 . 1 1 100 100 LYS HA H 100 4.126 4.126 4.123 0.003 25148 12018 1 18 . 1 1 100 100 LYS CA C 100 58.773 58.773 57.894 0.879 25148 12019 1 18 . 1 1 100 100 LYS CB C 100 32.195 32.195 32.529 -0.334 25148 12020 1 18 . 1 1 101 101 ASP HA H 101 4.924 4.924 4.757 0.167 25148 12021 1 18 . 1 1 101 101 ASP C C 101 176.884 176.884 176.726 0.158 25148 12022 1 18 . 1 1 101 101 ASP CA C 101 54.134 54.134 53.400 0.734 25148 12023 1 18 . 1 1 101 101 ASP CB C 101 40.272 40.272 40.676 -0.404 25148 12024 1 18 . 1 1 102 102 PHE N N 102 118.703 118.703 121.155 -2.452 25148 12025 1 18 . 1 1 102 102 PHE HA H 102 4.295 4.295 4.208 0.087 25148 12026 1 18 . 1 1 102 102 PHE C C 102 176.477 176.477 177.246 -0.769 25148 12027 1 18 . 1 1 102 102 PHE CA C 102 60.748 60.748 59.990 0.757 25148 12028 1 18 . 1 1 102 102 PHE CB C 102 39.667 39.667 39.242 0.425 25148 12029 1 18 . 1 1 102 102 PHE H H 102 7.862 7.862 7.710 0.152 25148 12030 1 18 . 1 1 103 103 GLY CA C 103 47.430 47.430 47.256 0.174 25148 12031 1 18 . 1 1 104 104 ARG N N 104 121.819 121.819 120.352 1.467 25148 12032 1 18 . 1 1 104 104 ARG HA H 104 4.176 4.176 4.134 0.042 25148 12033 1 18 . 1 1 104 104 ARG C C 104 178.912 178.912 178.362 0.550 25148 12034 1 18 . 1 1 104 104 ARG CA C 104 59.235 59.235 58.382 0.853 25148 12035 1 18 . 1 1 104 104 ARG CB C 104 30.000 30.000 29.939 0.061 25148 12036 1 18 . 1 1 104 104 ARG H H 104 7.809 7.809 7.358 0.451 25148 12037 1 18 . 1 1 105 105 ILE N N 105 120.331 120.331 121.074 -0.743 25148 12038 1 18 . 1 1 105 105 ILE HA H 105 3.836 3.836 3.576 0.260 25148 12039 1 18 . 1 1 105 105 ILE C C 105 179.206 179.206 177.519 1.687 25148 12040 1 18 . 1 1 105 105 ILE CA C 105 63.025 63.025 64.458 -1.433 25148 12041 1 18 . 1 1 105 105 ILE CB C 105 38.127 38.127 37.400 0.727 25148 12042 1 18 . 1 1 105 105 ILE H H 105 7.203 7.203 7.372 -0.169 25148 12043 1 18 . 1 1 106 106 ALA N N 106 124.867 124.867 121.602 3.265 25148 12044 1 18 . 1 1 106 106 ALA HA H 106 3.665 3.665 3.628 0.037 25148 12045 1 18 . 1 1 106 106 ALA C C 106 178.590 178.590 179.052 -0.462 25148 12046 1 18 . 1 1 106 106 ALA CA C 106 54.842 54.842 55.226 -0.384 25148 12047 1 18 . 1 1 106 106 ALA CB C 106 18.659 18.659 17.690 0.969 25148 12048 1 18 . 1 1 106 106 ALA H H 106 8.813 8.813 8.246 0.567 25148 12049 1 18 . 1 1 107 107 ALA N N 107 119.597 119.597 120.608 -1.011 25148 12050 1 18 . 1 1 107 107 ALA HA H 107 4.014 4.014 3.996 0.018 25148 12051 1 18 . 1 1 107 107 ALA C C 107 180.214 180.214 179.629 0.585 25148 12052 1 18 . 1 1 107 107 ALA CA C 107 55.454 55.454 54.751 0.703 25148 12053 1 18 . 1 1 107 107 ALA CB C 107 18.260 18.260 18.085 0.175 25148 12054 1 18 . 1 1 107 107 ALA H H 107 8.012 8.012 7.674 0.338 25148 12055 1 18 . 1 1 108 108 GLN N N 108 116.896 116.896 118.165 -1.269 25148 12056 1 18 . 1 1 108 108 GLN HA H 108 4.054 4.054 3.948 0.106 25148 12057 1 18 . 1 1 108 108 GLN C C 108 178.784 178.784 178.381 0.403 25148 12058 1 18 . 1 1 108 108 GLN CA C 108 58.705 58.705 58.973 -0.268 25148 12059 1 18 . 1 1 108 108 GLN CB C 108 28.647 28.647 28.645 0.001 25148 12060 1 18 . 1 1 108 108 GLN H H 108 7.498 7.498 8.017 -0.519 25148 12061 1 18 . 1 1 109 109 THR N N 109 117.495 117.495 115.874 1.621 25148 12062 1 18 . 1 1 109 109 THR HA H 109 3.917 3.917 4.118 -0.201 25148 12063 1 18 . 1 1 109 109 THR C C 109 175.732 175.732 176.031 -0.299 25148 12064 1 18 . 1 1 109 109 THR CA C 109 66.989 66.989 65.672 1.317 25148 12065 1 18 . 1 1 109 109 THR CB C 109 68.766 68.766 68.891 -0.125 25148 12066 1 18 . 1 1 109 109 THR H H 109 8.203 8.203 8.007 0.196 25148 12067 1 18 . 1 1 110 110 ALA N N 110 122.308 122.308 124.576 -2.268 25148 12068 1 18 . 1 1 110 110 ALA HA H 110 3.854 3.854 4.047 -0.193 25148 12069 1 18 . 1 1 110 110 ALA C C 110 178.380 178.380 178.867 -0.487 25148 12070 1 18 . 1 1 110 110 ALA CA C 110 55.903 55.903 55.017 0.886 25148 12071 1 18 . 1 1 110 110 ALA CB C 110 18.524 18.524 18.404 0.120 25148 12072 1 18 . 1 1 110 110 ALA H H 110 8.668 8.668 8.253 0.415 25148 12073 1 18 . 1 1 111 111 LYS N N 111 115.552 115.552 118.308 -2.756 25148 12074 1 18 . 1 1 111 111 LYS HA H 111 3.923 3.923 3.959 -0.036 25148 12075 1 18 . 1 1 111 111 LYS C C 111 179.111 179.111 178.240 0.871 25148 12076 1 18 . 1 1 111 111 LYS CA C 111 59.825 59.825 59.368 0.457 25148 12077 1 18 . 1 1 111 111 LYS CB C 111 32.251 32.251 31.678 0.573 25148 12078 1 18 . 1 1 111 111 LYS H H 111 7.642 7.642 8.452 -0.810 25148 12079 1 18 . 1 1 112 112 GLN N N 112 120.178 120.178 118.025 2.153 25148 12080 1 18 . 1 1 112 112 GLN HA H 112 4.060 4.060 4.129 -0.069 25148 12081 1 18 . 1 1 112 112 GLN C C 112 178.355 178.355 178.456 -0.101 25148 12082 1 18 . 1 1 112 112 GLN CA C 112 59.240 59.240 58.198 1.042 25148 12083 1 18 . 1 1 112 112 GLN CB C 112 28.250 28.250 28.525 -0.275 25148 12084 1 18 . 1 1 112 112 GLN H H 112 7.798 7.798 7.619 0.179 25148 12085 1 18 . 1 1 113 113 VAL N N 113 119.799 119.799 120.791 -0.992 25148 12086 1 18 . 1 1 113 113 VAL HA H 113 3.705 3.705 3.841 -0.136 25148 12087 1 18 . 1 1 113 113 VAL C C 113 178.303 178.303 178.108 0.195 25148 12088 1 18 . 1 1 113 113 VAL CA C 113 66.277 66.277 64.967 1.310 25148 12089 1 18 . 1 1 113 113 VAL CB C 113 31.954 31.954 31.622 0.332 25148 12090 1 18 . 1 1 113 113 VAL H H 113 8.105 8.105 7.606 0.499 25148 12091 1 18 . 1 1 114 114 VAL N N 114 118.265 118.265 116.973 1.292 25148 12092 1 18 . 1 1 114 114 VAL HA H 114 3.392 3.392 3.687 -0.295 25148 12093 1 18 . 1 1 114 114 VAL C C 114 177.360 177.360 177.830 -0.470 25148 12094 1 18 . 1 1 114 114 VAL CA C 114 67.832 67.832 66.284 1.548 25148 12095 1 18 . 1 1 114 114 VAL CB C 114 31.801 31.801 30.622 1.179 25148 12096 1 18 . 1 1 114 114 VAL H H 114 8.180 8.180 8.213 -0.033 25148 12097 1 18 . 1 1 115 115 THR N N 115 113.460 113.460 115.508 -2.048 25148 12098 1 18 . 1 1 115 115 THR HA H 115 3.856 3.856 3.972 -0.116 25148 12099 1 18 . 1 1 115 115 THR C C 115 176.529 176.529 176.565 -0.036 25148 12100 1 18 . 1 1 115 115 THR CA C 115 66.706 66.706 66.425 0.281 25148 12101 1 18 . 1 1 115 115 THR CB C 115 69.008 69.008 68.433 0.575 25148 12102 1 18 . 1 1 115 115 THR H H 115 8.143 8.143 7.567 0.576 25148 12103 1 18 . 1 1 116 116 GLN N N 116 120.129 120.129 120.663 -0.534 25148 12104 1 18 . 1 1 116 116 GLN HA H 116 4.054 4.054 4.062 -0.008 25148 12105 1 18 . 1 1 116 116 GLN C C 116 178.100 178.100 178.383 -0.283 25148 12106 1 18 . 1 1 116 116 GLN CA C 116 58.950 58.950 59.172 -0.222 25148 12107 1 18 . 1 1 116 116 GLN CB C 116 28.244 28.244 28.621 -0.377 25148 12108 1 18 . 1 1 116 116 GLN H H 116 7.936 7.936 7.725 0.211 25148 12109 1 18 . 1 1 117 117 ARG N N 117 117.838 117.838 119.408 -1.570 25148 12110 1 18 . 1 1 117 117 ARG HA H 117 4.174 4.174 4.143 0.031 25148 12111 1 18 . 1 1 117 117 ARG C C 117 179.138 179.138 178.912 0.226 25148 12112 1 18 . 1 1 117 117 ARG CA C 117 57.461 57.461 58.010 -0.549 25148 12113 1 18 . 1 1 117 117 ARG CB C 117 29.548 29.548 29.315 0.233 25148 12114 1 18 . 1 1 117 117 ARG H H 117 8.240 8.240 7.771 0.469 25148 12115 1 18 . 1 1 118 118 VAL N N 118 120.278 120.278 119.681 0.597 25148 12116 1 18 . 1 1 118 118 VAL HA H 118 3.709 3.709 3.643 0.066 25148 12117 1 18 . 1 1 118 118 VAL C C 118 177.597 177.597 177.741 -0.144 25148 12118 1 18 . 1 1 118 118 VAL CA C 118 66.246 66.246 66.508 -0.262 25148 12119 1 18 . 1 1 118 118 VAL CB C 118 31.785 31.785 31.223 0.562 25148 12120 1 18 . 1 1 118 118 VAL H H 118 8.480 8.480 7.450 1.030 25148 12121 1 18 . 1 1 119 119 ARG N N 119 120.197 120.197 118.315 1.882 25148 12122 1 18 . 1 1 119 119 ARG HA H 119 4.173 4.173 4.350 -0.177 25148 12123 1 18 . 1 1 119 119 ARG C C 119 178.864 178.864 178.640 0.224 25148 12124 1 18 . 1 1 119 119 ARG CA C 119 58.772 58.772 58.592 0.180 25148 12125 1 18 . 1 1 119 119 ARG CB C 119 29.873 29.873 29.749 0.124 25148 12126 1 18 . 1 1 119 119 ARG H H 119 7.899 7.899 7.416 0.483 25148 12127 1 18 . 1 1 120 120 GLU N N 120 118.768 118.768 119.996 -1.228 25148 12128 1 18 . 1 1 120 120 GLU HA H 120 4.110 4.110 4.023 0.087 25148 12129 1 18 . 1 1 120 120 GLU C C 120 177.823 177.823 178.748 -0.925 25148 12130 1 18 . 1 1 120 120 GLU CA C 120 58.223 58.223 59.437 -1.214 25148 12131 1 18 . 1 1 120 120 GLU CB C 120 29.854 29.854 29.336 0.518 25148 12132 1 18 . 1 1 120 120 GLU H H 120 8.084 8.084 8.444 -0.360 25148 12133 1 18 . 1 1 121 121 ALA N N 121 121.984 121.984 121.111 0.873 25148 12134 1 18 . 1 1 121 121 ALA HA H 121 4.296 4.296 4.073 0.223 25148 12135 1 18 . 1 1 121 121 ALA C C 121 178.586 178.586 180.122 -1.536 25148 12136 1 18 . 1 1 121 121 ALA CA C 121 53.475 53.475 55.070 -1.595 25148 12137 1 18 . 1 1 121 121 ALA CB C 121 18.856 18.856 18.307 0.549 25148 12138 1 18 . 1 1 121 121 ALA H H 121 7.810 7.810 7.910 -0.100 25148 12139 1 18 . 1 1 122 122 GLU N N 122 118.229 118.229 116.733 1.496 25148 12140 1 18 . 1 1 122 122 GLU HA H 122 4.241 4.241 4.020 0.221 25148 12141 1 18 . 1 1 122 122 GLU C C 122 176.839 176.839 178.732 -1.893 25148 12142 1 18 . 1 1 122 122 GLU CA C 122 57.118 57.118 58.305 -1.187 25148 12143 1 18 . 1 1 122 122 GLU CB C 122 30.018 30.018 29.294 0.724 25148 12144 1 18 . 1 1 122 122 GLU H H 122 7.938 7.938 7.747 0.191 25148 12145 1 18 . 1 1 123 123 ARG N N 123 120.601 120.601 119.596 1.005 25148 12146 1 18 . 1 1 123 123 ARG HA H 123 4.348 4.348 4.202 0.146 25148 12147 1 18 . 1 1 123 123 ARG C C 123 176.071 176.071 176.475 -0.404 25148 12148 1 18 . 1 1 123 123 ARG CA C 123 56.510 56.510 57.209 -0.699 25148 12149 1 18 . 1 1 123 123 ARG CB C 123 30.765 30.765 30.819 -0.054 25148 12150 1 18 . 1 1 123 123 ARG H H 123 7.977 7.977 8.169 -0.192 25148 12151 1 19 . 1 1 4 4 GLU HA H 4 4.138 4.138 4.038 0.100 25148 12152 1 19 . 1 1 4 4 GLU C C 4 179.152 179.152 178.139 1.013 25148 12153 1 19 . 1 1 4 4 GLU CA C 4 59.566 59.566 59.582 -0.016 25148 12154 1 19 . 1 1 4 4 GLU CB C 4 29.407 29.407 29.178 0.229 25148 12155 1 19 . 1 1 5 5 LEU N N 5 121.360 121.360 117.699 3.661 25148 12156 1 19 . 1 1 5 5 LEU HA H 5 4.195 4.195 4.031 0.164 25148 12157 1 19 . 1 1 5 5 LEU C C 5 178.179 178.179 178.118 0.061 25148 12158 1 19 . 1 1 5 5 LEU CA C 5 57.830 57.830 57.423 0.407 25148 12159 1 19 . 1 1 5 5 LEU CB C 5 41.630 41.630 41.222 0.408 25148 12160 1 19 . 1 1 5 5 LEU H H 5 7.877 7.877 7.708 0.169 25148 12161 1 19 . 1 1 6 6 LEU N N 6 118.058 118.058 119.122 -1.064 25148 12162 1 19 . 1 1 6 6 LEU HA H 6 3.919 3.919 3.823 0.096 25148 12163 1 19 . 1 1 6 6 LEU C C 6 180.274 180.274 179.169 1.105 25148 12164 1 19 . 1 1 6 6 LEU CA C 6 58.221 58.221 58.013 0.208 25148 12165 1 19 . 1 1 6 6 LEU CB C 6 40.684 40.684 40.997 -0.313 25148 12166 1 19 . 1 1 6 6 LEU H H 6 7.685 7.685 8.041 -0.356 25148 12167 1 19 . 1 1 7 7 ASP N N 7 120.662 120.662 117.839 2.823 25148 12168 1 19 . 1 1 7 7 ASP HA H 7 4.416 4.416 4.377 0.039 25148 12169 1 19 . 1 1 7 7 ASP C C 7 178.738 178.738 177.726 1.012 25148 12170 1 19 . 1 1 7 7 ASP CA C 7 57.519 57.519 56.824 0.695 25148 12171 1 19 . 1 1 7 7 ASP CB C 7 40.167 40.167 40.623 -0.456 25148 12172 1 19 . 1 1 7 7 ASP H H 7 8.427 8.427 7.781 0.646 25148 12173 1 19 . 1 1 8 8 ALA N N 8 122.612 122.612 122.579 0.033 25148 12174 1 19 . 1 1 8 8 ALA HA H 8 4.146 4.146 4.079 0.067 25148 12175 1 19 . 1 1 8 8 ALA C C 8 180.787 180.787 179.843 0.944 25148 12176 1 19 . 1 1 8 8 ALA CA C 8 55.165 55.165 54.955 0.210 25148 12177 1 19 . 1 1 8 8 ALA CB C 8 17.711 17.711 18.290 -0.579 25148 12178 1 19 . 1 1 8 8 ALA H H 8 7.847 7.847 7.192 0.655 25148 12179 1 19 . 1 1 9 9 LEU N N 9 116.977 116.977 117.814 -0.837 25148 12180 1 19 . 1 1 9 9 LEU HA H 9 4.115 4.115 3.837 0.278 25148 12181 1 19 . 1 1 9 9 LEU C C 9 179.510 179.510 179.339 0.171 25148 12182 1 19 . 1 1 9 9 LEU CA C 9 57.468 57.468 58.026 -0.558 25148 12183 1 19 . 1 1 9 9 LEU CB C 9 41.203 41.203 41.605 -0.402 25148 12184 1 19 . 1 1 9 9 LEU H H 9 8.256 8.256 7.644 0.612 25148 12185 1 19 . 1 1 10 10 THR N N 10 118.764 118.764 115.439 3.325 25148 12186 1 19 . 1 1 10 10 THR HA H 10 4.487 4.487 3.921 0.566 25148 12187 1 19 . 1 1 10 10 THR C C 10 176.567 176.567 177.141 -0.574 25148 12188 1 19 . 1 1 10 10 THR CA C 10 68.768 68.768 66.671 2.097 25148 12189 1 19 . 1 1 10 10 THR CB C 10 66.961 66.961 68.680 -1.720 25148 12190 1 19 . 1 1 10 10 THR H H 10 8.218 8.218 7.397 0.821 25148 12191 1 19 . 1 1 11 11 ILE N N 11 122.555 122.555 121.169 1.386 25148 12192 1 19 . 1 1 11 11 ILE HA H 11 3.779 3.779 3.733 0.046 25148 12193 1 19 . 1 1 11 11 ILE C C 11 177.793 177.793 177.672 0.121 25148 12194 1 19 . 1 1 11 11 ILE CA C 11 64.695 64.695 64.928 -0.233 25148 12195 1 19 . 1 1 11 11 ILE CB C 11 37.856 37.856 37.675 0.181 25148 12196 1 19 . 1 1 11 11 ILE H H 11 7.632 7.632 7.873 -0.241 25148 12197 1 19 . 1 1 12 12 LEU N N 12 120.469 120.469 118.276 2.193 25148 12198 1 19 . 1 1 12 12 LEU HA H 12 4.065 4.065 4.072 -0.007 25148 12199 1 19 . 1 1 12 12 LEU C C 12 179.139 179.139 178.776 0.363 25148 12200 1 19 . 1 1 12 12 LEU CA C 12 57.944 57.944 56.931 1.013 25148 12201 1 19 . 1 1 12 12 LEU CB C 12 42.170 42.170 41.125 1.045 25148 12202 1 19 . 1 1 12 12 LEU H H 12 7.951 7.951 7.731 0.220 25148 12203 1 19 . 1 1 13 13 GLU N N 13 119.669 119.669 119.369 0.300 25148 12204 1 19 . 1 1 13 13 GLU HA H 13 4.183 4.183 3.987 0.196 25148 12205 1 19 . 1 1 13 13 GLU C C 13 179.007 179.007 177.294 1.713 25148 12206 1 19 . 1 1 13 13 GLU CA C 13 59.703 59.703 58.728 0.975 25148 12207 1 19 . 1 1 13 13 GLU CB C 13 30.110 30.110 29.350 0.760 25148 12208 1 19 . 1 1 13 13 GLU H H 13 8.003 8.003 7.943 0.060 25148 12209 1 19 . 1 1 14 14 LYS N N 14 118.935 118.935 117.588 1.347 25148 12210 1 19 . 1 1 14 14 LYS HA H 14 4.124 4.124 4.099 0.025 25148 12211 1 19 . 1 1 14 14 LYS CA C 14 58.847 58.847 57.499 1.348 25148 12212 1 19 . 1 1 14 14 LYS CB C 14 33.053 33.053 32.630 0.423 25148 12213 1 19 . 1 1 14 14 LYS H H 14 7.862 7.862 7.373 0.489 25148 12214 1 19 . 1 1 15 15 GLU HA H 15 3.693 3.693 4.265 -0.572 25148 12215 1 19 . 1 1 15 15 GLU CA C 15 56.688 56.688 56.685 0.003 25148 12216 1 19 . 1 1 15 15 GLU CB C 15 32.204 32.204 30.273 1.931 25148 12217 1 19 . 1 1 16 16 LYS HA H 16 4.678 4.678 4.428 0.250 25148 12218 1 19 . 1 1 16 16 LYS CA C 16 55.135 55.135 55.399 -0.264 25148 12219 1 19 . 1 1 16 16 LYS CB C 16 34.049 34.049 33.717 0.332 25148 12220 1 19 . 1 1 17 17 GLY CA C 17 46.541 46.541 45.265 1.276 25148 12221 1 19 . 1 1 18 18 ILE N N 18 115.364 115.364 115.996 -0.632 25148 12222 1 19 . 1 1 18 18 ILE HA H 18 4.079 4.079 4.465 -0.386 25148 12223 1 19 . 1 1 18 18 ILE C C 18 174.751 174.751 174.331 0.420 25148 12224 1 19 . 1 1 18 18 ILE CA C 18 60.333 60.333 59.128 1.205 25148 12225 1 19 . 1 1 18 18 ILE CB C 18 39.044 39.044 40.521 -1.477 25148 12226 1 19 . 1 1 18 18 ILE H H 18 8.203 8.203 7.349 0.854 25148 12227 1 19 . 1 1 19 19 SER N N 19 119.891 119.891 119.274 0.617 25148 12228 1 19 . 1 1 19 19 SER HA H 19 4.362 4.362 4.830 -0.468 25148 12229 1 19 . 1 1 19 19 SER CA C 19 58.476 58.476 56.641 1.835 25148 12230 1 19 . 1 1 19 19 SER CB C 19 63.533 63.533 65.613 -2.080 25148 12231 1 19 . 1 1 19 19 SER H H 19 8.253 8.253 8.400 -0.147 25148 12232 1 19 . 1 1 20 20 LYS N N 20 124.782 124.782 124.595 0.187 25148 12233 1 19 . 1 1 20 20 LYS HA H 20 4.137 4.137 4.112 0.025 25148 12234 1 19 . 1 1 20 20 LYS C C 20 177.889 177.889 177.651 0.238 25148 12235 1 19 . 1 1 20 20 LYS CA C 20 59.485 59.485 58.766 0.719 25148 12236 1 19 . 1 1 20 20 LYS CB C 20 32.711 32.711 31.987 0.724 25148 12237 1 19 . 1 1 20 20 LYS H H 20 8.918 8.918 8.875 0.043 25148 12238 1 19 . 1 1 21 21 GLU N N 21 117.831 117.831 118.054 -0.223 25148 12239 1 19 . 1 1 21 21 GLU HA H 21 3.957 3.957 4.047 -0.090 25148 12240 1 19 . 1 1 21 21 GLU C C 21 178.822 178.822 178.782 0.040 25148 12241 1 19 . 1 1 21 21 GLU CA C 21 59.529 59.529 59.078 0.451 25148 12242 1 19 . 1 1 21 21 GLU CB C 21 29.237 29.237 29.206 0.031 25148 12243 1 19 . 1 1 21 21 GLU H H 21 8.361 8.361 8.599 -0.238 25148 12244 1 19 . 1 1 22 22 ILE N N 22 118.690 118.690 118.280 0.410 25148 12245 1 19 . 1 1 22 22 ILE HA H 22 3.884 3.884 3.910 -0.026 25148 12246 1 19 . 1 1 22 22 ILE C C 22 179.247 179.247 177.467 1.780 25148 12247 1 19 . 1 1 22 22 ILE CA C 22 63.735 63.735 63.850 -0.115 25148 12248 1 19 . 1 1 22 22 ILE CB C 22 37.415 37.415 37.950 -0.535 25148 12249 1 19 . 1 1 22 22 ILE H H 22 7.353 7.353 7.406 -0.053 25148 12250 1 19 . 1 1 23 23 ILE N N 23 120.880 120.880 120.888 -0.008 25148 12251 1 19 . 1 1 23 23 ILE HA H 23 3.733 3.733 3.706 0.027 25148 12252 1 19 . 1 1 23 23 ILE C C 23 177.817 177.817 177.945 -0.128 25148 12253 1 19 . 1 1 23 23 ILE CA C 23 64.172 64.172 63.840 0.332 25148 12254 1 19 . 1 1 23 23 ILE CB C 23 36.473 36.473 36.843 -0.370 25148 12255 1 19 . 1 1 23 23 ILE H H 23 7.571 7.571 7.247 0.324 25148 12256 1 19 . 1 1 24 24 ILE N N 24 121.460 121.460 119.025 2.435 25148 12257 1 19 . 1 1 24 24 ILE HA H 24 3.486 3.486 3.610 -0.124 25148 12258 1 19 . 1 1 24 24 ILE C C 24 177.759 177.759 177.761 -0.002 25148 12259 1 19 . 1 1 24 24 ILE CA C 24 66.641 66.641 66.114 0.527 25148 12260 1 19 . 1 1 24 24 ILE CB C 24 37.307 37.307 37.316 -0.009 25148 12261 1 19 . 1 1 24 24 ILE H H 24 8.709 8.709 7.702 1.007 25148 12262 1 19 . 1 1 25 25 GLU N N 25 119.323 119.323 118.340 0.983 25148 12263 1 19 . 1 1 25 25 GLU HA H 25 4.177 4.177 3.929 0.248 25148 12264 1 19 . 1 1 25 25 GLU C C 25 179.348 179.348 178.548 0.800 25148 12265 1 19 . 1 1 25 25 GLU CA C 25 59.951 59.951 59.230 0.721 25148 12266 1 19 . 1 1 25 25 GLU CB C 25 29.340 29.340 29.138 0.202 25148 12267 1 19 . 1 1 25 25 GLU H H 25 8.048 8.048 7.813 0.235 25148 12268 1 19 . 1 1 26 26 ALA N N 26 122.390 122.390 122.898 -0.508 25148 12269 1 19 . 1 1 26 26 ALA HA H 26 4.325 4.325 4.130 0.195 25148 12270 1 19 . 1 1 26 26 ALA C C 26 181.440 181.440 179.665 1.775 25148 12271 1 19 . 1 1 26 26 ALA CA C 26 54.935 54.935 54.910 0.025 25148 12272 1 19 . 1 1 26 26 ALA CB C 26 17.834 17.834 18.347 -0.513 25148 12273 1 19 . 1 1 26 26 ALA H H 26 7.768 7.768 7.831 -0.063 25148 12274 1 19 . 1 1 27 27 ILE N N 27 122.342 122.342 119.585 2.757 25148 12275 1 19 . 1 1 27 27 ILE HA H 27 3.575 3.575 3.593 -0.018 25148 12276 1 19 . 1 1 27 27 ILE C C 27 177.541 177.541 178.064 -0.523 25148 12277 1 19 . 1 1 27 27 ILE CA C 27 66.536 66.536 65.850 0.686 25148 12278 1 19 . 1 1 27 27 ILE CB C 27 37.886 37.886 37.627 0.259 25148 12279 1 19 . 1 1 27 27 ILE H H 27 8.805 8.805 7.693 1.112 25148 12280 1 19 . 1 1 28 28 GLU N N 28 120.188 120.188 118.770 1.418 25148 12281 1 19 . 1 1 28 28 GLU HA H 28 3.687 3.687 3.933 -0.246 25148 12282 1 19 . 1 1 28 28 GLU C C 28 178.707 178.707 179.030 -0.323 25148 12283 1 19 . 1 1 28 28 GLU CA C 28 61.458 61.458 59.960 1.498 25148 12284 1 19 . 1 1 28 28 GLU CB C 28 29.624 29.624 29.152 0.472 25148 12285 1 19 . 1 1 28 28 GLU H H 28 8.882 8.882 7.762 1.120 25148 12286 1 19 . 1 1 29 29 ALA N N 29 119.293 119.293 121.385 -2.092 25148 12287 1 19 . 1 1 29 29 ALA HA H 29 4.214 4.214 4.135 0.079 25148 12288 1 19 . 1 1 29 29 ALA C C 29 181.200 181.200 179.776 1.424 25148 12289 1 19 . 1 1 29 29 ALA CA C 29 55.435 55.435 54.821 0.615 25148 12290 1 19 . 1 1 29 29 ALA CB C 29 18.090 18.090 18.088 0.002 25148 12291 1 19 . 1 1 29 29 ALA H H 29 8.065 8.065 7.859 0.206 25148 12292 1 19 . 1 1 30 30 ALA N N 30 121.729 121.729 121.933 -0.204 25148 12293 1 19 . 1 1 30 30 ALA HA H 30 4.307 4.307 4.149 0.158 25148 12294 1 19 . 1 1 30 30 ALA C C 30 181.315 181.315 179.618 1.697 25148 12295 1 19 . 1 1 30 30 ALA CA C 30 54.594 54.594 54.694 -0.100 25148 12296 1 19 . 1 1 30 30 ALA CB C 30 18.704 18.704 18.441 0.263 25148 12297 1 19 . 1 1 30 30 ALA H H 30 8.099 8.099 7.743 0.356 25148 12298 1 19 . 1 1 31 31 LEU N N 31 120.900 120.900 120.862 0.038 25148 12299 1 19 . 1 1 31 31 LEU HA H 31 4.347 4.347 4.055 0.292 25148 12300 1 19 . 1 1 31 31 LEU C C 31 179.137 179.137 179.059 0.078 25148 12301 1 19 . 1 1 31 31 LEU CA C 31 57.569 57.569 59.304 -1.735 25148 12302 1 19 . 1 1 31 31 LEU CB C 31 42.353 42.353 42.056 0.297 25148 12303 1 19 . 1 1 31 31 LEU H H 31 8.863 8.863 8.187 0.676 25148 12304 1 19 . 1 1 32 32 ILE N N 32 122.410 122.410 118.578 3.832 25148 12305 1 19 . 1 1 32 32 ILE HA H 32 3.699 3.699 3.679 0.020 25148 12306 1 19 . 1 1 32 32 ILE C C 32 178.303 178.303 177.610 0.693 25148 12307 1 19 . 1 1 32 32 ILE CA C 32 66.066 66.066 65.468 0.598 25148 12308 1 19 . 1 1 32 32 ILE CB C 32 37.882 37.882 37.931 -0.049 25148 12309 1 19 . 1 1 32 32 ILE H H 32 8.234 8.234 8.430 -0.196 25148 12310 1 19 . 1 1 33 33 SER N N 33 114.201 114.201 115.743 -1.542 25148 12311 1 19 . 1 1 33 33 SER HA H 33 4.311 4.311 4.151 0.160 25148 12312 1 19 . 1 1 33 33 SER C C 33 177.012 177.012 176.366 0.646 25148 12313 1 19 . 1 1 33 33 SER CA C 33 61.860 61.860 61.742 0.118 25148 12314 1 19 . 1 1 33 33 SER CB C 33 62.508 62.508 63.106 -0.598 25148 12315 1 19 . 1 1 33 33 SER H H 33 7.558 7.558 7.799 -0.241 25148 12316 1 19 . 1 1 34 34 ALA N N 34 122.893 122.893 124.846 -1.953 25148 12317 1 19 . 1 1 34 34 ALA HA H 34 4.215 4.215 4.139 0.076 25148 12318 1 19 . 1 1 34 34 ALA C C 34 180.814 180.814 179.140 1.674 25148 12319 1 19 . 1 1 34 34 ALA CA C 34 55.283 55.283 54.897 0.387 25148 12320 1 19 . 1 1 34 34 ALA CB C 34 18.273 18.273 18.263 0.010 25148 12321 1 19 . 1 1 34 34 ALA H H 34 8.409 8.409 7.892 0.517 25148 12322 1 19 . 1 1 35 35 TYR N N 35 120.259 120.259 119.229 1.030 25148 12323 1 19 . 1 1 35 35 TYR HA H 35 4.393 4.393 4.321 0.072 25148 12324 1 19 . 1 1 35 35 TYR C C 35 177.892 177.892 178.205 -0.313 25148 12325 1 19 . 1 1 35 35 TYR CA C 35 63.071 63.071 61.071 2.001 25148 12326 1 19 . 1 1 35 35 TYR CB C 35 38.021 38.021 38.917 -0.896 25148 12327 1 19 . 1 1 35 35 TYR H H 35 8.975 8.975 8.246 0.729 25148 12328 1 19 . 1 1 36 36 LYS N N 36 120.942 120.942 119.803 1.139 25148 12329 1 19 . 1 1 36 36 LYS HA H 36 4.032 4.032 3.983 0.049 25148 12330 1 19 . 1 1 36 36 LYS C C 36 177.797 177.797 179.147 -1.350 25148 12331 1 19 . 1 1 36 36 LYS CA C 36 59.900 59.900 59.651 0.249 25148 12332 1 19 . 1 1 36 36 LYS CB C 36 32.429 32.429 32.098 0.331 25148 12333 1 19 . 1 1 36 36 LYS H H 36 8.654 8.654 8.429 0.225 25148 12334 1 19 . 1 1 37 37 ARG N N 37 115.139 115.139 117.842 -2.703 25148 12335 1 19 . 1 1 37 37 ARG HA H 37 4.101 4.101 4.059 0.042 25148 12336 1 19 . 1 1 37 37 ARG C C 37 177.517 177.517 178.084 -0.567 25148 12337 1 19 . 1 1 37 37 ARG CA C 37 58.276 58.276 58.612 -0.336 25148 12338 1 19 . 1 1 37 37 ARG CB C 37 31.014 31.014 29.709 1.305 25148 12339 1 19 . 1 1 37 37 ARG H H 37 8.138 8.138 7.726 0.412 25148 12340 1 19 . 1 1 38 38 ASN N N 38 112.555 112.555 116.164 -3.609 25148 12341 1 19 . 1 1 38 38 ASN HA H 38 4.540 4.540 4.307 0.233 25148 12342 1 19 . 1 1 38 38 ASN C C 38 173.994 173.994 174.996 -1.002 25148 12343 1 19 . 1 1 38 38 ASN CA C 38 54.722 54.722 55.030 -0.308 25148 12344 1 19 . 1 1 38 38 ASN CB C 38 42.077 42.077 39.325 2.752 25148 12345 1 19 . 1 1 38 38 ASN H H 38 7.426 7.426 7.892 -0.466 25148 12346 1 19 . 1 1 39 39 PHE N N 39 116.711 116.711 117.025 -0.314 25148 12347 1 19 . 1 1 39 39 PHE HA H 39 4.569 4.569 4.699 -0.130 25148 12348 1 19 . 1 1 39 39 PHE CA C 39 58.913 58.913 56.671 2.242 25148 12349 1 19 . 1 1 39 39 PHE CB C 39 39.781 39.781 38.795 0.986 25148 12350 1 19 . 1 1 39 39 PHE H H 39 7.959 7.959 7.593 0.366 25148 12351 1 19 . 1 1 40 40 ASN HA H 40 4.018 4.018 4.579 -0.561 25148 12352 1 19 . 1 1 40 40 ASN CA C 40 58.944 58.944 55.254 3.690 25148 12353 1 19 . 1 1 41 41 GLN HA H 41 4.298 4.298 4.455 -0.157 25148 12354 1 19 . 1 1 41 41 GLN C C 41 175.237 175.237 175.814 -0.577 25148 12355 1 19 . 1 1 41 41 GLN CA C 41 57.360 57.360 56.540 0.820 25148 12356 1 19 . 1 1 41 41 GLN CB C 41 28.724 28.724 28.212 0.512 25148 12357 1 19 . 1 1 42 42 ALA N N 42 120.514 120.514 121.861 -1.347 25148 12358 1 19 . 1 1 42 42 ALA HA H 42 4.622 4.622 4.429 0.193 25148 12359 1 19 . 1 1 42 42 ALA C C 42 175.922 175.922 177.053 -1.131 25148 12360 1 19 . 1 1 42 42 ALA CA C 42 51.841 51.841 52.033 -0.192 25148 12361 1 19 . 1 1 42 42 ALA CB C 42 21.576 21.576 19.965 1.611 25148 12362 1 19 . 1 1 42 42 ALA H H 42 7.817 7.817 8.119 -0.302 25148 12363 1 19 . 1 1 43 43 GLN N N 43 117.594 117.594 114.914 2.680 25148 12364 1 19 . 1 1 43 43 GLN HA H 43 4.265 4.265 4.553 -0.288 25148 12365 1 19 . 1 1 43 43 GLN C C 43 174.942 174.942 173.534 1.408 25148 12366 1 19 . 1 1 43 43 GLN CA C 43 57.047 57.047 55.016 2.031 25148 12367 1 19 . 1 1 43 43 GLN CB C 43 30.863 30.863 31.584 -0.721 25148 12368 1 19 . 1 1 43 43 GLN H H 43 7.400 7.400 7.543 -0.143 25148 12369 1 19 . 1 1 44 44 ASN N N 44 120.467 120.467 119.266 1.201 25148 12370 1 19 . 1 1 44 44 ASN HA H 44 5.005 5.005 4.725 0.280 25148 12371 1 19 . 1 1 44 44 ASN C C 44 174.365 174.365 174.385 -0.020 25148 12372 1 19 . 1 1 44 44 ASN CA C 44 52.381 52.381 52.955 -0.574 25148 12373 1 19 . 1 1 44 44 ASN CB C 44 38.177 38.177 39.101 -0.924 25148 12374 1 19 . 1 1 44 44 ASN H H 44 9.123 9.123 8.499 0.624 25148 12375 1 19 . 1 1 45 45 VAL N N 45 115.479 115.479 116.069 -0.590 25148 12376 1 19 . 1 1 45 45 VAL HA H 45 5.376 5.376 4.255 1.121 25148 12377 1 19 . 1 1 45 45 VAL C C 45 174.908 174.908 173.536 1.372 25148 12378 1 19 . 1 1 45 45 VAL CA C 45 59.022 59.022 62.134 -3.112 25148 12379 1 19 . 1 1 45 45 VAL CB C 45 35.776 35.776 34.934 0.842 25148 12380 1 19 . 1 1 45 45 VAL H H 45 7.732 7.732 8.070 -0.338 25148 12381 1 19 . 1 1 46 46 ARG N N 46 121.146 121.146 123.918 -2.772 25148 12382 1 19 . 1 1 46 46 ARG HA H 46 4.566 4.566 4.806 -0.240 25148 12383 1 19 . 1 1 46 46 ARG C C 46 173.790 173.790 174.486 -0.696 25148 12384 1 19 . 1 1 46 46 ARG CA C 46 54.762 54.762 53.990 0.772 25148 12385 1 19 . 1 1 46 46 ARG CB C 46 33.946 33.946 32.293 1.653 25148 12386 1 19 . 1 1 46 46 ARG H H 46 8.850 8.850 8.957 -0.107 25148 12387 1 19 . 1 1 47 47 VAL N N 47 122.339 122.339 125.603 -3.264 25148 12388 1 19 . 1 1 47 47 VAL HA H 47 4.741 4.741 4.144 0.597 25148 12389 1 19 . 1 1 47 47 VAL C C 47 173.541 173.541 176.152 -2.611 25148 12390 1 19 . 1 1 47 47 VAL CA C 47 60.893 60.893 62.192 -1.299 25148 12391 1 19 . 1 1 47 47 VAL CB C 47 33.563 33.563 32.343 1.220 25148 12392 1 19 . 1 1 47 47 VAL H H 47 8.444 8.444 8.604 -0.160 25148 12393 1 19 . 1 1 48 48 ASP N N 48 127.701 127.701 128.093 -0.392 25148 12394 1 19 . 1 1 48 48 ASP HA H 48 4.946 4.946 4.961 -0.015 25148 12395 1 19 . 1 1 48 48 ASP C C 48 173.744 173.744 174.557 -0.813 25148 12396 1 19 . 1 1 48 48 ASP CA C 48 52.651 52.651 53.757 -1.106 25148 12397 1 19 . 1 1 48 48 ASP CB C 48 45.225 45.225 43.583 1.643 25148 12398 1 19 . 1 1 48 48 ASP H H 48 9.068 9.068 8.941 0.127 25148 12399 1 19 . 1 1 49 49 LEU N N 49 130.945 130.945 125.607 5.338 25148 12400 1 19 . 1 1 49 49 LEU HA H 49 4.774 4.774 4.865 -0.091 25148 12401 1 19 . 1 1 49 49 LEU C C 49 174.531 174.531 175.407 -0.876 25148 12402 1 19 . 1 1 49 49 LEU CA C 49 54.337 54.337 53.784 0.553 25148 12403 1 19 . 1 1 49 49 LEU CB C 49 43.192 43.192 44.893 -1.701 25148 12404 1 19 . 1 1 49 49 LEU H H 49 9.369 9.369 8.344 1.025 25148 12405 1 19 . 1 1 50 50 ASN N N 50 126.268 126.268 123.078 3.190 25148 12406 1 19 . 1 1 50 50 ASN HA H 50 4.629 4.629 5.101 -0.472 25148 12407 1 19 . 1 1 50 50 ASN C C 50 176.602 176.602 175.458 1.144 25148 12408 1 19 . 1 1 50 50 ASN CA C 50 54.048 54.048 52.206 1.842 25148 12409 1 19 . 1 1 50 50 ASN CB C 50 39.891 39.891 39.114 0.777 25148 12410 1 19 . 1 1 50 50 ASN H H 50 8.672 8.672 8.732 -0.060 25148 12411 1 19 . 1 1 51 51 ARG N N 51 125.897 125.897 124.791 1.106 25148 12412 1 19 . 1 1 51 51 ARG HA H 51 3.789 3.789 4.048 -0.259 25148 12413 1 19 . 1 1 51 51 ARG C C 51 175.681 175.681 176.532 -0.851 25148 12414 1 19 . 1 1 51 51 ARG CA C 51 58.162 58.162 58.376 -0.214 25148 12415 1 19 . 1 1 51 51 ARG CB C 51 29.944 29.944 29.878 0.066 25148 12416 1 19 . 1 1 51 51 ARG H H 51 8.984 8.984 8.772 0.212 25148 12417 1 19 . 1 1 52 52 GLU N N 52 116.733 116.733 118.564 -1.831 25148 12418 1 19 . 1 1 52 52 GLU HA H 52 4.368 4.368 4.217 0.151 25148 12419 1 19 . 1 1 52 52 GLU C C 52 178.049 178.049 177.218 0.831 25148 12420 1 19 . 1 1 52 52 GLU CA C 52 58.048 58.048 58.243 -0.195 25148 12421 1 19 . 1 1 52 52 GLU CB C 52 30.716 30.716 29.339 1.377 25148 12422 1 19 . 1 1 52 52 GLU H H 52 8.541 8.541 8.564 -0.023 25148 12423 1 19 . 1 1 53 53 THR N N 53 106.556 106.556 107.538 -0.982 25148 12424 1 19 . 1 1 53 53 THR HA H 53 4.424 4.424 4.617 -0.193 25148 12425 1 19 . 1 1 53 53 THR C C 53 176.352 176.352 175.163 1.189 25148 12426 1 19 . 1 1 53 53 THR CA C 53 61.320 61.320 61.198 0.122 25148 12427 1 19 . 1 1 53 53 THR CB C 53 71.220 71.220 69.869 1.351 25148 12428 1 19 . 1 1 53 53 THR H H 53 8.085 8.085 7.566 0.519 25148 12429 1 19 . 1 1 54 54 GLY N N 54 111.843 111.843 110.867 0.976 25148 12430 1 19 . 1 1 54 54 GLY C C 54 172.690 172.690 174.491 -1.801 25148 12431 1 19 . 1 1 54 54 GLY CA C 54 45.417 45.417 46.159 -0.742 25148 12432 1 19 . 1 1 54 54 GLY H H 54 8.330 8.330 7.819 0.511 25148 12433 1 19 . 1 1 55 55 SER N N 55 113.844 113.844 113.683 0.161 25148 12434 1 19 . 1 1 55 55 SER HA H 55 4.279 4.279 4.666 -0.387 25148 12435 1 19 . 1 1 55 55 SER C C 55 174.127 174.127 173.115 1.012 25148 12436 1 19 . 1 1 55 55 SER CA C 55 59.229 59.229 57.572 1.657 25148 12437 1 19 . 1 1 55 55 SER CB C 55 63.939 63.939 65.354 -1.415 25148 12438 1 19 . 1 1 55 55 SER H H 55 7.653 7.653 7.649 0.004 25148 12439 1 19 . 1 1 56 56 ILE N N 56 125.286 125.286 120.587 4.699 25148 12440 1 19 . 1 1 56 56 ILE HA H 56 5.082 5.082 4.589 0.493 25148 12441 1 19 . 1 1 56 56 ILE C C 56 175.346 175.346 174.539 0.807 25148 12442 1 19 . 1 1 56 56 ILE CA C 56 59.967 59.967 60.213 -0.246 25148 12443 1 19 . 1 1 56 56 ILE CB C 56 40.165 40.165 41.455 -1.290 25148 12444 1 19 . 1 1 56 56 ILE H H 56 8.478 8.478 8.465 0.013 25148 12445 1 19 . 1 1 57 57 ARG N N 57 126.332 126.332 125.817 0.515 25148 12446 1 19 . 1 1 57 57 ARG HA H 57 4.740 4.740 4.511 0.229 25148 12447 1 19 . 1 1 57 57 ARG C C 57 173.921 173.921 173.545 0.376 25148 12448 1 19 . 1 1 57 57 ARG CA C 57 54.311 54.311 53.593 0.718 25148 12449 1 19 . 1 1 57 57 ARG CB C 57 35.805 35.805 33.977 1.828 25148 12450 1 19 . 1 1 57 57 ARG H H 57 8.590 8.590 8.768 -0.178 25148 12451 1 19 . 1 1 58 58 VAL N N 58 120.987 120.987 122.826 -1.839 25148 12452 1 19 . 1 1 58 58 VAL HA H 58 4.334 4.334 4.441 -0.107 25148 12453 1 19 . 1 1 58 58 VAL C C 58 174.204 174.204 174.481 -0.277 25148 12454 1 19 . 1 1 58 58 VAL CA C 58 60.861 60.861 60.610 0.251 25148 12455 1 19 . 1 1 58 58 VAL CB C 58 33.383 33.383 31.986 1.397 25148 12456 1 19 . 1 1 58 58 VAL H H 58 8.585 8.585 8.215 0.370 25148 12457 1 19 . 1 1 59 59 PHE N N 59 124.913 124.913 125.925 -1.012 25148 12458 1 19 . 1 1 59 59 PHE HA H 59 5.046 5.046 5.349 -0.303 25148 12459 1 19 . 1 1 59 59 PHE C C 59 174.446 174.446 174.224 0.222 25148 12460 1 19 . 1 1 59 59 PHE CA C 59 56.695 56.695 55.231 1.464 25148 12461 1 19 . 1 1 59 59 PHE CB C 59 42.779 42.779 43.325 -0.546 25148 12462 1 19 . 1 1 59 59 PHE H H 59 8.920 8.920 8.599 0.321 25148 12463 1 19 . 1 1 60 60 ALA N N 60 124.035 124.035 122.354 1.681 25148 12464 1 19 . 1 1 60 60 ALA HA H 60 5.102 5.102 4.808 0.294 25148 12465 1 19 . 1 1 60 60 ALA C C 60 176.017 176.017 176.383 -0.366 25148 12466 1 19 . 1 1 60 60 ALA CA C 60 50.083 50.083 50.602 -0.519 25148 12467 1 19 . 1 1 60 60 ALA CB C 60 22.400 22.400 20.465 1.935 25148 12468 1 19 . 1 1 60 60 ALA H H 60 9.457 9.457 8.781 0.676 25148 12469 1 19 . 1 1 61 61 ARG N N 61 121.530 121.530 125.492 -3.962 25148 12470 1 19 . 1 1 61 61 ARG HA H 61 4.958 4.958 4.697 0.261 25148 12471 1 19 . 1 1 61 61 ARG C C 61 176.737 176.737 175.781 0.956 25148 12472 1 19 . 1 1 61 61 ARG CA C 61 55.375 55.375 56.329 -0.954 25148 12473 1 19 . 1 1 61 61 ARG CB C 61 31.230 31.230 30.914 0.316 25148 12474 1 19 . 1 1 61 61 ARG H H 61 8.447 8.447 8.760 -0.313 25148 12475 1 19 . 1 1 62 62 LYS N N 62 124.784 124.784 126.008 -1.224 25148 12476 1 19 . 1 1 62 62 LYS HA H 62 4.709 4.709 4.512 0.197 25148 12477 1 19 . 1 1 62 62 LYS C C 62 173.899 173.899 174.618 -0.719 25148 12478 1 19 . 1 1 62 62 LYS CA C 62 54.812 54.812 55.066 -0.254 25148 12479 1 19 . 1 1 62 62 LYS CB C 62 37.147 37.147 35.819 1.328 25148 12480 1 19 . 1 1 62 62 LYS H H 62 9.137 9.137 8.603 0.534 25148 12481 1 19 . 1 1 63 63 ASP N N 63 122.552 122.552 124.860 -2.308 25148 12482 1 19 . 1 1 63 63 ASP HA H 63 4.877 4.877 4.663 0.214 25148 12483 1 19 . 1 1 63 63 ASP C C 63 175.560 175.560 176.604 -1.044 25148 12484 1 19 . 1 1 63 63 ASP CA C 63 54.576 54.576 54.465 0.111 25148 12485 1 19 . 1 1 63 63 ASP CB C 63 42.841 42.841 41.156 1.685 25148 12486 1 19 . 1 1 63 63 ASP H H 63 8.334 8.334 8.702 -0.368 25148 12487 1 19 . 1 1 64 64 VAL N N 64 123.109 123.109 126.661 -3.552 25148 12488 1 19 . 1 1 64 64 VAL HA H 64 4.557 4.557 4.486 0.071 25148 12489 1 19 . 1 1 64 64 VAL C C 64 177.260 177.260 175.446 1.814 25148 12490 1 19 . 1 1 64 64 VAL CA C 64 62.268 62.268 63.493 -1.225 25148 12491 1 19 . 1 1 64 64 VAL CB C 64 30.348 30.348 30.837 -0.489 25148 12492 1 19 . 1 1 64 64 VAL H H 64 8.693 8.693 8.408 0.285 25148 12493 1 19 . 1 1 65 65 VAL N N 65 122.320 122.320 122.753 -0.433 25148 12494 1 19 . 1 1 65 65 VAL HA H 65 4.939 4.939 4.579 0.360 25148 12495 1 19 . 1 1 65 65 VAL C C 65 174.754 174.754 175.145 -0.391 25148 12496 1 19 . 1 1 65 65 VAL CA C 65 59.173 59.173 59.254 -0.081 25148 12497 1 19 . 1 1 65 65 VAL CB C 65 36.289 36.289 35.345 0.944 25148 12498 1 19 . 1 1 65 65 VAL H H 65 8.656 8.656 8.718 -0.062 25148 12499 1 19 . 1 1 66 66 ASP N N 66 119.805 119.805 120.259 -0.454 25148 12500 1 19 . 1 1 66 66 ASP HA H 66 4.499 4.499 4.468 0.031 25148 12501 1 19 . 1 1 66 66 ASP C C 66 176.565 176.565 176.452 0.113 25148 12502 1 19 . 1 1 66 66 ASP CA C 66 57.236 57.236 56.727 0.509 25148 12503 1 19 . 1 1 66 66 ASP CB C 66 41.662 41.662 41.079 0.583 25148 12504 1 19 . 1 1 66 66 ASP H H 66 8.628 8.628 8.630 -0.002 25148 12505 1 19 . 1 1 67 67 GLU N N 67 117.604 117.604 116.714 0.890 25148 12506 1 19 . 1 1 67 67 GLU HA H 67 4.350 4.350 4.481 -0.131 25148 12507 1 19 . 1 1 67 67 GLU C C 67 173.736 173.736 175.724 -1.988 25148 12508 1 19 . 1 1 67 67 GLU CA C 67 55.203 55.203 54.981 0.222 25148 12509 1 19 . 1 1 67 67 GLU CB C 67 32.240 32.240 32.913 -0.673 25148 12510 1 19 . 1 1 67 67 GLU H H 67 7.525 7.525 7.690 -0.165 25148 12511 1 19 . 1 1 68 68 VAL N N 68 125.774 125.774 123.094 2.680 25148 12512 1 19 . 1 1 68 68 VAL HA H 68 3.578 3.578 3.934 -0.356 25148 12513 1 19 . 1 1 68 68 VAL C C 68 175.885 175.885 175.488 0.397 25148 12514 1 19 . 1 1 68 68 VAL CA C 68 63.397 63.397 64.606 -1.208 25148 12515 1 19 . 1 1 68 68 VAL CB C 68 32.452 32.452 31.419 1.033 25148 12516 1 19 . 1 1 68 68 VAL H H 68 8.573 8.573 8.688 -0.115 25148 12517 1 19 . 1 1 69 69 TYR N N 69 129.859 129.859 127.088 2.771 25148 12518 1 19 . 1 1 69 69 TYR HA H 69 4.642 4.642 4.634 0.008 25148 12519 1 19 . 1 1 69 69 TYR C C 69 176.100 176.100 175.472 0.628 25148 12520 1 19 . 1 1 69 69 TYR CA C 69 59.092 59.092 58.392 0.700 25148 12521 1 19 . 1 1 69 69 TYR CB C 69 39.830 39.830 40.516 -0.686 25148 12522 1 19 . 1 1 69 69 TYR H H 69 9.801 9.801 8.885 0.916 25148 12523 1 19 . 1 1 70 70 ASP N N 70 120.204 120.204 120.698 -0.494 25148 12524 1 19 . 1 1 70 70 ASP HA H 70 4.772 4.772 4.885 -0.113 25148 12525 1 19 . 1 1 70 70 ASP C C 70 176.622 176.622 176.253 0.369 25148 12526 1 19 . 1 1 70 70 ASP CA C 70 52.885 52.885 52.997 -0.112 25148 12527 1 19 . 1 1 70 70 ASP CB C 70 41.878 41.878 40.675 1.203 25148 12528 1 19 . 1 1 70 70 ASP H H 70 8.348 8.348 8.026 0.322 25148 12529 1 19 . 1 1 71 71 GLN N N 71 125.440 125.440 124.116 1.324 25148 12530 1 19 . 1 1 71 71 GLN HA H 71 4.315 4.315 3.986 0.329 25148 12531 1 19 . 1 1 71 71 GLN C C 71 175.819 175.819 176.639 -0.820 25148 12532 1 19 . 1 1 71 71 GLN CA C 71 57.914 57.914 58.563 -0.649 25148 12533 1 19 . 1 1 71 71 GLN CB C 71 28.307 28.307 28.728 -0.421 25148 12534 1 19 . 1 1 71 71 GLN H H 71 9.097 9.097 8.664 0.433 25148 12535 1 19 . 1 1 72 72 ARG N N 72 116.306 116.306 115.491 0.815 25148 12536 1 19 . 1 1 72 72 ARG HA H 72 4.252 4.252 4.133 0.119 25148 12537 1 19 . 1 1 72 72 ARG C C 72 178.087 178.087 175.645 2.442 25148 12538 1 19 . 1 1 72 72 ARG CA C 72 58.532 58.532 57.296 1.236 25148 12539 1 19 . 1 1 72 72 ARG CB C 72 30.143 30.143 30.564 -0.421 25148 12540 1 19 . 1 1 72 72 ARG H H 72 8.534 8.534 8.299 0.235 25148 12541 1 19 . 1 1 73 73 LEU N N 73 116.734 116.734 113.562 3.172 25148 12542 1 19 . 1 1 73 73 LEU HA H 73 4.621 4.621 4.668 -0.047 25148 12543 1 19 . 1 1 73 73 LEU C C 73 175.946 175.946 175.013 0.933 25148 12544 1 19 . 1 1 73 73 LEU CA C 73 55.250 55.250 55.591 -0.341 25148 12545 1 19 . 1 1 73 73 LEU CB C 73 46.960 46.960 44.478 2.482 25148 12546 1 19 . 1 1 73 73 LEU H H 73 7.460 7.460 7.451 0.009 25148 12547 1 19 . 1 1 74 74 GLU N N 74 118.787 118.787 122.114 -3.327 25148 12548 1 19 . 1 1 74 74 GLU HA H 74 5.403 5.403 4.617 0.786 25148 12549 1 19 . 1 1 74 74 GLU C C 74 173.709 173.709 174.499 -0.790 25148 12550 1 19 . 1 1 74 74 GLU CA C 74 54.914 54.914 55.857 -0.943 25148 12551 1 19 . 1 1 74 74 GLU CB C 74 35.053 35.053 33.422 1.631 25148 12552 1 19 . 1 1 74 74 GLU H H 74 7.752 7.752 8.054 -0.302 25148 12553 1 19 . 1 1 75 75 ILE N N 75 119.803 119.803 123.085 -3.282 25148 12554 1 19 . 1 1 75 75 ILE HA H 75 4.507 4.507 4.499 0.008 25148 12555 1 19 . 1 1 75 75 ILE C C 75 172.126 172.126 174.194 -2.068 25148 12556 1 19 . 1 1 75 75 ILE CA C 75 58.664 58.664 60.126 -1.462 25148 12557 1 19 . 1 1 75 75 ILE CB C 75 42.560 42.560 41.859 0.701 25148 12558 1 19 . 1 1 75 75 ILE H H 75 8.975 8.975 8.764 0.211 25148 12559 1 19 . 1 1 76 76 SER N N 76 123.236 123.236 124.163 -0.927 25148 12560 1 19 . 1 1 76 76 SER HA H 76 4.505 4.505 4.834 -0.329 25148 12561 1 19 . 1 1 76 76 SER C C 76 176.145 176.145 175.779 0.366 25148 12562 1 19 . 1 1 76 76 SER CA C 76 58.108 58.108 58.696 -0.588 25148 12563 1 19 . 1 1 76 76 SER CB C 76 65.000 65.000 63.976 1.024 25148 12564 1 19 . 1 1 76 76 SER H H 76 8.810 8.810 8.721 0.089 25148 12565 1 19 . 1 1 77 77 ILE N N 77 120.629 120.629 126.682 -6.053 25148 12566 1 19 . 1 1 77 77 ILE HA H 77 3.935 3.935 3.726 0.209 25148 12567 1 19 . 1 1 77 77 ILE C C 77 175.806 175.806 176.905 -1.099 25148 12568 1 19 . 1 1 77 77 ILE CA C 77 61.928 61.928 63.831 -1.903 25148 12569 1 19 . 1 1 77 77 ILE CB C 77 38.031 38.031 38.272 -0.241 25148 12570 1 19 . 1 1 77 77 ILE H H 77 8.321 8.321 8.437 -0.116 25148 12571 1 19 . 1 1 78 78 GLU N N 78 121.032 121.032 117.354 3.678 25148 12572 1 19 . 1 1 78 78 GLU HA H 78 4.082 4.082 3.999 0.083 25148 12573 1 19 . 1 1 78 78 GLU C C 78 179.829 179.829 178.356 1.473 25148 12574 1 19 . 1 1 78 78 GLU CA C 78 60.180 60.180 59.246 0.934 25148 12575 1 19 . 1 1 78 78 GLU CB C 78 28.988 28.988 28.702 0.286 25148 12576 1 19 . 1 1 78 78 GLU H H 78 8.222 8.222 8.539 -0.317 25148 12577 1 19 . 1 1 79 79 GLU N N 79 120.710 120.710 121.247 -0.537 25148 12578 1 19 . 1 1 79 79 GLU HA H 79 4.012 4.012 4.115 -0.103 25148 12579 1 19 . 1 1 79 79 GLU C C 79 180.339 180.339 178.998 1.341 25148 12580 1 19 . 1 1 79 79 GLU CA C 79 59.332 59.332 58.781 0.551 25148 12581 1 19 . 1 1 79 79 GLU CB C 79 29.317 29.317 29.335 -0.018 25148 12582 1 19 . 1 1 79 79 GLU H H 79 7.908 7.908 7.668 0.240 25148 12583 1 19 . 1 1 80 80 ALA N N 80 122.879 122.879 122.000 0.879 25148 12584 1 19 . 1 1 80 80 ALA HA H 80 3.966 3.966 4.141 -0.175 25148 12585 1 19 . 1 1 80 80 ALA C C 80 179.833 179.833 179.986 -0.153 25148 12586 1 19 . 1 1 80 80 ALA CA C 80 55.881 55.881 55.045 0.836 25148 12587 1 19 . 1 1 80 80 ALA CB C 80 18.870 18.870 18.078 0.792 25148 12588 1 19 . 1 1 80 80 ALA H H 80 9.132 9.132 8.049 1.083 25148 12589 1 19 . 1 1 81 81 GLN N N 81 115.829 115.829 116.742 -0.913 25148 12590 1 19 . 1 1 81 81 GLN HA H 81 4.749 4.749 4.323 0.426 25148 12591 1 19 . 1 1 81 81 GLN C C 81 178.126 178.126 178.018 0.108 25148 12592 1 19 . 1 1 81 81 GLN CA C 81 57.682 57.682 58.033 -0.351 25148 12593 1 19 . 1 1 81 81 GLN CB C 81 27.307 27.307 28.653 -1.346 25148 12594 1 19 . 1 1 81 81 GLN H H 81 8.709 8.709 7.786 0.923 25148 12595 1 19 . 1 1 82 82 GLY N N 82 105.531 105.531 106.700 -1.169 25148 12596 1 19 . 1 1 82 82 GLY C C 82 174.917 174.917 175.037 -0.120 25148 12597 1 19 . 1 1 82 82 GLY CA C 82 45.915 45.915 46.530 -0.615 25148 12598 1 19 . 1 1 82 82 GLY H H 82 7.479 7.479 8.051 -0.572 25148 12599 1 19 . 1 1 83 83 ILE N N 83 122.828 122.828 113.757 9.071 25148 12600 1 19 . 1 1 83 83 ILE HA H 83 3.970 3.970 4.446 -0.476 25148 12601 1 19 . 1 1 83 83 ILE C C 83 177.209 177.209 175.547 1.662 25148 12602 1 19 . 1 1 83 83 ILE CA C 83 64.305 64.305 61.641 2.664 25148 12603 1 19 . 1 1 83 83 ILE CB C 83 38.452 38.452 40.212 -1.760 25148 12604 1 19 . 1 1 83 83 ILE H H 83 7.634 7.634 7.550 0.084 25148 12605 1 19 . 1 1 84 84 HIS N N 84 118.927 118.927 120.062 -1.135 25148 12606 1 19 . 1 1 84 84 HIS HA H 84 4.713 4.713 4.938 -0.225 25148 12607 1 19 . 1 1 84 84 HIS CA C 84 55.487 55.487 54.444 1.043 25148 12608 1 19 . 1 1 84 84 HIS CB C 84 33.506 33.506 32.315 1.191 25148 12609 1 19 . 1 1 84 84 HIS H H 84 8.155 8.155 8.406 -0.251 25148 12610 1 19 . 1 1 85 85 PRO HA H 85 4.456 4.456 4.611 -0.155 25148 12611 1 19 . 1 1 85 85 PRO C C 85 177.357 177.357 177.225 0.132 25148 12612 1 19 . 1 1 85 85 PRO CA C 85 64.475 64.475 64.082 0.393 25148 12613 1 19 . 1 1 85 85 PRO CB C 85 32.489 32.489 32.101 0.388 25148 12614 1 19 . 1 1 86 86 GLU N N 86 116.314 116.314 117.608 -1.294 25148 12615 1 19 . 1 1 86 86 GLU HA H 86 4.286 4.286 4.178 0.108 25148 12616 1 19 . 1 1 86 86 GLU C C 86 177.624 177.624 177.237 0.387 25148 12617 1 19 . 1 1 86 86 GLU CA C 86 56.619 56.619 56.583 0.036 25148 12618 1 19 . 1 1 86 86 GLU CB C 86 29.389 29.389 29.501 -0.112 25148 12619 1 19 . 1 1 86 86 GLU H H 86 8.938 8.938 7.813 1.125 25148 12620 1 19 . 1 1 87 87 TYR N N 87 119.773 119.773 120.377 -0.604 25148 12621 1 19 . 1 1 87 87 TYR HA H 87 4.744 4.744 4.209 0.535 25148 12622 1 19 . 1 1 87 87 TYR C C 87 174.533 174.533 176.397 -1.864 25148 12623 1 19 . 1 1 87 87 TYR CA C 87 59.117 59.117 59.433 -0.316 25148 12624 1 19 . 1 1 87 87 TYR CB C 87 38.859 38.859 38.810 0.049 25148 12625 1 19 . 1 1 87 87 TYR H H 87 7.447 7.447 7.383 0.064 25148 12626 1 19 . 1 1 88 88 MET N N 88 118.298 118.298 117.301 0.997 25148 12627 1 19 . 1 1 88 88 MET HA H 88 4.770 4.770 4.661 0.109 25148 12628 1 19 . 1 1 88 88 MET C C 88 175.638 175.638 173.965 1.673 25148 12629 1 19 . 1 1 88 88 MET CA C 88 53.133 53.133 54.595 -1.462 25148 12630 1 19 . 1 1 88 88 MET CB C 88 37.102 37.102 35.475 1.627 25148 12631 1 19 . 1 1 88 88 MET H H 88 9.023 9.023 8.285 0.738 25148 12632 1 19 . 1 1 89 89 VAL N N 89 120.157 120.157 123.517 -3.360 25148 12633 1 19 . 1 1 89 89 VAL HA H 89 3.330 3.330 3.725 -0.395 25148 12634 1 19 . 1 1 89 89 VAL C C 89 177.432 177.432 177.167 0.265 25148 12635 1 19 . 1 1 89 89 VAL CA C 89 65.675 65.675 63.398 2.277 25148 12636 1 19 . 1 1 89 89 VAL CB C 89 31.321 31.321 30.017 1.304 25148 12637 1 19 . 1 1 89 89 VAL H H 89 8.313 8.313 8.576 -0.263 25148 12638 1 19 . 1 1 90 90 GLY N N 90 116.935 116.935 116.404 0.531 25148 12639 1 19 . 1 1 90 90 GLY C C 90 175.196 175.196 174.243 0.953 25148 12640 1 19 . 1 1 90 90 GLY CA C 90 44.685 44.685 44.825 -0.140 25148 12641 1 19 . 1 1 90 90 GLY H H 90 8.551 8.551 9.008 -0.458 25148 12642 1 19 . 1 1 91 91 ASP N N 91 121.616 121.616 122.281 -0.665 25148 12643 1 19 . 1 1 91 91 ASP HA H 91 4.790 4.790 4.912 -0.122 25148 12644 1 19 . 1 1 91 91 ASP C C 91 174.431 174.431 175.127 -0.696 25148 12645 1 19 . 1 1 91 91 ASP CA C 91 55.011 55.011 53.349 1.661 25148 12646 1 19 . 1 1 91 91 ASP CB C 91 42.079 42.079 42.302 -0.223 25148 12647 1 19 . 1 1 91 91 ASP H H 91 8.073 8.073 8.044 0.029 25148 12648 1 19 . 1 1 92 92 VAL N N 92 118.919 118.919 114.801 4.118 25148 12649 1 19 . 1 1 92 92 VAL HA H 92 4.709 4.709 5.076 -0.367 25148 12650 1 19 . 1 1 92 92 VAL C C 92 175.602 175.602 174.145 1.457 25148 12651 1 19 . 1 1 92 92 VAL CA C 92 61.527 61.527 59.888 1.639 25148 12652 1 19 . 1 1 92 92 VAL CB C 92 34.110 34.110 35.274 -1.164 25148 12653 1 19 . 1 1 92 92 VAL H H 92 8.216 8.216 8.090 0.126 25148 12654 1 19 . 1 1 93 93 VAL N N 93 123.922 123.922 123.532 0.390 25148 12655 1 19 . 1 1 93 93 VAL HA H 93 4.231 4.231 4.188 0.043 25148 12656 1 19 . 1 1 93 93 VAL C C 93 174.105 174.105 174.132 -0.027 25148 12657 1 19 . 1 1 93 93 VAL CA C 93 59.644 59.644 59.061 0.583 25148 12658 1 19 . 1 1 93 93 VAL CB C 93 34.661 34.661 34.510 0.151 25148 12659 1 19 . 1 1 93 93 VAL H H 93 8.812 8.812 8.321 0.491 25148 12660 1 19 . 1 1 94 94 GLU N N 94 123.605 123.605 127.990 -4.385 25148 12661 1 19 . 1 1 94 94 GLU HA H 94 5.347 5.347 5.092 0.255 25148 12662 1 19 . 1 1 94 94 GLU C C 94 175.708 175.708 175.521 0.187 25148 12663 1 19 . 1 1 94 94 GLU CA C 94 54.979 54.979 55.143 -0.164 25148 12664 1 19 . 1 1 94 94 GLU CB C 94 31.612 31.612 31.688 -0.076 25148 12665 1 19 . 1 1 94 94 GLU H H 94 8.312 8.312 8.438 -0.126 25148 12666 1 19 . 1 1 95 95 ILE N N 95 123.581 123.581 124.389 -0.808 25148 12667 1 19 . 1 1 95 95 ILE HA H 95 4.601 4.601 4.560 0.041 25148 12668 1 19 . 1 1 95 95 ILE C C 95 175.081 175.081 175.249 -0.168 25148 12669 1 19 . 1 1 95 95 ILE CA C 95 58.601 58.601 59.579 -0.978 25148 12670 1 19 . 1 1 95 95 ILE CB C 95 41.727 41.727 41.839 -0.112 25148 12671 1 19 . 1 1 95 95 ILE H H 95 9.045 9.045 8.136 0.909 25148 12672 1 19 . 1 1 96 96 GLU N N 96 128.094 128.094 127.949 0.145 25148 12673 1 19 . 1 1 96 96 GLU HA H 96 4.098 4.098 3.964 0.134 25148 12674 1 19 . 1 1 96 96 GLU C C 96 176.845 176.845 175.649 1.196 25148 12675 1 19 . 1 1 96 96 GLU CA C 96 57.853 57.853 57.925 -0.072 25148 12676 1 19 . 1 1 96 96 GLU CB C 96 28.323 28.323 29.248 -0.925 25148 12677 1 19 . 1 1 96 96 GLU H H 96 9.256 9.256 8.929 0.327 25148 12678 1 19 . 1 1 97 97 VAL N N 97 118.446 118.446 123.783 -5.337 25148 12679 1 19 . 1 1 97 97 VAL HA H 97 4.568 4.568 4.260 0.308 25148 12680 1 19 . 1 1 97 97 VAL C C 97 175.051 175.051 174.967 0.084 25148 12681 1 19 . 1 1 97 97 VAL CA C 97 59.796 59.796 60.660 -0.864 25148 12682 1 19 . 1 1 97 97 VAL CB C 97 32.399 32.399 33.217 -0.818 25148 12683 1 19 . 1 1 97 97 VAL H H 97 8.609 8.609 8.657 -0.048 25148 12684 1 19 . 1 1 98 98 THR N N 98 119.118 119.118 118.867 0.251 25148 12685 1 19 . 1 1 98 98 THR HA H 98 3.320 3.320 4.005 -0.685 25148 12686 1 19 . 1 1 98 98 THR CA C 98 61.628 61.628 59.220 2.408 25148 12687 1 19 . 1 1 98 98 THR CB C 98 70.031 70.031 69.377 0.654 25148 12688 1 19 . 1 1 98 98 THR H H 98 7.396 7.396 7.378 0.018 25148 12689 1 19 . 1 1 99 99 PRO HA H 99 4.458 4.458 4.586 -0.128 25148 12690 1 19 . 1 1 99 99 PRO CA C 99 62.348 62.348 62.510 -0.162 25148 12691 1 19 . 1 1 99 99 PRO CB C 99 33.182 33.182 32.653 0.529 25148 12692 1 19 . 1 1 100 100 LYS HA H 100 4.126 4.126 4.211 -0.085 25148 12693 1 19 . 1 1 100 100 LYS CA C 100 58.773 58.773 57.868 0.905 25148 12694 1 19 . 1 1 100 100 LYS CB C 100 32.195 32.195 32.176 0.019 25148 12695 1 19 . 1 1 101 101 ASP HA H 101 4.924 4.924 4.786 0.138 25148 12696 1 19 . 1 1 101 101 ASP C C 101 176.884 176.884 176.599 0.285 25148 12697 1 19 . 1 1 101 101 ASP CA C 101 54.134 54.134 54.152 -0.018 25148 12698 1 19 . 1 1 101 101 ASP CB C 101 40.272 40.272 41.005 -0.734 25148 12699 1 19 . 1 1 102 102 PHE N N 102 118.703 118.703 121.333 -2.630 25148 12700 1 19 . 1 1 102 102 PHE HA H 102 4.295 4.295 4.223 0.072 25148 12701 1 19 . 1 1 102 102 PHE C C 102 176.477 176.477 177.032 -0.555 25148 12702 1 19 . 1 1 102 102 PHE CA C 102 60.748 60.748 60.112 0.636 25148 12703 1 19 . 1 1 102 102 PHE CB C 102 39.667 39.667 39.161 0.506 25148 12704 1 19 . 1 1 102 102 PHE H H 102 7.862 7.862 7.714 0.148 25148 12705 1 19 . 1 1 103 103 GLY CA C 103 47.430 47.430 47.380 0.050 25148 12706 1 19 . 1 1 104 104 ARG N N 104 121.819 121.819 121.288 0.531 25148 12707 1 19 . 1 1 104 104 ARG HA H 104 4.176 4.176 4.198 -0.022 25148 12708 1 19 . 1 1 104 104 ARG C C 104 178.912 178.912 178.520 0.392 25148 12709 1 19 . 1 1 104 104 ARG CA C 104 59.235 59.235 57.421 1.814 25148 12710 1 19 . 1 1 104 104 ARG CB C 104 30.000 30.000 30.223 -0.223 25148 12711 1 19 . 1 1 104 104 ARG H H 104 7.809 7.809 7.585 0.224 25148 12712 1 19 . 1 1 105 105 ILE N N 105 120.331 120.331 120.576 -0.245 25148 12713 1 19 . 1 1 105 105 ILE HA H 105 3.836 3.836 3.507 0.329 25148 12714 1 19 . 1 1 105 105 ILE C C 105 179.206 179.206 177.255 1.951 25148 12715 1 19 . 1 1 105 105 ILE CA C 105 63.025 63.025 64.953 -1.928 25148 12716 1 19 . 1 1 105 105 ILE CB C 105 38.127 38.127 37.387 0.740 25148 12717 1 19 . 1 1 105 105 ILE H H 105 7.203 7.203 7.394 -0.191 25148 12718 1 19 . 1 1 106 106 ALA N N 106 124.867 124.867 122.686 2.181 25148 12719 1 19 . 1 1 106 106 ALA HA H 106 3.665 3.665 3.573 0.092 25148 12720 1 19 . 1 1 106 106 ALA C C 106 178.590 178.590 178.962 -0.372 25148 12721 1 19 . 1 1 106 106 ALA CA C 106 54.842 54.842 55.470 -0.628 25148 12722 1 19 . 1 1 106 106 ALA CB C 106 18.659 18.659 17.794 0.865 25148 12723 1 19 . 1 1 106 106 ALA H H 106 8.813 8.813 8.182 0.631 25148 12724 1 19 . 1 1 107 107 ALA N N 107 119.597 119.597 119.312 0.285 25148 12725 1 19 . 1 1 107 107 ALA HA H 107 4.014 4.014 3.968 0.046 25148 12726 1 19 . 1 1 107 107 ALA C C 107 180.214 180.214 179.379 0.835 25148 12727 1 19 . 1 1 107 107 ALA CA C 107 55.454 55.454 54.295 1.159 25148 12728 1 19 . 1 1 107 107 ALA CB C 107 18.260 18.260 18.005 0.255 25148 12729 1 19 . 1 1 107 107 ALA H H 107 8.012 8.012 7.808 0.204 25148 12730 1 19 . 1 1 108 108 GLN N N 108 116.896 116.896 118.041 -1.145 25148 12731 1 19 . 1 1 108 108 GLN HA H 108 4.054 4.054 4.094 -0.040 25148 12732 1 19 . 1 1 108 108 GLN C C 108 178.784 178.784 178.301 0.483 25148 12733 1 19 . 1 1 108 108 GLN CA C 108 58.705 58.705 58.821 -0.116 25148 12734 1 19 . 1 1 108 108 GLN CB C 108 28.647 28.647 28.833 -0.186 25148 12735 1 19 . 1 1 108 108 GLN H H 108 7.498 7.498 7.893 -0.395 25148 12736 1 19 . 1 1 109 109 THR N N 109 117.495 117.495 115.758 1.737 25148 12737 1 19 . 1 1 109 109 THR HA H 109 3.917 3.917 4.302 -0.385 25148 12738 1 19 . 1 1 109 109 THR C C 109 175.732 175.732 175.929 -0.197 25148 12739 1 19 . 1 1 109 109 THR CA C 109 66.989 66.989 65.662 1.327 25148 12740 1 19 . 1 1 109 109 THR CB C 109 68.766 68.766 68.854 -0.088 25148 12741 1 19 . 1 1 109 109 THR H H 109 8.203 8.203 8.231 -0.028 25148 12742 1 19 . 1 1 110 110 ALA N N 110 122.308 122.308 124.758 -2.450 25148 12743 1 19 . 1 1 110 110 ALA HA H 110 3.854 3.854 4.062 -0.208 25148 12744 1 19 . 1 1 110 110 ALA C C 110 178.380 178.380 178.689 -0.309 25148 12745 1 19 . 1 1 110 110 ALA CA C 110 55.903 55.903 55.006 0.897 25148 12746 1 19 . 1 1 110 110 ALA CB C 110 18.524 18.524 18.312 0.212 25148 12747 1 19 . 1 1 110 110 ALA H H 110 8.668 8.668 7.895 0.773 25148 12748 1 19 . 1 1 111 111 LYS N N 111 115.552 115.552 117.757 -2.205 25148 12749 1 19 . 1 1 111 111 LYS HA H 111 3.923 3.923 3.977 -0.054 25148 12750 1 19 . 1 1 111 111 LYS C C 111 179.111 179.111 178.798 0.313 25148 12751 1 19 . 1 1 111 111 LYS CA C 111 59.825 59.825 59.281 0.544 25148 12752 1 19 . 1 1 111 111 LYS CB C 111 32.251 32.251 31.909 0.342 25148 12753 1 19 . 1 1 111 111 LYS H H 111 7.642 7.642 7.791 -0.149 25148 12754 1 19 . 1 1 112 112 GLN N N 112 120.178 120.178 118.682 1.496 25148 12755 1 19 . 1 1 112 112 GLN HA H 112 4.060 4.060 4.143 -0.083 25148 12756 1 19 . 1 1 112 112 GLN C C 112 178.355 178.355 178.222 0.133 25148 12757 1 19 . 1 1 112 112 GLN CA C 112 59.240 59.240 58.162 1.078 25148 12758 1 19 . 1 1 112 112 GLN CB C 112 28.250 28.250 28.565 -0.315 25148 12759 1 19 . 1 1 112 112 GLN H H 112 7.798 7.798 7.658 0.140 25148 12760 1 19 . 1 1 113 113 VAL N N 113 119.799 119.799 120.745 -0.946 25148 12761 1 19 . 1 1 113 113 VAL HA H 113 3.705 3.705 4.038 -0.333 25148 12762 1 19 . 1 1 113 113 VAL C C 113 178.303 178.303 178.149 0.154 25148 12763 1 19 . 1 1 113 113 VAL CA C 113 66.277 66.277 64.479 1.798 25148 12764 1 19 . 1 1 113 113 VAL CB C 113 31.954 31.954 31.524 0.430 25148 12765 1 19 . 1 1 113 113 VAL H H 113 8.105 8.105 7.530 0.575 25148 12766 1 19 . 1 1 114 114 VAL N N 114 118.265 118.265 116.925 1.340 25148 12767 1 19 . 1 1 114 114 VAL HA H 114 3.392 3.392 3.701 -0.309 25148 12768 1 19 . 1 1 114 114 VAL C C 114 177.360 177.360 178.014 -0.654 25148 12769 1 19 . 1 1 114 114 VAL CA C 114 67.832 67.832 66.884 0.948 25148 12770 1 19 . 1 1 114 114 VAL CB C 114 31.801 31.801 30.899 0.902 25148 12771 1 19 . 1 1 114 114 VAL H H 114 8.180 8.180 8.219 -0.039 25148 12772 1 19 . 1 1 115 115 THR N N 115 113.460 113.460 114.732 -1.272 25148 12773 1 19 . 1 1 115 115 THR HA H 115 3.856 3.856 4.031 -0.175 25148 12774 1 19 . 1 1 115 115 THR C C 115 176.529 176.529 176.637 -0.108 25148 12775 1 19 . 1 1 115 115 THR CA C 115 66.706 66.706 66.514 0.192 25148 12776 1 19 . 1 1 115 115 THR CB C 115 69.008 69.008 68.549 0.460 25148 12777 1 19 . 1 1 115 115 THR H H 115 8.143 8.143 7.669 0.474 25148 12778 1 19 . 1 1 116 116 GLN N N 116 120.129 120.129 121.175 -1.046 25148 12779 1 19 . 1 1 116 116 GLN HA H 116 4.054 4.054 4.086 -0.032 25148 12780 1 19 . 1 1 116 116 GLN C C 116 178.100 178.100 178.493 -0.393 25148 12781 1 19 . 1 1 116 116 GLN CA C 116 58.950 58.950 59.303 -0.353 25148 12782 1 19 . 1 1 116 116 GLN CB C 116 28.244 28.244 28.531 -0.287 25148 12783 1 19 . 1 1 116 116 GLN H H 116 7.936 7.936 7.421 0.515 25148 12784 1 19 . 1 1 117 117 ARG N N 117 117.838 117.838 119.227 -1.389 25148 12785 1 19 . 1 1 117 117 ARG HA H 117 4.174 4.174 4.055 0.119 25148 12786 1 19 . 1 1 117 117 ARG C C 117 179.138 179.138 178.697 0.441 25148 12787 1 19 . 1 1 117 117 ARG CA C 117 57.461 57.461 58.577 -1.115 25148 12788 1 19 . 1 1 117 117 ARG CB C 117 29.548 29.548 29.393 0.155 25148 12789 1 19 . 1 1 117 117 ARG H H 117 8.240 8.240 8.205 0.035 25148 12790 1 19 . 1 1 118 118 VAL N N 118 120.278 120.278 119.813 0.465 25148 12791 1 19 . 1 1 118 118 VAL HA H 118 3.709 3.709 3.681 0.028 25148 12792 1 19 . 1 1 118 118 VAL C C 118 177.597 177.597 178.043 -0.446 25148 12793 1 19 . 1 1 118 118 VAL CA C 118 66.246 66.246 66.279 -0.034 25148 12794 1 19 . 1 1 118 118 VAL CB C 118 31.785 31.785 31.006 0.779 25148 12795 1 19 . 1 1 118 118 VAL H H 118 8.480 8.480 7.606 0.874 25148 12796 1 19 . 1 1 119 119 ARG N N 119 120.197 120.197 118.800 1.397 25148 12797 1 19 . 1 1 119 119 ARG HA H 119 4.173 4.173 4.084 0.089 25148 12798 1 19 . 1 1 119 119 ARG C C 119 178.864 178.864 179.159 -0.295 25148 12799 1 19 . 1 1 119 119 ARG CA C 119 58.772 58.772 59.231 -0.459 25148 12800 1 19 . 1 1 119 119 ARG CB C 119 29.873 29.873 29.842 0.031 25148 12801 1 19 . 1 1 119 119 ARG H H 119 7.899 7.899 7.620 0.280 25148 12802 1 19 . 1 1 120 120 GLU N N 120 118.768 118.768 119.646 -0.878 25148 12803 1 19 . 1 1 120 120 GLU HA H 120 4.110 4.110 4.085 0.025 25148 12804 1 19 . 1 1 120 120 GLU C C 120 177.823 177.823 178.490 -0.667 25148 12805 1 19 . 1 1 120 120 GLU CA C 120 58.223 58.223 58.712 -0.489 25148 12806 1 19 . 1 1 120 120 GLU CB C 120 29.854 29.854 29.390 0.464 25148 12807 1 19 . 1 1 120 120 GLU H H 120 8.084 8.084 7.896 0.188 25148 12808 1 19 . 1 1 121 121 ALA N N 121 121.984 121.984 121.801 0.183 25148 12809 1 19 . 1 1 121 121 ALA HA H 121 4.296 4.296 4.067 0.229 25148 12810 1 19 . 1 1 121 121 ALA C C 121 178.586 178.586 179.819 -1.233 25148 12811 1 19 . 1 1 121 121 ALA CA C 121 53.475 53.475 55.222 -1.747 25148 12812 1 19 . 1 1 121 121 ALA CB C 121 18.856 18.856 18.600 0.256 25148 12813 1 19 . 1 1 121 121 ALA H H 121 7.810 7.810 8.376 -0.566 25148 12814 1 19 . 1 1 122 122 GLU N N 122 118.229 118.229 118.422 -0.193 25148 12815 1 19 . 1 1 122 122 GLU HA H 122 4.241 4.241 3.973 0.268 25148 12816 1 19 . 1 1 122 122 GLU C C 122 176.839 176.839 178.551 -1.712 25148 12817 1 19 . 1 1 122 122 GLU CA C 122 57.118 57.118 58.541 -1.423 25148 12818 1 19 . 1 1 122 122 GLU CB C 122 30.018 30.018 28.816 1.202 25148 12819 1 19 . 1 1 122 122 GLU H H 122 7.938 7.938 8.028 -0.090 25148 12820 1 19 . 1 1 123 123 ARG N N 123 120.601 120.601 120.251 0.350 25148 12821 1 19 . 1 1 123 123 ARG HA H 123 4.348 4.348 4.094 0.254 25148 12822 1 19 . 1 1 123 123 ARG C C 123 176.071 176.071 176.749 -0.678 25148 12823 1 19 . 1 1 123 123 ARG CA C 123 56.510 56.510 57.731 -1.221 25148 12824 1 19 . 1 1 123 123 ARG CB C 123 30.765 30.765 30.917 -0.152 25148 12825 1 19 . 1 1 123 123 ARG H H 123 7.977 7.977 7.651 0.326 25148 12826 1 20 . 1 1 4 4 GLU HA H 4 4.138 4.138 4.031 0.107 25148 12827 1 20 . 1 1 4 4 GLU C C 4 179.152 179.152 177.531 1.621 25148 12828 1 20 . 1 1 4 4 GLU CA C 4 59.566 59.566 59.340 0.226 25148 12829 1 20 . 1 1 4 4 GLU CB C 4 29.407 29.407 29.603 -0.196 25148 12830 1 20 . 1 1 5 5 LEU N N 5 121.360 121.360 116.530 4.830 25148 12831 1 20 . 1 1 5 5 LEU HA H 5 4.195 4.195 4.043 0.152 25148 12832 1 20 . 1 1 5 5 LEU C C 5 178.179 178.179 178.293 -0.114 25148 12833 1 20 . 1 1 5 5 LEU CA C 5 57.830 57.830 57.572 0.258 25148 12834 1 20 . 1 1 5 5 LEU CB C 5 41.630 41.630 41.432 0.198 25148 12835 1 20 . 1 1 5 5 LEU H H 5 7.877 7.877 7.980 -0.103 25148 12836 1 20 . 1 1 6 6 LEU N N 6 118.058 118.058 118.782 -0.724 25148 12837 1 20 . 1 1 6 6 LEU HA H 6 3.919 3.919 3.920 -0.001 25148 12838 1 20 . 1 1 6 6 LEU C C 6 180.274 180.274 179.154 1.120 25148 12839 1 20 . 1 1 6 6 LEU CA C 6 58.221 58.221 57.585 0.636 25148 12840 1 20 . 1 1 6 6 LEU CB C 6 40.684 40.684 41.193 -0.509 25148 12841 1 20 . 1 1 6 6 LEU H H 6 7.685 7.685 7.480 0.205 25148 12842 1 20 . 1 1 7 7 ASP N N 7 120.662 120.662 118.468 2.194 25148 12843 1 20 . 1 1 7 7 ASP HA H 7 4.416 4.416 4.479 -0.063 25148 12844 1 20 . 1 1 7 7 ASP C C 7 178.738 178.738 177.788 0.950 25148 12845 1 20 . 1 1 7 7 ASP CA C 7 57.519 57.519 55.959 1.560 25148 12846 1 20 . 1 1 7 7 ASP CB C 7 40.167 40.167 40.888 -0.721 25148 12847 1 20 . 1 1 7 7 ASP H H 7 8.427 8.427 7.683 0.744 25148 12848 1 20 . 1 1 8 8 ALA N N 8 122.612 122.612 123.118 -0.506 25148 12849 1 20 . 1 1 8 8 ALA HA H 8 4.146 4.146 3.970 0.176 25148 12850 1 20 . 1 1 8 8 ALA C C 8 180.787 180.787 179.648 1.139 25148 12851 1 20 . 1 1 8 8 ALA CA C 8 55.165 55.165 55.236 -0.071 25148 12852 1 20 . 1 1 8 8 ALA CB C 8 17.711 17.711 18.567 -0.856 25148 12853 1 20 . 1 1 8 8 ALA H H 8 7.847 7.847 7.929 -0.082 25148 12854 1 20 . 1 1 9 9 LEU N N 9 116.977 116.977 117.258 -0.281 25148 12855 1 20 . 1 1 9 9 LEU HA H 9 4.115 4.115 3.924 0.191 25148 12856 1 20 . 1 1 9 9 LEU C C 9 179.510 179.510 179.297 0.213 25148 12857 1 20 . 1 1 9 9 LEU CA C 9 57.468 57.468 57.664 -0.196 25148 12858 1 20 . 1 1 9 9 LEU CB C 9 41.203 41.203 41.605 -0.402 25148 12859 1 20 . 1 1 9 9 LEU H H 9 8.256 8.256 7.683 0.573 25148 12860 1 20 . 1 1 10 10 THR N N 10 118.764 118.764 115.695 3.069 25148 12861 1 20 . 1 1 10 10 THR HA H 10 4.487 4.487 3.918 0.569 25148 12862 1 20 . 1 1 10 10 THR C C 10 176.567 176.567 176.694 -0.127 25148 12863 1 20 . 1 1 10 10 THR CA C 10 68.768 68.768 66.350 2.418 25148 12864 1 20 . 1 1 10 10 THR CB C 10 66.961 66.961 68.344 -1.383 25148 12865 1 20 . 1 1 10 10 THR H H 10 8.218 8.218 7.398 0.820 25148 12866 1 20 . 1 1 11 11 ILE N N 11 122.555 122.555 119.892 2.663 25148 12867 1 20 . 1 1 11 11 ILE HA H 11 3.779 3.779 3.703 0.076 25148 12868 1 20 . 1 1 11 11 ILE C C 11 177.793 177.793 177.596 0.197 25148 12869 1 20 . 1 1 11 11 ILE CA C 11 64.695 64.695 64.947 -0.252 25148 12870 1 20 . 1 1 11 11 ILE CB C 11 37.856 37.856 37.754 0.102 25148 12871 1 20 . 1 1 11 11 ILE H H 11 7.632 7.632 7.785 -0.153 25148 12872 1 20 . 1 1 12 12 LEU N N 12 120.469 120.469 117.732 2.737 25148 12873 1 20 . 1 1 12 12 LEU HA H 12 4.065 4.065 4.335 -0.270 25148 12874 1 20 . 1 1 12 12 LEU C C 12 179.139 179.139 179.621 -0.482 25148 12875 1 20 . 1 1 12 12 LEU CA C 12 57.944 57.944 56.367 1.577 25148 12876 1 20 . 1 1 12 12 LEU CB C 12 42.170 42.170 41.531 0.639 25148 12877 1 20 . 1 1 12 12 LEU H H 12 7.951 7.951 7.722 0.229 25148 12878 1 20 . 1 1 13 13 GLU N N 13 119.669 119.669 119.429 0.240 25148 12879 1 20 . 1 1 13 13 GLU HA H 13 4.183 4.183 3.949 0.234 25148 12880 1 20 . 1 1 13 13 GLU C C 13 179.007 179.007 177.699 1.308 25148 12881 1 20 . 1 1 13 13 GLU CA C 13 59.703 59.703 58.968 0.735 25148 12882 1 20 . 1 1 13 13 GLU CB C 13 30.110 30.110 29.501 0.609 25148 12883 1 20 . 1 1 13 13 GLU H H 13 8.003 8.003 7.847 0.156 25148 12884 1 20 . 1 1 14 14 LYS N N 14 118.935 118.935 117.713 1.222 25148 12885 1 20 . 1 1 14 14 LYS HA H 14 4.124 4.124 4.090 0.034 25148 12886 1 20 . 1 1 14 14 LYS CA C 14 58.847 58.847 57.787 1.060 25148 12887 1 20 . 1 1 14 14 LYS CB C 14 33.053 33.053 32.375 0.678 25148 12888 1 20 . 1 1 14 14 LYS H H 14 7.862 7.862 7.690 0.172 25148 12889 1 20 . 1 1 15 15 GLU HA H 15 3.693 3.693 4.170 -0.477 25148 12890 1 20 . 1 1 15 15 GLU CA C 15 56.688 56.688 56.634 0.054 25148 12891 1 20 . 1 1 15 15 GLU CB C 15 32.204 32.204 30.169 2.035 25148 12892 1 20 . 1 1 16 16 LYS HA H 16 4.678 4.678 4.418 0.260 25148 12893 1 20 . 1 1 16 16 LYS CA C 16 55.135 55.135 55.581 -0.446 25148 12894 1 20 . 1 1 16 16 LYS CB C 16 34.049 34.049 33.887 0.162 25148 12895 1 20 . 1 1 17 17 GLY CA C 17 46.541 46.541 45.239 1.302 25148 12896 1 20 . 1 1 18 18 ILE N N 18 115.364 115.364 121.534 -6.170 25148 12897 1 20 . 1 1 18 18 ILE HA H 18 4.079 4.079 4.203 -0.124 25148 12898 1 20 . 1 1 18 18 ILE C C 18 174.751 174.751 175.288 -0.537 25148 12899 1 20 . 1 1 18 18 ILE CA C 18 60.333 60.333 60.199 0.134 25148 12900 1 20 . 1 1 18 18 ILE CB C 18 39.044 39.044 37.827 1.217 25148 12901 1 20 . 1 1 18 18 ILE H H 18 8.203 8.203 7.730 0.473 25148 12902 1 20 . 1 1 19 19 SER N N 19 119.891 119.891 123.758 -3.867 25148 12903 1 20 . 1 1 19 19 SER HA H 19 4.362 4.362 4.533 -0.171 25148 12904 1 20 . 1 1 19 19 SER CA C 19 58.476 58.476 58.488 -0.012 25148 12905 1 20 . 1 1 19 19 SER CB C 19 63.533 63.533 63.550 -0.016 25148 12906 1 20 . 1 1 19 19 SER H H 19 8.253 8.253 8.815 -0.562 25148 12907 1 20 . 1 1 20 20 LYS N N 20 124.782 124.782 127.519 -2.737 25148 12908 1 20 . 1 1 20 20 LYS HA H 20 4.137 4.137 4.057 0.080 25148 12909 1 20 . 1 1 20 20 LYS C C 20 177.889 177.889 177.462 0.427 25148 12910 1 20 . 1 1 20 20 LYS CA C 20 59.485 59.485 58.794 0.691 25148 12911 1 20 . 1 1 20 20 LYS CB C 20 32.711 32.711 32.120 0.591 25148 12912 1 20 . 1 1 20 20 LYS H H 20 8.918 8.918 8.519 0.399 25148 12913 1 20 . 1 1 21 21 GLU N N 21 117.831 117.831 118.561 -0.730 25148 12914 1 20 . 1 1 21 21 GLU HA H 21 3.957 3.957 4.048 -0.091 25148 12915 1 20 . 1 1 21 21 GLU C C 21 178.822 178.822 178.513 0.309 25148 12916 1 20 . 1 1 21 21 GLU CA C 21 59.529 59.529 58.899 0.630 25148 12917 1 20 . 1 1 21 21 GLU CB C 21 29.237 29.237 28.900 0.337 25148 12918 1 20 . 1 1 21 21 GLU H H 21 8.361 8.361 8.700 -0.339 25148 12919 1 20 . 1 1 22 22 ILE N N 22 118.690 118.690 119.705 -1.015 25148 12920 1 20 . 1 1 22 22 ILE HA H 22 3.884 3.884 3.918 -0.034 25148 12921 1 20 . 1 1 22 22 ILE C C 22 179.247 179.247 177.725 1.522 25148 12922 1 20 . 1 1 22 22 ILE CA C 22 63.735 63.735 63.884 -0.149 25148 12923 1 20 . 1 1 22 22 ILE CB C 22 37.415 37.415 37.991 -0.576 25148 12924 1 20 . 1 1 22 22 ILE H H 22 7.353 7.353 7.397 -0.044 25148 12925 1 20 . 1 1 23 23 ILE N N 23 120.880 120.880 120.901 -0.021 25148 12926 1 20 . 1 1 23 23 ILE HA H 23 3.733 3.733 3.713 0.020 25148 12927 1 20 . 1 1 23 23 ILE C C 23 177.817 177.817 178.058 -0.241 25148 12928 1 20 . 1 1 23 23 ILE CA C 23 64.172 64.172 63.908 0.263 25148 12929 1 20 . 1 1 23 23 ILE CB C 23 36.473 36.473 36.864 -0.390 25148 12930 1 20 . 1 1 23 23 ILE H H 23 7.571 7.571 7.146 0.425 25148 12931 1 20 . 1 1 24 24 ILE N N 24 121.460 121.460 118.822 2.638 25148 12932 1 20 . 1 1 24 24 ILE HA H 24 3.486 3.486 3.607 -0.121 25148 12933 1 20 . 1 1 24 24 ILE C C 24 177.759 177.759 177.727 0.032 25148 12934 1 20 . 1 1 24 24 ILE CA C 24 66.641 66.641 66.096 0.545 25148 12935 1 20 . 1 1 24 24 ILE CB C 24 37.307 37.307 37.293 0.014 25148 12936 1 20 . 1 1 24 24 ILE H H 24 8.709 8.709 7.701 1.008 25148 12937 1 20 . 1 1 25 25 GLU N N 25 119.323 119.323 118.242 1.081 25148 12938 1 20 . 1 1 25 25 GLU HA H 25 4.177 4.177 4.051 0.126 25148 12939 1 20 . 1 1 25 25 GLU C C 25 179.348 179.348 178.458 0.890 25148 12940 1 20 . 1 1 25 25 GLU CA C 25 59.951 59.951 59.067 0.884 25148 12941 1 20 . 1 1 25 25 GLU CB C 25 29.340 29.340 29.040 0.300 25148 12942 1 20 . 1 1 25 25 GLU H H 25 8.048 8.048 7.868 0.180 25148 12943 1 20 . 1 1 26 26 ALA N N 26 122.390 122.390 122.517 -0.127 25148 12944 1 20 . 1 1 26 26 ALA HA H 26 4.325 4.325 4.142 0.183 25148 12945 1 20 . 1 1 26 26 ALA C C 26 181.440 181.440 179.705 1.735 25148 12946 1 20 . 1 1 26 26 ALA CA C 26 54.935 54.935 54.733 0.202 25148 12947 1 20 . 1 1 26 26 ALA CB C 26 17.834 17.834 18.287 -0.453 25148 12948 1 20 . 1 1 26 26 ALA H H 26 7.768 7.768 7.787 -0.019 25148 12949 1 20 . 1 1 27 27 ILE N N 27 122.342 122.342 119.607 2.735 25148 12950 1 20 . 1 1 27 27 ILE HA H 27 3.575 3.575 3.674 -0.099 25148 12951 1 20 . 1 1 27 27 ILE C C 27 177.541 177.541 177.681 -0.140 25148 12952 1 20 . 1 1 27 27 ILE CA C 27 66.536 66.536 65.008 1.528 25148 12953 1 20 . 1 1 27 27 ILE CB C 27 37.886 37.886 37.928 -0.042 25148 12954 1 20 . 1 1 27 27 ILE H H 27 8.805 8.805 7.464 1.341 25148 12955 1 20 . 1 1 28 28 GLU N N 28 120.188 120.188 119.911 0.277 25148 12956 1 20 . 1 1 28 28 GLU HA H 28 3.687 3.687 3.962 -0.275 25148 12957 1 20 . 1 1 28 28 GLU C C 28 178.707 178.707 178.869 -0.162 25148 12958 1 20 . 1 1 28 28 GLU CA C 28 61.458 61.458 59.527 1.931 25148 12959 1 20 . 1 1 28 28 GLU CB C 28 29.624 29.624 28.934 0.690 25148 12960 1 20 . 1 1 28 28 GLU H H 28 8.882 8.882 7.665 1.217 25148 12961 1 20 . 1 1 29 29 ALA N N 29 119.293 119.293 121.111 -1.818 25148 12962 1 20 . 1 1 29 29 ALA HA H 29 4.214 4.214 4.072 0.142 25148 12963 1 20 . 1 1 29 29 ALA C C 29 181.200 181.200 179.523 1.677 25148 12964 1 20 . 1 1 29 29 ALA CA C 29 55.435 55.435 54.811 0.624 25148 12965 1 20 . 1 1 29 29 ALA CB C 29 18.090 18.090 18.077 0.013 25148 12966 1 20 . 1 1 29 29 ALA H H 29 8.065 8.065 8.163 -0.098 25148 12967 1 20 . 1 1 30 30 ALA N N 30 121.729 121.729 121.836 -0.107 25148 12968 1 20 . 1 1 30 30 ALA HA H 30 4.307 4.307 4.170 0.137 25148 12969 1 20 . 1 1 30 30 ALA C C 30 181.315 181.315 179.480 1.835 25148 12970 1 20 . 1 1 30 30 ALA CA C 30 54.594 54.594 54.730 -0.136 25148 12971 1 20 . 1 1 30 30 ALA CB C 30 18.704 18.704 18.318 0.386 25148 12972 1 20 . 1 1 30 30 ALA H H 30 8.099 8.099 7.393 0.706 25148 12973 1 20 . 1 1 31 31 LEU N N 31 120.900 120.900 120.474 0.426 25148 12974 1 20 . 1 1 31 31 LEU HA H 31 4.347 4.347 4.109 0.238 25148 12975 1 20 . 1 1 31 31 LEU C C 31 179.137 179.137 179.352 -0.215 25148 12976 1 20 . 1 1 31 31 LEU CA C 31 57.569 57.569 58.092 -0.523 25148 12977 1 20 . 1 1 31 31 LEU CB C 31 42.353 42.353 40.974 1.379 25148 12978 1 20 . 1 1 31 31 LEU H H 31 8.863 8.863 7.589 1.274 25148 12979 1 20 . 1 1 32 32 ILE N N 32 122.410 122.410 118.887 3.523 25148 12980 1 20 . 1 1 32 32 ILE HA H 32 3.699 3.699 3.692 0.007 25148 12981 1 20 . 1 1 32 32 ILE C C 32 178.303 178.303 177.826 0.477 25148 12982 1 20 . 1 1 32 32 ILE CA C 32 66.066 66.066 65.425 0.641 25148 12983 1 20 . 1 1 32 32 ILE CB C 32 37.882 37.882 37.904 -0.022 25148 12984 1 20 . 1 1 32 32 ILE H H 32 8.234 8.234 8.279 -0.045 25148 12985 1 20 . 1 1 33 33 SER N N 33 114.201 114.201 115.802 -1.601 25148 12986 1 20 . 1 1 33 33 SER HA H 33 4.311 4.311 4.146 0.165 25148 12987 1 20 . 1 1 33 33 SER C C 33 177.012 177.012 176.618 0.394 25148 12988 1 20 . 1 1 33 33 SER CA C 33 61.860 61.860 62.036 -0.176 25148 12989 1 20 . 1 1 33 33 SER CB C 33 62.508 62.508 63.226 -0.718 25148 12990 1 20 . 1 1 33 33 SER H H 33 7.558 7.558 7.683 -0.125 25148 12991 1 20 . 1 1 34 34 ALA N N 34 122.893 122.893 124.346 -1.453 25148 12992 1 20 . 1 1 34 34 ALA HA H 34 4.215 4.215 4.096 0.119 25148 12993 1 20 . 1 1 34 34 ALA C C 34 180.814 180.814 179.273 1.541 25148 12994 1 20 . 1 1 34 34 ALA CA C 34 55.283 55.283 54.963 0.320 25148 12995 1 20 . 1 1 34 34 ALA CB C 34 18.273 18.273 18.348 -0.075 25148 12996 1 20 . 1 1 34 34 ALA H H 34 8.409 8.409 8.309 0.100 25148 12997 1 20 . 1 1 35 35 TYR N N 35 120.259 120.259 118.662 1.597 25148 12998 1 20 . 1 1 35 35 TYR HA H 35 4.393 4.393 4.439 -0.046 25148 12999 1 20 . 1 1 35 35 TYR C C 35 177.892 177.892 177.920 -0.028 25148 13000 1 20 . 1 1 35 35 TYR CA C 35 63.071 63.071 60.324 2.747 25148 13001 1 20 . 1 1 35 35 TYR CB C 35 38.021 38.021 39.110 -1.089 25148 13002 1 20 . 1 1 35 35 TYR H H 35 8.975 8.975 8.097 0.878 25148 13003 1 20 . 1 1 36 36 LYS N N 36 120.942 120.942 121.581 -0.639 25148 13004 1 20 . 1 1 36 36 LYS HA H 36 4.032 4.032 4.085 -0.053 25148 13005 1 20 . 1 1 36 36 LYS C C 36 177.797 177.797 179.009 -1.212 25148 13006 1 20 . 1 1 36 36 LYS CA C 36 59.900 59.900 59.139 0.761 25148 13007 1 20 . 1 1 36 36 LYS CB C 36 32.429 32.429 32.276 0.153 25148 13008 1 20 . 1 1 36 36 LYS H H 36 8.654 8.654 8.224 0.430 25148 13009 1 20 . 1 1 37 37 ARG N N 37 115.139 115.139 116.776 -1.637 25148 13010 1 20 . 1 1 37 37 ARG HA H 37 4.101 4.101 4.204 -0.103 25148 13011 1 20 . 1 1 37 37 ARG C C 37 177.517 177.517 177.957 -0.440 25148 13012 1 20 . 1 1 37 37 ARG CA C 37 58.276 58.276 58.739 -0.463 25148 13013 1 20 . 1 1 37 37 ARG CB C 37 31.014 31.014 29.890 1.124 25148 13014 1 20 . 1 1 37 37 ARG H H 37 8.138 8.138 8.101 0.037 25148 13015 1 20 . 1 1 38 38 ASN N N 38 112.555 112.555 116.181 -3.626 25148 13016 1 20 . 1 1 38 38 ASN HA H 38 4.540 4.540 4.285 0.255 25148 13017 1 20 . 1 1 38 38 ASN C C 38 173.994 173.994 174.956 -0.962 25148 13018 1 20 . 1 1 38 38 ASN CA C 38 54.722 54.722 55.108 -0.386 25148 13019 1 20 . 1 1 38 38 ASN CB C 38 42.077 42.077 39.074 3.003 25148 13020 1 20 . 1 1 38 38 ASN H H 38 7.426 7.426 7.448 -0.022 25148 13021 1 20 . 1 1 39 39 PHE N N 39 116.711 116.711 117.213 -0.502 25148 13022 1 20 . 1 1 39 39 PHE HA H 39 4.569 4.569 4.734 -0.165 25148 13023 1 20 . 1 1 39 39 PHE CA C 39 58.913 58.913 56.718 2.195 25148 13024 1 20 . 1 1 39 39 PHE CB C 39 39.781 39.781 38.937 0.844 25148 13025 1 20 . 1 1 39 39 PHE H H 39 7.959 7.959 7.597 0.362 25148 13026 1 20 . 1 1 40 40 ASN HA H 40 4.018 4.018 4.626 -0.608 25148 13027 1 20 . 1 1 40 40 ASN CA C 40 58.944 58.944 55.827 3.117 25148 13028 1 20 . 1 1 41 41 GLN HA H 41 4.298 4.298 4.432 -0.134 25148 13029 1 20 . 1 1 41 41 GLN C C 41 175.237 175.237 175.811 -0.574 25148 13030 1 20 . 1 1 41 41 GLN CA C 41 57.360 57.360 56.530 0.830 25148 13031 1 20 . 1 1 41 41 GLN CB C 41 28.724 28.724 28.124 0.600 25148 13032 1 20 . 1 1 42 42 ALA N N 42 120.514 120.514 121.008 -0.494 25148 13033 1 20 . 1 1 42 42 ALA HA H 42 4.622 4.622 4.410 0.212 25148 13034 1 20 . 1 1 42 42 ALA C C 42 175.922 175.922 176.593 -0.671 25148 13035 1 20 . 1 1 42 42 ALA CA C 42 51.841 51.841 52.244 -0.403 25148 13036 1 20 . 1 1 42 42 ALA CB C 42 21.576 21.576 20.028 1.548 25148 13037 1 20 . 1 1 42 42 ALA H H 42 7.817 7.817 8.101 -0.284 25148 13038 1 20 . 1 1 43 43 GLN N N 43 117.594 117.594 116.056 1.538 25148 13039 1 20 . 1 1 43 43 GLN HA H 43 4.265 4.265 4.387 -0.122 25148 13040 1 20 . 1 1 43 43 GLN C C 43 174.942 174.942 173.500 1.442 25148 13041 1 20 . 1 1 43 43 GLN CA C 43 57.047 57.047 55.301 1.746 25148 13042 1 20 . 1 1 43 43 GLN CB C 43 30.863 30.863 31.240 -0.377 25148 13043 1 20 . 1 1 43 43 GLN H H 43 7.400 7.400 7.516 -0.116 25148 13044 1 20 . 1 1 44 44 ASN N N 44 120.467 120.467 119.738 0.729 25148 13045 1 20 . 1 1 44 44 ASN HA H 44 5.005 5.005 4.729 0.276 25148 13046 1 20 . 1 1 44 44 ASN C C 44 174.365 174.365 173.995 0.370 25148 13047 1 20 . 1 1 44 44 ASN CA C 44 52.381 52.381 52.649 -0.268 25148 13048 1 20 . 1 1 44 44 ASN CB C 44 38.177 38.177 39.138 -0.961 25148 13049 1 20 . 1 1 44 44 ASN H H 44 9.123 9.123 8.567 0.556 25148 13050 1 20 . 1 1 45 45 VAL N N 45 115.479 115.479 116.963 -1.484 25148 13051 1 20 . 1 1 45 45 VAL HA H 45 5.376 5.376 4.257 1.119 25148 13052 1 20 . 1 1 45 45 VAL C C 45 174.908 174.908 173.703 1.205 25148 13053 1 20 . 1 1 45 45 VAL CA C 45 59.022 59.022 61.765 -2.743 25148 13054 1 20 . 1 1 45 45 VAL CB C 45 35.776 35.776 35.276 0.500 25148 13055 1 20 . 1 1 45 45 VAL H H 45 7.732 7.732 8.138 -0.406 25148 13056 1 20 . 1 1 46 46 ARG N N 46 121.146 121.146 125.354 -4.208 25148 13057 1 20 . 1 1 46 46 ARG HA H 46 4.566 4.566 4.873 -0.307 25148 13058 1 20 . 1 1 46 46 ARG C C 46 173.790 173.790 174.599 -0.809 25148 13059 1 20 . 1 1 46 46 ARG CA C 46 54.762 54.762 53.807 0.955 25148 13060 1 20 . 1 1 46 46 ARG CB C 46 33.946 33.946 32.216 1.730 25148 13061 1 20 . 1 1 46 46 ARG H H 46 8.850 8.850 9.121 -0.271 25148 13062 1 20 . 1 1 47 47 VAL N N 47 122.339 122.339 124.756 -2.417 25148 13063 1 20 . 1 1 47 47 VAL HA H 47 4.741 4.741 4.584 0.157 25148 13064 1 20 . 1 1 47 47 VAL C C 47 173.541 173.541 175.629 -2.088 25148 13065 1 20 . 1 1 47 47 VAL CA C 47 60.893 60.893 61.650 -0.757 25148 13066 1 20 . 1 1 47 47 VAL CB C 47 33.563 33.563 33.480 0.083 25148 13067 1 20 . 1 1 47 47 VAL H H 47 8.444 8.444 8.577 -0.133 25148 13068 1 20 . 1 1 48 48 ASP N N 48 127.701 127.701 125.949 1.752 25148 13069 1 20 . 1 1 48 48 ASP HA H 48 4.946 4.946 4.955 -0.009 25148 13070 1 20 . 1 1 48 48 ASP C C 48 173.744 173.744 174.819 -1.075 25148 13071 1 20 . 1 1 48 48 ASP CA C 48 52.651 52.651 53.022 -0.371 25148 13072 1 20 . 1 1 48 48 ASP CB C 48 45.225 45.225 43.579 1.646 25148 13073 1 20 . 1 1 48 48 ASP H H 48 9.068 9.068 8.394 0.674 25148 13074 1 20 . 1 1 49 49 LEU N N 49 130.945 130.945 126.907 4.038 25148 13075 1 20 . 1 1 49 49 LEU HA H 49 4.774 4.774 4.542 0.232 25148 13076 1 20 . 1 1 49 49 LEU C C 49 174.531 174.531 175.848 -1.317 25148 13077 1 20 . 1 1 49 49 LEU CA C 49 54.337 54.337 54.882 -0.545 25148 13078 1 20 . 1 1 49 49 LEU CB C 49 43.192 43.192 43.430 -0.238 25148 13079 1 20 . 1 1 49 49 LEU H H 49 9.369 9.369 8.092 1.277 25148 13080 1 20 . 1 1 50 50 ASN N N 50 126.268 126.268 125.642 0.626 25148 13081 1 20 . 1 1 50 50 ASN HA H 50 4.629 4.629 5.008 -0.379 25148 13082 1 20 . 1 1 50 50 ASN C C 50 176.602 176.602 175.411 1.191 25148 13083 1 20 . 1 1 50 50 ASN CA C 50 54.048 54.048 52.246 1.802 25148 13084 1 20 . 1 1 50 50 ASN CB C 50 39.891 39.891 39.012 0.879 25148 13085 1 20 . 1 1 50 50 ASN H H 50 8.672 8.672 8.834 -0.162 25148 13086 1 20 . 1 1 51 51 ARG N N 51 125.897 125.897 124.921 0.976 25148 13087 1 20 . 1 1 51 51 ARG HA H 51 3.789 3.789 4.121 -0.332 25148 13088 1 20 . 1 1 51 51 ARG C C 51 175.681 175.681 176.175 -0.494 25148 13089 1 20 . 1 1 51 51 ARG CA C 51 58.162 58.162 58.438 -0.276 25148 13090 1 20 . 1 1 51 51 ARG CB C 51 29.944 29.944 29.487 0.457 25148 13091 1 20 . 1 1 51 51 ARG H H 51 8.984 8.984 8.681 0.303 25148 13092 1 20 . 1 1 52 52 GLU N N 52 116.733 116.733 118.551 -1.818 25148 13093 1 20 . 1 1 52 52 GLU HA H 52 4.368 4.368 4.229 0.139 25148 13094 1 20 . 1 1 52 52 GLU C C 52 178.049 178.049 177.286 0.763 25148 13095 1 20 . 1 1 52 52 GLU CA C 52 58.048 58.048 58.297 -0.249 25148 13096 1 20 . 1 1 52 52 GLU CB C 52 30.716 30.716 29.397 1.319 25148 13097 1 20 . 1 1 52 52 GLU H H 52 8.541 8.541 8.419 0.122 25148 13098 1 20 . 1 1 53 53 THR N N 53 106.556 106.556 107.920 -1.364 25148 13099 1 20 . 1 1 53 53 THR HA H 53 4.424 4.424 4.628 -0.204 25148 13100 1 20 . 1 1 53 53 THR C C 53 176.352 176.352 175.044 1.308 25148 13101 1 20 . 1 1 53 53 THR CA C 53 61.320 61.320 61.045 0.275 25148 13102 1 20 . 1 1 53 53 THR CB C 53 71.220 71.220 69.762 1.458 25148 13103 1 20 . 1 1 53 53 THR H H 53 8.085 8.085 7.488 0.597 25148 13104 1 20 . 1 1 54 54 GLY N N 54 111.843 111.843 110.297 1.546 25148 13105 1 20 . 1 1 54 54 GLY C C 54 172.690 172.690 174.392 -1.702 25148 13106 1 20 . 1 1 54 54 GLY CA C 54 45.417 45.417 46.241 -0.824 25148 13107 1 20 . 1 1 54 54 GLY H H 54 8.330 8.330 7.888 0.442 25148 13108 1 20 . 1 1 55 55 SER N N 55 113.844 113.844 113.620 0.224 25148 13109 1 20 . 1 1 55 55 SER HA H 55 4.279 4.279 4.661 -0.382 25148 13110 1 20 . 1 1 55 55 SER C C 55 174.127 174.127 173.006 1.121 25148 13111 1 20 . 1 1 55 55 SER CA C 55 59.229 59.229 57.395 1.834 25148 13112 1 20 . 1 1 55 55 SER CB C 55 63.939 63.939 65.437 -1.498 25148 13113 1 20 . 1 1 55 55 SER H H 55 7.653 7.653 7.525 0.128 25148 13114 1 20 . 1 1 56 56 ILE N N 56 125.286 125.286 120.313 4.973 25148 13115 1 20 . 1 1 56 56 ILE HA H 56 5.082 5.082 4.552 0.530 25148 13116 1 20 . 1 1 56 56 ILE C C 56 175.346 175.346 174.358 0.988 25148 13117 1 20 . 1 1 56 56 ILE CA C 56 59.967 59.967 60.560 -0.593 25148 13118 1 20 . 1 1 56 56 ILE CB C 56 40.165 40.165 41.952 -1.787 25148 13119 1 20 . 1 1 56 56 ILE H H 56 8.478 8.478 8.434 0.044 25148 13120 1 20 . 1 1 57 57 ARG N N 57 126.332 126.332 127.660 -1.328 25148 13121 1 20 . 1 1 57 57 ARG HA H 57 4.740 4.740 4.580 0.160 25148 13122 1 20 . 1 1 57 57 ARG C C 57 173.921 173.921 173.726 0.195 25148 13123 1 20 . 1 1 57 57 ARG CA C 57 54.311 54.311 54.062 0.249 25148 13124 1 20 . 1 1 57 57 ARG CB C 57 35.805 35.805 33.079 2.726 25148 13125 1 20 . 1 1 57 57 ARG H H 57 8.590 8.590 8.252 0.338 25148 13126 1 20 . 1 1 58 58 VAL N N 58 120.987 120.987 123.142 -2.155 25148 13127 1 20 . 1 1 58 58 VAL HA H 58 4.334 4.334 4.061 0.273 25148 13128 1 20 . 1 1 58 58 VAL C C 58 174.204 174.204 173.828 0.376 25148 13129 1 20 . 1 1 58 58 VAL CA C 58 60.861 60.861 61.654 -0.793 25148 13130 1 20 . 1 1 58 58 VAL CB C 58 33.383 33.383 31.614 1.769 25148 13131 1 20 . 1 1 58 58 VAL H H 58 8.585 8.585 8.309 0.276 25148 13132 1 20 . 1 1 59 59 PHE N N 59 124.913 124.913 126.314 -1.401 25148 13133 1 20 . 1 1 59 59 PHE HA H 59 5.046 5.046 5.345 -0.299 25148 13134 1 20 . 1 1 59 59 PHE C C 59 174.446 174.446 174.219 0.227 25148 13135 1 20 . 1 1 59 59 PHE CA C 59 56.695 56.695 55.322 1.373 25148 13136 1 20 . 1 1 59 59 PHE CB C 59 42.779 42.779 43.128 -0.349 25148 13137 1 20 . 1 1 59 59 PHE H H 59 8.920 8.920 8.539 0.381 25148 13138 1 20 . 1 1 60 60 ALA N N 60 124.035 124.035 123.770 0.265 25148 13139 1 20 . 1 1 60 60 ALA HA H 60 5.102 5.102 4.809 0.293 25148 13140 1 20 . 1 1 60 60 ALA C C 60 176.017 176.017 176.252 -0.235 25148 13141 1 20 . 1 1 60 60 ALA CA C 60 50.083 50.083 50.664 -0.581 25148 13142 1 20 . 1 1 60 60 ALA CB C 60 22.400 22.400 20.625 1.775 25148 13143 1 20 . 1 1 60 60 ALA H H 60 9.457 9.457 8.689 0.768 25148 13144 1 20 . 1 1 61 61 ARG N N 61 121.530 121.530 125.223 -3.693 25148 13145 1 20 . 1 1 61 61 ARG HA H 61 4.958 4.958 4.969 -0.011 25148 13146 1 20 . 1 1 61 61 ARG C C 61 176.737 176.737 175.667 1.070 25148 13147 1 20 . 1 1 61 61 ARG CA C 61 55.375 55.375 55.593 -0.218 25148 13148 1 20 . 1 1 61 61 ARG CB C 61 31.230 31.230 30.861 0.369 25148 13149 1 20 . 1 1 61 61 ARG H H 61 8.447 8.447 8.790 -0.343 25148 13150 1 20 . 1 1 62 62 LYS N N 62 124.784 124.784 126.851 -2.067 25148 13151 1 20 . 1 1 62 62 LYS HA H 62 4.709 4.709 4.451 0.258 25148 13152 1 20 . 1 1 62 62 LYS C C 62 173.899 173.899 174.844 -0.945 25148 13153 1 20 . 1 1 62 62 LYS CA C 62 54.812 54.812 55.251 -0.439 25148 13154 1 20 . 1 1 62 62 LYS CB C 62 37.147 37.147 35.068 2.079 25148 13155 1 20 . 1 1 62 62 LYS H H 62 9.137 9.137 7.999 1.138 25148 13156 1 20 . 1 1 63 63 ASP N N 63 122.552 122.552 124.193 -1.641 25148 13157 1 20 . 1 1 63 63 ASP HA H 63 4.877 4.877 4.593 0.284 25148 13158 1 20 . 1 1 63 63 ASP C C 63 175.560 175.560 175.824 -0.264 25148 13159 1 20 . 1 1 63 63 ASP CA C 63 54.576 54.576 55.014 -0.438 25148 13160 1 20 . 1 1 63 63 ASP CB C 63 42.841 42.841 41.631 1.210 25148 13161 1 20 . 1 1 63 63 ASP H H 63 8.334 8.334 8.587 -0.253 25148 13162 1 20 . 1 1 64 64 VAL N N 64 123.109 123.109 127.744 -4.635 25148 13163 1 20 . 1 1 64 64 VAL HA H 64 4.557 4.557 4.835 -0.278 25148 13164 1 20 . 1 1 64 64 VAL C C 64 177.260 177.260 174.995 2.265 25148 13165 1 20 . 1 1 64 64 VAL CA C 64 62.268 62.268 61.648 0.620 25148 13166 1 20 . 1 1 64 64 VAL CB C 64 30.348 30.348 30.954 -0.606 25148 13167 1 20 . 1 1 64 64 VAL H H 64 8.693 8.693 7.938 0.755 25148 13168 1 20 . 1 1 65 65 VAL N N 65 122.320 122.320 123.344 -1.024 25148 13169 1 20 . 1 1 65 65 VAL HA H 65 4.939 4.939 4.597 0.342 25148 13170 1 20 . 1 1 65 65 VAL C C 65 174.754 174.754 175.140 -0.386 25148 13171 1 20 . 1 1 65 65 VAL CA C 65 59.173 59.173 59.504 -0.331 25148 13172 1 20 . 1 1 65 65 VAL CB C 65 36.289 36.289 35.361 0.928 25148 13173 1 20 . 1 1 65 65 VAL H H 65 8.656 8.656 7.845 0.811 25148 13174 1 20 . 1 1 66 66 ASP N N 66 119.805 119.805 123.486 -3.681 25148 13175 1 20 . 1 1 66 66 ASP HA H 66 4.499 4.499 4.380 0.119 25148 13176 1 20 . 1 1 66 66 ASP C C 66 176.565 176.565 175.952 0.613 25148 13177 1 20 . 1 1 66 66 ASP CA C 66 57.236 57.236 56.174 1.062 25148 13178 1 20 . 1 1 66 66 ASP CB C 66 41.662 41.662 41.114 0.548 25148 13179 1 20 . 1 1 66 66 ASP H H 66 8.628 8.628 8.786 -0.158 25148 13180 1 20 . 1 1 67 67 GLU N N 67 117.604 117.604 119.117 -1.513 25148 13181 1 20 . 1 1 67 67 GLU HA H 67 4.350 4.350 4.392 -0.042 25148 13182 1 20 . 1 1 67 67 GLU C C 67 173.736 173.736 174.980 -1.244 25148 13183 1 20 . 1 1 67 67 GLU CA C 67 55.203 55.203 54.959 0.244 25148 13184 1 20 . 1 1 67 67 GLU CB C 67 32.240 32.240 32.214 0.026 25148 13185 1 20 . 1 1 67 67 GLU H H 67 7.525 7.525 7.991 -0.466 25148 13186 1 20 . 1 1 68 68 VAL N N 68 125.774 125.774 124.292 1.482 25148 13187 1 20 . 1 1 68 68 VAL HA H 68 3.578 3.578 4.098 -0.520 25148 13188 1 20 . 1 1 68 68 VAL C C 68 175.885 175.885 175.752 0.133 25148 13189 1 20 . 1 1 68 68 VAL CA C 68 63.397 63.397 63.683 -0.286 25148 13190 1 20 . 1 1 68 68 VAL CB C 68 32.452 32.452 31.503 0.949 25148 13191 1 20 . 1 1 68 68 VAL H H 68 8.573 8.573 8.476 0.097 25148 13192 1 20 . 1 1 69 69 TYR N N 69 129.859 129.859 125.212 4.647 25148 13193 1 20 . 1 1 69 69 TYR HA H 69 4.642 4.642 4.530 0.112 25148 13194 1 20 . 1 1 69 69 TYR C C 69 176.100 176.100 175.856 0.244 25148 13195 1 20 . 1 1 69 69 TYR CA C 69 59.092 59.092 58.608 0.484 25148 13196 1 20 . 1 1 69 69 TYR CB C 69 39.830 39.830 40.126 -0.296 25148 13197 1 20 . 1 1 69 69 TYR H H 69 9.801 9.801 8.403 1.398 25148 13198 1 20 . 1 1 70 70 ASP N N 70 120.204 120.204 119.965 0.239 25148 13199 1 20 . 1 1 70 70 ASP HA H 70 4.772 4.772 4.862 -0.090 25148 13200 1 20 . 1 1 70 70 ASP C C 70 176.622 176.622 176.380 0.242 25148 13201 1 20 . 1 1 70 70 ASP CA C 70 52.885 52.885 53.448 -0.563 25148 13202 1 20 . 1 1 70 70 ASP CB C 70 41.878 41.878 40.061 1.817 25148 13203 1 20 . 1 1 70 70 ASP H H 70 8.348 8.348 8.086 0.262 25148 13204 1 20 . 1 1 71 71 GLN N N 71 125.440 125.440 123.263 2.177 25148 13205 1 20 . 1 1 71 71 GLN HA H 71 4.315 4.315 3.937 0.378 25148 13206 1 20 . 1 1 71 71 GLN C C 71 175.819 175.819 176.828 -1.009 25148 13207 1 20 . 1 1 71 71 GLN CA C 71 57.914 57.914 58.888 -0.974 25148 13208 1 20 . 1 1 71 71 GLN CB C 71 28.307 28.307 28.888 -0.581 25148 13209 1 20 . 1 1 71 71 GLN H H 71 9.097 9.097 8.577 0.520 25148 13210 1 20 . 1 1 72 72 ARG N N 72 116.306 116.306 115.736 0.570 25148 13211 1 20 . 1 1 72 72 ARG HA H 72 4.252 4.252 4.112 0.140 25148 13212 1 20 . 1 1 72 72 ARG C C 72 178.087 178.087 176.092 1.995 25148 13213 1 20 . 1 1 72 72 ARG CA C 72 58.532 58.532 57.236 1.296 25148 13214 1 20 . 1 1 72 72 ARG CB C 72 30.143 30.143 30.359 -0.216 25148 13215 1 20 . 1 1 72 72 ARG H H 72 8.534 8.534 8.330 0.204 25148 13216 1 20 . 1 1 73 73 LEU N N 73 116.734 116.734 113.912 2.822 25148 13217 1 20 . 1 1 73 73 LEU HA H 73 4.621 4.621 4.576 0.045 25148 13218 1 20 . 1 1 73 73 LEU C C 73 175.946 175.946 174.992 0.954 25148 13219 1 20 . 1 1 73 73 LEU CA C 73 55.250 55.250 55.094 0.156 25148 13220 1 20 . 1 1 73 73 LEU CB C 73 46.960 46.960 44.807 2.153 25148 13221 1 20 . 1 1 73 73 LEU H H 73 7.460 7.460 7.480 -0.020 25148 13222 1 20 . 1 1 74 74 GLU N N 74 118.787 118.787 123.189 -4.402 25148 13223 1 20 . 1 1 74 74 GLU HA H 74 5.403 5.403 4.710 0.693 25148 13224 1 20 . 1 1 74 74 GLU C C 74 173.709 173.709 174.173 -0.464 25148 13225 1 20 . 1 1 74 74 GLU CA C 74 54.914 54.914 55.581 -0.667 25148 13226 1 20 . 1 1 74 74 GLU CB C 74 35.053 35.053 33.456 1.597 25148 13227 1 20 . 1 1 74 74 GLU H H 74 7.752 7.752 8.143 -0.391 25148 13228 1 20 . 1 1 75 75 ILE N N 75 119.803 119.803 122.505 -2.702 25148 13229 1 20 . 1 1 75 75 ILE HA H 75 4.507 4.507 4.468 0.039 25148 13230 1 20 . 1 1 75 75 ILE C C 75 172.126 172.126 174.026 -1.900 25148 13231 1 20 . 1 1 75 75 ILE CA C 75 58.664 58.664 59.955 -1.291 25148 13232 1 20 . 1 1 75 75 ILE CB C 75 42.560 42.560 41.833 0.727 25148 13233 1 20 . 1 1 75 75 ILE H H 75 8.975 8.975 8.986 -0.011 25148 13234 1 20 . 1 1 76 76 SER N N 76 123.236 123.236 124.321 -1.085 25148 13235 1 20 . 1 1 76 76 SER HA H 76 4.505 4.505 4.664 -0.159 25148 13236 1 20 . 1 1 76 76 SER C C 76 176.145 176.145 175.745 0.400 25148 13237 1 20 . 1 1 76 76 SER CA C 76 58.108 58.108 58.158 -0.050 25148 13238 1 20 . 1 1 76 76 SER CB C 76 65.000 65.000 64.127 0.873 25148 13239 1 20 . 1 1 76 76 SER H H 76 8.810 8.810 8.667 0.143 25148 13240 1 20 . 1 1 77 77 ILE N N 77 120.629 120.629 125.293 -4.664 25148 13241 1 20 . 1 1 77 77 ILE HA H 77 3.935 3.935 3.710 0.225 25148 13242 1 20 . 1 1 77 77 ILE C C 77 175.806 175.806 176.978 -1.172 25148 13243 1 20 . 1 1 77 77 ILE CA C 77 61.928 61.928 63.801 -1.873 25148 13244 1 20 . 1 1 77 77 ILE CB C 77 38.031 38.031 38.166 -0.135 25148 13245 1 20 . 1 1 77 77 ILE H H 77 8.321 8.321 8.007 0.314 25148 13246 1 20 . 1 1 78 78 GLU N N 78 121.032 121.032 117.515 3.517 25148 13247 1 20 . 1 1 78 78 GLU HA H 78 4.082 4.082 3.980 0.102 25148 13248 1 20 . 1 1 78 78 GLU C C 78 179.829 179.829 178.387 1.442 25148 13249 1 20 . 1 1 78 78 GLU CA C 78 60.180 60.180 59.000 1.180 25148 13250 1 20 . 1 1 78 78 GLU CB C 78 28.988 28.988 28.696 0.292 25148 13251 1 20 . 1 1 78 78 GLU H H 78 8.222 8.222 8.215 0.007 25148 13252 1 20 . 1 1 79 79 GLU N N 79 120.710 120.710 121.271 -0.561 25148 13253 1 20 . 1 1 79 79 GLU HA H 79 4.012 4.012 4.077 -0.065 25148 13254 1 20 . 1 1 79 79 GLU C C 79 180.339 180.339 179.074 1.265 25148 13255 1 20 . 1 1 79 79 GLU CA C 79 59.332 59.332 58.785 0.547 25148 13256 1 20 . 1 1 79 79 GLU CB C 79 29.317 29.317 29.288 0.029 25148 13257 1 20 . 1 1 79 79 GLU H H 79 7.908 7.908 8.137 -0.229 25148 13258 1 20 . 1 1 80 80 ALA N N 80 122.879 122.879 121.945 0.934 25148 13259 1 20 . 1 1 80 80 ALA HA H 80 3.966 3.966 4.133 -0.167 25148 13260 1 20 . 1 1 80 80 ALA C C 80 179.833 179.833 179.992 -0.159 25148 13261 1 20 . 1 1 80 80 ALA CA C 80 55.881 55.881 55.034 0.847 25148 13262 1 20 . 1 1 80 80 ALA CB C 80 18.870 18.870 18.031 0.839 25148 13263 1 20 . 1 1 80 80 ALA H H 80 9.132 9.132 7.910 1.222 25148 13264 1 20 . 1 1 81 81 GLN N N 81 115.829 115.829 116.877 -1.048 25148 13265 1 20 . 1 1 81 81 GLN HA H 81 4.749 4.749 4.314 0.435 25148 13266 1 20 . 1 1 81 81 GLN C C 81 178.126 178.126 178.046 0.080 25148 13267 1 20 . 1 1 81 81 GLN CA C 81 57.682 57.682 58.051 -0.369 25148 13268 1 20 . 1 1 81 81 GLN CB C 81 27.307 27.307 28.618 -1.311 25148 13269 1 20 . 1 1 81 81 GLN H H 81 8.709 8.709 7.808 0.901 25148 13270 1 20 . 1 1 82 82 GLY N N 82 105.531 105.531 106.673 -1.142 25148 13271 1 20 . 1 1 82 82 GLY C C 82 174.917 174.917 175.047 -0.130 25148 13272 1 20 . 1 1 82 82 GLY CA C 82 45.915 45.915 46.554 -0.639 25148 13273 1 20 . 1 1 82 82 GLY H H 82 7.479 7.479 8.043 -0.564 25148 13274 1 20 . 1 1 83 83 ILE N N 83 122.828 122.828 113.740 9.088 25148 13275 1 20 . 1 1 83 83 ILE HA H 83 3.970 3.970 4.444 -0.474 25148 13276 1 20 . 1 1 83 83 ILE C C 83 177.209 177.209 175.558 1.651 25148 13277 1 20 . 1 1 83 83 ILE CA C 83 64.305 64.305 61.659 2.646 25148 13278 1 20 . 1 1 83 83 ILE CB C 83 38.452 38.452 40.234 -1.782 25148 13279 1 20 . 1 1 83 83 ILE H H 83 7.634 7.634 7.577 0.057 25148 13280 1 20 . 1 1 84 84 HIS N N 84 118.927 118.927 120.096 -1.169 25148 13281 1 20 . 1 1 84 84 HIS HA H 84 4.713 4.713 4.949 -0.236 25148 13282 1 20 . 1 1 84 84 HIS CA C 84 55.487 55.487 54.415 1.072 25148 13283 1 20 . 1 1 84 84 HIS CB C 84 33.506 33.506 32.315 1.191 25148 13284 1 20 . 1 1 84 84 HIS H H 84 8.155 8.155 8.436 -0.281 25148 13285 1 20 . 1 1 85 85 PRO HA H 85 4.456 4.456 4.622 -0.167 25148 13286 1 20 . 1 1 85 85 PRO C C 85 177.357 177.357 177.235 0.122 25148 13287 1 20 . 1 1 85 85 PRO CA C 85 64.475 64.475 64.079 0.397 25148 13288 1 20 . 1 1 85 85 PRO CB C 85 32.489 32.489 32.104 0.385 25148 13289 1 20 . 1 1 86 86 GLU N N 86 116.314 116.314 117.565 -1.251 25148 13290 1 20 . 1 1 86 86 GLU HA H 86 4.286 4.286 4.181 0.105 25148 13291 1 20 . 1 1 86 86 GLU C C 86 177.624 177.624 177.230 0.394 25148 13292 1 20 . 1 1 86 86 GLU CA C 86 56.619 56.619 56.665 -0.046 25148 13293 1 20 . 1 1 86 86 GLU CB C 86 29.389 29.389 29.530 -0.141 25148 13294 1 20 . 1 1 86 86 GLU H H 86 8.938 8.938 7.812 1.125 25148 13295 1 20 . 1 1 87 87 TYR N N 87 119.773 119.773 120.257 -0.484 25148 13296 1 20 . 1 1 87 87 TYR HA H 87 4.744 4.744 4.200 0.544 25148 13297 1 20 . 1 1 87 87 TYR C C 87 174.533 174.533 176.063 -1.530 25148 13298 1 20 . 1 1 87 87 TYR CA C 87 59.117 59.117 59.768 -0.651 25148 13299 1 20 . 1 1 87 87 TYR CB C 87 38.859 38.859 38.753 0.106 25148 13300 1 20 . 1 1 87 87 TYR H H 87 7.447 7.447 7.395 0.052 25148 13301 1 20 . 1 1 88 88 MET N N 88 118.298 118.298 117.338 0.960 25148 13302 1 20 . 1 1 88 88 MET HA H 88 4.770 4.770 4.671 0.099 25148 13303 1 20 . 1 1 88 88 MET C C 88 175.638 175.638 173.997 1.641 25148 13304 1 20 . 1 1 88 88 MET CA C 88 53.133 53.133 54.575 -1.442 25148 13305 1 20 . 1 1 88 88 MET CB C 88 37.102 37.102 35.609 1.493 25148 13306 1 20 . 1 1 88 88 MET H H 88 9.023 9.023 8.278 0.745 25148 13307 1 20 . 1 1 89 89 VAL N N 89 120.157 120.157 123.538 -3.381 25148 13308 1 20 . 1 1 89 89 VAL HA H 89 3.330 3.330 3.902 -0.572 25148 13309 1 20 . 1 1 89 89 VAL C C 89 177.432 177.432 177.288 0.144 25148 13310 1 20 . 1 1 89 89 VAL CA C 89 65.675 65.675 63.609 2.066 25148 13311 1 20 . 1 1 89 89 VAL CB C 89 31.321 31.321 30.384 0.937 25148 13312 1 20 . 1 1 89 89 VAL H H 89 8.313 8.313 8.575 -0.262 25148 13313 1 20 . 1 1 90 90 GLY N N 90 116.935 116.935 116.217 0.718 25148 13314 1 20 . 1 1 90 90 GLY C C 90 175.196 175.196 174.310 0.886 25148 13315 1 20 . 1 1 90 90 GLY CA C 90 44.685 44.685 44.827 -0.142 25148 13316 1 20 . 1 1 90 90 GLY H H 90 8.551 8.551 9.088 -0.537 25148 13317 1 20 . 1 1 91 91 ASP N N 91 121.616 121.616 121.820 -0.204 25148 13318 1 20 . 1 1 91 91 ASP HA H 91 4.790 4.790 4.906 -0.116 25148 13319 1 20 . 1 1 91 91 ASP C C 91 174.431 174.431 175.151 -0.720 25148 13320 1 20 . 1 1 91 91 ASP CA C 91 55.011 55.011 54.310 0.701 25148 13321 1 20 . 1 1 91 91 ASP CB C 91 42.079 42.079 42.592 -0.513 25148 13322 1 20 . 1 1 91 91 ASP H H 91 8.073 8.073 8.092 -0.019 25148 13323 1 20 . 1 1 92 92 VAL N N 92 118.919 118.919 114.131 4.788 25148 13324 1 20 . 1 1 92 92 VAL HA H 92 4.709 4.709 4.846 -0.137 25148 13325 1 20 . 1 1 92 92 VAL C C 92 175.602 175.602 174.366 1.236 25148 13326 1 20 . 1 1 92 92 VAL CA C 92 61.527 61.527 60.080 1.447 25148 13327 1 20 . 1 1 92 92 VAL CB C 92 34.110 34.110 35.211 -1.101 25148 13328 1 20 . 1 1 92 92 VAL H H 92 8.216 8.216 8.073 0.143 25148 13329 1 20 . 1 1 93 93 VAL N N 93 123.922 123.922 124.147 -0.225 25148 13330 1 20 . 1 1 93 93 VAL HA H 93 4.231 4.231 4.316 -0.085 25148 13331 1 20 . 1 1 93 93 VAL C C 93 174.105 174.105 174.196 -0.091 25148 13332 1 20 . 1 1 93 93 VAL CA C 93 59.644 59.644 59.554 0.090 25148 13333 1 20 . 1 1 93 93 VAL CB C 93 34.661 34.661 34.390 0.271 25148 13334 1 20 . 1 1 93 93 VAL H H 93 8.812 8.812 7.870 0.942 25148 13335 1 20 . 1 1 94 94 GLU N N 94 123.605 123.605 128.152 -4.547 25148 13336 1 20 . 1 1 94 94 GLU HA H 94 5.347 5.347 5.286 0.061 25148 13337 1 20 . 1 1 94 94 GLU C C 94 175.708 175.708 175.627 0.081 25148 13338 1 20 . 1 1 94 94 GLU CA C 94 54.979 54.979 55.095 -0.116 25148 13339 1 20 . 1 1 94 94 GLU CB C 94 31.612 31.612 32.134 -0.522 25148 13340 1 20 . 1 1 94 94 GLU H H 94 8.312 8.312 8.522 -0.210 25148 13341 1 20 . 1 1 95 95 ILE N N 95 123.581 123.581 123.630 -0.049 25148 13342 1 20 . 1 1 95 95 ILE HA H 95 4.601 4.601 4.549 0.052 25148 13343 1 20 . 1 1 95 95 ILE C C 95 175.081 175.081 175.100 -0.019 25148 13344 1 20 . 1 1 95 95 ILE CA C 95 58.601 58.601 59.784 -1.183 25148 13345 1 20 . 1 1 95 95 ILE CB C 95 41.727 41.727 42.334 -0.607 25148 13346 1 20 . 1 1 95 95 ILE H H 95 9.045 9.045 8.231 0.814 25148 13347 1 20 . 1 1 96 96 GLU N N 96 128.094 128.094 127.990 0.104 25148 13348 1 20 . 1 1 96 96 GLU HA H 96 4.098 4.098 4.118 -0.020 25148 13349 1 20 . 1 1 96 96 GLU C C 96 176.845 176.845 175.695 1.150 25148 13350 1 20 . 1 1 96 96 GLU CA C 96 57.853 57.853 57.944 -0.091 25148 13351 1 20 . 1 1 96 96 GLU CB C 96 28.323 28.323 29.250 -0.927 25148 13352 1 20 . 1 1 96 96 GLU H H 96 9.256 9.256 8.933 0.323 25148 13353 1 20 . 1 1 97 97 VAL N N 97 118.446 118.446 123.994 -5.548 25148 13354 1 20 . 1 1 97 97 VAL HA H 97 4.568 4.568 4.278 0.290 25148 13355 1 20 . 1 1 97 97 VAL C C 97 175.051 175.051 175.038 0.013 25148 13356 1 20 . 1 1 97 97 VAL CA C 97 59.796 59.796 60.659 -0.863 25148 13357 1 20 . 1 1 97 97 VAL CB C 97 32.399 32.399 33.164 -0.765 25148 13358 1 20 . 1 1 97 97 VAL H H 97 8.609 8.609 8.840 -0.231 25148 13359 1 20 . 1 1 98 98 THR N N 98 119.118 119.118 119.043 0.075 25148 13360 1 20 . 1 1 98 98 THR HA H 98 3.320 3.320 3.995 -0.675 25148 13361 1 20 . 1 1 98 98 THR CA C 98 61.628 61.628 59.421 2.207 25148 13362 1 20 . 1 1 98 98 THR CB C 98 70.031 70.031 69.319 0.712 25148 13363 1 20 . 1 1 98 98 THR H H 98 7.396 7.396 7.430 -0.034 25148 13364 1 20 . 1 1 99 99 PRO HA H 99 4.458 4.458 4.599 -0.141 25148 13365 1 20 . 1 1 99 99 PRO CA C 99 62.348 62.348 62.346 0.002 25148 13366 1 20 . 1 1 99 99 PRO CB C 99 33.182 33.182 32.664 0.518 25148 13367 1 20 . 1 1 100 100 LYS HA H 100 4.126 4.126 4.114 0.012 25148 13368 1 20 . 1 1 100 100 LYS CA C 100 58.773 58.773 57.995 0.777 25148 13369 1 20 . 1 1 100 100 LYS CB C 100 32.195 32.195 32.475 -0.280 25148 13370 1 20 . 1 1 101 101 ASP HA H 101 4.924 4.924 4.710 0.214 25148 13371 1 20 . 1 1 101 101 ASP C C 101 176.884 176.884 176.879 0.005 25148 13372 1 20 . 1 1 101 101 ASP CA C 101 54.134 54.134 53.707 0.427 25148 13373 1 20 . 1 1 101 101 ASP CB C 101 40.272 40.272 40.053 0.219 25148 13374 1 20 . 1 1 102 102 PHE N N 102 118.703 118.703 121.760 -3.057 25148 13375 1 20 . 1 1 102 102 PHE HA H 102 4.295 4.295 4.288 0.007 25148 13376 1 20 . 1 1 102 102 PHE C C 102 176.477 176.477 177.261 -0.784 25148 13377 1 20 . 1 1 102 102 PHE CA C 102 60.748 60.748 60.316 0.432 25148 13378 1 20 . 1 1 102 102 PHE CB C 102 39.667 39.667 39.475 0.192 25148 13379 1 20 . 1 1 102 102 PHE H H 102 7.862 7.862 7.671 0.191 25148 13380 1 20 . 1 1 103 103 GLY CA C 103 47.430 47.430 47.248 0.182 25148 13381 1 20 . 1 1 104 104 ARG N N 104 121.819 121.819 120.907 0.912 25148 13382 1 20 . 1 1 104 104 ARG HA H 104 4.176 4.176 4.159 0.017 25148 13383 1 20 . 1 1 104 104 ARG C C 104 178.912 178.912 178.225 0.687 25148 13384 1 20 . 1 1 104 104 ARG CA C 104 59.235 59.235 58.291 0.944 25148 13385 1 20 . 1 1 104 104 ARG CB C 104 30.000 30.000 30.431 -0.431 25148 13386 1 20 . 1 1 104 104 ARG H H 104 7.809 7.809 7.785 0.024 25148 13387 1 20 . 1 1 105 105 ILE N N 105 120.331 120.331 120.222 0.109 25148 13388 1 20 . 1 1 105 105 ILE HA H 105 3.836 3.836 3.679 0.157 25148 13389 1 20 . 1 1 105 105 ILE C C 105 179.206 179.206 177.532 1.674 25148 13390 1 20 . 1 1 105 105 ILE CA C 105 63.025 63.025 64.608 -1.583 25148 13391 1 20 . 1 1 105 105 ILE CB C 105 38.127 38.127 37.523 0.604 25148 13392 1 20 . 1 1 105 105 ILE H H 105 7.203 7.203 7.458 -0.255 25148 13393 1 20 . 1 1 106 106 ALA N N 106 124.867 124.867 122.194 2.673 25148 13394 1 20 . 1 1 106 106 ALA HA H 106 3.665 3.665 3.598 0.067 25148 13395 1 20 . 1 1 106 106 ALA C C 106 178.590 178.590 178.976 -0.386 25148 13396 1 20 . 1 1 106 106 ALA CA C 106 54.842 54.842 55.196 -0.354 25148 13397 1 20 . 1 1 106 106 ALA CB C 106 18.659 18.659 17.725 0.934 25148 13398 1 20 . 1 1 106 106 ALA H H 106 8.813 8.813 8.235 0.578 25148 13399 1 20 . 1 1 107 107 ALA N N 107 119.597 119.597 120.653 -1.056 25148 13400 1 20 . 1 1 107 107 ALA HA H 107 4.014 4.014 4.010 0.004 25148 13401 1 20 . 1 1 107 107 ALA C C 107 180.214 180.214 179.485 0.729 25148 13402 1 20 . 1 1 107 107 ALA CA C 107 55.454 55.454 54.642 0.812 25148 13403 1 20 . 1 1 107 107 ALA CB C 107 18.260 18.260 18.078 0.182 25148 13404 1 20 . 1 1 107 107 ALA H H 107 8.012 8.012 7.581 0.431 25148 13405 1 20 . 1 1 108 108 GLN N N 108 116.896 116.896 118.223 -1.327 25148 13406 1 20 . 1 1 108 108 GLN HA H 108 4.054 4.054 3.975 0.079 25148 13407 1 20 . 1 1 108 108 GLN C C 108 178.784 178.784 178.495 0.289 25148 13408 1 20 . 1 1 108 108 GLN CA C 108 58.705 58.705 59.012 -0.307 25148 13409 1 20 . 1 1 108 108 GLN CB C 108 28.647 28.647 28.690 -0.043 25148 13410 1 20 . 1 1 108 108 GLN H H 108 7.498 7.498 8.068 -0.570 25148 13411 1 20 . 1 1 109 109 THR N N 109 117.495 117.495 114.407 3.088 25148 13412 1 20 . 1 1 109 109 THR HA H 109 3.917 3.917 4.374 -0.457 25148 13413 1 20 . 1 1 109 109 THR C C 109 175.732 175.732 175.666 0.066 25148 13414 1 20 . 1 1 109 109 THR CA C 109 66.989 66.989 65.485 1.504 25148 13415 1 20 . 1 1 109 109 THR CB C 109 68.766 68.766 68.880 -0.114 25148 13416 1 20 . 1 1 109 109 THR H H 109 8.203 8.203 8.123 0.080 25148 13417 1 20 . 1 1 110 110 ALA N N 110 122.308 122.308 124.996 -2.688 25148 13418 1 20 . 1 1 110 110 ALA HA H 110 3.854 3.854 4.017 -0.163 25148 13419 1 20 . 1 1 110 110 ALA C C 110 178.380 178.380 178.786 -0.406 25148 13420 1 20 . 1 1 110 110 ALA CA C 110 55.903 55.903 54.969 0.934 25148 13421 1 20 . 1 1 110 110 ALA CB C 110 18.524 18.524 18.354 0.170 25148 13422 1 20 . 1 1 110 110 ALA H H 110 8.668 8.668 7.772 0.896 25148 13423 1 20 . 1 1 111 111 LYS N N 111 115.552 115.552 117.783 -2.231 25148 13424 1 20 . 1 1 111 111 LYS HA H 111 3.923 3.923 3.951 -0.028 25148 13425 1 20 . 1 1 111 111 LYS C C 111 179.111 179.111 178.629 0.482 25148 13426 1 20 . 1 1 111 111 LYS CA C 111 59.825 59.825 59.265 0.560 25148 13427 1 20 . 1 1 111 111 LYS CB C 111 32.251 32.251 31.925 0.326 25148 13428 1 20 . 1 1 111 111 LYS H H 111 7.642 7.642 8.544 -0.902 25148 13429 1 20 . 1 1 112 112 GLN N N 112 120.178 120.178 119.360 0.818 25148 13430 1 20 . 1 1 112 112 GLN HA H 112 4.060 4.060 4.144 -0.084 25148 13431 1 20 . 1 1 112 112 GLN C C 112 178.355 178.355 177.823 0.532 25148 13432 1 20 . 1 1 112 112 GLN CA C 112 59.240 59.240 58.380 0.860 25148 13433 1 20 . 1 1 112 112 GLN CB C 112 28.250 28.250 28.507 -0.257 25148 13434 1 20 . 1 1 112 112 GLN H H 112 7.798 7.798 7.593 0.205 25148 13435 1 20 . 1 1 113 113 VAL N N 113 119.799 119.799 120.230 -0.431 25148 13436 1 20 . 1 1 113 113 VAL HA H 113 3.705 3.705 3.832 -0.127 25148 13437 1 20 . 1 1 113 113 VAL C C 113 178.303 178.303 178.135 0.168 25148 13438 1 20 . 1 1 113 113 VAL CA C 113 66.277 66.277 64.762 1.515 25148 13439 1 20 . 1 1 113 113 VAL CB C 113 31.954 31.954 31.423 0.531 25148 13440 1 20 . 1 1 113 113 VAL H H 113 8.105 8.105 7.374 0.731 25148 13441 1 20 . 1 1 114 114 VAL N N 114 118.265 118.265 116.656 1.609 25148 13442 1 20 . 1 1 114 114 VAL HA H 114 3.392 3.392 3.675 -0.283 25148 13443 1 20 . 1 1 114 114 VAL C C 114 177.360 177.360 177.803 -0.443 25148 13444 1 20 . 1 1 114 114 VAL CA C 114 67.832 67.832 66.798 1.034 25148 13445 1 20 . 1 1 114 114 VAL CB C 114 31.801 31.801 30.761 1.040 25148 13446 1 20 . 1 1 114 114 VAL H H 114 8.180 8.180 7.795 0.385 25148 13447 1 20 . 1 1 115 115 THR N N 115 113.460 113.460 114.913 -1.453 25148 13448 1 20 . 1 1 115 115 THR HA H 115 3.856 3.856 3.968 -0.112 25148 13449 1 20 . 1 1 115 115 THR C C 115 176.529 176.529 176.766 -0.237 25148 13450 1 20 . 1 1 115 115 THR CA C 115 66.706 66.706 66.697 0.009 25148 13451 1 20 . 1 1 115 115 THR CB C 115 69.008 69.008 68.327 0.681 25148 13452 1 20 . 1 1 115 115 THR H H 115 8.143 8.143 7.707 0.436 25148 13453 1 20 . 1 1 116 116 GLN N N 116 120.129 120.129 120.032 0.097 25148 13454 1 20 . 1 1 116 116 GLN HA H 116 4.054 4.054 4.118 -0.064 25148 13455 1 20 . 1 1 116 116 GLN C C 116 178.100 178.100 178.319 -0.219 25148 13456 1 20 . 1 1 116 116 GLN CA C 116 58.950 58.950 58.809 0.141 25148 13457 1 20 . 1 1 116 116 GLN CB C 116 28.244 28.244 28.618 -0.374 25148 13458 1 20 . 1 1 116 116 GLN H H 116 7.936 7.936 7.673 0.263 25148 13459 1 20 . 1 1 117 117 ARG N N 117 117.838 117.838 119.490 -1.652 25148 13460 1 20 . 1 1 117 117 ARG HA H 117 4.174 4.174 4.248 -0.074 25148 13461 1 20 . 1 1 117 117 ARG C C 117 179.138 179.138 178.450 0.688 25148 13462 1 20 . 1 1 117 117 ARG CA C 117 57.461 57.461 56.916 0.545 25148 13463 1 20 . 1 1 117 117 ARG CB C 117 29.548 29.548 29.808 -0.260 25148 13464 1 20 . 1 1 117 117 ARG H H 117 8.240 8.240 7.530 0.710 25148 13465 1 20 . 1 1 118 118 VAL N N 118 120.278 120.278 120.043 0.235 25148 13466 1 20 . 1 1 118 118 VAL HA H 118 3.709 3.709 3.712 -0.003 25148 13467 1 20 . 1 1 118 118 VAL C C 118 177.597 177.597 177.691 -0.094 25148 13468 1 20 . 1 1 118 118 VAL CA C 118 66.246 66.246 65.431 0.815 25148 13469 1 20 . 1 1 118 118 VAL CB C 118 31.785 31.785 31.462 0.323 25148 13470 1 20 . 1 1 118 118 VAL H H 118 8.480 8.480 8.274 0.206 25148 13471 1 20 . 1 1 119 119 ARG N N 119 120.197 120.197 119.103 1.094 25148 13472 1 20 . 1 1 119 119 ARG HA H 119 4.173 4.173 4.306 -0.133 25148 13473 1 20 . 1 1 119 119 ARG C C 119 178.864 178.864 178.822 0.042 25148 13474 1 20 . 1 1 119 119 ARG CA C 119 58.772 58.772 59.755 -0.983 25148 13475 1 20 . 1 1 119 119 ARG CB C 119 29.873 29.873 30.037 -0.164 25148 13476 1 20 . 1 1 119 119 ARG H H 119 7.899 7.899 7.699 0.200 25148 13477 1 20 . 1 1 120 120 GLU N N 120 118.768 118.768 119.749 -0.981 25148 13478 1 20 . 1 1 120 120 GLU HA H 120 4.110 4.110 4.049 0.061 25148 13479 1 20 . 1 1 120 120 GLU C C 120 177.823 177.823 178.933 -1.110 25148 13480 1 20 . 1 1 120 120 GLU CA C 120 58.223 58.223 58.975 -0.752 25148 13481 1 20 . 1 1 120 120 GLU CB C 120 29.854 29.854 29.469 0.385 25148 13482 1 20 . 1 1 120 120 GLU H H 120 8.084 8.084 7.813 0.271 25148 13483 1 20 . 1 1 121 121 ALA N N 121 121.984 121.984 121.797 0.187 25148 13484 1 20 . 1 1 121 121 ALA HA H 121 4.296 4.296 4.110 0.186 25148 13485 1 20 . 1 1 121 121 ALA C C 121 178.586 178.586 179.145 -0.559 25148 13486 1 20 . 1 1 121 121 ALA CA C 121 53.475 53.475 55.050 -1.575 25148 13487 1 20 . 1 1 121 121 ALA CB C 121 18.856 18.856 18.513 0.343 25148 13488 1 20 . 1 1 121 121 ALA H H 121 7.810 7.810 8.386 -0.576 25148 13489 1 20 . 1 1 122 122 GLU N N 122 118.229 118.229 117.494 0.735 25148 13490 1 20 . 1 1 122 122 GLU HA H 122 4.241 4.241 4.063 0.178 25148 13491 1 20 . 1 1 122 122 GLU C C 122 176.839 176.839 179.150 -2.311 25148 13492 1 20 . 1 1 122 122 GLU CA C 122 57.118 57.118 58.451 -1.333 25148 13493 1 20 . 1 1 122 122 GLU CB C 122 30.018 30.018 29.359 0.659 25148 13494 1 20 . 1 1 122 122 GLU H H 122 7.938 7.938 7.834 0.104 25148 13495 1 20 . 1 1 123 123 ARG N N 123 120.601 120.601 120.331 0.270 25148 13496 1 20 . 1 1 123 123 ARG HA H 123 4.348 4.348 4.122 0.226 25148 13497 1 20 . 1 1 123 123 ARG C C 123 176.071 176.071 177.003 -0.932 25148 13498 1 20 . 1 1 123 123 ARG CA C 123 56.510 56.510 57.475 -0.965 25148 13499 1 20 . 1 1 123 123 ARG CB C 123 30.765 30.765 30.302 0.463 25148 13500 1 20 . 1 1 123 123 ARG H H 123 7.977 7.977 8.414 -0.437 25148 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 109 2.513 0.109 2.523 25148 2 1 1 "Average Difference" HA 125 0.274 -0.046 0.271 25148 3 1 1 "Average Difference" C 108 0.914 -0.172 0.902 25148 4 1 1 "Average Difference" CA 120 1.056 -0.216 1.038 25148 5 1 1 "Average Difference" CB 114 0.938 -0.265 0.904 25148 6 1 1 "Average Difference" HN 109 0.535 -0.261 0.470 25148 7 1 2 "Average Difference" N 109 2.382 0.068 2.392 25148 8 1 2 "Average Difference" HA 125 0.282 -0.041 0.280 25148 9 1 2 "Average Difference" C 108 0.930 -0.176 0.918 25148 10 1 2 "Average Difference" CA 120 1.032 -0.250 1.005 25148 11 1 2 "Average Difference" CB 114 0.959 -0.237 0.934 25148 12 1 2 "Average Difference" HN 109 0.500 -0.215 0.453 25148 13 1 3 "Average Difference" N 109 2.416 0.017 2.427 25148 14 1 3 "Average Difference" HA 125 0.285 -0.041 0.283 25148 15 1 3 "Average Difference" C 108 0.953 -0.208 0.935 25148 16 1 3 "Average Difference" CA 120 1.099 -0.235 1.078 25148 17 1 3 "Average Difference" CB 114 1.005 -0.250 0.978 25148 18 1 3 "Average Difference" HN 109 0.524 -0.246 0.465 25148 19 1 4 "Average Difference" N 109 2.367 0.042 2.378 25148 20 1 4 "Average Difference" HA 125 0.282 -0.048 0.279 25148 21 1 4 "Average Difference" C 108 0.946 -0.157 0.938 25148 22 1 4 "Average Difference" CA 120 1.048 -0.216 1.030 25148 23 1 4 "Average Difference" CB 114 0.974 -0.274 0.938 25148 24 1 4 "Average Difference" HN 109 0.512 -0.240 0.454 25148 25 1 5 "Average Difference" N 109 2.383 0.161 2.389 25148 26 1 5 "Average Difference" HA 125 0.280 -0.040 0.278 25148 27 1 5 "Average Difference" C 108 0.913 -0.181 0.899 25148 28 1 5 "Average Difference" CA 120 1.094 -0.227 1.074 25148 29 1 5 "Average Difference" CB 114 0.961 -0.267 0.928 25148 30 1 5 "Average Difference" HN 109 0.480 -0.227 0.425 25148 31 1 6 "Average Difference" N 109 2.534 -0.031 2.546 25148 32 1 6 "Average Difference" HA 125 0.281 -0.039 0.279 25148 33 1 6 "Average Difference" C 108 0.940 -0.191 0.925 25148 34 1 6 "Average Difference" CA 120 1.053 -0.226 1.033 25148 35 1 6 "Average Difference" CB 114 0.963 -0.207 0.945 25148 36 1 6 "Average Difference" HN 109 0.525 -0.244 0.467 25148 37 1 7 "Average Difference" N 109 2.365 0.033 2.376 25148 38 1 7 "Average Difference" HA 125 0.282 -0.039 0.281 25148 39 1 7 "Average Difference" C 108 0.940 -0.200 0.923 25148 40 1 7 "Average Difference" CA 120 1.087 -0.267 1.058 25148 41 1 7 "Average Difference" CB 114 0.962 -0.234 0.937 25148 42 1 7 "Average Difference" HN 109 0.512 -0.259 0.444 25148 43 1 8 "Average Difference" N 109 2.463 -0.016 2.474 25148 44 1 8 "Average Difference" HA 125 0.271 -0.047 0.268 25148 45 1 8 "Average Difference" C 108 0.952 -0.147 0.945 25148 46 1 8 "Average Difference" CA 120 1.065 -0.174 1.055 25148 47 1 8 "Average Difference" CB 114 1.002 -0.292 0.963 25148 48 1 8 "Average Difference" HN 109 0.509 -0.206 0.467 25148 49 1 9 "Average Difference" N 109 2.459 0.047 2.470 25148 50 1 9 "Average Difference" HA 125 0.285 -0.025 0.285 25148 51 1 9 "Average Difference" C 108 0.925 -0.189 0.910 25148 52 1 9 "Average Difference" CA 120 1.033 -0.218 1.014 25148 53 1 9 "Average Difference" CB 114 0.938 -0.240 0.911 25148 54 1 9 "Average Difference" HN 109 0.499 -0.222 0.449 25148 55 1 10 "Average Difference" N 109 2.391 -0.040 2.402 25148 56 1 10 "Average Difference" HA 125 0.293 -0.049 0.290 25148 57 1 10 "Average Difference" C 108 0.941 -0.171 0.929 25148 58 1 10 "Average Difference" CA 120 1.007 -0.201 0.991 25148 59 1 10 "Average Difference" CB 114 0.949 -0.196 0.932 25148 60 1 10 "Average Difference" HN 109 0.513 -0.252 0.449 25148 61 1 11 "Average Difference" N 109 2.372 0.078 2.382 25148 62 1 11 "Average Difference" HA 125 0.282 -0.040 0.280 25148 63 1 11 "Average Difference" C 108 0.900 -0.218 0.877 25148 64 1 11 "Average Difference" CA 120 1.049 -0.258 1.021 25148 65 1 11 "Average Difference" CB 114 0.952 -0.228 0.928 25148 66 1 11 "Average Difference" HN 109 0.488 -0.235 0.430 25148 67 1 12 "Average Difference" N 109 2.444 0.018 2.455 25148 68 1 12 "Average Difference" HA 125 0.261 -0.024 0.261 25148 69 1 12 "Average Difference" C 108 0.912 -0.189 0.896 25148 70 1 12 "Average Difference" CA 120 1.092 -0.295 1.055 25148 71 1 12 "Average Difference" CB 114 0.973 -0.240 0.947 25148 72 1 12 "Average Difference" HN 109 0.494 -0.211 0.448 25148 73 1 13 "Average Difference" N 109 2.479 0.087 2.489 25148 74 1 13 "Average Difference" HA 125 0.280 -0.056 0.276 25148 75 1 13 "Average Difference" C 108 0.916 -0.139 0.910 25148 76 1 13 "Average Difference" CA 120 1.014 -0.165 1.005 25148 77 1 13 "Average Difference" CB 114 0.887 -0.232 0.860 25148 78 1 13 "Average Difference" HN 109 0.508 -0.233 0.453 25148 79 1 14 "Average Difference" N 109 2.540 0.096 2.550 25148 80 1 14 "Average Difference" HA 125 0.268 -0.040 0.267 25148 81 1 14 "Average Difference" C 108 0.952 -0.173 0.941 25148 82 1 14 "Average Difference" CA 120 1.005 -0.221 0.985 25148 83 1 14 "Average Difference" CB 114 1.016 -0.331 0.964 25148 84 1 14 "Average Difference" HN 109 0.505 -0.221 0.456 25148 85 1 15 "Average Difference" N 109 2.517 0.120 2.526 25148 86 1 15 "Average Difference" HA 125 0.283 -0.039 0.281 25148 87 1 15 "Average Difference" C 108 0.973 -0.134 0.968 25148 88 1 15 "Average Difference" CA 120 1.039 -0.228 1.018 25148 89 1 15 "Average Difference" CB 114 0.966 -0.292 0.925 25148 90 1 15 "Average Difference" HN 109 0.521 -0.245 0.462 25148 91 1 16 "Average Difference" N 109 2.452 0.034 2.463 25148 92 1 16 "Average Difference" HA 125 0.280 -0.046 0.277 25148 93 1 16 "Average Difference" C 108 0.976 -0.158 0.968 25148 94 1 16 "Average Difference" CA 120 1.067 -0.220 1.049 25148 95 1 16 "Average Difference" CB 114 0.971 -0.245 0.944 25148 96 1 16 "Average Difference" HN 109 0.498 -0.252 0.432 25148 97 1 17 "Average Difference" N 109 2.456 0.134 2.463 25148 98 1 17 "Average Difference" HA 125 0.280 -0.050 0.276 25148 99 1 17 "Average Difference" C 108 0.955 -0.181 0.942 25148 100 1 17 "Average Difference" CA 120 1.035 -0.212 1.017 25148 101 1 17 "Average Difference" CB 114 0.927 -0.271 0.890 25148 102 1 17 "Average Difference" HN 109 0.505 -0.239 0.446 25148 103 1 18 "Average Difference" N 109 2.516 -0.047 2.528 25148 104 1 18 "Average Difference" HA 125 0.275 -0.057 0.270 25148 105 1 18 "Average Difference" C 108 0.936 -0.167 0.925 25148 106 1 18 "Average Difference" CA 120 1.077 -0.214 1.060 25148 107 1 18 "Average Difference" CB 114 0.987 -0.285 0.949 25148 108 1 18 "Average Difference" HN 109 0.524 -0.239 0.469 25148 109 1 19 "Average Difference" N 109 2.261 -0.026 2.271 25148 110 1 19 "Average Difference" HA 125 0.288 -0.043 0.286 25148 111 1 19 "Average Difference" C 108 0.988 -0.145 0.982 25148 112 1 19 "Average Difference" CA 120 1.108 -0.244 1.086 25148 113 1 19 "Average Difference" CB 114 0.952 -0.251 0.922 25148 114 1 19 "Average Difference" HN 109 0.463 -0.207 0.416 25148 115 1 20 "Average Difference" N 109 2.442 0.183 2.446 25148 116 1 20 "Average Difference" HA 125 0.277 -0.039 0.276 25148 117 1 20 "Average Difference" C 108 0.956 -0.174 0.944 25148 118 1 20 "Average Difference" CA 120 1.044 -0.274 1.012 25148 119 1 20 "Average Difference" CB 114 0.943 -0.298 0.899 25148 120 1 20 "Average Difference" HN 109 0.539 -0.235 0.488 25148 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 25148 _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 4 4 GLU HA H 4 4.138 4.138 4.049 0.089 25148 2 1 . 1 1 4 4 GLU C C 4 179.152 179.152 177.934 1.218 25148 3 1 . 1 1 4 4 GLU CA C 4 59.566 59.566 59.102 0.465 25148 4 1 . 1 1 4 4 GLU CB C 4 29.407 29.407 29.438 -0.031 25148 5 1 . 1 1 5 5 LEU N N 5 121.360 121.360 117.314 4.046 25148 6 1 . 1 1 5 5 LEU HA H 5 4.195 4.195 4.051 0.144 25148 7 1 . 1 1 5 5 LEU C C 5 178.179 178.179 178.211 -0.032 25148 8 1 . 1 1 5 5 LEU CA C 5 57.830 57.830 57.577 0.253 25148 9 1 . 1 1 5 5 LEU CB C 5 41.630 41.630 41.351 0.279 25148 10 1 . 1 1 5 5 LEU H H 5 7.877 7.877 7.887 -0.010 25148 11 1 . 1 1 6 6 LEU N N 6 118.058 118.058 119.091 -1.033 25148 12 1 . 1 1 6 6 LEU HA H 6 3.919 3.919 3.898 0.021 25148 13 1 . 1 1 6 6 LEU C C 6 180.274 180.274 179.111 1.163 25148 14 1 . 1 1 6 6 LEU CA C 6 58.221 58.221 57.727 0.494 25148 15 1 . 1 1 6 6 LEU CB C 6 40.684 40.684 41.175 -0.491 25148 16 1 . 1 1 6 6 LEU H H 6 7.685 7.685 7.596 0.089 25148 17 1 . 1 1 7 7 ASP N N 7 120.662 120.662 118.258 2.404 25148 18 1 . 1 1 7 7 ASP HA H 7 4.416 4.416 4.391 0.025 25148 19 1 . 1 1 7 7 ASP C C 7 178.738 178.738 177.840 0.898 25148 20 1 . 1 1 7 7 ASP CA C 7 57.519 57.519 56.747 0.772 25148 21 1 . 1 1 7 7 ASP CB C 7 40.167 40.167 40.882 -0.715 25148 22 1 . 1 1 7 7 ASP H H 7 8.427 8.427 7.760 0.667 25148 23 1 . 1 1 8 8 ALA N N 8 122.612 122.612 122.890 -0.278 25148 24 1 . 1 1 8 8 ALA HA H 8 4.146 4.146 4.008 0.138 25148 25 1 . 1 1 8 8 ALA C C 8 180.787 180.787 179.699 1.088 25148 26 1 . 1 1 8 8 ALA CA C 8 55.165 55.165 55.189 -0.024 25148 27 1 . 1 1 8 8 ALA CB C 8 17.711 17.711 18.430 -0.719 25148 28 1 . 1 1 8 8 ALA H H 8 7.847 7.847 7.709 0.138 25148 29 1 . 1 1 9 9 LEU N N 9 116.977 116.977 117.479 -0.502 25148 30 1 . 1 1 9 9 LEU HA H 9 4.115 4.115 3.875 0.240 25148 31 1 . 1 1 9 9 LEU C C 9 179.510 179.510 179.355 0.155 25148 32 1 . 1 1 9 9 LEU CA C 9 57.468 57.468 57.895 -0.428 25148 33 1 . 1 1 9 9 LEU CB C 9 41.203 41.203 41.604 -0.401 25148 34 1 . 1 1 9 9 LEU H H 9 8.256 8.256 7.678 0.578 25148 35 1 . 1 1 10 10 THR N N 10 118.764 118.764 115.756 3.008 25148 36 1 . 1 1 10 10 THR HA H 10 4.487 4.487 3.921 0.566 25148 37 1 . 1 1 10 10 THR C C 10 176.567 176.567 176.910 -0.343 25148 38 1 . 1 1 10 10 THR CA C 10 68.768 68.768 66.719 2.049 25148 39 1 . 1 1 10 10 THR CB C 10 66.961 66.961 68.623 -1.662 25148 40 1 . 1 1 10 10 THR H H 10 8.218 8.218 7.372 0.846 25148 41 1 . 1 1 11 11 ILE N N 11 122.555 122.555 120.670 1.885 25148 42 1 . 1 1 11 11 ILE HA H 11 3.779 3.779 3.720 0.059 25148 43 1 . 1 1 11 11 ILE C C 11 177.793 177.793 177.734 0.059 25148 44 1 . 1 1 11 11 ILE CA C 11 64.695 64.695 64.987 -0.292 25148 45 1 . 1 1 11 11 ILE CB C 11 37.856 37.856 37.672 0.184 25148 46 1 . 1 1 11 11 ILE H H 11 7.632 7.632 7.827 -0.195 25148 47 1 . 1 1 12 12 LEU N N 12 120.469 120.469 117.869 2.600 25148 48 1 . 1 1 12 12 LEU HA H 12 4.065 4.065 4.081 -0.016 25148 49 1 . 1 1 12 12 LEU C C 12 179.139 179.139 178.990 0.149 25148 50 1 . 1 1 12 12 LEU CA C 12 57.944 57.944 56.944 1.000 25148 51 1 . 1 1 12 12 LEU CB C 12 42.170 42.170 41.150 1.020 25148 52 1 . 1 1 12 12 LEU H H 12 7.951 7.951 7.601 0.350 25148 53 1 . 1 1 13 13 GLU N N 13 119.669 119.669 119.235 0.434 25148 54 1 . 1 1 13 13 GLU HA H 13 4.183 4.183 4.012 0.171 25148 55 1 . 1 1 13 13 GLU C C 13 179.007 179.007 177.542 1.465 25148 56 1 . 1 1 13 13 GLU CA C 13 59.703 59.703 58.723 0.980 25148 57 1 . 1 1 13 13 GLU CB C 13 30.110 30.110 29.188 0.922 25148 58 1 . 1 1 13 13 GLU H H 13 8.003 8.003 7.883 0.120 25148 59 1 . 1 1 14 14 LYS N N 14 118.935 118.935 117.593 1.342 25148 60 1 . 1 1 14 14 LYS HA H 14 4.124 4.124 4.069 0.055 25148 61 1 . 1 1 14 14 LYS CA C 14 58.847 58.847 57.689 1.158 25148 62 1 . 1 1 14 14 LYS CB C 14 33.053 33.053 32.550 0.503 25148 63 1 . 1 1 14 14 LYS H H 14 7.862 7.862 7.426 0.436 25148 64 1 . 1 1 15 15 GLU HA H 15 3.693 3.693 4.303 -0.610 25148 65 1 . 1 1 15 15 GLU CA C 15 56.688 56.688 56.060 0.628 25148 66 1 . 1 1 15 15 GLU CB C 15 32.204 32.204 30.402 1.802 25148 67 1 . 1 1 16 16 LYS HA H 16 4.678 4.678 4.350 0.328 25148 68 1 . 1 1 16 16 LYS CA C 16 55.135 55.135 56.026 -0.891 25148 69 1 . 1 1 16 16 LYS CB C 16 34.049 34.049 33.151 0.898 25148 70 1 . 1 1 17 17 GLY CA C 17 46.541 46.541 45.414 1.127 25148 71 1 . 1 1 18 18 ILE N N 18 115.364 115.364 119.219 -3.855 25148 72 1 . 1 1 18 18 ILE HA H 18 4.079 4.079 4.307 -0.228 25148 73 1 . 1 1 18 18 ILE C C 18 174.751 174.751 174.890 -0.139 25148 74 1 . 1 1 18 18 ILE CA C 18 60.333 60.333 59.769 0.564 25148 75 1 . 1 1 18 18 ILE CB C 18 39.044 39.044 38.866 0.178 25148 76 1 . 1 1 18 18 ILE H H 18 8.203 8.203 7.636 0.567 25148 77 1 . 1 1 19 19 SER N N 19 119.891 119.891 119.664 0.227 25148 78 1 . 1 1 19 19 SER HA H 19 4.362 4.362 4.647 -0.285 25148 79 1 . 1 1 19 19 SER CA C 19 58.476 58.476 57.986 0.490 25148 80 1 . 1 1 19 19 SER CB C 19 63.533 63.533 64.424 -0.891 25148 81 1 . 1 1 19 19 SER H H 19 8.253 8.253 8.462 -0.209 25148 82 1 . 1 1 20 20 LYS N N 20 124.782 124.782 126.668 -1.886 25148 83 1 . 1 1 20 20 LYS HA H 20 4.137 4.137 4.087 0.050 25148 84 1 . 1 1 20 20 LYS C C 20 177.889 177.889 177.621 0.268 25148 85 1 . 1 1 20 20 LYS CA C 20 59.485 59.485 58.886 0.599 25148 86 1 . 1 1 20 20 LYS CB C 20 32.711 32.711 32.196 0.515 25148 87 1 . 1 1 20 20 LYS H H 20 8.918 8.918 8.817 0.101 25148 88 1 . 1 1 21 21 GLU N N 21 117.831 117.831 118.816 -0.985 25148 89 1 . 1 1 21 21 GLU HA H 21 3.957 3.957 4.062 -0.105 25148 90 1 . 1 1 21 21 GLU C C 21 178.822 178.822 178.677 0.145 25148 91 1 . 1 1 21 21 GLU CA C 21 59.529 59.529 59.007 0.522 25148 92 1 . 1 1 21 21 GLU CB C 21 29.237 29.237 29.113 0.124 25148 93 1 . 1 1 21 21 GLU H H 21 8.361 8.361 8.508 -0.147 25148 94 1 . 1 1 22 22 ILE N N 22 118.690 118.690 118.489 0.201 25148 95 1 . 1 1 22 22 ILE HA H 22 3.884 3.884 3.940 -0.056 25148 96 1 . 1 1 22 22 ILE C C 22 179.247 179.247 177.662 1.585 25148 97 1 . 1 1 22 22 ILE CA C 22 63.735 63.735 63.898 -0.163 25148 98 1 . 1 1 22 22 ILE CB C 22 37.415 37.415 38.075 -0.660 25148 99 1 . 1 1 22 22 ILE H H 22 7.353 7.353 7.410 -0.057 25148 100 1 . 1 1 23 23 ILE N N 23 120.880 120.880 120.934 -0.054 25148 101 1 . 1 1 23 23 ILE HA H 23 3.733 3.733 3.714 0.019 25148 102 1 . 1 1 23 23 ILE C C 23 177.817 177.817 177.902 -0.085 25148 103 1 . 1 1 23 23 ILE CA C 23 64.172 64.172 63.571 0.601 25148 104 1 . 1 1 23 23 ILE CB C 23 36.473 36.473 36.831 -0.358 25148 105 1 . 1 1 23 23 ILE H H 23 7.571 7.571 7.293 0.278 25148 106 1 . 1 1 24 24 ILE N N 24 121.460 121.460 119.261 2.199 25148 107 1 . 1 1 24 24 ILE HA H 24 3.486 3.486 3.592 -0.106 25148 108 1 . 1 1 24 24 ILE C C 24 177.759 177.759 177.841 -0.082 25148 109 1 . 1 1 24 24 ILE CA C 24 66.641 66.641 66.123 0.518 25148 110 1 . 1 1 24 24 ILE CB C 24 37.307 37.307 37.383 -0.076 25148 111 1 . 1 1 24 24 ILE H H 24 8.709 8.709 7.847 0.862 25148 112 1 . 1 1 25 25 GLU N N 25 119.323 119.323 118.438 0.885 25148 113 1 . 1 1 25 25 GLU HA H 25 4.177 4.177 4.167 0.010 25148 114 1 . 1 1 25 25 GLU C C 25 179.348 179.348 178.613 0.735 25148 115 1 . 1 1 25 25 GLU CA C 25 59.951 59.951 59.066 0.885 25148 116 1 . 1 1 25 25 GLU CB C 25 29.340 29.340 29.131 0.208 25148 117 1 . 1 1 25 25 GLU H H 25 8.048 8.048 7.921 0.127 25148 118 1 . 1 1 26 26 ALA N N 26 122.390 122.390 122.764 -0.374 25148 119 1 . 1 1 26 26 ALA HA H 26 4.325 4.325 4.118 0.207 25148 120 1 . 1 1 26 26 ALA C C 26 181.440 181.440 179.732 1.708 25148 121 1 . 1 1 26 26 ALA CA C 26 54.935 54.935 54.882 0.053 25148 122 1 . 1 1 26 26 ALA CB C 26 17.834 17.834 18.300 -0.466 25148 123 1 . 1 1 26 26 ALA H H 26 7.768 7.768 7.784 -0.016 25148 124 1 . 1 1 27 27 ILE N N 27 122.342 122.342 119.585 2.757 25148 125 1 . 1 1 27 27 ILE HA H 27 3.575 3.575 3.618 -0.043 25148 126 1 . 1 1 27 27 ILE C C 27 177.541 177.541 177.982 -0.441 25148 127 1 . 1 1 27 27 ILE CA C 27 66.536 66.536 65.633 0.903 25148 128 1 . 1 1 27 27 ILE CB C 27 37.886 37.886 37.778 0.108 25148 129 1 . 1 1 27 27 ILE H H 27 8.805 8.805 7.652 1.153 25148 130 1 . 1 1 28 28 GLU N N 28 120.188 120.188 119.445 0.743 25148 131 1 . 1 1 28 28 GLU HA H 28 3.687 3.687 3.922 -0.235 25148 132 1 . 1 1 28 28 GLU C C 28 178.707 178.707 178.944 -0.237 25148 133 1 . 1 1 28 28 GLU CA C 28 61.458 61.458 59.785 1.673 25148 134 1 . 1 1 28 28 GLU CB C 28 29.624 29.624 29.131 0.493 25148 135 1 . 1 1 28 28 GLU H H 28 8.882 8.882 7.745 1.137 25148 136 1 . 1 1 29 29 ALA N N 29 119.293 119.293 121.263 -1.970 25148 137 1 . 1 1 29 29 ALA HA H 29 4.214 4.214 4.090 0.124 25148 138 1 . 1 1 29 29 ALA C C 29 181.200 181.200 179.619 1.581 25148 139 1 . 1 1 29 29 ALA CA C 29 55.435 55.435 54.858 0.577 25148 140 1 . 1 1 29 29 ALA CB C 29 18.090 18.090 18.124 -0.034 25148 141 1 . 1 1 29 29 ALA H H 29 8.065 8.065 7.896 0.169 25148 142 1 . 1 1 30 30 ALA N N 30 121.729 121.729 121.963 -0.234 25148 143 1 . 1 1 30 30 ALA HA H 30 4.307 4.307 4.157 0.150 25148 144 1 . 1 1 30 30 ALA C C 30 181.315 181.315 179.581 1.734 25148 145 1 . 1 1 30 30 ALA CA C 30 54.594 54.594 54.768 -0.174 25148 146 1 . 1 1 30 30 ALA CB C 30 18.704 18.704 18.350 0.354 25148 147 1 . 1 1 30 30 ALA H H 30 8.099 8.099 7.552 0.547 25148 148 1 . 1 1 31 31 LEU N N 31 120.900 120.900 120.639 0.261 25148 149 1 . 1 1 31 31 LEU HA H 31 4.347 4.347 4.106 0.241 25148 150 1 . 1 1 31 31 LEU C C 31 179.137 179.137 179.228 -0.091 25148 151 1 . 1 1 31 31 LEU CA C 31 57.569 57.569 58.541 -0.972 25148 152 1 . 1 1 31 31 LEU CB C 31 42.353 42.353 41.428 0.925 25148 153 1 . 1 1 31 31 LEU H H 31 8.863 8.863 8.054 0.809 25148 154 1 . 1 1 32 32 ILE N N 32 122.410 122.410 118.825 3.585 25148 155 1 . 1 1 32 32 ILE HA H 32 3.699 3.699 3.683 0.016 25148 156 1 . 1 1 32 32 ILE C C 32 178.303 178.303 177.783 0.520 25148 157 1 . 1 1 32 32 ILE CA C 32 66.066 66.066 65.367 0.699 25148 158 1 . 1 1 32 32 ILE CB C 32 37.882 37.882 37.925 -0.043 25148 159 1 . 1 1 32 32 ILE H H 32 8.234 8.234 8.295 -0.061 25148 160 1 . 1 1 33 33 SER N N 33 114.201 114.201 115.637 -1.436 25148 161 1 . 1 1 33 33 SER HA H 33 4.311 4.311 4.164 0.147 25148 162 1 . 1 1 33 33 SER C C 33 177.012 177.012 176.660 0.352 25148 163 1 . 1 1 33 33 SER CA C 33 61.860 61.860 61.850 0.010 25148 164 1 . 1 1 33 33 SER CB C 33 62.508 62.508 63.153 -0.645 25148 165 1 . 1 1 33 33 SER H H 33 7.558 7.558 7.787 -0.229 25148 166 1 . 1 1 34 34 ALA N N 34 122.893 122.893 124.555 -1.662 25148 167 1 . 1 1 34 34 ALA HA H 34 4.215 4.215 4.111 0.104 25148 168 1 . 1 1 34 34 ALA C C 34 180.814 180.814 179.357 1.457 25148 169 1 . 1 1 34 34 ALA CA C 34 55.283 55.283 54.935 0.348 25148 170 1 . 1 1 34 34 ALA CB C 34 18.273 18.273 18.296 -0.023 25148 171 1 . 1 1 34 34 ALA H H 34 8.409 8.409 8.100 0.309 25148 172 1 . 1 1 35 35 TYR N N 35 120.259 120.259 119.093 1.166 25148 173 1 . 1 1 35 35 TYR HA H 35 4.393 4.393 4.369 0.024 25148 174 1 . 1 1 35 35 TYR C C 35 177.892 177.892 177.717 0.175 25148 175 1 . 1 1 35 35 TYR CA C 35 63.071 63.071 60.704 2.367 25148 176 1 . 1 1 35 35 TYR CB C 35 38.021 38.021 38.939 -0.918 25148 177 1 . 1 1 35 35 TYR H H 35 8.975 8.975 8.203 0.772 25148 178 1 . 1 1 36 36 LYS N N 36 120.942 120.942 120.127 0.815 25148 179 1 . 1 1 36 36 LYS HA H 36 4.032 4.032 4.049 -0.017 25148 180 1 . 1 1 36 36 LYS C C 36 177.797 177.797 178.439 -0.642 25148 181 1 . 1 1 36 36 LYS CA C 36 59.900 59.900 59.213 0.687 25148 182 1 . 1 1 36 36 LYS CB C 36 32.429 32.429 32.252 0.177 25148 183 1 . 1 1 36 36 LYS H H 36 8.654 8.654 8.104 0.550 25148 184 1 . 1 1 37 37 ARG N N 37 115.139 115.139 116.627 -1.488 25148 185 1 . 1 1 37 37 ARG HA H 37 4.101 4.101 4.090 0.011 25148 186 1 . 1 1 37 37 ARG C C 37 177.517 177.517 178.044 -0.527 25148 187 1 . 1 1 37 37 ARG CA C 37 58.276 58.276 58.332 -0.056 25148 188 1 . 1 1 37 37 ARG CB C 37 31.014 31.014 29.774 1.240 25148 189 1 . 1 1 37 37 ARG H H 37 8.138 8.138 7.792 0.346 25148 190 1 . 1 1 38 38 ASN N N 38 112.555 112.555 116.585 -4.030 25148 191 1 . 1 1 38 38 ASN HA H 38 4.540 4.540 4.299 0.241 25148 192 1 . 1 1 38 38 ASN C C 38 173.994 173.994 175.190 -1.196 25148 193 1 . 1 1 38 38 ASN CA C 38 54.722 54.722 55.159 -0.437 25148 194 1 . 1 1 38 38 ASN CB C 38 42.077 42.077 39.159 2.918 25148 195 1 . 1 1 38 38 ASN H H 38 7.426 7.426 7.589 -0.163 25148 196 1 . 1 1 39 39 PHE N N 39 116.711 116.711 117.082 -0.371 25148 197 1 . 1 1 39 39 PHE HA H 39 4.569 4.569 4.734 -0.165 25148 198 1 . 1 1 39 39 PHE CA C 39 58.913 58.913 56.347 2.566 25148 199 1 . 1 1 39 39 PHE CB C 39 39.781 39.781 38.707 1.074 25148 200 1 . 1 1 39 39 PHE H H 39 7.959 7.959 7.435 0.524 25148 201 1 . 1 1 40 40 ASN HA H 40 4.018 4.018 4.565 -0.547 25148 202 1 . 1 1 40 40 ASN CA C 40 58.944 58.944 55.237 3.707 25148 203 1 . 1 1 41 41 GLN HA H 41 4.298 4.298 4.463 -0.165 25148 204 1 . 1 1 41 41 GLN C C 41 175.237 175.237 175.735 -0.498 25148 205 1 . 1 1 41 41 GLN CA C 41 57.360 57.360 56.584 0.776 25148 206 1 . 1 1 41 41 GLN CB C 41 28.724 28.724 28.067 0.657 25148 207 1 . 1 1 42 42 ALA N N 42 120.514 120.514 121.242 -0.728 25148 208 1 . 1 1 42 42 ALA HA H 42 4.622 4.622 4.436 0.185 25148 209 1 . 1 1 42 42 ALA C C 42 175.922 175.922 176.588 -0.666 25148 210 1 . 1 1 42 42 ALA CA C 42 51.841 51.841 52.260 -0.419 25148 211 1 . 1 1 42 42 ALA CB C 42 21.576 21.576 20.223 1.353 25148 212 1 . 1 1 42 42 ALA H H 42 7.817 7.817 8.102 -0.285 25148 213 1 . 1 1 43 43 GLN N N 43 117.594 117.594 115.610 1.984 25148 214 1 . 1 1 43 43 GLN HA H 43 4.265 4.265 4.492 -0.227 25148 215 1 . 1 1 43 43 GLN C C 43 174.942 174.942 173.672 1.270 25148 216 1 . 1 1 43 43 GLN CA C 43 57.047 57.047 55.335 1.712 25148 217 1 . 1 1 43 43 GLN CB C 43 30.863 30.863 31.458 -0.595 25148 218 1 . 1 1 43 43 GLN H H 43 7.400 7.400 7.527 -0.127 25148 219 1 . 1 1 44 44 ASN N N 44 120.467 120.467 120.523 -0.056 25148 220 1 . 1 1 44 44 ASN HA H 44 5.005 5.005 4.700 0.305 25148 221 1 . 1 1 44 44 ASN C C 44 174.365 174.365 174.212 0.153 25148 222 1 . 1 1 44 44 ASN CA C 44 52.381 52.381 53.162 -0.781 25148 223 1 . 1 1 44 44 ASN CB C 44 38.177 38.177 39.218 -1.041 25148 224 1 . 1 1 44 44 ASN H H 44 9.123 9.123 8.573 0.550 25148 225 1 . 1 1 45 45 VAL N N 45 115.479 115.479 117.182 -1.703 25148 226 1 . 1 1 45 45 VAL HA H 45 5.376 5.376 4.279 1.097 25148 227 1 . 1 1 45 45 VAL C C 45 174.908 174.908 173.814 1.094 25148 228 1 . 1 1 45 45 VAL CA C 45 59.022 59.022 61.768 -2.746 25148 229 1 . 1 1 45 45 VAL CB C 45 35.776 35.776 34.991 0.785 25148 230 1 . 1 1 45 45 VAL H H 45 7.732 7.732 8.142 -0.410 25148 231 1 . 1 1 46 46 ARG N N 46 121.146 121.146 125.178 -4.032 25148 232 1 . 1 1 46 46 ARG HA H 46 4.566 4.566 4.816 -0.250 25148 233 1 . 1 1 46 46 ARG C C 46 173.790 173.790 174.480 -0.690 25148 234 1 . 1 1 46 46 ARG CA C 46 54.762 54.762 54.399 0.363 25148 235 1 . 1 1 46 46 ARG CB C 46 33.946 33.946 32.398 1.548 25148 236 1 . 1 1 46 46 ARG H H 46 8.850 8.850 9.017 -0.167 25148 237 1 . 1 1 47 47 VAL N N 47 122.339 122.339 124.862 -2.523 25148 238 1 . 1 1 47 47 VAL HA H 47 4.741 4.741 4.501 0.240 25148 239 1 . 1 1 47 47 VAL C C 47 173.541 173.541 175.680 -2.139 25148 240 1 . 1 1 47 47 VAL CA C 47 60.893 60.893 61.603 -0.710 25148 241 1 . 1 1 47 47 VAL CB C 47 33.563 33.563 33.090 0.473 25148 242 1 . 1 1 47 47 VAL H H 47 8.444 8.444 8.523 -0.079 25148 243 1 . 1 1 48 48 ASP N N 48 127.701 127.701 126.360 1.341 25148 244 1 . 1 1 48 48 ASP HA H 48 4.946 4.946 4.960 -0.014 25148 245 1 . 1 1 48 48 ASP C C 48 173.744 173.744 174.539 -0.795 25148 246 1 . 1 1 48 48 ASP CA C 48 52.651 52.651 53.031 -0.380 25148 247 1 . 1 1 48 48 ASP CB C 48 45.225 45.225 43.733 1.492 25148 248 1 . 1 1 48 48 ASP H H 48 9.068 9.068 8.546 0.522 25148 249 1 . 1 1 49 49 LEU N N 49 130.945 130.945 126.323 4.622 25148 250 1 . 1 1 49 49 LEU HA H 49 4.774 4.774 4.660 0.114 25148 251 1 . 1 1 49 49 LEU C C 49 174.531 174.531 175.627 -1.096 25148 252 1 . 1 1 49 49 LEU CA C 49 54.337 54.337 54.369 -0.032 25148 253 1 . 1 1 49 49 LEU CB C 49 43.192 43.192 43.804 -0.612 25148 254 1 . 1 1 49 49 LEU H H 49 9.369 9.369 8.492 0.877 25148 255 1 . 1 1 50 50 ASN N N 50 126.268 126.268 124.410 1.858 25148 256 1 . 1 1 50 50 ASN HA H 50 4.629 4.629 5.017 -0.388 25148 257 1 . 1 1 50 50 ASN C C 50 176.602 176.602 175.347 1.255 25148 258 1 . 1 1 50 50 ASN CA C 50 54.048 54.048 52.547 1.501 25148 259 1 . 1 1 50 50 ASN CB C 50 39.891 39.891 39.328 0.563 25148 260 1 . 1 1 50 50 ASN H H 50 8.672 8.672 8.855 -0.183 25148 261 1 . 1 1 51 51 ARG N N 51 125.897 125.897 124.477 1.419 25148 262 1 . 1 1 51 51 ARG HA H 51 3.789 3.789 4.170 -0.381 25148 263 1 . 1 1 51 51 ARG C C 51 175.681 175.681 176.276 -0.595 25148 264 1 . 1 1 51 51 ARG CA C 51 58.162 58.162 58.467 -0.305 25148 265 1 . 1 1 51 51 ARG CB C 51 29.944 29.944 29.802 0.142 25148 266 1 . 1 1 51 51 ARG H H 51 8.984 8.984 8.705 0.279 25148 267 1 . 1 1 52 52 GLU N N 52 116.733 116.733 118.739 -2.006 25148 268 1 . 1 1 52 52 GLU HA H 52 4.368 4.368 4.195 0.173 25148 269 1 . 1 1 52 52 GLU C C 52 178.049 178.049 177.330 0.719 25148 270 1 . 1 1 52 52 GLU CA C 52 58.048 58.048 58.180 -0.132 25148 271 1 . 1 1 52 52 GLU CB C 52 30.716 30.716 29.365 1.351 25148 272 1 . 1 1 52 52 GLU H H 52 8.541 8.541 8.396 0.145 25148 273 1 . 1 1 53 53 THR N N 53 106.556 106.556 109.670 -3.114 25148 274 1 . 1 1 53 53 THR HA H 53 4.424 4.424 4.542 -0.118 25148 275 1 . 1 1 53 53 THR C C 53 176.352 176.352 175.005 1.347 25148 276 1 . 1 1 53 53 THR CA C 53 61.320 61.320 61.029 0.291 25148 277 1 . 1 1 53 53 THR CB C 53 71.220 71.220 69.748 1.472 25148 278 1 . 1 1 53 53 THR H H 53 8.085 8.085 7.571 0.514 25148 279 1 . 1 1 54 54 GLY N N 54 111.843 111.843 110.488 1.355 25148 280 1 . 1 1 54 54 GLY C C 54 172.690 172.690 174.389 -1.699 25148 281 1 . 1 1 54 54 GLY CA C 54 45.417 45.417 46.240 -0.823 25148 282 1 . 1 1 54 54 GLY H H 54 8.330 8.330 7.793 0.537 25148 283 1 . 1 1 55 55 SER N N 55 113.844 113.844 113.971 -0.127 25148 284 1 . 1 1 55 55 SER HA H 55 4.279 4.279 4.678 -0.399 25148 285 1 . 1 1 55 55 SER C C 55 174.127 174.127 173.069 1.058 25148 286 1 . 1 1 55 55 SER CA C 55 59.229 59.229 57.860 1.369 25148 287 1 . 1 1 55 55 SER CB C 55 63.939 63.939 65.481 -1.542 25148 288 1 . 1 1 55 55 SER H H 55 7.653 7.653 7.562 0.090 25148 289 1 . 1 1 56 56 ILE N N 56 125.286 125.286 120.363 4.923 25148 290 1 . 1 1 56 56 ILE HA H 56 5.082 5.082 4.694 0.388 25148 291 1 . 1 1 56 56 ILE C C 56 175.346 175.346 174.395 0.951 25148 292 1 . 1 1 56 56 ILE CA C 56 59.967 59.967 60.365 -0.398 25148 293 1 . 1 1 56 56 ILE CB C 56 40.165 40.165 42.127 -1.962 25148 294 1 . 1 1 56 56 ILE H H 56 8.478 8.478 8.444 0.034 25148 295 1 . 1 1 57 57 ARG N N 57 126.332 126.332 127.200 -0.868 25148 296 1 . 1 1 57 57 ARG HA H 57 4.740 4.740 4.578 0.162 25148 297 1 . 1 1 57 57 ARG C C 57 173.921 173.921 173.633 0.288 25148 298 1 . 1 1 57 57 ARG CA C 57 54.311 54.311 53.717 0.594 25148 299 1 . 1 1 57 57 ARG CB C 57 35.805 35.805 33.294 2.511 25148 300 1 . 1 1 57 57 ARG H H 57 8.590 8.590 8.397 0.193 25148 301 1 . 1 1 58 58 VAL N N 58 120.987 120.987 123.149 -2.162 25148 302 1 . 1 1 58 58 VAL HA H 58 4.334 4.334 4.159 0.175 25148 303 1 . 1 1 58 58 VAL C C 58 174.204 174.204 174.137 0.067 25148 304 1 . 1 1 58 58 VAL CA C 58 60.861 60.861 61.168 -0.307 25148 305 1 . 1 1 58 58 VAL CB C 58 33.383 33.383 31.797 1.586 25148 306 1 . 1 1 58 58 VAL H H 58 8.585 8.585 8.239 0.346 25148 307 1 . 1 1 59 59 PHE N N 59 124.913 124.913 126.334 -1.421 25148 308 1 . 1 1 59 59 PHE HA H 59 5.046 5.046 5.352 -0.306 25148 309 1 . 1 1 59 59 PHE C C 59 174.446 174.446 174.274 0.172 25148 310 1 . 1 1 59 59 PHE CA C 59 56.695 56.695 55.278 1.417 25148 311 1 . 1 1 59 59 PHE CB C 59 42.779 42.779 43.211 -0.432 25148 312 1 . 1 1 59 59 PHE H H 59 8.920 8.920 8.608 0.312 25148 313 1 . 1 1 60 60 ALA N N 60 124.035 124.035 123.549 0.486 25148 314 1 . 1 1 60 60 ALA HA H 60 5.102 5.102 4.815 0.287 25148 315 1 . 1 1 60 60 ALA C C 60 176.017 176.017 176.374 -0.357 25148 316 1 . 1 1 60 60 ALA CA C 60 50.083 50.083 50.643 -0.560 25148 317 1 . 1 1 60 60 ALA CB C 60 22.400 22.400 20.614 1.787 25148 318 1 . 1 1 60 60 ALA H H 60 9.457 9.457 8.783 0.674 25148 319 1 . 1 1 61 61 ARG N N 61 121.530 121.530 124.929 -3.399 25148 320 1 . 1 1 61 61 ARG HA H 61 4.958 4.958 4.862 0.096 25148 321 1 . 1 1 61 61 ARG C C 61 176.737 176.737 175.752 0.985 25148 322 1 . 1 1 61 61 ARG CA C 61 55.375 55.375 55.866 -0.491 25148 323 1 . 1 1 61 61 ARG CB C 61 31.230 31.230 31.076 0.154 25148 324 1 . 1 1 61 61 ARG H H 61 8.447 8.447 8.734 -0.287 25148 325 1 . 1 1 62 62 LYS N N 62 124.784 124.784 125.610 -0.826 25148 326 1 . 1 1 62 62 LYS HA H 62 4.709 4.709 4.477 0.232 25148 327 1 . 1 1 62 62 LYS C C 62 173.899 173.899 174.860 -0.961 25148 328 1 . 1 1 62 62 LYS CA C 62 54.812 54.812 55.130 -0.318 25148 329 1 . 1 1 62 62 LYS CB C 62 37.147 37.147 35.566 1.581 25148 330 1 . 1 1 62 62 LYS H H 62 9.137 9.137 8.184 0.953 25148 331 1 . 1 1 63 63 ASP N N 63 122.552 122.552 124.729 -2.177 25148 332 1 . 1 1 63 63 ASP HA H 63 4.877 4.877 4.634 0.244 25148 333 1 . 1 1 63 63 ASP C C 63 175.560 175.560 176.233 -0.673 25148 334 1 . 1 1 63 63 ASP CA C 63 54.576 54.576 54.848 -0.272 25148 335 1 . 1 1 63 63 ASP CB C 63 42.841 42.841 41.508 1.333 25148 336 1 . 1 1 63 63 ASP H H 63 8.334 8.334 8.722 -0.388 25148 337 1 . 1 1 64 64 VAL N N 64 123.109 123.109 126.810 -3.701 25148 338 1 . 1 1 64 64 VAL HA H 64 4.557 4.557 4.575 -0.019 25148 339 1 . 1 1 64 64 VAL C C 64 177.260 177.260 175.388 1.872 25148 340 1 . 1 1 64 64 VAL CA C 64 62.268 62.268 62.941 -0.673 25148 341 1 . 1 1 64 64 VAL CB C 64 30.348 30.348 31.195 -0.847 25148 342 1 . 1 1 64 64 VAL H H 64 8.693 8.693 8.120 0.573 25148 343 1 . 1 1 65 65 VAL N N 65 122.320 122.320 122.701 -0.381 25148 344 1 . 1 1 65 65 VAL HA H 65 4.939 4.939 4.583 0.356 25148 345 1 . 1 1 65 65 VAL C C 65 174.754 174.754 174.940 -0.186 25148 346 1 . 1 1 65 65 VAL CA C 65 59.173 59.173 59.650 -0.477 25148 347 1 . 1 1 65 65 VAL CB C 65 36.289 36.289 35.611 0.678 25148 348 1 . 1 1 65 65 VAL H H 65 8.656 8.656 8.466 0.190 25148 349 1 . 1 1 66 66 ASP N N 66 119.805 119.805 121.673 -1.868 25148 350 1 . 1 1 66 66 ASP HA H 66 4.499 4.499 4.395 0.104 25148 351 1 . 1 1 66 66 ASP C C 66 176.565 176.565 175.944 0.621 25148 352 1 . 1 1 66 66 ASP CA C 66 57.236 57.236 56.520 0.716 25148 353 1 . 1 1 66 66 ASP CB C 66 41.662 41.662 41.209 0.453 25148 354 1 . 1 1 66 66 ASP H H 66 8.628 8.628 8.764 -0.136 25148 355 1 . 1 1 67 67 GLU N N 67 117.604 117.604 117.368 0.236 25148 356 1 . 1 1 67 67 GLU HA H 67 4.350 4.350 4.433 -0.083 25148 357 1 . 1 1 67 67 GLU C C 67 173.736 173.736 175.169 -1.433 25148 358 1 . 1 1 67 67 GLU CA C 67 55.203 55.203 54.856 0.347 25148 359 1 . 1 1 67 67 GLU CB C 67 32.240 32.240 32.419 -0.179 25148 360 1 . 1 1 67 67 GLU H H 67 7.525 7.525 7.853 -0.328 25148 361 1 . 1 1 68 68 VAL N N 68 125.774 125.774 123.424 2.350 25148 362 1 . 1 1 68 68 VAL HA H 68 3.578 3.578 3.903 -0.325 25148 363 1 . 1 1 68 68 VAL C C 68 175.885 175.885 175.578 0.307 25148 364 1 . 1 1 68 68 VAL CA C 68 63.397 63.397 64.019 -0.622 25148 365 1 . 1 1 68 68 VAL CB C 68 32.452 32.452 31.435 1.017 25148 366 1 . 1 1 68 68 VAL H H 68 8.573 8.573 8.477 0.096 25148 367 1 . 1 1 69 69 TYR N N 69 129.859 129.859 126.101 3.758 25148 368 1 . 1 1 69 69 TYR HA H 69 4.642 4.642 4.603 0.039 25148 369 1 . 1 1 69 69 TYR C C 69 176.100 176.100 175.630 0.469 25148 370 1 . 1 1 69 69 TYR CA C 69 59.092 59.092 58.667 0.425 25148 371 1 . 1 1 69 69 TYR CB C 69 39.830 39.830 40.299 -0.469 25148 372 1 . 1 1 69 69 TYR H H 69 9.801 9.801 8.474 1.327 25148 373 1 . 1 1 70 70 ASP N N 70 120.204 120.204 120.361 -0.157 25148 374 1 . 1 1 70 70 ASP HA H 70 4.772 4.772 4.912 -0.140 25148 375 1 . 1 1 70 70 ASP C C 70 176.622 176.622 176.307 0.315 25148 376 1 . 1 1 70 70 ASP CA C 70 52.885 52.885 53.225 -0.340 25148 377 1 . 1 1 70 70 ASP CB C 70 41.878 41.878 40.934 0.944 25148 378 1 . 1 1 70 70 ASP H H 70 8.348 8.348 7.997 0.351 25148 379 1 . 1 1 71 71 GLN N N 71 125.440 125.440 123.581 1.859 25148 380 1 . 1 1 71 71 GLN HA H 71 4.315 4.315 3.999 0.316 25148 381 1 . 1 1 71 71 GLN C C 71 175.819 175.819 176.785 -0.966 25148 382 1 . 1 1 71 71 GLN CA C 71 57.914 57.914 58.422 -0.508 25148 383 1 . 1 1 71 71 GLN CB C 71 28.307 28.307 28.653 -0.346 25148 384 1 . 1 1 71 71 GLN H H 71 9.097 9.097 8.750 0.347 25148 385 1 . 1 1 72 72 ARG N N 72 116.306 116.306 115.777 0.529 25148 386 1 . 1 1 72 72 ARG HA H 72 4.252 4.252 4.160 0.092 25148 387 1 . 1 1 72 72 ARG C C 72 178.087 178.087 175.813 2.274 25148 388 1 . 1 1 72 72 ARG CA C 72 58.532 58.532 57.423 1.109 25148 389 1 . 1 1 72 72 ARG CB C 72 30.143 30.143 30.650 -0.507 25148 390 1 . 1 1 72 72 ARG H H 72 8.534 8.534 8.175 0.359 25148 391 1 . 1 1 73 73 LEU N N 73 116.734 116.734 113.738 2.996 25148 392 1 . 1 1 73 73 LEU HA H 73 4.621 4.621 4.642 -0.021 25148 393 1 . 1 1 73 73 LEU C C 73 175.946 175.946 175.002 0.944 25148 394 1 . 1 1 73 73 LEU CA C 73 55.250 55.250 55.383 -0.133 25148 395 1 . 1 1 73 73 LEU CB C 73 46.960 46.960 44.550 2.410 25148 396 1 . 1 1 73 73 LEU H H 73 7.460 7.460 7.442 0.018 25148 397 1 . 1 1 74 74 GLU N N 74 118.787 118.787 122.240 -3.453 25148 398 1 . 1 1 74 74 GLU HA H 74 5.403 5.403 4.652 0.751 25148 399 1 . 1 1 74 74 GLU C C 74 173.709 173.709 174.304 -0.595 25148 400 1 . 1 1 74 74 GLU CA C 74 54.914 54.914 55.868 -0.954 25148 401 1 . 1 1 74 74 GLU CB C 74 35.053 35.053 33.550 1.503 25148 402 1 . 1 1 74 74 GLU H H 74 7.752 7.752 8.090 -0.338 25148 403 1 . 1 1 75 75 ILE N N 75 119.803 119.803 121.981 -2.177 25148 404 1 . 1 1 75 75 ILE HA H 75 4.507 4.507 4.488 0.019 25148 405 1 . 1 1 75 75 ILE C C 75 172.126 172.126 173.830 -1.704 25148 406 1 . 1 1 75 75 ILE CA C 75 58.664 58.664 60.200 -1.536 25148 407 1 . 1 1 75 75 ILE CB C 75 42.560 42.560 41.918 0.642 25148 408 1 . 1 1 75 75 ILE H H 75 8.975 8.975 8.669 0.306 25148 409 1 . 1 1 76 76 SER N N 76 123.236 123.236 124.082 -0.846 25148 410 1 . 1 1 76 76 SER HA H 76 4.505 4.505 4.816 -0.311 25148 411 1 . 1 1 76 76 SER C C 76 176.145 176.145 175.854 0.291 25148 412 1 . 1 1 76 76 SER CA C 76 58.108 58.108 58.456 -0.348 25148 413 1 . 1 1 76 76 SER CB C 76 65.000 65.000 64.096 0.904 25148 414 1 . 1 1 76 76 SER H H 76 8.810 8.810 8.586 0.224 25148 415 1 . 1 1 77 77 ILE N N 77 120.629 120.629 126.360 -5.731 25148 416 1 . 1 1 77 77 ILE HA H 77 3.935 3.935 3.749 0.186 25148 417 1 . 1 1 77 77 ILE C C 77 175.806 175.806 176.858 -1.052 25148 418 1 . 1 1 77 77 ILE CA C 77 61.928 61.928 63.804 -1.876 25148 419 1 . 1 1 77 77 ILE CB C 77 38.031 38.031 38.249 -0.218 25148 420 1 . 1 1 77 77 ILE H H 77 8.321 8.321 8.184 0.137 25148 421 1 . 1 1 78 78 GLU N N 78 121.032 121.032 117.420 3.612 25148 422 1 . 1 1 78 78 GLU HA H 78 4.082 4.082 4.015 0.067 25148 423 1 . 1 1 78 78 GLU C C 78 179.829 179.829 178.400 1.429 25148 424 1 . 1 1 78 78 GLU CA C 78 60.180 60.180 59.051 1.129 25148 425 1 . 1 1 78 78 GLU CB C 78 28.988 28.988 28.789 0.199 25148 426 1 . 1 1 78 78 GLU H H 78 8.222 8.222 8.376 -0.154 25148 427 1 . 1 1 79 79 GLU N N 79 120.710 120.710 121.145 -0.435 25148 428 1 . 1 1 79 79 GLU HA H 79 4.012 4.012 4.092 -0.080 25148 429 1 . 1 1 79 79 GLU C C 79 180.339 180.339 178.977 1.362 25148 430 1 . 1 1 79 79 GLU CA C 79 59.332 59.332 58.793 0.539 25148 431 1 . 1 1 79 79 GLU CB C 79 29.317 29.317 29.397 -0.080 25148 432 1 . 1 1 79 79 GLU H H 79 7.908 7.908 7.746 0.162 25148 433 1 . 1 1 80 80 ALA N N 80 122.879 122.879 121.851 1.028 25148 434 1 . 1 1 80 80 ALA HA H 80 3.966 3.966 4.133 -0.167 25148 435 1 . 1 1 80 80 ALA C C 80 179.833 179.833 179.951 -0.118 25148 436 1 . 1 1 80 80 ALA CA C 80 55.881 55.881 55.049 0.832 25148 437 1 . 1 1 80 80 ALA CB C 80 18.870 18.870 18.120 0.750 25148 438 1 . 1 1 80 80 ALA H H 80 9.132 9.132 7.988 1.144 25148 439 1 . 1 1 81 81 GLN N N 81 115.829 115.829 116.772 -0.943 25148 440 1 . 1 1 81 81 GLN HA H 81 4.749 4.749 4.325 0.423 25148 441 1 . 1 1 81 81 GLN C C 81 178.126 178.126 177.974 0.152 25148 442 1 . 1 1 81 81 GLN CA C 81 57.682 57.682 57.902 -0.220 25148 443 1 . 1 1 81 81 GLN CB C 81 27.307 27.307 28.680 -1.373 25148 444 1 . 1 1 81 81 GLN H H 81 8.709 8.709 7.805 0.904 25148 445 1 . 1 1 82 82 GLY N N 82 105.531 105.531 106.748 -1.217 25148 446 1 . 1 1 82 82 GLY C C 82 174.917 174.917 175.026 -0.109 25148 447 1 . 1 1 82 82 GLY CA C 82 45.915 45.915 46.569 -0.654 25148 448 1 . 1 1 82 82 GLY H H 82 7.479 7.479 7.961 -0.482 25148 449 1 . 1 1 83 83 ILE N N 83 122.828 122.828 113.850 8.978 25148 450 1 . 1 1 83 83 ILE HA H 83 3.970 3.970 4.427 -0.457 25148 451 1 . 1 1 83 83 ILE C C 83 177.209 177.209 175.581 1.628 25148 452 1 . 1 1 83 83 ILE CA C 83 64.305 64.305 61.622 2.683 25148 453 1 . 1 1 83 83 ILE CB C 83 38.452 38.452 40.185 -1.733 25148 454 1 . 1 1 83 83 ILE H H 83 7.634 7.634 7.524 0.110 25148 455 1 . 1 1 84 84 HIS N N 84 118.927 118.927 120.062 -1.135 25148 456 1 . 1 1 84 84 HIS HA H 84 4.713 4.713 4.936 -0.222 25148 457 1 . 1 1 84 84 HIS CA C 84 55.487 55.487 54.473 1.014 25148 458 1 . 1 1 84 84 HIS CB C 84 33.506 33.506 32.302 1.204 25148 459 1 . 1 1 84 84 HIS H H 84 8.155 8.155 8.369 -0.214 25148 460 1 . 1 1 85 85 PRO HA H 85 4.456 4.456 4.580 -0.124 25148 461 1 . 1 1 85 85 PRO C C 85 177.357 177.357 177.265 0.092 25148 462 1 . 1 1 85 85 PRO CA C 85 64.475 64.475 64.089 0.386 25148 463 1 . 1 1 85 85 PRO CB C 85 32.489 32.489 32.109 0.380 25148 464 1 . 1 1 86 86 GLU N N 86 116.314 116.314 117.340 -1.026 25148 465 1 . 1 1 86 86 GLU HA H 86 4.286 4.286 4.148 0.138 25148 466 1 . 1 1 86 86 GLU C C 86 177.624 177.624 177.247 0.377 25148 467 1 . 1 1 86 86 GLU CA C 86 56.619 56.619 56.899 -0.280 25148 468 1 . 1 1 86 86 GLU CB C 86 29.389 29.389 29.487 -0.098 25148 469 1 . 1 1 86 86 GLU H H 86 8.938 8.938 7.817 1.121 25148 470 1 . 1 1 87 87 TYR N N 87 119.773 119.773 120.197 -0.424 25148 471 1 . 1 1 87 87 TYR HA H 87 4.744 4.744 4.205 0.539 25148 472 1 . 1 1 87 87 TYR C C 87 174.533 174.533 176.231 -1.698 25148 473 1 . 1 1 87 87 TYR CA C 87 59.117 59.117 59.442 -0.325 25148 474 1 . 1 1 87 87 TYR CB C 87 38.859 38.859 38.783 0.076 25148 475 1 . 1 1 87 87 TYR H H 87 7.447 7.447 7.371 0.076 25148 476 1 . 1 1 88 88 MET N N 88 118.298 118.298 117.181 1.117 25148 477 1 . 1 1 88 88 MET HA H 88 4.770 4.770 4.695 0.075 25148 478 1 . 1 1 88 88 MET C C 88 175.638 175.638 173.968 1.670 25148 479 1 . 1 1 88 88 MET CA C 88 53.133 53.133 54.592 -1.459 25148 480 1 . 1 1 88 88 MET CB C 88 37.102 37.102 35.535 1.567 25148 481 1 . 1 1 88 88 MET H H 88 9.023 9.023 8.306 0.717 25148 482 1 . 1 1 89 89 VAL N N 89 120.157 120.157 124.223 -4.066 25148 483 1 . 1 1 89 89 VAL HA H 89 3.330 3.330 3.742 -0.412 25148 484 1 . 1 1 89 89 VAL C C 89 177.432 177.432 177.035 0.397 25148 485 1 . 1 1 89 89 VAL CA C 89 65.675 65.675 64.322 1.353 25148 486 1 . 1 1 89 89 VAL CB C 89 31.321 31.321 30.591 0.730 25148 487 1 . 1 1 89 89 VAL H H 89 8.313 8.313 8.599 -0.286 25148 488 1 . 1 1 90 90 GLY N N 90 116.935 116.935 116.136 0.799 25148 489 1 . 1 1 90 90 GLY C C 90 175.196 175.196 174.302 0.895 25148 490 1 . 1 1 90 90 GLY CA C 90 44.685 44.685 44.777 -0.092 25148 491 1 . 1 1 90 90 GLY H H 90 8.551 8.551 8.966 -0.415 25148 492 1 . 1 1 91 91 ASP N N 91 121.616 121.616 121.954 -0.338 25148 493 1 . 1 1 91 91 ASP HA H 91 4.790 4.790 4.924 -0.134 25148 494 1 . 1 1 91 91 ASP C C 91 174.431 174.431 174.995 -0.564 25148 495 1 . 1 1 91 91 ASP CA C 91 55.011 55.011 53.816 1.195 25148 496 1 . 1 1 91 91 ASP CB C 91 42.079 42.079 42.534 -0.455 25148 497 1 . 1 1 91 91 ASP H H 91 8.073 8.073 8.050 0.023 25148 498 1 . 1 1 92 92 VAL N N 92 118.919 118.919 114.571 4.348 25148 499 1 . 1 1 92 92 VAL HA H 92 4.709 4.709 4.950 -0.241 25148 500 1 . 1 1 92 92 VAL C C 92 175.602 175.602 174.258 1.344 25148 501 1 . 1 1 92 92 VAL CA C 92 61.527 61.527 59.863 1.664 25148 502 1 . 1 1 92 92 VAL CB C 92 34.110 34.110 35.091 -0.981 25148 503 1 . 1 1 92 92 VAL H H 92 8.216 8.216 8.073 0.143 25148 504 1 . 1 1 93 93 VAL N N 93 123.922 123.922 122.933 0.989 25148 505 1 . 1 1 93 93 VAL HA H 93 4.231 4.231 4.243 -0.012 25148 506 1 . 1 1 93 93 VAL C C 93 174.105 174.105 174.176 -0.071 25148 507 1 . 1 1 93 93 VAL CA C 93 59.644 59.644 59.421 0.223 25148 508 1 . 1 1 93 93 VAL CB C 93 34.661 34.661 35.018 -0.357 25148 509 1 . 1 1 93 93 VAL H H 93 8.812 8.812 7.962 0.850 25148 510 1 . 1 1 94 94 GLU N N 94 123.605 123.605 128.270 -4.665 25148 511 1 . 1 1 94 94 GLU HA H 94 5.347 5.347 5.140 0.207 25148 512 1 . 1 1 94 94 GLU C C 94 175.708 175.708 175.591 0.117 25148 513 1 . 1 1 94 94 GLU CA C 94 54.979 54.979 55.132 -0.153 25148 514 1 . 1 1 94 94 GLU CB C 94 31.612 31.612 31.607 0.005 25148 515 1 . 1 1 94 94 GLU H H 94 8.312 8.312 8.427 -0.115 25148 516 1 . 1 1 95 95 ILE N N 95 123.581 123.581 124.013 -0.432 25148 517 1 . 1 1 95 95 ILE HA H 95 4.601 4.601 4.497 0.104 25148 518 1 . 1 1 95 95 ILE C C 95 175.081 175.081 175.417 -0.336 25148 519 1 . 1 1 95 95 ILE CA C 95 58.601 58.601 59.676 -1.075 25148 520 1 . 1 1 95 95 ILE CB C 95 41.727 41.727 41.824 -0.097 25148 521 1 . 1 1 95 95 ILE H H 95 9.045 9.045 8.169 0.876 25148 522 1 . 1 1 96 96 GLU N N 96 128.094 128.094 127.707 0.387 25148 523 1 . 1 1 96 96 GLU HA H 96 4.098 4.098 4.212 -0.114 25148 524 1 . 1 1 96 96 GLU C C 96 176.845 176.845 175.752 1.093 25148 525 1 . 1 1 96 96 GLU CA C 96 57.853 57.853 58.137 -0.284 25148 526 1 . 1 1 96 96 GLU CB C 96 28.323 28.323 29.336 -1.013 25148 527 1 . 1 1 96 96 GLU H H 96 9.256 9.256 8.931 0.325 25148 528 1 . 1 1 97 97 VAL N N 97 118.446 118.446 124.286 -5.840 25148 529 1 . 1 1 97 97 VAL HA H 97 4.568 4.568 4.225 0.343 25148 530 1 . 1 1 97 97 VAL C C 97 175.051 175.051 174.881 0.170 25148 531 1 . 1 1 97 97 VAL CA C 97 59.796 59.796 61.033 -1.237 25148 532 1 . 1 1 97 97 VAL CB C 97 32.399 32.399 33.178 -0.779 25148 533 1 . 1 1 97 97 VAL H H 97 8.609 8.609 8.813 -0.204 25148 534 1 . 1 1 98 98 THR N N 98 119.118 119.118 118.066 1.052 25148 535 1 . 1 1 98 98 THR HA H 98 3.320 3.320 3.954 -0.634 25148 536 1 . 1 1 98 98 THR CA C 98 61.628 61.628 59.460 2.168 25148 537 1 . 1 1 98 98 THR CB C 98 70.031 70.031 69.302 0.729 25148 538 1 . 1 1 98 98 THR H H 98 7.396 7.396 7.432 -0.036 25148 539 1 . 1 1 99 99 PRO HA H 99 4.458 4.458 4.612 -0.154 25148 540 1 . 1 1 99 99 PRO CA C 99 62.348 62.348 62.462 -0.114 25148 541 1 . 1 1 99 99 PRO CB C 99 33.182 33.182 32.621 0.561 25148 542 1 . 1 1 100 100 LYS HA H 100 4.126 4.126 4.166 -0.040 25148 543 1 . 1 1 100 100 LYS CA C 100 58.773 58.773 57.915 0.858 25148 544 1 . 1 1 100 100 LYS CB C 100 32.195 32.195 32.260 -0.065 25148 545 1 . 1 1 101 101 ASP HA H 101 4.924 4.924 4.781 0.143 25148 546 1 . 1 1 101 101 ASP C C 101 176.884 176.884 176.602 0.282 25148 547 1 . 1 1 101 101 ASP CA C 101 54.134 54.134 53.724 0.410 25148 548 1 . 1 1 101 101 ASP CB C 101 40.272 40.272 40.679 -0.407 25148 549 1 . 1 1 102 102 PHE N N 102 118.703 118.703 121.447 -2.744 25148 550 1 . 1 1 102 102 PHE HA H 102 4.295 4.295 4.217 0.078 25148 551 1 . 1 1 102 102 PHE C C 102 176.477 176.477 177.105 -0.628 25148 552 1 . 1 1 102 102 PHE CA C 102 60.748 60.748 60.123 0.625 25148 553 1 . 1 1 102 102 PHE CB C 102 39.667 39.667 39.193 0.474 25148 554 1 . 1 1 102 102 PHE H H 102 7.862 7.862 7.706 0.156 25148 555 1 . 1 1 103 103 GLY CA C 103 47.430 47.430 47.283 0.147 25148 556 1 . 1 1 104 104 ARG N N 104 121.819 121.819 120.968 0.851 25148 557 1 . 1 1 104 104 ARG HA H 104 4.176 4.176 4.180 -0.004 25148 558 1 . 1 1 104 104 ARG C C 104 178.912 178.912 178.463 0.449 25148 559 1 . 1 1 104 104 ARG CA C 104 59.235 59.235 58.027 1.208 25148 560 1 . 1 1 104 104 ARG CB C 104 30.000 30.000 30.163 -0.163 25148 561 1 . 1 1 104 104 ARG H H 104 7.809 7.809 7.496 0.313 25148 562 1 . 1 1 105 105 ILE N N 105 120.331 120.331 120.746 -0.415 25148 563 1 . 1 1 105 105 ILE HA H 105 3.836 3.836 3.615 0.221 25148 564 1 . 1 1 105 105 ILE C C 105 179.206 179.206 177.563 1.643 25148 565 1 . 1 1 105 105 ILE CA C 105 63.025 63.025 64.757 -1.732 25148 566 1 . 1 1 105 105 ILE CB C 105 38.127 38.127 37.378 0.749 25148 567 1 . 1 1 105 105 ILE H H 105 7.203 7.203 7.426 -0.223 25148 568 1 . 1 1 106 106 ALA N N 106 124.867 124.867 122.059 2.808 25148 569 1 . 1 1 106 106 ALA HA H 106 3.665 3.665 3.569 0.096 25148 570 1 . 1 1 106 106 ALA C C 106 178.590 178.590 179.001 -0.411 25148 571 1 . 1 1 106 106 ALA CA C 106 54.842 54.842 55.249 -0.407 25148 572 1 . 1 1 106 106 ALA CB C 106 18.659 18.659 17.756 0.903 25148 573 1 . 1 1 106 106 ALA H H 106 8.813 8.813 8.206 0.607 25148 574 1 . 1 1 107 107 ALA N N 107 119.597 119.597 120.409 -0.812 25148 575 1 . 1 1 107 107 ALA HA H 107 4.014 4.014 3.998 0.016 25148 576 1 . 1 1 107 107 ALA C C 107 180.214 180.214 179.532 0.682 25148 577 1 . 1 1 107 107 ALA CA C 107 55.454 55.454 54.662 0.792 25148 578 1 . 1 1 107 107 ALA CB C 107 18.260 18.260 18.084 0.176 25148 579 1 . 1 1 107 107 ALA H H 107 8.012 8.012 7.584 0.427 25148 580 1 . 1 1 108 108 GLN N N 108 116.896 116.896 118.372 -1.476 25148 581 1 . 1 1 108 108 GLN HA H 108 4.054 4.054 4.003 0.051 25148 582 1 . 1 1 108 108 GLN C C 108 178.784 178.784 178.391 0.393 25148 583 1 . 1 1 108 108 GLN CA C 108 58.705 58.705 58.969 -0.264 25148 584 1 . 1 1 108 108 GLN CB C 108 28.647 28.647 28.728 -0.081 25148 585 1 . 1 1 108 108 GLN H H 108 7.498 7.498 8.166 -0.667 25148 586 1 . 1 1 109 109 THR N N 109 117.495 117.495 115.535 1.960 25148 587 1 . 1 1 109 109 THR HA H 109 3.917 3.917 4.253 -0.336 25148 588 1 . 1 1 109 109 THR C C 109 175.732 175.732 175.891 -0.159 25148 589 1 . 1 1 109 109 THR CA C 109 66.989 66.989 65.535 1.454 25148 590 1 . 1 1 109 109 THR CB C 109 68.766 68.766 68.683 0.083 25148 591 1 . 1 1 109 109 THR H H 109 8.203 8.203 8.207 -0.004 25148 592 1 . 1 1 110 110 ALA N N 110 122.308 122.308 124.856 -2.548 25148 593 1 . 1 1 110 110 ALA HA H 110 3.854 3.854 4.043 -0.189 25148 594 1 . 1 1 110 110 ALA C C 110 178.380 178.380 178.807 -0.427 25148 595 1 . 1 1 110 110 ALA CA C 110 55.903 55.903 54.961 0.942 25148 596 1 . 1 1 110 110 ALA CB C 110 18.524 18.524 18.338 0.186 25148 597 1 . 1 1 110 110 ALA H H 110 8.668 8.668 7.878 0.790 25148 598 1 . 1 1 111 111 LYS N N 111 115.552 115.552 118.011 -2.459 25148 599 1 . 1 1 111 111 LYS HA H 111 3.923 3.923 3.967 -0.044 25148 600 1 . 1 1 111 111 LYS C C 111 179.111 179.111 178.682 0.429 25148 601 1 . 1 1 111 111 LYS CA C 111 59.825 59.825 59.265 0.560 25148 602 1 . 1 1 111 111 LYS CB C 111 32.251 32.251 31.821 0.430 25148 603 1 . 1 1 111 111 LYS H H 111 7.642 7.642 8.386 -0.744 25148 604 1 . 1 1 112 112 GLN N N 112 120.178 120.178 118.691 1.487 25148 605 1 . 1 1 112 112 GLN HA H 112 4.060 4.060 4.129 -0.069 25148 606 1 . 1 1 112 112 GLN C C 112 178.355 178.355 178.197 0.158 25148 607 1 . 1 1 112 112 GLN CA C 112 59.240 59.240 58.225 1.015 25148 608 1 . 1 1 112 112 GLN CB C 112 28.250 28.250 28.470 -0.220 25148 609 1 . 1 1 112 112 GLN H H 112 7.798 7.798 7.637 0.161 25148 610 1 . 1 1 113 113 VAL N N 113 119.799 119.799 120.678 -0.879 25148 611 1 . 1 1 113 113 VAL HA H 113 3.705 3.705 3.868 -0.163 25148 612 1 . 1 1 113 113 VAL C C 113 178.303 178.303 178.029 0.274 25148 613 1 . 1 1 113 113 VAL CA C 113 66.277 66.277 65.808 0.469 25148 614 1 . 1 1 113 113 VAL CB C 113 31.954 31.954 31.780 0.174 25148 615 1 . 1 1 113 113 VAL H H 113 8.105 8.105 7.476 0.629 25148 616 1 . 1 1 114 114 VAL N N 114 118.265 118.265 116.773 1.492 25148 617 1 . 1 1 114 114 VAL HA H 114 3.392 3.392 3.646 -0.254 25148 618 1 . 1 1 114 114 VAL C C 114 177.360 177.360 177.893 -0.533 25148 619 1 . 1 1 114 114 VAL CA C 114 67.832 67.832 66.716 1.116 25148 620 1 . 1 1 114 114 VAL CB C 114 31.801 31.801 30.917 0.884 25148 621 1 . 1 1 114 114 VAL H H 114 8.180 8.180 8.112 0.068 25148 622 1 . 1 1 115 115 THR N N 115 113.460 113.460 114.985 -1.525 25148 623 1 . 1 1 115 115 THR HA H 115 3.856 3.856 3.992 -0.136 25148 624 1 . 1 1 115 115 THR C C 115 176.529 176.529 176.654 -0.125 25148 625 1 . 1 1 115 115 THR CA C 115 66.706 66.706 66.472 0.234 25148 626 1 . 1 1 115 115 THR CB C 115 69.008 69.008 68.448 0.560 25148 627 1 . 1 1 115 115 THR H H 115 8.143 8.143 7.754 0.389 25148 628 1 . 1 1 116 116 GLN N N 116 120.129 120.129 120.640 -0.511 25148 629 1 . 1 1 116 116 GLN HA H 116 4.054 4.054 4.060 -0.006 25148 630 1 . 1 1 116 116 GLN C C 116 178.100 178.100 178.419 -0.319 25148 631 1 . 1 1 116 116 GLN CA C 116 58.950 58.950 59.189 -0.239 25148 632 1 . 1 1 116 116 GLN CB C 116 28.244 28.244 28.539 -0.295 25148 633 1 . 1 1 116 116 GLN H H 116 7.936 7.936 7.527 0.409 25148 634 1 . 1 1 117 117 ARG N N 117 117.838 117.838 119.373 -1.535 25148 635 1 . 1 1 117 117 ARG HA H 117 4.174 4.174 4.096 0.078 25148 636 1 . 1 1 117 117 ARG C C 117 179.138 179.138 178.741 0.397 25148 637 1 . 1 1 117 117 ARG CA C 117 57.461 57.461 58.220 -0.759 25148 638 1 . 1 1 117 117 ARG CB C 117 29.548 29.548 29.396 0.152 25148 639 1 . 1 1 117 117 ARG H H 117 8.240 8.240 7.979 0.261 25148 640 1 . 1 1 118 118 VAL N N 118 120.278 120.278 119.311 0.967 25148 641 1 . 1 1 118 118 VAL HA H 118 3.709 3.709 3.677 0.032 25148 642 1 . 1 1 118 118 VAL C C 118 177.597 177.597 177.925 -0.328 25148 643 1 . 1 1 118 118 VAL CA C 118 66.246 66.246 66.326 -0.080 25148 644 1 . 1 1 118 118 VAL CB C 118 31.785 31.785 31.073 0.712 25148 645 1 . 1 1 118 118 VAL H H 118 8.480 8.480 7.745 0.735 25148 646 1 . 1 1 119 119 ARG N N 119 120.197 120.197 119.103 1.094 25148 647 1 . 1 1 119 119 ARG HA H 119 4.173 4.173 4.149 0.024 25148 648 1 . 1 1 119 119 ARG C C 119 178.864 178.864 178.812 0.052 25148 649 1 . 1 1 119 119 ARG CA C 119 58.772 58.772 59.179 -0.407 25148 650 1 . 1 1 119 119 ARG CB C 119 29.873 29.873 29.825 0.048 25148 651 1 . 1 1 119 119 ARG H H 119 7.899 7.899 7.679 0.220 25148 652 1 . 1 1 120 120 GLU N N 120 118.768 118.768 119.537 -0.769 25148 653 1 . 1 1 120 120 GLU HA H 120 4.110 4.110 4.069 0.041 25148 654 1 . 1 1 120 120 GLU C C 120 177.823 177.823 178.841 -1.018 25148 655 1 . 1 1 120 120 GLU CA C 120 58.223 58.223 59.051 -0.828 25148 656 1 . 1 1 120 120 GLU CB C 120 29.854 29.854 29.429 0.425 25148 657 1 . 1 1 120 120 GLU H H 120 8.084 8.084 7.916 0.168 25148 658 1 . 1 1 121 121 ALA N N 121 121.984 121.984 121.436 0.548 25148 659 1 . 1 1 121 121 ALA HA H 121 4.296 4.296 4.067 0.229 25148 660 1 . 1 1 121 121 ALA C C 121 178.586 178.586 179.491 -0.905 25148 661 1 . 1 1 121 121 ALA CA C 121 53.475 53.475 54.983 -1.508 25148 662 1 . 1 1 121 121 ALA CB C 121 18.856 18.856 18.471 0.385 25148 663 1 . 1 1 121 121 ALA H H 121 7.810 7.810 8.250 -0.440 25148 664 1 . 1 1 122 122 GLU N N 122 118.229 118.229 117.014 1.215 25148 665 1 . 1 1 122 122 GLU HA H 122 4.241 4.241 4.140 0.101 25148 666 1 . 1 1 122 122 GLU C C 122 176.839 176.839 178.297 -1.458 25148 667 1 . 1 1 122 122 GLU CA C 122 57.118 57.118 57.837 -0.719 25148 668 1 . 1 1 122 122 GLU CB C 122 30.018 30.018 29.391 0.627 25148 669 1 . 1 1 122 122 GLU H H 122 7.938 7.938 7.845 0.093 25148 670 1 . 1 1 123 123 ARG N N 123 120.601 120.601 119.613 0.988 25148 671 1 . 1 1 123 123 ARG HA H 123 4.348 4.348 4.204 0.144 25148 672 1 . 1 1 123 123 ARG C C 123 176.071 176.071 176.605 -0.534 25148 673 1 . 1 1 123 123 ARG CA C 123 56.510 56.510 57.045 -0.535 25148 674 1 . 1 1 123 123 ARG CB C 123 30.765 30.765 30.837 -0.072 25148 675 1 . 1 1 123 123 ARG H H 123 7.977 7.977 7.916 0.061 25148 stop_ save_