data_18703 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 18703 _Entry.PDB_ID 2LXY 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 18703 _Entity_delta_chem_shifts.ID 1 loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Conformer_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 1 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.487 -0.241 18703 2 1 1 . 1 1 3 3 ARG C C 3 178.379 178.379 177.349 1.030 18703 3 1 1 . 1 1 3 3 ARG CA C 3 58.367 58.367 57.017 1.350 18703 4 1 1 . 1 1 3 3 ARG CB C 3 30.691 30.691 30.859 -0.168 18703 5 1 1 . 1 1 3 3 ARG H H 3 7.905 7.905 7.830 0.075 18703 6 1 1 . 1 1 4 4 VAL N N 4 118.966 118.966 121.003 -2.037 18703 7 1 1 . 1 1 4 4 VAL HA H 4 3.803 3.803 3.941 -0.138 18703 8 1 1 . 1 1 4 4 VAL C C 4 176.968 176.968 177.118 -0.150 18703 9 1 1 . 1 1 4 4 VAL CA C 4 65.441 65.441 65.203 0.238 18703 10 1 1 . 1 1 4 4 VAL CB C 4 31.710 31.710 31.785 -0.075 18703 11 1 1 . 1 1 4 4 VAL H H 4 8.070 8.070 8.237 -0.167 18703 12 1 1 . 1 1 5 5 LYS N N 5 122.058 122.058 121.131 0.927 18703 13 1 1 . 1 1 5 5 LYS HA H 5 4.154 4.154 4.093 0.061 18703 14 1 1 . 1 1 5 5 LYS C C 5 178.553 178.553 178.288 0.265 18703 15 1 1 . 1 1 5 5 LYS CA C 5 58.712 58.712 58.678 0.034 18703 16 1 1 . 1 1 5 5 LYS CB C 5 31.788 31.788 31.932 -0.144 18703 17 1 1 . 1 1 5 5 LYS H H 5 7.798 7.798 8.390 -0.592 18703 18 1 1 . 1 1 6 6 ALA N N 6 119.955 119.955 119.162 0.793 18703 19 1 1 . 1 1 6 6 ALA HA H 6 4.198 4.198 4.271 -0.073 18703 20 1 1 . 1 1 6 6 ALA C C 6 180.974 180.974 179.265 1.709 18703 21 1 1 . 1 1 6 6 ALA CA C 6 54.850 54.850 54.032 0.818 18703 22 1 1 . 1 1 6 6 ALA CB C 6 17.995 17.995 18.291 -0.296 18703 23 1 1 . 1 1 6 6 ALA H H 6 7.928 7.928 8.105 -0.177 18703 24 1 1 . 1 1 7 7 LEU N N 7 119.211 119.211 120.480 -1.269 18703 25 1 1 . 1 1 7 7 LEU HA H 7 4.124 4.124 3.894 0.230 18703 26 1 1 . 1 1 7 7 LEU C C 7 178.353 178.353 178.609 -0.256 18703 27 1 1 . 1 1 7 7 LEU CA C 7 57.658 57.658 57.744 -0.086 18703 28 1 1 . 1 1 7 7 LEU CB C 7 41.971 41.971 42.020 -0.049 18703 29 1 1 . 1 1 7 7 LEU H H 7 7.594 7.594 7.351 0.243 18703 30 1 1 . 1 1 8 8 GLU N N 8 120.258 120.258 117.420 2.838 18703 31 1 1 . 1 1 8 8 GLU HA H 8 3.846 3.846 3.923 -0.077 18703 32 1 1 . 1 1 8 8 GLU C C 8 179.546 179.546 178.947 0.599 18703 33 1 1 . 1 1 8 8 GLU CA C 8 60.006 60.006 59.584 0.422 18703 34 1 1 . 1 1 8 8 GLU CB C 8 29.683 29.683 29.483 0.200 18703 35 1 1 . 1 1 8 8 GLU H H 8 8.382 8.382 7.791 0.591 18703 36 1 1 . 1 1 9 9 GLU N N 9 118.584 118.584 117.243 1.341 18703 37 1 1 . 1 1 9 9 GLU HA H 9 4.039 4.039 4.168 -0.129 18703 38 1 1 . 1 1 9 9 GLU C C 9 179.635 179.635 178.580 1.055 18703 39 1 1 . 1 1 9 9 GLU CA C 9 59.235 59.235 58.413 0.822 18703 40 1 1 . 1 1 9 9 GLU CB C 9 29.358 29.358 29.213 0.145 18703 41 1 1 . 1 1 9 9 GLU H H 9 7.908 7.908 8.100 -0.192 18703 42 1 1 . 1 1 10 10 LYS N N 10 120.956 120.956 120.553 0.403 18703 43 1 1 . 1 1 10 10 LYS HA H 10 4.190 4.190 4.082 0.108 18703 44 1 1 . 1 1 10 10 LYS C C 10 179.395 179.395 178.835 0.560 18703 45 1 1 . 1 1 10 10 LYS CA C 10 59.231 59.231 59.428 -0.197 18703 46 1 1 . 1 1 10 10 LYS CB C 10 32.211 32.211 32.708 -0.497 18703 47 1 1 . 1 1 10 10 LYS H H 10 8.009 8.009 7.413 0.596 18703 48 1 1 . 1 1 11 11 VAL N N 11 119.577 119.577 118.249 1.328 18703 49 1 1 . 1 1 11 11 VAL HA H 11 3.844 3.844 3.682 0.162 18703 50 1 1 . 1 1 11 11 VAL C C 11 177.078 177.078 177.259 -0.181 18703 51 1 1 . 1 1 11 11 VAL CA C 11 66.407 66.407 66.191 0.216 18703 52 1 1 . 1 1 11 11 VAL CB C 11 31.252 31.252 31.449 -0.197 18703 53 1 1 . 1 1 11 11 VAL H H 11 8.488 8.488 7.533 0.955 18703 54 1 1 . 1 1 12 12 LYS N N 12 122.864 122.864 120.019 2.845 18703 55 1 1 . 1 1 12 12 LYS HA H 12 4.189 4.189 4.001 0.188 18703 56 1 1 . 1 1 12 12 LYS C C 12 178.755 178.755 178.370 0.385 18703 57 1 1 . 1 1 12 12 LYS CA C 12 59.375 59.375 59.312 0.063 18703 58 1 1 . 1 1 12 12 LYS CB C 12 31.991 31.991 32.094 -0.103 18703 59 1 1 . 1 1 12 12 LYS H H 12 7.944 7.944 7.618 0.326 18703 60 1 1 . 1 1 13 13 ALA N N 13 121.202 121.202 120.474 0.728 18703 61 1 1 . 1 1 13 13 ALA HA H 13 4.209 4.209 4.268 -0.059 18703 62 1 1 . 1 1 13 13 ALA C C 13 181.060 181.060 179.641 1.419 18703 63 1 1 . 1 1 13 13 ALA CA C 13 54.710 54.710 54.176 0.534 18703 64 1 1 . 1 1 13 13 ALA CB C 13 17.861 17.861 18.358 -0.497 18703 65 1 1 . 1 1 13 13 ALA H H 13 7.563 7.563 7.461 0.102 18703 66 1 1 . 1 1 14 14 LEU N N 14 120.014 120.014 119.760 0.254 18703 67 1 1 . 1 1 14 14 LEU HA H 14 4.072 4.072 4.014 0.058 18703 68 1 1 . 1 1 14 14 LEU C C 14 177.862 177.862 178.108 -0.246 18703 69 1 1 . 1 1 14 14 LEU CA C 14 57.864 57.864 57.509 0.355 18703 70 1 1 . 1 1 14 14 LEU CB C 14 41.539 41.539 42.160 -0.621 18703 71 1 1 . 1 1 14 14 LEU H H 14 8.087 8.087 7.520 0.567 18703 72 1 1 . 1 1 15 15 GLU N N 15 121.644 121.644 120.048 1.596 18703 73 1 1 . 1 1 15 15 GLU HA H 15 3.692 3.692 4.011 -0.319 18703 74 1 1 . 1 1 15 15 GLU C C 15 177.819 177.819 178.282 -0.463 18703 75 1 1 . 1 1 15 15 GLU CA C 15 59.239 59.239 59.263 -0.024 18703 76 1 1 . 1 1 15 15 GLU CB C 15 28.865 28.865 29.547 -0.682 18703 77 1 1 . 1 1 15 15 GLU H H 15 8.542 8.542 7.673 0.869 18703 78 1 1 . 1 1 16 16 GLU N N 16 116.016 116.016 118.429 -2.413 18703 79 1 1 . 1 1 16 16 GLU HA H 16 3.955 3.955 3.996 -0.041 18703 80 1 1 . 1 1 16 16 GLU C C 16 179.159 179.159 178.818 0.341 18703 81 1 1 . 1 1 16 16 GLU CA C 16 59.324 59.324 59.248 0.076 18703 82 1 1 . 1 1 16 16 GLU CB C 16 29.060 29.060 29.340 -0.280 18703 83 1 1 . 1 1 16 16 GLU H H 16 7.492 7.492 7.939 -0.447 18703 84 1 1 . 1 1 17 17 LYS N N 17 118.546 118.546 119.179 -0.633 18703 85 1 1 . 1 1 17 17 LYS HA H 17 4.117 4.117 4.133 -0.016 18703 86 1 1 . 1 1 17 17 LYS C C 17 178.976 178.976 178.775 0.201 18703 87 1 1 . 1 1 17 17 LYS CA C 17 58.837 58.837 59.043 -0.206 18703 88 1 1 . 1 1 17 17 LYS CB C 17 32.538 32.538 32.512 0.026 18703 89 1 1 . 1 1 17 17 LYS H H 17 7.720 7.720 7.459 0.261 18703 90 1 1 . 1 1 18 18 VAL N N 18 118.376 118.376 119.423 -1.047 18703 91 1 1 . 1 1 18 18 VAL HA H 18 3.711 3.711 3.648 0.063 18703 92 1 1 . 1 1 18 18 VAL C C 18 178.765 178.765 178.704 0.061 18703 93 1 1 . 1 1 18 18 VAL CA C 18 66.237 66.237 66.527 -0.290 18703 94 1 1 . 1 1 18 18 VAL CB C 18 31.682 31.682 31.674 0.008 18703 95 1 1 . 1 1 18 18 VAL H H 18 8.754 8.754 7.454 1.300 18703 96 1 1 . 1 1 19 19 LYS N N 19 118.817 118.817 120.668 -1.851 18703 97 1 1 . 1 1 19 19 LYS HA H 19 4.078 4.078 4.007 0.071 18703 98 1 1 . 1 1 19 19 LYS C C 19 178.049 178.049 177.663 0.386 18703 99 1 1 . 1 1 19 19 LYS CA C 19 59.731 59.731 59.220 0.511 18703 100 1 1 . 1 1 19 19 LYS CB C 19 32.523 32.523 32.095 0.428 18703 101 1 1 . 1 1 19 19 LYS H H 19 8.299 8.299 8.513 -0.214 18703 102 1 1 . 1 1 20 20 ALA N N 20 119.656 119.656 118.770 0.886 18703 103 1 1 . 1 1 20 20 ALA HA H 20 4.347 4.347 4.382 -0.035 18703 104 1 1 . 1 1 20 20 ALA C C 20 178.532 178.532 177.859 0.673 18703 105 1 1 . 1 1 20 20 ALA CA C 20 52.853 52.853 52.156 0.697 18703 106 1 1 . 1 1 20 20 ALA CB C 20 18.832 18.832 19.241 -0.408 18703 107 1 1 . 1 1 20 20 ALA H H 20 7.425 7.425 7.511 -0.086 18703 108 1 1 . 1 1 21 21 LEU N N 21 118.594 118.594 119.319 -0.725 18703 109 1 1 . 1 1 21 21 LEU HA H 21 4.297 4.297 4.332 -0.035 18703 110 1 1 . 1 1 21 21 LEU C C 21 177.784 177.784 176.606 1.178 18703 111 1 1 . 1 1 21 21 LEU CA C 21 55.750 55.750 55.001 0.749 18703 112 1 1 . 1 1 21 21 LEU CB C 21 42.898 42.898 43.178 -0.280 18703 113 1 1 . 1 1 21 21 LEU H H 21 7.508 7.508 7.786 -0.278 18703 114 1 1 . 1 1 22 22 GLY N N 22 106.650 106.650 105.480 1.170 18703 115 1 1 . 1 1 22 22 GLY C C 22 173.605 173.605 172.739 0.866 18703 116 1 1 . 1 1 22 22 GLY CA C 22 45.330 45.330 44.905 0.425 18703 117 1 1 . 1 1 22 22 GLY H H 22 7.814 7.814 8.483 -0.669 18703 118 1 1 . 1 1 23 23 GLY N N 23 108.011 108.011 108.235 -0.224 18703 119 1 1 . 1 1 23 23 GLY C C 23 174.061 174.061 173.192 0.869 18703 120 1 1 . 1 1 23 23 GLY CA C 23 44.772 44.772 44.456 0.316 18703 121 1 1 . 1 1 23 23 GLY H H 23 8.139 8.139 7.889 0.250 18703 122 1 1 . 1 1 24 24 GLY N N 24 107.826 107.826 106.182 1.644 18703 123 1 1 . 1 1 24 24 GLY C C 24 175.046 175.046 174.104 0.942 18703 124 1 1 . 1 1 24 24 GLY CA C 24 44.422 44.422 43.575 0.847 18703 125 1 1 . 1 1 24 24 GLY H H 24 8.497 8.497 8.422 0.075 18703 126 1 1 . 1 1 25 25 GLY N N 25 108.830 108.830 107.803 1.027 18703 127 1 1 . 1 1 25 25 GLY C C 25 176.272 176.272 176.173 0.099 18703 128 1 1 . 1 1 25 25 GLY CA C 25 47.101 47.101 45.647 1.454 18703 129 1 1 . 1 1 25 25 GLY H H 25 8.616 8.616 8.249 0.367 18703 130 1 1 . 1 1 26 26 ARG N N 26 123.109 123.109 125.264 -2.155 18703 131 1 1 . 1 1 26 26 ARG HA H 26 4.283 4.283 4.211 0.072 18703 132 1 1 . 1 1 26 26 ARG C C 26 177.848 177.848 177.684 0.164 18703 133 1 1 . 1 1 26 26 ARG CA C 26 57.663 57.663 58.163 -0.500 18703 134 1 1 . 1 1 26 26 ARG CB C 26 29.811 29.811 29.716 0.095 18703 135 1 1 . 1 1 26 26 ARG H H 26 8.770 8.770 8.547 0.223 18703 136 1 1 . 1 1 27 27 ILE N N 27 118.104 118.104 119.921 -1.817 18703 137 1 1 . 1 1 27 27 ILE HA H 27 3.787 3.787 3.833 -0.046 18703 138 1 1 . 1 1 27 27 ILE C C 27 177.473 177.473 177.745 -0.272 18703 139 1 1 . 1 1 27 27 ILE CA C 27 63.036 63.036 64.168 -1.132 18703 140 1 1 . 1 1 27 27 ILE CB C 27 36.664 36.664 37.664 -1.000 18703 141 1 1 . 1 1 27 27 ILE H H 27 7.708 7.708 7.727 -0.019 18703 142 1 1 . 1 1 28 28 GLU N N 28 119.934 119.934 119.993 -0.059 18703 143 1 1 . 1 1 28 28 GLU HA H 28 3.954 3.954 3.931 0.023 18703 144 1 1 . 1 1 28 28 GLU C C 28 179.514 179.514 178.606 0.908 18703 145 1 1 . 1 1 28 28 GLU CA C 28 59.450 59.450 59.965 -0.515 18703 146 1 1 . 1 1 28 28 GLU CB C 28 29.600 29.600 29.317 0.283 18703 147 1 1 . 1 1 28 28 GLU H H 28 7.872 7.872 7.629 0.243 18703 148 1 1 . 1 1 29 29 GLU N N 29 118.134 118.134 119.672 -1.538 18703 149 1 1 . 1 1 29 29 GLU HA H 29 4.028 4.028 4.099 -0.071 18703 150 1 1 . 1 1 29 29 GLU C C 29 179.182 179.182 179.254 -0.072 18703 151 1 1 . 1 1 29 29 GLU CA C 29 59.173 59.173 59.204 -0.031 18703 152 1 1 . 1 1 29 29 GLU CB C 29 29.503 29.503 29.482 0.021 18703 153 1 1 . 1 1 29 29 GLU H H 29 8.166 8.166 7.593 0.573 18703 154 1 1 . 1 1 30 30 LEU N N 30 120.242 120.242 117.763 2.479 18703 155 1 1 . 1 1 30 30 LEU HA H 30 4.028 4.028 4.103 -0.075 18703 156 1 1 . 1 1 30 30 LEU C C 30 178.796 178.796 178.811 -0.015 18703 157 1 1 . 1 1 30 30 LEU CA C 30 57.654 57.654 56.634 1.020 18703 158 1 1 . 1 1 30 30 LEU CB C 30 41.629 41.629 41.788 -0.158 18703 159 1 1 . 1 1 30 30 LEU H H 30 7.695 7.695 7.627 0.068 18703 160 1 1 . 1 1 31 31 LYS N N 31 120.506 120.506 120.424 0.082 18703 161 1 1 . 1 1 31 31 LYS HA H 31 3.532 3.532 4.043 -0.511 18703 162 1 1 . 1 1 31 31 LYS C C 31 178.919 178.919 178.300 0.619 18703 163 1 1 . 1 1 31 31 LYS CA C 31 60.240 60.240 59.307 0.933 18703 164 1 1 . 1 1 31 31 LYS CB C 31 32.015 32.015 32.275 -0.260 18703 165 1 1 . 1 1 31 31 LYS H H 31 8.561 8.561 7.567 0.994 18703 166 1 1 . 1 1 32 32 LYS N N 32 118.566 118.566 118.892 -0.326 18703 167 1 1 . 1 1 32 32 LYS C C 32 179.392 179.392 179.329 0.063 18703 168 1 1 . 1 1 32 32 LYS CA C 32 59.356 59.356 59.771 -0.415 18703 169 1 1 . 1 1 32 32 LYS CB C 32 32.117 32.117 32.394 -0.277 18703 170 1 1 . 1 1 32 32 LYS H H 32 7.699 7.699 7.550 0.149 18703 171 1 1 . 1 1 33 33 LYS N N 33 118.964 118.964 118.216 0.748 18703 172 1 1 . 1 1 33 33 LYS HA H 33 4.117 4.117 4.473 -0.356 18703 173 1 1 . 1 1 33 33 LYS C C 33 178.355 178.355 178.907 -0.552 18703 174 1 1 . 1 1 33 33 LYS CA C 33 58.633 58.633 58.343 0.291 18703 175 1 1 . 1 1 33 33 LYS CB C 33 31.904 31.904 32.165 -0.261 18703 176 1 1 . 1 1 33 33 LYS H H 33 7.752 7.752 7.609 0.143 18703 177 1 1 . 1 1 34 34 CYS N N 34 119.956 119.956 118.885 1.071 18703 178 1 1 . 1 1 34 34 CYS HA H 34 3.967 3.967 4.128 -0.161 18703 179 1 1 . 1 1 34 34 CYS C C 34 175.521 175.521 176.704 -1.183 18703 180 1 1 . 1 1 34 34 CYS CA C 34 60.987 60.987 63.044 -2.057 18703 181 1 1 . 1 1 34 34 CYS CB C 34 36.600 36.600 26.727 9.873 18703 182 1 1 . 1 1 34 34 CYS H H 34 8.393 8.393 7.577 0.816 18703 183 1 1 . 1 1 35 35 GLU N N 35 120.327 120.327 120.044 0.283 18703 184 1 1 . 1 1 35 35 GLU HA H 35 3.891 3.891 3.946 -0.055 18703 185 1 1 . 1 1 35 35 GLU C C 35 179.684 179.684 178.700 0.984 18703 186 1 1 . 1 1 35 35 GLU CA C 35 60.059 60.059 59.297 0.762 18703 187 1 1 . 1 1 35 35 GLU CB C 35 29.718 29.718 28.800 0.918 18703 188 1 1 . 1 1 35 35 GLU H H 35 8.558 8.558 7.851 0.707 18703 189 1 1 . 1 1 36 36 GLU N N 36 120.190 120.190 119.439 0.751 18703 190 1 1 . 1 1 36 36 GLU HA H 36 4.051 4.051 3.950 0.101 18703 191 1 1 . 1 1 36 36 GLU C C 36 179.408 179.408 178.956 0.452 18703 192 1 1 . 1 1 36 36 GLU CA C 36 59.148 59.148 58.629 0.519 18703 193 1 1 . 1 1 36 36 GLU CB C 36 29.766 29.766 29.229 0.537 18703 194 1 1 . 1 1 36 36 GLU H H 36 8.038 8.038 7.788 0.250 18703 195 1 1 . 1 1 37 37 LEU N N 37 121.102 121.102 120.921 0.181 18703 196 1 1 . 1 1 37 37 LEU HA H 37 4.079 4.079 4.168 -0.089 18703 197 1 1 . 1 1 37 37 LEU C C 37 178.279 178.279 178.222 0.057 18703 198 1 1 . 1 1 37 37 LEU CA C 37 57.803 57.803 57.176 0.627 18703 199 1 1 . 1 1 37 37 LEU CB C 37 41.502 41.502 41.795 -0.293 18703 200 1 1 . 1 1 37 37 LEU H H 37 8.065 8.065 7.475 0.590 18703 201 1 1 . 1 1 38 38 LYS N N 38 119.980 119.980 118.908 1.072 18703 202 1 1 . 1 1 38 38 LYS HA H 38 3.851 3.851 3.921 -0.070 18703 203 1 1 . 1 1 38 38 LYS C C 38 178.919 178.919 179.132 -0.213 18703 204 1 1 . 1 1 38 38 LYS CA C 38 60.794 60.794 59.737 1.057 18703 205 1 1 . 1 1 38 38 LYS CB C 38 32.863 32.863 32.286 0.577 18703 206 1 1 . 1 1 38 38 LYS H H 38 8.741 8.741 7.687 1.054 18703 207 1 1 . 1 1 39 39 LYS N N 39 118.307 118.307 117.511 0.796 18703 208 1 1 . 1 1 39 39 LYS HA H 39 4.125 4.125 4.177 -0.052 18703 209 1 1 . 1 1 39 39 LYS C C 39 178.622 178.622 178.606 0.016 18703 210 1 1 . 1 1 39 39 LYS CA C 39 58.993 58.993 59.122 -0.129 18703 211 1 1 . 1 1 39 39 LYS CB C 39 32.097 32.097 31.740 0.357 18703 212 1 1 . 1 1 39 39 LYS H H 39 7.584 7.584 7.689 -0.105 18703 213 1 1 . 1 1 40 40 LYS N N 40 118.826 118.826 120.106 -1.280 18703 214 1 1 . 1 1 40 40 LYS HA H 40 4.069 4.069 4.457 -0.388 18703 215 1 1 . 1 1 40 40 LYS C C 40 179.802 179.802 178.818 0.984 18703 216 1 1 . 1 1 40 40 LYS CA C 40 59.322 59.322 58.566 0.756 18703 217 1 1 . 1 1 40 40 LYS CB C 40 32.505 32.505 32.382 0.123 18703 218 1 1 . 1 1 40 40 LYS H H 40 7.945 7.945 7.355 0.590 18703 219 1 1 . 1 1 41 41 ILE N N 41 118.958 118.958 119.156 -0.198 18703 220 1 1 . 1 1 41 41 ILE HA H 41 3.659 3.659 3.819 -0.160 18703 221 1 1 . 1 1 41 41 ILE C C 41 178.146 178.146 177.788 0.358 18703 222 1 1 . 1 1 41 41 ILE CA C 41 65.037 65.037 63.964 1.073 18703 223 1 1 . 1 1 41 41 ILE CB C 41 37.950 37.950 37.836 0.114 18703 224 1 1 . 1 1 41 41 ILE H H 41 8.369 8.369 8.231 0.138 18703 225 1 1 . 1 1 42 42 GLU N N 42 120.331 120.331 119.375 0.956 18703 226 1 1 . 1 1 42 42 GLU HA H 42 4.094 4.094 4.040 0.054 18703 227 1 1 . 1 1 42 42 GLU C C 42 178.697 178.697 177.923 0.774 18703 228 1 1 . 1 1 42 42 GLU CA C 42 58.927 58.927 59.310 -0.383 18703 229 1 1 . 1 1 42 42 GLU CB C 42 29.399 29.399 29.472 -0.073 18703 230 1 1 . 1 1 42 42 GLU H H 42 7.805 7.805 7.760 0.045 18703 231 1 1 . 1 1 43 43 GLU N N 43 117.120 117.120 117.391 -0.271 18703 232 1 1 . 1 1 43 43 GLU HA H 43 4.291 4.291 4.098 0.193 18703 233 1 1 . 1 1 43 43 GLU C C 43 177.551 177.551 177.619 -0.068 18703 234 1 1 . 1 1 43 43 GLU CA C 43 56.800 56.800 57.224 -0.424 18703 235 1 1 . 1 1 43 43 GLU CB C 43 29.931 29.931 29.693 0.238 18703 236 1 1 . 1 1 43 43 GLU H H 43 7.701 7.701 7.673 0.028 18703 237 1 1 . 1 1 44 44 LEU N N 44 120.940 120.940 121.796 -0.856 18703 238 1 1 . 1 1 44 44 LEU HA H 44 4.251 4.251 4.059 0.192 18703 239 1 1 . 1 1 44 44 LEU C C 44 178.596 178.596 176.891 1.705 18703 240 1 1 . 1 1 44 44 LEU CA C 44 56.448 56.448 55.357 1.091 18703 241 1 1 . 1 1 44 44 LEU CB C 44 42.519 42.519 42.520 -0.001 18703 242 1 1 . 1 1 44 44 LEU H H 44 7.581 7.581 7.369 0.212 18703 243 1 1 . 1 1 45 45 GLY N N 45 108.689 108.689 106.727 1.962 18703 244 1 1 . 1 1 45 45 GLY C C 45 174.853 174.853 174.314 0.539 18703 245 1 1 . 1 1 45 45 GLY CA C 45 46.233 46.233 44.963 1.270 18703 246 1 1 . 1 1 45 45 GLY H H 45 8.232 8.232 8.372 -0.140 18703 247 1 1 . 1 1 46 46 GLY N N 46 108.029 108.029 108.733 -0.704 18703 248 1 1 . 1 1 46 46 GLY C C 46 174.351 174.351 174.855 -0.504 18703 249 1 1 . 1 1 46 46 GLY CA C 46 45.105 45.105 45.111 -0.006 18703 250 1 1 . 1 1 46 46 GLY H H 46 8.176 8.176 8.397 -0.221 18703 251 1 1 . 1 1 47 47 GLY N N 47 108.183 108.183 106.107 2.076 18703 252 1 1 . 1 1 47 47 GLY C C 47 174.671 174.671 173.906 0.765 18703 253 1 1 . 1 1 47 47 GLY CA C 47 45.254 45.254 44.453 0.801 18703 254 1 1 . 1 1 47 47 GLY H H 47 8.290 8.290 7.507 0.783 18703 255 1 1 . 1 1 48 48 GLY N N 48 108.616 108.616 109.267 -0.651 18703 256 1 1 . 1 1 48 48 GLY C C 48 174.321 174.321 176.006 -1.685 18703 257 1 1 . 1 1 48 48 GLY CA C 48 45.192 45.192 45.740 -0.548 18703 258 1 1 . 1 1 48 48 GLY H H 48 8.027 8.027 8.254 -0.227 18703 259 1 1 . 1 1 49 49 GLU N N 49 121.057 121.057 122.448 -1.391 18703 260 1 1 . 1 1 49 49 GLU HA H 49 4.425 4.425 4.201 0.224 18703 261 1 1 . 1 1 49 49 GLU C C 49 177.072 177.072 178.303 -1.231 18703 262 1 1 . 1 1 49 49 GLU CA C 49 56.330 56.330 57.920 -1.590 18703 263 1 1 . 1 1 49 49 GLU CB C 49 29.602 29.602 29.678 -0.076 18703 264 1 1 . 1 1 49 49 GLU H H 49 8.486 8.486 8.468 0.018 18703 265 1 1 . 1 1 50 50 VAL N N 50 122.122 122.122 118.013 4.109 18703 266 1 1 . 1 1 50 50 VAL HA H 50 3.792 3.792 3.570 0.222 18703 267 1 1 . 1 1 50 50 VAL C C 50 176.774 176.774 177.500 -0.726 18703 268 1 1 . 1 1 50 50 VAL CA C 50 64.864 64.864 65.514 -0.650 18703 269 1 1 . 1 1 50 50 VAL CB C 50 32.179 32.179 31.346 0.833 18703 270 1 1 . 1 1 50 50 VAL H H 50 8.095 8.095 8.036 0.059 18703 271 1 1 . 1 1 51 51 LYS N N 51 120.602 120.602 118.836 1.766 18703 272 1 1 . 1 1 51 51 LYS HA H 51 4.195 4.195 4.078 0.117 18703 273 1 1 . 1 1 51 51 LYS C C 51 178.530 178.530 178.476 0.054 18703 274 1 1 . 1 1 51 51 LYS CA C 51 59.348 59.348 59.050 0.298 18703 275 1 1 . 1 1 51 51 LYS CB C 51 32.265 32.265 32.421 -0.156 18703 276 1 1 . 1 1 51 51 LYS H H 51 8.268 8.268 7.744 0.524 18703 277 1 1 . 1 1 52 52 LYS N N 52 117.547 117.547 120.536 -2.989 18703 278 1 1 . 1 1 52 52 LYS HA H 52 4.162 4.162 4.100 0.062 18703 279 1 1 . 1 1 52 52 LYS C C 52 179.132 179.132 178.899 0.233 18703 280 1 1 . 1 1 52 52 LYS CA C 52 58.811 58.811 58.770 0.041 18703 281 1 1 . 1 1 52 52 LYS CB C 52 32.054 32.054 31.845 0.209 18703 282 1 1 . 1 1 52 52 LYS H H 52 7.595 7.595 7.666 -0.071 18703 283 1 1 . 1 1 53 53 VAL N N 53 119.190 119.190 118.281 0.909 18703 284 1 1 . 1 1 53 53 VAL HA H 53 3.767 3.767 4.052 -0.285 18703 285 1 1 . 1 1 53 53 VAL C C 53 177.933 177.933 178.451 -0.518 18703 286 1 1 . 1 1 53 53 VAL CA C 53 66.065 66.065 65.551 0.514 18703 287 1 1 . 1 1 53 53 VAL CB C 53 31.248 31.248 31.188 0.060 18703 288 1 1 . 1 1 53 53 VAL H H 53 7.597 7.597 7.536 0.061 18703 289 1 1 . 1 1 54 54 GLU N N 54 120.226 120.226 119.238 0.988 18703 290 1 1 . 1 1 54 54 GLU HA H 54 3.833 3.833 3.979 -0.146 18703 291 1 1 . 1 1 54 54 GLU C C 54 179.352 179.352 178.493 0.859 18703 292 1 1 . 1 1 54 54 GLU CA C 54 59.153 59.153 59.678 -0.525 18703 293 1 1 . 1 1 54 54 GLU CB C 54 29.224 29.224 29.456 -0.231 18703 294 1 1 . 1 1 54 54 GLU H H 54 8.609 8.609 7.691 0.918 18703 295 1 1 . 1 1 55 55 GLU N N 55 119.148 119.148 118.940 0.208 18703 296 1 1 . 1 1 55 55 GLU HA H 55 4.084 4.084 4.089 -0.005 18703 297 1 1 . 1 1 55 55 GLU C C 55 179.084 179.084 178.794 0.290 18703 298 1 1 . 1 1 55 55 GLU CA C 55 59.295 59.295 59.058 0.237 18703 299 1 1 . 1 1 55 55 GLU CB C 55 29.361 29.361 29.645 -0.284 18703 300 1 1 . 1 1 55 55 GLU H H 55 7.713 7.713 7.790 -0.077 18703 301 1 1 . 1 1 56 56 GLU N N 56 120.301 120.301 119.261 1.040 18703 302 1 1 . 1 1 56 56 GLU HA H 56 4.079 4.079 4.117 -0.038 18703 303 1 1 . 1 1 56 56 GLU C C 56 179.773 179.773 179.235 0.538 18703 304 1 1 . 1 1 56 56 GLU CA C 56 59.528 59.528 59.100 0.428 18703 305 1 1 . 1 1 56 56 GLU CB C 56 30.162 30.162 29.710 0.452 18703 306 1 1 . 1 1 56 56 GLU H H 56 7.899 7.899 7.551 0.348 18703 307 1 1 . 1 1 57 57 VAL N N 57 121.536 121.536 118.564 2.972 18703 308 1 1 . 1 1 57 57 VAL HA H 57 3.540 3.540 3.726 -0.186 18703 309 1 1 . 1 1 57 57 VAL C C 57 176.984 176.984 177.385 -0.401 18703 310 1 1 . 1 1 57 57 VAL CA C 57 66.734 66.734 65.847 0.887 18703 311 1 1 . 1 1 57 57 VAL CB C 57 31.425 31.425 31.628 -0.203 18703 312 1 1 . 1 1 57 57 VAL H H 57 8.652 8.652 7.473 1.179 18703 313 1 1 . 1 1 58 58 LYS N N 58 120.219 120.219 119.931 0.288 18703 314 1 1 . 1 1 58 58 LYS HA H 58 4.199 4.199 4.165 0.034 18703 315 1 1 . 1 1 58 58 LYS C C 58 178.972 178.972 178.605 0.367 18703 316 1 1 . 1 1 58 58 LYS CA C 58 59.357 59.357 58.292 1.065 18703 317 1 1 . 1 1 58 58 LYS CB C 58 32.186 32.186 31.879 0.307 18703 318 1 1 . 1 1 58 58 LYS H H 58 7.791 7.791 7.468 0.323 18703 319 1 1 . 1 1 59 59 LYS N N 59 118.252 118.252 119.961 -1.709 18703 320 1 1 . 1 1 59 59 LYS HA H 59 4.069 4.069 4.150 -0.081 18703 321 1 1 . 1 1 59 59 LYS C C 59 179.180 179.180 178.790 0.390 18703 322 1 1 . 1 1 59 59 LYS CA C 59 59.285 59.285 58.829 0.456 18703 323 1 1 . 1 1 59 59 LYS CB C 59 32.345 32.345 32.367 -0.021 18703 324 1 1 . 1 1 59 59 LYS H H 59 7.849 7.849 7.494 0.355 18703 325 1 1 . 1 1 60 60 LEU N N 60 121.243 121.243 119.785 1.458 18703 326 1 1 . 1 1 60 60 LEU HA H 60 4.242 4.242 4.121 0.121 18703 327 1 1 . 1 1 60 60 LEU C C 60 178.413 178.413 178.253 0.160 18703 328 1 1 . 1 1 60 60 LEU CA C 60 57.798 57.798 57.258 0.540 18703 329 1 1 . 1 1 60 60 LEU CB C 60 41.150 41.150 42.176 -1.026 18703 330 1 1 . 1 1 60 60 LEU H H 60 7.825 7.825 7.561 0.264 18703 331 1 1 . 1 1 61 61 GLU N N 61 118.844 118.844 120.018 -1.174 18703 332 1 1 . 1 1 61 61 GLU HA H 61 3.800 3.800 3.923 -0.123 18703 333 1 1 . 1 1 61 61 GLU C C 61 179.078 179.078 178.518 0.560 18703 334 1 1 . 1 1 61 61 GLU CA C 61 60.104 60.104 59.934 0.170 18703 335 1 1 . 1 1 61 61 GLU CB C 61 29.864 29.864 29.669 0.195 18703 336 1 1 . 1 1 61 61 GLU H H 61 8.582 8.582 7.727 0.855 18703 337 1 1 . 1 1 62 62 GLU N N 62 117.659 117.659 118.728 -1.069 18703 338 1 1 . 1 1 62 62 GLU HA H 62 3.990 3.990 4.034 -0.044 18703 339 1 1 . 1 1 62 62 GLU C C 62 178.847 178.847 178.961 -0.114 18703 340 1 1 . 1 1 62 62 GLU CA C 62 59.067 59.067 58.946 0.121 18703 341 1 1 . 1 1 62 62 GLU CB C 62 29.440 29.440 29.645 -0.205 18703 342 1 1 . 1 1 62 62 GLU H H 62 8.032 8.032 7.626 0.406 18703 343 1 1 . 1 1 63 63 GLU N N 63 119.290 119.290 119.245 0.045 18703 344 1 1 . 1 1 63 63 GLU HA H 63 4.012 4.012 4.098 -0.086 18703 345 1 1 . 1 1 63 63 GLU C C 63 179.784 179.784 179.380 0.404 18703 346 1 1 . 1 1 63 63 GLU CA C 63 59.300 59.300 59.186 0.114 18703 347 1 1 . 1 1 63 63 GLU CB C 63 29.728 29.728 29.556 0.172 18703 348 1 1 . 1 1 63 63 GLU H H 63 7.958 7.958 7.436 0.522 18703 349 1 1 . 1 1 64 64 ILE N N 64 118.453 118.453 119.128 -0.675 18703 350 1 1 . 1 1 64 64 ILE HA H 64 3.711 3.711 3.782 -0.071 18703 351 1 1 . 1 1 64 64 ILE C C 64 177.655 177.655 177.313 0.342 18703 352 1 1 . 1 1 64 64 ILE CA C 64 64.256 64.256 63.821 0.435 18703 353 1 1 . 1 1 64 64 ILE CB C 64 38.002 38.002 37.594 0.408 18703 354 1 1 . 1 1 64 64 ILE H H 64 8.160 8.160 7.540 0.620 18703 355 1 1 . 1 1 65 65 LYS N N 65 118.871 118.871 118.088 0.783 18703 356 1 1 . 1 1 65 65 LYS HA H 65 4.111 4.111 4.094 0.017 18703 357 1 1 . 1 1 65 65 LYS C C 65 177.076 177.076 177.456 -0.380 18703 358 1 1 . 1 1 65 65 LYS CA C 65 58.421 58.421 58.705 -0.284 18703 359 1 1 . 1 1 65 65 LYS CB C 65 32.639 32.639 32.428 0.211 18703 360 1 1 . 1 1 65 65 LYS H H 65 7.664 7.664 7.538 0.126 18703 361 1 1 . 1 1 66 66 LYS N N 66 116.944 116.944 116.367 0.577 18703 362 1 1 . 1 1 66 66 LYS HA H 66 4.320 4.320 4.408 -0.088 18703 363 1 1 . 1 1 66 66 LYS C C 66 175.897 175.897 177.021 -1.124 18703 364 1 1 . 1 1 66 66 LYS CA C 66 56.352 56.352 56.103 0.249 18703 365 1 1 . 1 1 66 66 LYS CB C 66 33.024 33.024 33.931 -0.907 18703 366 1 1 . 1 1 66 66 LYS H H 66 7.246 7.246 7.480 -0.234 18703 367 1 2 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.402 -0.156 18703 368 1 2 . 1 1 3 3 ARG C C 3 178.379 178.379 176.493 1.886 18703 369 1 2 . 1 1 3 3 ARG CA C 3 58.367 58.367 56.714 1.653 18703 370 1 2 . 1 1 3 3 ARG CB C 3 30.691 30.691 30.512 0.179 18703 371 1 2 . 1 1 3 3 ARG H H 3 7.905 7.905 8.535 -0.630 18703 372 1 2 . 1 1 4 4 VAL N N 4 118.966 118.966 121.037 -2.071 18703 373 1 2 . 1 1 4 4 VAL HA H 4 3.803 3.803 3.844 -0.041 18703 374 1 2 . 1 1 4 4 VAL C C 4 176.968 176.968 176.598 0.370 18703 375 1 2 . 1 1 4 4 VAL CA C 4 65.441 65.441 65.025 0.416 18703 376 1 2 . 1 1 4 4 VAL CB C 4 31.710 31.710 31.815 -0.105 18703 377 1 2 . 1 1 4 4 VAL H H 4 8.070 8.070 8.133 -0.063 18703 378 1 2 . 1 1 5 5 LYS N N 5 122.058 122.058 120.856 1.202 18703 379 1 2 . 1 1 5 5 LYS HA H 5 4.154 4.154 4.183 -0.029 18703 380 1 2 . 1 1 5 5 LYS C C 5 178.553 178.553 178.697 -0.144 18703 381 1 2 . 1 1 5 5 LYS CA C 5 58.712 58.712 59.015 -0.303 18703 382 1 2 . 1 1 5 5 LYS CB C 5 31.788 31.788 31.858 -0.070 18703 383 1 2 . 1 1 5 5 LYS H H 5 7.798 7.798 8.461 -0.663 18703 384 1 2 . 1 1 6 6 ALA N N 6 119.955 119.955 120.630 -0.675 18703 385 1 2 . 1 1 6 6 ALA HA H 6 4.198 4.198 4.323 -0.125 18703 386 1 2 . 1 1 6 6 ALA C C 6 180.974 180.974 179.142 1.832 18703 387 1 2 . 1 1 6 6 ALA CA C 6 54.850 54.850 54.136 0.713 18703 388 1 2 . 1 1 6 6 ALA CB C 6 17.995 17.995 18.137 -0.142 18703 389 1 2 . 1 1 6 6 ALA H H 6 7.928 7.928 8.083 -0.155 18703 390 1 2 . 1 1 7 7 LEU N N 7 119.211 119.211 120.639 -1.428 18703 391 1 2 . 1 1 7 7 LEU HA H 7 4.124 4.124 3.898 0.226 18703 392 1 2 . 1 1 7 7 LEU C C 7 178.353 178.353 178.423 -0.070 18703 393 1 2 . 1 1 7 7 LEU CA C 7 57.658 57.658 57.741 -0.083 18703 394 1 2 . 1 1 7 7 LEU CB C 7 41.971 41.971 42.109 -0.138 18703 395 1 2 . 1 1 7 7 LEU H H 7 7.594 7.594 7.548 0.046 18703 396 1 2 . 1 1 8 8 GLU N N 8 120.258 120.258 117.253 3.005 18703 397 1 2 . 1 1 8 8 GLU HA H 8 3.846 3.846 3.911 -0.065 18703 398 1 2 . 1 1 8 8 GLU C C 8 179.546 179.546 178.967 0.579 18703 399 1 2 . 1 1 8 8 GLU CA C 8 60.006 60.006 59.644 0.362 18703 400 1 2 . 1 1 8 8 GLU CB C 8 29.683 29.683 29.408 0.275 18703 401 1 2 . 1 1 8 8 GLU H H 8 8.382 8.382 7.776 0.606 18703 402 1 2 . 1 1 9 9 GLU N N 9 118.584 118.584 117.669 0.915 18703 403 1 2 . 1 1 9 9 GLU HA H 9 4.039 4.039 4.165 -0.126 18703 404 1 2 . 1 1 9 9 GLU C C 9 179.635 179.635 178.486 1.149 18703 405 1 2 . 1 1 9 9 GLU CA C 9 59.235 59.235 58.529 0.706 18703 406 1 2 . 1 1 9 9 GLU CB C 9 29.358 29.358 29.098 0.260 18703 407 1 2 . 1 1 9 9 GLU H H 9 7.908 7.908 8.034 -0.126 18703 408 1 2 . 1 1 10 10 LYS N N 10 120.956 120.956 120.004 0.952 18703 409 1 2 . 1 1 10 10 LYS HA H 10 4.190 4.190 4.109 0.081 18703 410 1 2 . 1 1 10 10 LYS C C 10 179.395 179.395 178.992 0.403 18703 411 1 2 . 1 1 10 10 LYS CA C 10 59.231 59.231 59.056 0.175 18703 412 1 2 . 1 1 10 10 LYS CB C 10 32.211 32.211 32.654 -0.443 18703 413 1 2 . 1 1 10 10 LYS H H 10 8.009 8.009 7.503 0.506 18703 414 1 2 . 1 1 11 11 VAL N N 11 119.577 119.577 118.092 1.485 18703 415 1 2 . 1 1 11 11 VAL HA H 11 3.844 3.844 3.684 0.160 18703 416 1 2 . 1 1 11 11 VAL C C 11 177.078 177.078 177.337 -0.259 18703 417 1 2 . 1 1 11 11 VAL CA C 11 66.407 66.407 66.418 -0.011 18703 418 1 2 . 1 1 11 11 VAL CB C 11 31.252 31.252 31.774 -0.522 18703 419 1 2 . 1 1 11 11 VAL H H 11 8.488 8.488 7.530 0.958 18703 420 1 2 . 1 1 12 12 LYS N N 12 122.864 122.864 120.039 2.825 18703 421 1 2 . 1 1 12 12 LYS HA H 12 4.189 4.189 4.009 0.180 18703 422 1 2 . 1 1 12 12 LYS C C 12 178.755 178.755 178.161 0.594 18703 423 1 2 . 1 1 12 12 LYS CA C 12 59.375 59.375 59.389 -0.014 18703 424 1 2 . 1 1 12 12 LYS CB C 12 31.991 31.991 32.314 -0.323 18703 425 1 2 . 1 1 12 12 LYS H H 12 7.944 7.944 7.573 0.371 18703 426 1 2 . 1 1 13 13 ALA N N 13 121.202 121.202 120.421 0.781 18703 427 1 2 . 1 1 13 13 ALA HA H 13 4.209 4.209 4.265 -0.056 18703 428 1 2 . 1 1 13 13 ALA C C 13 181.060 181.060 179.431 1.629 18703 429 1 2 . 1 1 13 13 ALA CA C 13 54.710 54.710 54.276 0.434 18703 430 1 2 . 1 1 13 13 ALA CB C 13 17.861 17.861 18.435 -0.574 18703 431 1 2 . 1 1 13 13 ALA H H 13 7.563 7.563 7.429 0.134 18703 432 1 2 . 1 1 14 14 LEU N N 14 120.014 120.014 119.608 0.406 18703 433 1 2 . 1 1 14 14 LEU HA H 14 4.072 4.072 4.023 0.049 18703 434 1 2 . 1 1 14 14 LEU C C 14 177.862 177.862 178.240 -0.378 18703 435 1 2 . 1 1 14 14 LEU CA C 14 57.864 57.864 57.394 0.470 18703 436 1 2 . 1 1 14 14 LEU CB C 14 41.539 41.539 42.076 -0.537 18703 437 1 2 . 1 1 14 14 LEU H H 14 8.087 8.087 7.491 0.596 18703 438 1 2 . 1 1 15 15 GLU N N 15 121.644 121.644 120.392 1.252 18703 439 1 2 . 1 1 15 15 GLU HA H 15 3.692 3.692 4.028 -0.336 18703 440 1 2 . 1 1 15 15 GLU C C 15 177.819 177.819 178.278 -0.459 18703 441 1 2 . 1 1 15 15 GLU CA C 15 59.239 59.239 59.383 -0.144 18703 442 1 2 . 1 1 15 15 GLU CB C 15 28.865 28.865 29.583 -0.718 18703 443 1 2 . 1 1 15 15 GLU H H 15 8.542 8.542 7.767 0.775 18703 444 1 2 . 1 1 16 16 GLU N N 16 116.016 116.016 118.620 -2.604 18703 445 1 2 . 1 1 16 16 GLU HA H 16 3.955 3.955 3.951 0.004 18703 446 1 2 . 1 1 16 16 GLU C C 16 179.159 179.159 179.125 0.034 18703 447 1 2 . 1 1 16 16 GLU CA C 16 59.324 59.324 59.078 0.246 18703 448 1 2 . 1 1 16 16 GLU CB C 16 29.060 29.060 28.956 0.104 18703 449 1 2 . 1 1 16 16 GLU H H 16 7.492 7.492 7.983 -0.491 18703 450 1 2 . 1 1 17 17 LYS N N 17 118.546 118.546 119.116 -0.570 18703 451 1 2 . 1 1 17 17 LYS HA H 17 4.117 4.117 4.127 -0.010 18703 452 1 2 . 1 1 17 17 LYS C C 17 178.976 178.976 177.950 1.026 18703 453 1 2 . 1 1 17 17 LYS CA C 17 58.837 58.837 58.648 0.189 18703 454 1 2 . 1 1 17 17 LYS CB C 17 32.538 32.538 32.461 0.077 18703 455 1 2 . 1 1 17 17 LYS H H 17 7.720 7.720 7.466 0.254 18703 456 1 2 . 1 1 18 18 VAL N N 18 118.376 118.376 119.132 -0.756 18703 457 1 2 . 1 1 18 18 VAL HA H 18 3.711 3.711 3.777 -0.066 18703 458 1 2 . 1 1 18 18 VAL C C 18 178.765 178.765 178.464 0.301 18703 459 1 2 . 1 1 18 18 VAL CA C 18 66.237 66.237 65.855 0.382 18703 460 1 2 . 1 1 18 18 VAL CB C 18 31.682 31.682 31.927 -0.245 18703 461 1 2 . 1 1 18 18 VAL H H 18 8.754 8.754 7.626 1.128 18703 462 1 2 . 1 1 19 19 LYS N N 19 118.817 118.817 119.830 -1.013 18703 463 1 2 . 1 1 19 19 LYS HA H 19 4.078 4.078 3.973 0.105 18703 464 1 2 . 1 1 19 19 LYS C C 19 178.049 178.049 177.683 0.366 18703 465 1 2 . 1 1 19 19 LYS CA C 19 59.731 59.731 59.243 0.487 18703 466 1 2 . 1 1 19 19 LYS CB C 19 32.523 32.523 31.819 0.704 18703 467 1 2 . 1 1 19 19 LYS H H 19 8.299 8.299 8.657 -0.358 18703 468 1 2 . 1 1 20 20 ALA N N 20 119.656 119.656 119.585 0.071 18703 469 1 2 . 1 1 20 20 ALA HA H 20 4.347 4.347 4.372 -0.025 18703 470 1 2 . 1 1 20 20 ALA C C 20 178.532 178.532 177.916 0.616 18703 471 1 2 . 1 1 20 20 ALA CA C 20 52.853 52.853 51.941 0.912 18703 472 1 2 . 1 1 20 20 ALA CB C 20 18.832 18.832 19.593 -0.761 18703 473 1 2 . 1 1 20 20 ALA H H 20 7.425 7.425 7.541 -0.116 18703 474 1 2 . 1 1 21 21 LEU N N 21 118.594 118.594 120.077 -1.483 18703 475 1 2 . 1 1 21 21 LEU HA H 21 4.297 4.297 4.216 0.081 18703 476 1 2 . 1 1 21 21 LEU C C 21 177.784 177.784 176.698 1.086 18703 477 1 2 . 1 1 21 21 LEU CA C 21 55.750 55.750 54.982 0.768 18703 478 1 2 . 1 1 21 21 LEU CB C 21 42.898 42.898 43.006 -0.108 18703 479 1 2 . 1 1 21 21 LEU H H 21 7.508 7.508 7.597 -0.089 18703 480 1 2 . 1 1 22 22 GLY N N 22 106.650 106.650 109.110 -2.460 18703 481 1 2 . 1 1 22 22 GLY C C 22 173.605 173.605 173.133 0.472 18703 482 1 2 . 1 1 22 22 GLY CA C 22 45.330 45.330 45.221 0.109 18703 483 1 2 . 1 1 22 22 GLY H H 22 7.814 7.814 8.389 -0.575 18703 484 1 2 . 1 1 23 23 GLY N N 23 108.011 108.011 109.794 -1.783 18703 485 1 2 . 1 1 23 23 GLY C C 23 174.061 174.061 172.840 1.221 18703 486 1 2 . 1 1 23 23 GLY CA C 23 44.772 44.772 45.261 -0.489 18703 487 1 2 . 1 1 23 23 GLY H H 23 8.139 8.139 8.390 -0.251 18703 488 1 2 . 1 1 24 24 GLY N N 24 107.826 107.826 106.155 1.671 18703 489 1 2 . 1 1 24 24 GLY C C 24 175.046 175.046 173.918 1.128 18703 490 1 2 . 1 1 24 24 GLY CA C 24 44.422 44.422 44.833 -0.411 18703 491 1 2 . 1 1 24 24 GLY H H 24 8.497 8.497 8.199 0.298 18703 492 1 2 . 1 1 25 25 GLY N N 25 108.830 108.830 109.057 -0.227 18703 493 1 2 . 1 1 25 25 GLY C C 25 176.272 176.272 176.210 0.062 18703 494 1 2 . 1 1 25 25 GLY CA C 25 47.101 47.101 45.936 1.165 18703 495 1 2 . 1 1 25 25 GLY H H 25 8.616 8.616 8.491 0.125 18703 496 1 2 . 1 1 26 26 ARG N N 26 123.109 123.109 124.355 -1.246 18703 497 1 2 . 1 1 26 26 ARG HA H 26 4.283 4.283 4.084 0.199 18703 498 1 2 . 1 1 26 26 ARG C C 26 177.848 177.848 178.563 -0.715 18703 499 1 2 . 1 1 26 26 ARG CA C 26 57.663 57.663 58.342 -0.679 18703 500 1 2 . 1 1 26 26 ARG CB C 26 29.811 29.811 30.015 -0.204 18703 501 1 2 . 1 1 26 26 ARG H H 26 8.770 8.770 7.921 0.849 18703 502 1 2 . 1 1 27 27 ILE N N 27 118.104 118.104 119.080 -0.976 18703 503 1 2 . 1 1 27 27 ILE HA H 27 3.787 3.787 3.689 0.098 18703 504 1 2 . 1 1 27 27 ILE C C 27 177.473 177.473 178.037 -0.564 18703 505 1 2 . 1 1 27 27 ILE CA C 27 63.036 63.036 65.037 -2.002 18703 506 1 2 . 1 1 27 27 ILE CB C 27 36.664 36.664 37.681 -1.017 18703 507 1 2 . 1 1 27 27 ILE H H 27 7.708 7.708 8.244 -0.536 18703 508 1 2 . 1 1 28 28 GLU N N 28 119.934 119.934 119.567 0.367 18703 509 1 2 . 1 1 28 28 GLU HA H 28 3.954 3.954 3.849 0.105 18703 510 1 2 . 1 1 28 28 GLU C C 28 179.514 179.514 178.427 1.087 18703 511 1 2 . 1 1 28 28 GLU CA C 28 59.450 59.450 60.378 -0.928 18703 512 1 2 . 1 1 28 28 GLU CB C 28 29.600 29.600 29.239 0.361 18703 513 1 2 . 1 1 28 28 GLU H H 28 7.872 7.872 8.227 -0.355 18703 514 1 2 . 1 1 29 29 GLU N N 29 118.134 118.134 119.553 -1.419 18703 515 1 2 . 1 1 29 29 GLU HA H 29 4.028 4.028 4.064 -0.036 18703 516 1 2 . 1 1 29 29 GLU C C 29 179.182 179.182 179.176 0.006 18703 517 1 2 . 1 1 29 29 GLU CA C 29 59.173 59.173 59.148 0.025 18703 518 1 2 . 1 1 29 29 GLU CB C 29 29.503 29.503 29.508 -0.005 18703 519 1 2 . 1 1 29 29 GLU H H 29 8.166 8.166 7.652 0.514 18703 520 1 2 . 1 1 30 30 LEU N N 30 120.242 120.242 117.990 2.252 18703 521 1 2 . 1 1 30 30 LEU HA H 30 4.028 4.028 4.099 -0.071 18703 522 1 2 . 1 1 30 30 LEU C C 30 178.796 178.796 178.728 0.068 18703 523 1 2 . 1 1 30 30 LEU CA C 30 57.654 57.654 56.944 0.710 18703 524 1 2 . 1 1 30 30 LEU CB C 30 41.629 41.629 41.935 -0.306 18703 525 1 2 . 1 1 30 30 LEU H H 30 7.695 7.695 7.508 0.187 18703 526 1 2 . 1 1 31 31 LYS N N 31 120.506 120.506 120.485 0.021 18703 527 1 2 . 1 1 31 31 LYS HA H 31 3.532 3.532 4.039 -0.507 18703 528 1 2 . 1 1 31 31 LYS C C 31 178.919 178.919 178.279 0.640 18703 529 1 2 . 1 1 31 31 LYS CA C 31 60.240 60.240 59.360 0.880 18703 530 1 2 . 1 1 31 31 LYS CB C 31 32.015 32.015 32.292 -0.277 18703 531 1 2 . 1 1 31 31 LYS H H 31 8.561 8.561 7.907 0.654 18703 532 1 2 . 1 1 32 32 LYS N N 32 118.566 118.566 118.820 -0.254 18703 533 1 2 . 1 1 32 32 LYS C C 32 179.392 179.392 179.384 0.008 18703 534 1 2 . 1 1 32 32 LYS CA C 32 59.356 59.356 59.861 -0.505 18703 535 1 2 . 1 1 32 32 LYS CB C 32 32.117 32.117 32.421 -0.304 18703 536 1 2 . 1 1 32 32 LYS H H 32 7.699 7.699 7.583 0.116 18703 537 1 2 . 1 1 33 33 LYS N N 33 118.964 118.964 118.245 0.719 18703 538 1 2 . 1 1 33 33 LYS HA H 33 4.117 4.117 4.244 -0.127 18703 539 1 2 . 1 1 33 33 LYS C C 33 178.355 178.355 178.386 -0.031 18703 540 1 2 . 1 1 33 33 LYS CA C 33 58.633 58.633 58.479 0.154 18703 541 1 2 . 1 1 33 33 LYS CB C 33 31.904 31.904 32.258 -0.354 18703 542 1 2 . 1 1 33 33 LYS H H 33 7.752 7.752 7.606 0.146 18703 543 1 2 . 1 1 34 34 CYS N N 34 119.956 119.956 118.780 1.176 18703 544 1 2 . 1 1 34 34 CYS HA H 34 3.967 3.967 4.105 -0.138 18703 545 1 2 . 1 1 34 34 CYS C C 34 175.521 175.521 176.816 -1.295 18703 546 1 2 . 1 1 34 34 CYS CA C 34 60.987 60.987 62.992 -2.006 18703 547 1 2 . 1 1 34 34 CYS CB C 34 36.600 36.600 26.777 9.822 18703 548 1 2 . 1 1 34 34 CYS H H 34 8.393 8.393 7.569 0.824 18703 549 1 2 . 1 1 35 35 GLU N N 35 120.327 120.327 119.553 0.774 18703 550 1 2 . 1 1 35 35 GLU HA H 35 3.891 3.891 3.913 -0.022 18703 551 1 2 . 1 1 35 35 GLU C C 35 179.684 179.684 178.592 1.092 18703 552 1 2 . 1 1 35 35 GLU CA C 35 60.059 60.059 59.341 0.718 18703 553 1 2 . 1 1 35 35 GLU CB C 35 29.718 29.718 28.783 0.935 18703 554 1 2 . 1 1 35 35 GLU H H 35 8.558 8.558 7.835 0.723 18703 555 1 2 . 1 1 36 36 GLU N N 36 120.190 120.190 119.914 0.276 18703 556 1 2 . 1 1 36 36 GLU HA H 36 4.051 4.051 3.992 0.059 18703 557 1 2 . 1 1 36 36 GLU C C 36 179.408 179.408 179.008 0.400 18703 558 1 2 . 1 1 36 36 GLU CA C 36 59.148 59.148 58.878 0.270 18703 559 1 2 . 1 1 36 36 GLU CB C 36 29.766 29.766 29.729 0.038 18703 560 1 2 . 1 1 36 36 GLU H H 36 8.038 8.038 7.713 0.325 18703 561 1 2 . 1 1 37 37 LEU N N 37 121.102 121.102 119.354 1.748 18703 562 1 2 . 1 1 37 37 LEU HA H 37 4.079 4.079 4.207 -0.128 18703 563 1 2 . 1 1 37 37 LEU C C 37 178.279 178.279 178.372 -0.093 18703 564 1 2 . 1 1 37 37 LEU CA C 37 57.803 57.803 57.209 0.594 18703 565 1 2 . 1 1 37 37 LEU CB C 37 41.502 41.502 41.784 -0.282 18703 566 1 2 . 1 1 37 37 LEU H H 37 8.065 8.065 7.480 0.585 18703 567 1 2 . 1 1 38 38 LYS N N 38 119.980 119.980 119.009 0.971 18703 568 1 2 . 1 1 38 38 LYS HA H 38 3.851 3.851 3.955 -0.104 18703 569 1 2 . 1 1 38 38 LYS C C 38 178.919 178.919 179.145 -0.226 18703 570 1 2 . 1 1 38 38 LYS CA C 38 60.794 60.794 60.100 0.694 18703 571 1 2 . 1 1 38 38 LYS CB C 38 32.863 32.863 32.277 0.586 18703 572 1 2 . 1 1 38 38 LYS H H 38 8.741 8.741 8.042 0.699 18703 573 1 2 . 1 1 39 39 LYS N N 39 118.307 118.307 118.531 -0.224 18703 574 1 2 . 1 1 39 39 LYS HA H 39 4.125 4.125 3.948 0.177 18703 575 1 2 . 1 1 39 39 LYS C C 39 178.622 178.622 178.604 0.018 18703 576 1 2 . 1 1 39 39 LYS CA C 39 58.993 58.993 59.164 -0.171 18703 577 1 2 . 1 1 39 39 LYS CB C 39 32.097 32.097 31.912 0.185 18703 578 1 2 . 1 1 39 39 LYS H H 39 7.584 7.584 7.780 -0.196 18703 579 1 2 . 1 1 40 40 LYS N N 40 118.826 118.826 119.768 -0.942 18703 580 1 2 . 1 1 40 40 LYS HA H 40 4.069 4.069 4.175 -0.106 18703 581 1 2 . 1 1 40 40 LYS C C 40 179.802 179.802 178.788 1.014 18703 582 1 2 . 1 1 40 40 LYS CA C 40 59.322 59.322 58.529 0.793 18703 583 1 2 . 1 1 40 40 LYS CB C 40 32.505 32.505 32.188 0.317 18703 584 1 2 . 1 1 40 40 LYS H H 40 7.945 7.945 7.375 0.570 18703 585 1 2 . 1 1 41 41 ILE N N 41 118.958 118.958 119.579 -0.621 18703 586 1 2 . 1 1 41 41 ILE HA H 41 3.659 3.659 3.817 -0.158 18703 587 1 2 . 1 1 41 41 ILE C C 41 178.146 178.146 177.855 0.291 18703 588 1 2 . 1 1 41 41 ILE CA C 41 65.037 65.037 64.315 0.722 18703 589 1 2 . 1 1 41 41 ILE CB C 41 37.950 37.950 37.775 0.175 18703 590 1 2 . 1 1 41 41 ILE H H 41 8.369 8.369 8.226 0.143 18703 591 1 2 . 1 1 42 42 GLU N N 42 120.331 120.331 118.765 1.566 18703 592 1 2 . 1 1 42 42 GLU HA H 42 4.094 4.094 4.047 0.047 18703 593 1 2 . 1 1 42 42 GLU C C 42 178.697 178.697 177.829 0.868 18703 594 1 2 . 1 1 42 42 GLU CA C 42 58.927 58.927 59.186 -0.259 18703 595 1 2 . 1 1 42 42 GLU CB C 42 29.399 29.399 29.839 -0.440 18703 596 1 2 . 1 1 42 42 GLU H H 42 7.805 7.805 7.782 0.023 18703 597 1 2 . 1 1 43 43 GLU N N 43 117.120 117.120 116.159 0.961 18703 598 1 2 . 1 1 43 43 GLU HA H 43 4.291 4.291 4.226 0.065 18703 599 1 2 . 1 1 43 43 GLU C C 43 177.551 177.551 177.587 -0.036 18703 600 1 2 . 1 1 43 43 GLU CA C 43 56.800 56.800 56.907 -0.107 18703 601 1 2 . 1 1 43 43 GLU CB C 43 29.931 29.931 29.851 0.080 18703 602 1 2 . 1 1 43 43 GLU H H 43 7.701 7.701 7.638 0.063 18703 603 1 2 . 1 1 44 44 LEU N N 44 120.940 120.940 121.044 -0.104 18703 604 1 2 . 1 1 44 44 LEU HA H 44 4.251 4.251 4.141 0.110 18703 605 1 2 . 1 1 44 44 LEU C C 44 178.596 178.596 177.218 1.378 18703 606 1 2 . 1 1 44 44 LEU CA C 44 56.448 56.448 55.355 1.093 18703 607 1 2 . 1 1 44 44 LEU CB C 44 42.519 42.519 42.582 -0.063 18703 608 1 2 . 1 1 44 44 LEU H H 44 7.581 7.581 7.370 0.211 18703 609 1 2 . 1 1 45 45 GLY N N 45 108.689 108.689 107.691 0.998 18703 610 1 2 . 1 1 45 45 GLY C C 45 174.853 174.853 174.486 0.367 18703 611 1 2 . 1 1 45 45 GLY CA C 45 46.233 46.233 45.235 0.998 18703 612 1 2 . 1 1 45 45 GLY H H 45 8.232 8.232 8.667 -0.435 18703 613 1 2 . 1 1 46 46 GLY N N 46 108.029 108.029 106.855 1.174 18703 614 1 2 . 1 1 46 46 GLY C C 46 174.351 174.351 174.345 0.006 18703 615 1 2 . 1 1 46 46 GLY CA C 46 45.105 45.105 45.299 -0.194 18703 616 1 2 . 1 1 46 46 GLY H H 46 8.176 8.176 8.843 -0.667 18703 617 1 2 . 1 1 47 47 GLY N N 47 108.183 108.183 107.768 0.415 18703 618 1 2 . 1 1 47 47 GLY C C 47 174.671 174.671 175.255 -0.584 18703 619 1 2 . 1 1 47 47 GLY CA C 47 45.254 45.254 44.549 0.705 18703 620 1 2 . 1 1 47 47 GLY H H 47 8.290 8.290 8.042 0.248 18703 621 1 2 . 1 1 48 48 GLY N N 48 108.616 108.616 112.536 -3.920 18703 622 1 2 . 1 1 48 48 GLY C C 48 174.321 174.321 175.044 -0.723 18703 623 1 2 . 1 1 48 48 GLY CA C 48 45.192 45.192 46.093 -0.901 18703 624 1 2 . 1 1 48 48 GLY H H 48 8.027 8.027 8.530 -0.503 18703 625 1 2 . 1 1 49 49 GLU N N 49 121.057 121.057 120.911 0.146 18703 626 1 2 . 1 1 49 49 GLU HA H 49 4.425 4.425 4.555 -0.130 18703 627 1 2 . 1 1 49 49 GLU C C 49 177.072 177.072 178.379 -1.307 18703 628 1 2 . 1 1 49 49 GLU CA C 49 56.330 56.330 56.474 -0.144 18703 629 1 2 . 1 1 49 49 GLU CB C 49 29.602 29.602 30.081 -0.479 18703 630 1 2 . 1 1 49 49 GLU H H 49 8.486 8.486 7.889 0.597 18703 631 1 2 . 1 1 50 50 VAL N N 50 122.122 122.122 120.927 1.195 18703 632 1 2 . 1 1 50 50 VAL HA H 50 3.792 3.792 3.715 0.077 18703 633 1 2 . 1 1 50 50 VAL C C 50 176.774 176.774 176.988 -0.214 18703 634 1 2 . 1 1 50 50 VAL CA C 50 64.864 64.864 65.807 -0.943 18703 635 1 2 . 1 1 50 50 VAL CB C 50 32.179 32.179 31.591 0.588 18703 636 1 2 . 1 1 50 50 VAL H H 50 8.095 8.095 8.236 -0.141 18703 637 1 2 . 1 1 51 51 LYS N N 51 120.602 120.602 117.775 2.827 18703 638 1 2 . 1 1 51 51 LYS HA H 51 4.195 4.195 4.051 0.144 18703 639 1 2 . 1 1 51 51 LYS C C 51 178.530 178.530 178.951 -0.421 18703 640 1 2 . 1 1 51 51 LYS CA C 51 59.348 59.348 59.580 -0.232 18703 641 1 2 . 1 1 51 51 LYS CB C 51 32.265 32.265 31.943 0.322 18703 642 1 2 . 1 1 51 51 LYS H H 51 8.268 8.268 8.319 -0.051 18703 643 1 2 . 1 1 52 52 LYS N N 52 117.547 117.547 120.398 -2.851 18703 644 1 2 . 1 1 52 52 LYS HA H 52 4.162 4.162 4.042 0.120 18703 645 1 2 . 1 1 52 52 LYS C C 52 179.132 179.132 178.888 0.244 18703 646 1 2 . 1 1 52 52 LYS CA C 52 58.811 58.811 58.795 0.015 18703 647 1 2 . 1 1 52 52 LYS CB C 52 32.054 32.054 31.647 0.407 18703 648 1 2 . 1 1 52 52 LYS H H 52 7.595 7.595 7.648 -0.053 18703 649 1 2 . 1 1 53 53 VAL N N 53 119.190 119.190 117.789 1.401 18703 650 1 2 . 1 1 53 53 VAL HA H 53 3.767 3.767 3.737 0.030 18703 651 1 2 . 1 1 53 53 VAL C C 53 177.933 177.933 178.195 -0.262 18703 652 1 2 . 1 1 53 53 VAL CA C 53 66.065 66.065 65.864 0.201 18703 653 1 2 . 1 1 53 53 VAL CB C 53 31.248 31.248 30.684 0.564 18703 654 1 2 . 1 1 53 53 VAL H H 53 7.597 7.597 7.559 0.038 18703 655 1 2 . 1 1 54 54 GLU N N 54 120.226 120.226 119.378 0.848 18703 656 1 2 . 1 1 54 54 GLU HA H 54 3.833 3.833 4.015 -0.182 18703 657 1 2 . 1 1 54 54 GLU C C 54 179.352 179.352 178.769 0.583 18703 658 1 2 . 1 1 54 54 GLU CA C 54 59.153 59.153 59.651 -0.498 18703 659 1 2 . 1 1 54 54 GLU CB C 54 29.224 29.224 29.346 -0.122 18703 660 1 2 . 1 1 54 54 GLU H H 54 8.609 8.609 7.654 0.955 18703 661 1 2 . 1 1 55 55 GLU N N 55 119.148 119.148 119.572 -0.424 18703 662 1 2 . 1 1 55 55 GLU HA H 55 4.084 4.084 4.108 -0.024 18703 663 1 2 . 1 1 55 55 GLU C C 55 179.084 179.084 178.827 0.257 18703 664 1 2 . 1 1 55 55 GLU CA C 55 59.295 59.295 59.051 0.244 18703 665 1 2 . 1 1 55 55 GLU CB C 55 29.361 29.361 29.559 -0.198 18703 666 1 2 . 1 1 55 55 GLU H H 55 7.713 7.713 7.848 -0.135 18703 667 1 2 . 1 1 56 56 GLU N N 56 120.301 120.301 118.493 1.808 18703 668 1 2 . 1 1 56 56 GLU HA H 56 4.079 4.079 4.130 -0.051 18703 669 1 2 . 1 1 56 56 GLU C C 56 179.773 179.773 179.305 0.468 18703 670 1 2 . 1 1 56 56 GLU CA C 56 59.528 59.528 59.217 0.311 18703 671 1 2 . 1 1 56 56 GLU CB C 56 30.162 30.162 29.714 0.448 18703 672 1 2 . 1 1 56 56 GLU H H 56 7.899 7.899 7.609 0.290 18703 673 1 2 . 1 1 57 57 VAL N N 57 121.536 121.536 119.737 1.799 18703 674 1 2 . 1 1 57 57 VAL HA H 57 3.540 3.540 3.821 -0.281 18703 675 1 2 . 1 1 57 57 VAL C C 57 176.984 176.984 177.350 -0.366 18703 676 1 2 . 1 1 57 57 VAL CA C 57 66.734 66.734 65.939 0.796 18703 677 1 2 . 1 1 57 57 VAL CB C 57 31.425 31.425 31.505 -0.080 18703 678 1 2 . 1 1 57 57 VAL H H 57 8.652 8.652 7.538 1.114 18703 679 1 2 . 1 1 58 58 LYS N N 58 120.219 120.219 120.014 0.205 18703 680 1 2 . 1 1 58 58 LYS HA H 58 4.199 4.199 4.098 0.101 18703 681 1 2 . 1 1 58 58 LYS C C 58 178.972 178.972 178.499 0.473 18703 682 1 2 . 1 1 58 58 LYS CA C 58 59.357 59.357 59.213 0.144 18703 683 1 2 . 1 1 58 58 LYS CB C 58 32.186 32.186 32.042 0.144 18703 684 1 2 . 1 1 58 58 LYS H H 58 7.791 7.791 7.444 0.347 18703 685 1 2 . 1 1 59 59 LYS N N 59 118.252 118.252 119.556 -1.304 18703 686 1 2 . 1 1 59 59 LYS HA H 59 4.069 4.069 4.168 -0.099 18703 687 1 2 . 1 1 59 59 LYS C C 59 179.180 179.180 178.580 0.600 18703 688 1 2 . 1 1 59 59 LYS CA C 59 59.285 59.285 59.040 0.245 18703 689 1 2 . 1 1 59 59 LYS CB C 59 32.345 32.345 32.280 0.065 18703 690 1 2 . 1 1 59 59 LYS H H 59 7.849 7.849 7.508 0.341 18703 691 1 2 . 1 1 60 60 LEU N N 60 121.243 121.243 119.708 1.535 18703 692 1 2 . 1 1 60 60 LEU HA H 60 4.242 4.242 4.133 0.109 18703 693 1 2 . 1 1 60 60 LEU C C 60 178.413 178.413 178.127 0.286 18703 694 1 2 . 1 1 60 60 LEU CA C 60 57.798 57.798 57.227 0.571 18703 695 1 2 . 1 1 60 60 LEU CB C 60 41.150 41.150 42.130 -0.980 18703 696 1 2 . 1 1 60 60 LEU H H 60 7.825 7.825 7.548 0.277 18703 697 1 2 . 1 1 61 61 GLU N N 61 118.844 118.844 120.109 -1.265 18703 698 1 2 . 1 1 61 61 GLU HA H 61 3.800 3.800 3.913 -0.113 18703 699 1 2 . 1 1 61 61 GLU C C 61 179.078 179.078 178.567 0.511 18703 700 1 2 . 1 1 61 61 GLU CA C 61 60.104 60.104 59.898 0.206 18703 701 1 2 . 1 1 61 61 GLU CB C 61 29.864 29.864 29.625 0.239 18703 702 1 2 . 1 1 61 61 GLU H H 61 8.582 8.582 7.713 0.869 18703 703 1 2 . 1 1 62 62 GLU N N 62 117.659 117.659 118.860 -1.201 18703 704 1 2 . 1 1 62 62 GLU HA H 62 3.990 3.990 4.041 -0.051 18703 705 1 2 . 1 1 62 62 GLU C C 62 178.847 178.847 178.910 -0.063 18703 706 1 2 . 1 1 62 62 GLU CA C 62 59.067 59.067 58.992 0.076 18703 707 1 2 . 1 1 62 62 GLU CB C 62 29.440 29.440 29.625 -0.185 18703 708 1 2 . 1 1 62 62 GLU H H 62 8.032 8.032 7.656 0.376 18703 709 1 2 . 1 1 63 63 GLU N N 63 119.290 119.290 119.247 0.043 18703 710 1 2 . 1 1 63 63 GLU HA H 63 4.012 4.012 4.067 -0.055 18703 711 1 2 . 1 1 63 63 GLU C C 63 179.784 179.784 179.144 0.640 18703 712 1 2 . 1 1 63 63 GLU CA C 63 59.300 59.300 59.279 0.021 18703 713 1 2 . 1 1 63 63 GLU CB C 63 29.728 29.728 29.638 0.090 18703 714 1 2 . 1 1 63 63 GLU H H 63 7.958 7.958 7.471 0.487 18703 715 1 2 . 1 1 64 64 ILE N N 64 118.453 118.453 118.499 -0.046 18703 716 1 2 . 1 1 64 64 ILE HA H 64 3.711 3.711 3.822 -0.111 18703 717 1 2 . 1 1 64 64 ILE C C 64 177.655 177.655 178.064 -0.409 18703 718 1 2 . 1 1 64 64 ILE CA C 64 64.256 64.256 63.969 0.287 18703 719 1 2 . 1 1 64 64 ILE CB C 64 38.002 38.002 37.739 0.263 18703 720 1 2 . 1 1 64 64 ILE H H 64 8.160 8.160 7.527 0.633 18703 721 1 2 . 1 1 65 65 LYS N N 65 118.871 118.871 119.174 -0.303 18703 722 1 2 . 1 1 65 65 LYS HA H 65 4.111 4.111 4.118 -0.007 18703 723 1 2 . 1 1 65 65 LYS C C 65 177.076 177.076 177.762 -0.686 18703 724 1 2 . 1 1 65 65 LYS CA C 65 58.421 58.421 58.395 0.026 18703 725 1 2 . 1 1 65 65 LYS CB C 65 32.639 32.639 32.136 0.503 18703 726 1 2 . 1 1 65 65 LYS H H 65 7.664 7.664 7.751 -0.087 18703 727 1 2 . 1 1 66 66 LYS N N 66 116.944 116.944 118.740 -1.796 18703 728 1 2 . 1 1 66 66 LYS HA H 66 4.320 4.320 4.095 0.225 18703 729 1 2 . 1 1 66 66 LYS C C 66 175.897 175.897 177.746 -1.849 18703 730 1 2 . 1 1 66 66 LYS CA C 66 56.352 56.352 58.167 -1.815 18703 731 1 2 . 1 1 66 66 LYS CB C 66 33.024 33.024 32.763 0.261 18703 732 1 2 . 1 1 66 66 LYS H H 66 7.246 7.246 7.451 -0.205 18703 733 1 3 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.309 -0.063 18703 734 1 3 . 1 1 3 3 ARG C C 3 178.379 178.379 176.890 1.489 18703 735 1 3 . 1 1 3 3 ARG CA C 3 58.367 58.367 57.191 1.176 18703 736 1 3 . 1 1 3 3 ARG CB C 3 30.691 30.691 30.609 0.082 18703 737 1 3 . 1 1 3 3 ARG H H 3 7.905 7.905 8.390 -0.485 18703 738 1 3 . 1 1 4 4 VAL N N 4 118.966 118.966 121.208 -2.242 18703 739 1 3 . 1 1 4 4 VAL HA H 4 3.803 3.803 3.676 0.127 18703 740 1 3 . 1 1 4 4 VAL C C 4 176.968 176.968 177.041 -0.073 18703 741 1 3 . 1 1 4 4 VAL CA C 4 65.441 65.441 65.485 -0.044 18703 742 1 3 . 1 1 4 4 VAL CB C 4 31.710 31.710 31.760 -0.050 18703 743 1 3 . 1 1 4 4 VAL H H 4 8.070 8.070 8.500 -0.430 18703 744 1 3 . 1 1 5 5 LYS N N 5 122.058 122.058 118.572 3.486 18703 745 1 3 . 1 1 5 5 LYS HA H 5 4.154 4.154 4.333 -0.179 18703 746 1 3 . 1 1 5 5 LYS C C 5 178.553 178.553 178.062 0.491 18703 747 1 3 . 1 1 5 5 LYS CA C 5 58.712 58.712 58.902 -0.190 18703 748 1 3 . 1 1 5 5 LYS CB C 5 31.788 31.788 31.727 0.061 18703 749 1 3 . 1 1 5 5 LYS H H 5 7.798 7.798 8.351 -0.553 18703 750 1 3 . 1 1 6 6 ALA N N 6 119.955 119.955 121.768 -1.813 18703 751 1 3 . 1 1 6 6 ALA HA H 6 4.198 4.198 4.226 -0.028 18703 752 1 3 . 1 1 6 6 ALA C C 6 180.974 180.974 179.528 1.446 18703 753 1 3 . 1 1 6 6 ALA CA C 6 54.850 54.850 54.331 0.519 18703 754 1 3 . 1 1 6 6 ALA CB C 6 17.995 17.995 18.342 -0.347 18703 755 1 3 . 1 1 6 6 ALA H H 6 7.928 7.928 7.620 0.308 18703 756 1 3 . 1 1 7 7 LEU N N 7 119.211 119.211 118.852 0.359 18703 757 1 3 . 1 1 7 7 LEU HA H 7 4.124 4.124 3.991 0.133 18703 758 1 3 . 1 1 7 7 LEU C C 7 178.353 178.353 178.618 -0.265 18703 759 1 3 . 1 1 7 7 LEU CA C 7 57.658 57.658 57.169 0.489 18703 760 1 3 . 1 1 7 7 LEU CB C 7 41.971 41.971 42.033 -0.062 18703 761 1 3 . 1 1 7 7 LEU H H 7 7.594 7.594 7.367 0.227 18703 762 1 3 . 1 1 8 8 GLU N N 8 120.258 120.258 118.481 1.777 18703 763 1 3 . 1 1 8 8 GLU HA H 8 3.846 3.846 4.038 -0.192 18703 764 1 3 . 1 1 8 8 GLU C C 8 179.546 179.546 178.731 0.815 18703 765 1 3 . 1 1 8 8 GLU CA C 8 60.006 60.006 59.636 0.370 18703 766 1 3 . 1 1 8 8 GLU CB C 8 29.683 29.683 29.557 0.126 18703 767 1 3 . 1 1 8 8 GLU H H 8 8.382 8.382 7.779 0.603 18703 768 1 3 . 1 1 9 9 GLU N N 9 118.584 118.584 119.072 -0.488 18703 769 1 3 . 1 1 9 9 GLU HA H 9 4.039 4.039 4.073 -0.034 18703 770 1 3 . 1 1 9 9 GLU C C 9 179.635 179.635 178.619 1.016 18703 771 1 3 . 1 1 9 9 GLU CA C 9 59.235 59.235 58.669 0.566 18703 772 1 3 . 1 1 9 9 GLU CB C 9 29.358 29.358 28.912 0.446 18703 773 1 3 . 1 1 9 9 GLU H H 9 7.908 7.908 7.849 0.059 18703 774 1 3 . 1 1 10 10 LYS N N 10 120.956 120.956 119.463 1.493 18703 775 1 3 . 1 1 10 10 LYS HA H 10 4.190 4.190 4.137 0.053 18703 776 1 3 . 1 1 10 10 LYS C C 10 179.395 179.395 178.807 0.588 18703 777 1 3 . 1 1 10 10 LYS CA C 10 59.231 59.231 59.110 0.121 18703 778 1 3 . 1 1 10 10 LYS CB C 10 32.211 32.211 32.626 -0.415 18703 779 1 3 . 1 1 10 10 LYS H H 10 8.009 8.009 7.495 0.514 18703 780 1 3 . 1 1 11 11 VAL N N 11 119.577 119.577 118.463 1.114 18703 781 1 3 . 1 1 11 11 VAL HA H 11 3.844 3.844 3.675 0.169 18703 782 1 3 . 1 1 11 11 VAL C C 11 177.078 177.078 177.572 -0.494 18703 783 1 3 . 1 1 11 11 VAL CA C 11 66.407 66.407 65.169 1.238 18703 784 1 3 . 1 1 11 11 VAL CB C 11 31.252 31.252 30.855 0.397 18703 785 1 3 . 1 1 11 11 VAL H H 11 8.488 8.488 7.488 1.000 18703 786 1 3 . 1 1 12 12 LYS N N 12 122.864 122.864 119.619 3.245 18703 787 1 3 . 1 1 12 12 LYS HA H 12 4.189 4.189 3.917 0.272 18703 788 1 3 . 1 1 12 12 LYS C C 12 178.755 178.755 178.322 0.433 18703 789 1 3 . 1 1 12 12 LYS CA C 12 59.375 59.375 59.803 -0.428 18703 790 1 3 . 1 1 12 12 LYS CB C 12 31.991 31.991 32.204 -0.213 18703 791 1 3 . 1 1 12 12 LYS H H 12 7.944 7.944 7.600 0.344 18703 792 1 3 . 1 1 13 13 ALA N N 13 121.202 121.202 120.669 0.533 18703 793 1 3 . 1 1 13 13 ALA HA H 13 4.209 4.209 4.255 -0.046 18703 794 1 3 . 1 1 13 13 ALA C C 13 181.060 181.060 179.595 1.465 18703 795 1 3 . 1 1 13 13 ALA CA C 13 54.710 54.710 54.182 0.528 18703 796 1 3 . 1 1 13 13 ALA CB C 13 17.861 17.861 18.384 -0.523 18703 797 1 3 . 1 1 13 13 ALA H H 13 7.563 7.563 7.448 0.115 18703 798 1 3 . 1 1 14 14 LEU N N 14 120.014 120.014 119.672 0.342 18703 799 1 3 . 1 1 14 14 LEU HA H 14 4.072 4.072 4.001 0.071 18703 800 1 3 . 1 1 14 14 LEU C C 14 177.862 177.862 178.203 -0.341 18703 801 1 3 . 1 1 14 14 LEU CA C 14 57.864 57.864 57.440 0.424 18703 802 1 3 . 1 1 14 14 LEU CB C 14 41.539 41.539 42.095 -0.556 18703 803 1 3 . 1 1 14 14 LEU H H 14 8.087 8.087 7.503 0.584 18703 804 1 3 . 1 1 15 15 GLU N N 15 121.644 121.644 120.055 1.589 18703 805 1 3 . 1 1 15 15 GLU HA H 15 3.692 3.692 3.988 -0.296 18703 806 1 3 . 1 1 15 15 GLU C C 15 177.819 177.819 178.302 -0.483 18703 807 1 3 . 1 1 15 15 GLU CA C 15 59.239 59.239 59.390 -0.151 18703 808 1 3 . 1 1 15 15 GLU CB C 15 28.865 28.865 29.539 -0.674 18703 809 1 3 . 1 1 15 15 GLU H H 15 8.542 8.542 7.685 0.857 18703 810 1 3 . 1 1 16 16 GLU N N 16 116.016 116.016 118.537 -2.521 18703 811 1 3 . 1 1 16 16 GLU HA H 16 3.955 3.955 4.015 -0.060 18703 812 1 3 . 1 1 16 16 GLU C C 16 179.159 179.159 179.228 -0.069 18703 813 1 3 . 1 1 16 16 GLU CA C 16 59.324 59.324 59.277 0.047 18703 814 1 3 . 1 1 16 16 GLU CB C 16 29.060 29.060 29.148 -0.088 18703 815 1 3 . 1 1 16 16 GLU H H 16 7.492 7.492 7.970 -0.478 18703 816 1 3 . 1 1 17 17 LYS N N 17 118.546 118.546 118.781 -0.235 18703 817 1 3 . 1 1 17 17 LYS HA H 17 4.117 4.117 4.123 -0.006 18703 818 1 3 . 1 1 17 17 LYS C C 17 178.976 178.976 178.185 0.791 18703 819 1 3 . 1 1 17 17 LYS CA C 17 58.837 58.837 59.068 -0.231 18703 820 1 3 . 1 1 17 17 LYS CB C 17 32.538 32.538 32.549 -0.011 18703 821 1 3 . 1 1 17 17 LYS H H 17 7.720 7.720 7.435 0.285 18703 822 1 3 . 1 1 18 18 VAL N N 18 118.376 118.376 118.834 -0.458 18703 823 1 3 . 1 1 18 18 VAL HA H 18 3.711 3.711 3.828 -0.117 18703 824 1 3 . 1 1 18 18 VAL C C 18 178.765 178.765 178.408 0.357 18703 825 1 3 . 1 1 18 18 VAL CA C 18 66.237 66.237 65.710 0.527 18703 826 1 3 . 1 1 18 18 VAL CB C 18 31.682 31.682 31.962 -0.280 18703 827 1 3 . 1 1 18 18 VAL H H 18 8.754 8.754 7.252 1.502 18703 828 1 3 . 1 1 19 19 LYS N N 19 118.817 118.817 119.856 -1.039 18703 829 1 3 . 1 1 19 19 LYS HA H 19 4.078 4.078 3.951 0.127 18703 830 1 3 . 1 1 19 19 LYS C C 19 178.049 178.049 177.249 0.800 18703 831 1 3 . 1 1 19 19 LYS CA C 19 59.731 59.731 59.379 0.352 18703 832 1 3 . 1 1 19 19 LYS CB C 19 32.523 32.523 32.128 0.395 18703 833 1 3 . 1 1 19 19 LYS H H 19 8.299 8.299 8.662 -0.363 18703 834 1 3 . 1 1 20 20 ALA N N 20 119.656 119.656 118.934 0.722 18703 835 1 3 . 1 1 20 20 ALA HA H 20 4.347 4.347 4.371 -0.024 18703 836 1 3 . 1 1 20 20 ALA C C 20 178.532 178.532 178.665 -0.133 18703 837 1 3 . 1 1 20 20 ALA CA C 20 52.853 52.853 52.750 0.103 18703 838 1 3 . 1 1 20 20 ALA CB C 20 18.832 18.832 19.054 -0.222 18703 839 1 3 . 1 1 20 20 ALA H H 20 7.425 7.425 7.542 -0.117 18703 840 1 3 . 1 1 21 21 LEU N N 21 118.594 118.594 120.289 -1.695 18703 841 1 3 . 1 1 21 21 LEU HA H 21 4.297 4.297 4.081 0.216 18703 842 1 3 . 1 1 21 21 LEU C C 21 177.784 177.784 177.748 0.036 18703 843 1 3 . 1 1 21 21 LEU CA C 21 55.750 55.750 56.120 -0.370 18703 844 1 3 . 1 1 21 21 LEU CB C 21 42.898 42.898 42.687 0.211 18703 845 1 3 . 1 1 21 21 LEU H H 21 7.508 7.508 7.846 -0.338 18703 846 1 3 . 1 1 22 22 GLY N N 22 106.650 106.650 105.141 1.509 18703 847 1 3 . 1 1 22 22 GLY C C 22 173.605 173.605 173.575 0.030 18703 848 1 3 . 1 1 22 22 GLY CA C 22 45.330 45.330 44.476 0.854 18703 849 1 3 . 1 1 22 22 GLY H H 22 7.814 7.814 7.990 -0.176 18703 850 1 3 . 1 1 23 23 GLY N N 23 108.011 108.011 109.502 -1.491 18703 851 1 3 . 1 1 23 23 GLY C C 23 174.061 174.061 173.431 0.630 18703 852 1 3 . 1 1 23 23 GLY CA C 23 44.772 44.772 44.711 0.061 18703 853 1 3 . 1 1 23 23 GLY H H 23 8.139 8.139 8.357 -0.218 18703 854 1 3 . 1 1 24 24 GLY N N 24 107.826 107.826 106.607 1.219 18703 855 1 3 . 1 1 24 24 GLY C C 24 175.046 175.046 174.056 0.990 18703 856 1 3 . 1 1 24 24 GLY CA C 24 44.422 44.422 44.821 -0.399 18703 857 1 3 . 1 1 24 24 GLY H H 24 8.497 8.497 8.198 0.299 18703 858 1 3 . 1 1 25 25 GLY N N 25 108.830 108.830 112.057 -3.227 18703 859 1 3 . 1 1 25 25 GLY C C 25 176.272 176.272 175.662 0.610 18703 860 1 3 . 1 1 25 25 GLY CA C 25 47.101 47.101 45.371 1.730 18703 861 1 3 . 1 1 25 25 GLY H H 25 8.616 8.616 8.184 0.432 18703 862 1 3 . 1 1 26 26 ARG N N 26 123.109 123.109 123.365 -0.256 18703 863 1 3 . 1 1 26 26 ARG HA H 26 4.283 4.283 4.169 0.114 18703 864 1 3 . 1 1 26 26 ARG C C 26 177.848 177.848 178.322 -0.474 18703 865 1 3 . 1 1 26 26 ARG CA C 26 57.663 57.663 58.181 -0.518 18703 866 1 3 . 1 1 26 26 ARG CB C 26 29.811 29.811 30.169 -0.358 18703 867 1 3 . 1 1 26 26 ARG H H 26 8.770 8.770 8.384 0.386 18703 868 1 3 . 1 1 27 27 ILE N N 27 118.104 118.104 118.927 -0.823 18703 869 1 3 . 1 1 27 27 ILE HA H 27 3.787 3.787 3.826 -0.039 18703 870 1 3 . 1 1 27 27 ILE C C 27 177.473 177.473 178.086 -0.613 18703 871 1 3 . 1 1 27 27 ILE CA C 27 63.036 63.036 64.597 -1.561 18703 872 1 3 . 1 1 27 27 ILE CB C 27 36.664 36.664 37.526 -0.862 18703 873 1 3 . 1 1 27 27 ILE H H 27 7.708 7.708 8.126 -0.418 18703 874 1 3 . 1 1 28 28 GLU N N 28 119.934 119.934 119.274 0.660 18703 875 1 3 . 1 1 28 28 GLU HA H 28 3.954 3.954 3.882 0.072 18703 876 1 3 . 1 1 28 28 GLU C C 28 179.514 179.514 178.736 0.778 18703 877 1 3 . 1 1 28 28 GLU CA C 28 59.450 59.450 60.306 -0.855 18703 878 1 3 . 1 1 28 28 GLU CB C 28 29.600 29.600 29.235 0.365 18703 879 1 3 . 1 1 28 28 GLU H H 28 7.872 7.872 8.228 -0.356 18703 880 1 3 . 1 1 29 29 GLU N N 29 118.134 118.134 119.491 -1.357 18703 881 1 3 . 1 1 29 29 GLU HA H 29 4.028 4.028 4.096 -0.068 18703 882 1 3 . 1 1 29 29 GLU C C 29 179.182 179.182 179.304 -0.122 18703 883 1 3 . 1 1 29 29 GLU CA C 29 59.173 59.173 59.026 0.147 18703 884 1 3 . 1 1 29 29 GLU CB C 29 29.503 29.503 29.436 0.067 18703 885 1 3 . 1 1 29 29 GLU H H 29 8.166 8.166 7.631 0.535 18703 886 1 3 . 1 1 30 30 LEU N N 30 120.242 120.242 118.020 2.222 18703 887 1 3 . 1 1 30 30 LEU HA H 30 4.028 4.028 4.119 -0.091 18703 888 1 3 . 1 1 30 30 LEU C C 30 178.796 178.796 178.639 0.157 18703 889 1 3 . 1 1 30 30 LEU CA C 30 57.654 57.654 56.804 0.850 18703 890 1 3 . 1 1 30 30 LEU CB C 30 41.629 41.629 41.962 -0.333 18703 891 1 3 . 1 1 30 30 LEU H H 30 7.695 7.695 7.521 0.174 18703 892 1 3 . 1 1 31 31 LYS N N 31 120.506 120.506 120.528 -0.022 18703 893 1 3 . 1 1 31 31 LYS HA H 31 3.532 3.532 4.054 -0.522 18703 894 1 3 . 1 1 31 31 LYS C C 31 178.919 178.919 178.386 0.533 18703 895 1 3 . 1 1 31 31 LYS CA C 31 60.240 60.240 59.379 0.861 18703 896 1 3 . 1 1 31 31 LYS CB C 31 32.015 32.015 32.304 -0.289 18703 897 1 3 . 1 1 31 31 LYS H H 31 8.561 8.561 7.797 0.764 18703 898 1 3 . 1 1 32 32 LYS N N 32 118.566 118.566 118.203 0.363 18703 899 1 3 . 1 1 32 32 LYS C C 32 179.392 179.392 179.331 0.061 18703 900 1 3 . 1 1 32 32 LYS CA C 32 59.356 59.356 59.551 -0.195 18703 901 1 3 . 1 1 32 32 LYS CB C 32 32.117 32.117 32.312 -0.195 18703 902 1 3 . 1 1 32 32 LYS H H 32 7.699 7.699 7.568 0.131 18703 903 1 3 . 1 1 33 33 LYS N N 33 118.964 118.964 118.434 0.530 18703 904 1 3 . 1 1 33 33 LYS HA H 33 4.117 4.117 4.216 -0.099 18703 905 1 3 . 1 1 33 33 LYS C C 33 178.355 178.355 178.574 -0.219 18703 906 1 3 . 1 1 33 33 LYS CA C 33 58.633 58.633 58.838 -0.205 18703 907 1 3 . 1 1 33 33 LYS CB C 33 31.904 31.904 32.410 -0.506 18703 908 1 3 . 1 1 33 33 LYS H H 33 7.752 7.752 7.619 0.133 18703 909 1 3 . 1 1 34 34 CYS N N 34 119.956 119.956 119.028 0.928 18703 910 1 3 . 1 1 34 34 CYS HA H 34 3.967 3.967 4.104 -0.137 18703 911 1 3 . 1 1 34 34 CYS C C 34 175.521 175.521 176.832 -1.311 18703 912 1 3 . 1 1 34 34 CYS CA C 34 60.987 60.987 63.014 -2.027 18703 913 1 3 . 1 1 34 34 CYS CB C 34 36.600 36.600 26.714 9.886 18703 914 1 3 . 1 1 34 34 CYS H H 34 8.393 8.393 7.540 0.853 18703 915 1 3 . 1 1 35 35 GLU N N 35 120.327 120.327 119.585 0.742 18703 916 1 3 . 1 1 35 35 GLU HA H 35 3.891 3.891 3.941 -0.050 18703 917 1 3 . 1 1 35 35 GLU C C 35 179.684 179.684 178.539 1.145 18703 918 1 3 . 1 1 35 35 GLU CA C 35 60.059 60.059 59.318 0.741 18703 919 1 3 . 1 1 35 35 GLU CB C 35 29.718 29.718 28.627 1.091 18703 920 1 3 . 1 1 35 35 GLU H H 35 8.558 8.558 7.945 0.613 18703 921 1 3 . 1 1 36 36 GLU N N 36 120.190 120.190 119.859 0.331 18703 922 1 3 . 1 1 36 36 GLU HA H 36 4.051 4.051 4.009 0.042 18703 923 1 3 . 1 1 36 36 GLU C C 36 179.408 179.408 178.955 0.453 18703 924 1 3 . 1 1 36 36 GLU CA C 36 59.148 59.148 58.931 0.217 18703 925 1 3 . 1 1 36 36 GLU CB C 36 29.766 29.766 29.638 0.128 18703 926 1 3 . 1 1 36 36 GLU H H 36 8.038 8.038 7.645 0.393 18703 927 1 3 . 1 1 37 37 LEU N N 37 121.102 121.102 119.446 1.656 18703 928 1 3 . 1 1 37 37 LEU HA H 37 4.079 4.079 4.207 -0.128 18703 929 1 3 . 1 1 37 37 LEU C C 37 178.279 178.279 178.271 0.008 18703 930 1 3 . 1 1 37 37 LEU CA C 37 57.803 57.803 57.403 0.400 18703 931 1 3 . 1 1 37 37 LEU CB C 37 41.502 41.502 41.797 -0.295 18703 932 1 3 . 1 1 37 37 LEU H H 37 8.065 8.065 7.502 0.563 18703 933 1 3 . 1 1 38 38 LYS N N 38 119.980 119.980 119.107 0.873 18703 934 1 3 . 1 1 38 38 LYS HA H 38 3.851 3.851 3.880 -0.029 18703 935 1 3 . 1 1 38 38 LYS C C 38 178.919 178.919 179.112 -0.193 18703 936 1 3 . 1 1 38 38 LYS CA C 38 60.794 60.794 60.211 0.583 18703 937 1 3 . 1 1 38 38 LYS CB C 38 32.863 32.863 32.150 0.713 18703 938 1 3 . 1 1 38 38 LYS H H 38 8.741 8.741 7.686 1.055 18703 939 1 3 . 1 1 39 39 LYS N N 39 118.307 118.307 117.523 0.784 18703 940 1 3 . 1 1 39 39 LYS HA H 39 4.125 4.125 4.001 0.124 18703 941 1 3 . 1 1 39 39 LYS C C 39 178.622 178.622 178.515 0.107 18703 942 1 3 . 1 1 39 39 LYS CA C 39 58.993 58.993 59.104 -0.111 18703 943 1 3 . 1 1 39 39 LYS CB C 39 32.097 32.097 31.822 0.275 18703 944 1 3 . 1 1 39 39 LYS H H 39 7.584 7.584 7.689 -0.105 18703 945 1 3 . 1 1 40 40 LYS N N 40 118.826 118.826 119.365 -0.539 18703 946 1 3 . 1 1 40 40 LYS HA H 40 4.069 4.069 4.171 -0.102 18703 947 1 3 . 1 1 40 40 LYS C C 40 179.802 179.802 178.884 0.918 18703 948 1 3 . 1 1 40 40 LYS CA C 40 59.322 59.322 58.516 0.806 18703 949 1 3 . 1 1 40 40 LYS CB C 40 32.505 32.505 32.164 0.341 18703 950 1 3 . 1 1 40 40 LYS H H 40 7.945 7.945 7.382 0.563 18703 951 1 3 . 1 1 41 41 ILE N N 41 118.958 118.958 118.405 0.553 18703 952 1 3 . 1 1 41 41 ILE HA H 41 3.659 3.659 3.768 -0.109 18703 953 1 3 . 1 1 41 41 ILE C C 41 178.146 178.146 176.889 1.257 18703 954 1 3 . 1 1 41 41 ILE CA C 41 65.037 65.037 64.217 0.820 18703 955 1 3 . 1 1 41 41 ILE CB C 41 37.950 37.950 37.806 0.144 18703 956 1 3 . 1 1 41 41 ILE H H 41 8.369 8.369 7.878 0.491 18703 957 1 3 . 1 1 42 42 GLU N N 42 120.331 120.331 117.290 3.041 18703 958 1 3 . 1 1 42 42 GLU HA H 42 4.094 4.094 4.075 0.019 18703 959 1 3 . 1 1 42 42 GLU C C 42 178.697 178.697 177.500 1.197 18703 960 1 3 . 1 1 42 42 GLU CA C 42 58.927 58.927 58.515 0.412 18703 961 1 3 . 1 1 42 42 GLU CB C 42 29.399 29.399 30.365 -0.966 18703 962 1 3 . 1 1 42 42 GLU H H 42 7.805 7.805 7.558 0.247 18703 963 1 3 . 1 1 43 43 GLU N N 43 117.120 117.120 116.411 0.709 18703 964 1 3 . 1 1 43 43 GLU HA H 43 4.291 4.291 4.178 0.113 18703 965 1 3 . 1 1 43 43 GLU C C 43 177.551 177.551 177.618 -0.067 18703 966 1 3 . 1 1 43 43 GLU CA C 43 56.800 56.800 57.125 -0.325 18703 967 1 3 . 1 1 43 43 GLU CB C 43 29.931 29.931 29.674 0.257 18703 968 1 3 . 1 1 43 43 GLU H H 43 7.701 7.701 7.575 0.126 18703 969 1 3 . 1 1 44 44 LEU N N 44 120.940 120.940 120.966 -0.026 18703 970 1 3 . 1 1 44 44 LEU HA H 44 4.251 4.251 4.023 0.228 18703 971 1 3 . 1 1 44 44 LEU C C 44 178.596 178.596 177.025 1.571 18703 972 1 3 . 1 1 44 44 LEU CA C 44 56.448 56.448 55.329 1.119 18703 973 1 3 . 1 1 44 44 LEU CB C 44 42.519 42.519 42.509 0.010 18703 974 1 3 . 1 1 44 44 LEU H H 44 7.581 7.581 7.382 0.199 18703 975 1 3 . 1 1 45 45 GLY N N 45 108.689 108.689 106.791 1.898 18703 976 1 3 . 1 1 45 45 GLY C C 45 174.853 174.853 173.722 1.131 18703 977 1 3 . 1 1 45 45 GLY CA C 45 46.233 46.233 45.496 0.737 18703 978 1 3 . 1 1 45 45 GLY H H 45 8.232 8.232 8.454 -0.222 18703 979 1 3 . 1 1 46 46 GLY N N 46 108.029 108.029 108.223 -0.194 18703 980 1 3 . 1 1 46 46 GLY C C 46 174.351 174.351 173.675 0.676 18703 981 1 3 . 1 1 46 46 GLY CA C 46 45.105 45.105 45.044 0.061 18703 982 1 3 . 1 1 46 46 GLY H H 46 8.176 8.176 7.869 0.307 18703 983 1 3 . 1 1 47 47 GLY N N 47 108.183 108.183 109.566 -1.383 18703 984 1 3 . 1 1 47 47 GLY C C 47 174.671 174.671 174.980 -0.309 18703 985 1 3 . 1 1 47 47 GLY CA C 47 45.254 45.254 44.848 0.406 18703 986 1 3 . 1 1 47 47 GLY H H 47 8.290 8.290 7.810 0.480 18703 987 1 3 . 1 1 48 48 GLY N N 48 108.616 108.616 106.942 1.674 18703 988 1 3 . 1 1 48 48 GLY C C 48 174.321 174.321 176.350 -2.029 18703 989 1 3 . 1 1 48 48 GLY CA C 48 45.192 45.192 45.334 -0.142 18703 990 1 3 . 1 1 48 48 GLY H H 48 8.027 8.027 8.197 -0.170 18703 991 1 3 . 1 1 49 49 GLU N N 49 121.057 121.057 121.661 -0.604 18703 992 1 3 . 1 1 49 49 GLU HA H 49 4.425 4.425 4.219 0.206 18703 993 1 3 . 1 1 49 49 GLU C C 49 177.072 177.072 178.664 -1.592 18703 994 1 3 . 1 1 49 49 GLU CA C 49 56.330 56.330 57.726 -1.396 18703 995 1 3 . 1 1 49 49 GLU CB C 49 29.602 29.602 29.611 -0.009 18703 996 1 3 . 1 1 49 49 GLU H H 49 8.486 8.486 8.856 -0.370 18703 997 1 3 . 1 1 50 50 VAL N N 50 122.122 122.122 119.103 3.019 18703 998 1 3 . 1 1 50 50 VAL HA H 50 3.792 3.792 3.531 0.261 18703 999 1 3 . 1 1 50 50 VAL C C 50 176.774 176.774 177.258 -0.484 18703 1000 1 3 . 1 1 50 50 VAL CA C 50 64.864 64.864 65.619 -0.755 18703 1001 1 3 . 1 1 50 50 VAL CB C 50 32.179 32.179 31.458 0.721 18703 1002 1 3 . 1 1 50 50 VAL H H 50 8.095 8.095 8.038 0.057 18703 1003 1 3 . 1 1 51 51 LYS N N 51 120.602 120.602 117.865 2.737 18703 1004 1 3 . 1 1 51 51 LYS HA H 51 4.195 4.195 4.132 0.063 18703 1005 1 3 . 1 1 51 51 LYS C C 51 178.530 178.530 178.406 0.124 18703 1006 1 3 . 1 1 51 51 LYS CA C 51 59.348 59.348 58.390 0.958 18703 1007 1 3 . 1 1 51 51 LYS CB C 51 32.265 32.265 32.219 0.045 18703 1008 1 3 . 1 1 51 51 LYS H H 51 8.268 8.268 7.705 0.563 18703 1009 1 3 . 1 1 52 52 LYS N N 52 117.547 117.547 120.911 -3.364 18703 1010 1 3 . 1 1 52 52 LYS HA H 52 4.162 4.162 4.064 0.098 18703 1011 1 3 . 1 1 52 52 LYS C C 52 179.132 179.132 178.915 0.217 18703 1012 1 3 . 1 1 52 52 LYS CA C 52 58.811 58.811 59.470 -0.659 18703 1013 1 3 . 1 1 52 52 LYS CB C 52 32.054 32.054 32.299 -0.245 18703 1014 1 3 . 1 1 52 52 LYS H H 52 7.595 7.595 7.892 -0.297 18703 1015 1 3 . 1 1 53 53 VAL N N 53 119.190 119.190 118.098 1.092 18703 1016 1 3 . 1 1 53 53 VAL HA H 53 3.767 3.767 4.012 -0.245 18703 1017 1 3 . 1 1 53 53 VAL C C 53 177.933 177.933 178.317 -0.384 18703 1018 1 3 . 1 1 53 53 VAL CA C 53 66.065 66.065 65.277 0.788 18703 1019 1 3 . 1 1 53 53 VAL CB C 53 31.248 31.248 31.188 0.060 18703 1020 1 3 . 1 1 53 53 VAL H H 53 7.597 7.597 7.547 0.050 18703 1021 1 3 . 1 1 54 54 GLU N N 54 120.226 120.226 119.012 1.214 18703 1022 1 3 . 1 1 54 54 GLU HA H 54 3.833 3.833 3.979 -0.146 18703 1023 1 3 . 1 1 54 54 GLU C C 54 179.352 179.352 178.551 0.801 18703 1024 1 3 . 1 1 54 54 GLU CA C 54 59.153 59.153 59.370 -0.217 18703 1025 1 3 . 1 1 54 54 GLU CB C 54 29.224 29.224 29.457 -0.233 18703 1026 1 3 . 1 1 54 54 GLU H H 54 8.609 8.609 7.664 0.945 18703 1027 1 3 . 1 1 55 55 GLU N N 55 119.148 119.148 118.942 0.206 18703 1028 1 3 . 1 1 55 55 GLU HA H 55 4.084 4.084 4.139 -0.055 18703 1029 1 3 . 1 1 55 55 GLU C C 55 179.084 179.084 178.742 0.342 18703 1030 1 3 . 1 1 55 55 GLU CA C 55 59.295 59.295 58.772 0.523 18703 1031 1 3 . 1 1 55 55 GLU CB C 55 29.361 29.361 29.720 -0.358 18703 1032 1 3 . 1 1 55 55 GLU H H 55 7.713 7.713 7.689 0.024 18703 1033 1 3 . 1 1 56 56 GLU N N 56 120.301 120.301 119.495 0.806 18703 1034 1 3 . 1 1 56 56 GLU HA H 56 4.079 4.079 4.120 -0.041 18703 1035 1 3 . 1 1 56 56 GLU C C 56 179.773 179.773 179.219 0.554 18703 1036 1 3 . 1 1 56 56 GLU CA C 56 59.528 59.528 59.175 0.353 18703 1037 1 3 . 1 1 56 56 GLU CB C 56 30.162 30.162 29.724 0.438 18703 1038 1 3 . 1 1 56 56 GLU H H 56 7.899 7.899 7.569 0.330 18703 1039 1 3 . 1 1 57 57 VAL N N 57 121.536 121.536 118.220 3.316 18703 1040 1 3 . 1 1 57 57 VAL HA H 57 3.540 3.540 3.747 -0.207 18703 1041 1 3 . 1 1 57 57 VAL C C 57 176.984 176.984 177.463 -0.479 18703 1042 1 3 . 1 1 57 57 VAL CA C 57 66.734 66.734 65.510 1.224 18703 1043 1 3 . 1 1 57 57 VAL CB C 57 31.425 31.425 31.657 -0.233 18703 1044 1 3 . 1 1 57 57 VAL H H 57 8.652 8.652 7.579 1.073 18703 1045 1 3 . 1 1 58 58 LYS N N 58 120.219 120.219 119.951 0.268 18703 1046 1 3 . 1 1 58 58 LYS HA H 58 4.199 4.199 4.110 0.089 18703 1047 1 3 . 1 1 58 58 LYS C C 58 178.972 178.972 178.365 0.607 18703 1048 1 3 . 1 1 58 58 LYS CA C 58 59.357 59.357 59.554 -0.197 18703 1049 1 3 . 1 1 58 58 LYS CB C 58 32.186 32.186 32.272 -0.086 18703 1050 1 3 . 1 1 58 58 LYS H H 58 7.791 7.791 7.523 0.268 18703 1051 1 3 . 1 1 59 59 LYS N N 59 118.252 118.252 119.878 -1.626 18703 1052 1 3 . 1 1 59 59 LYS HA H 59 4.069 4.069 4.140 -0.071 18703 1053 1 3 . 1 1 59 59 LYS C C 59 179.180 179.180 178.599 0.581 18703 1054 1 3 . 1 1 59 59 LYS CA C 59 59.285 59.285 58.786 0.499 18703 1055 1 3 . 1 1 59 59 LYS CB C 59 32.345 32.345 32.571 -0.226 18703 1056 1 3 . 1 1 59 59 LYS H H 59 7.849 7.849 7.523 0.326 18703 1057 1 3 . 1 1 60 60 LEU N N 60 121.243 121.243 119.761 1.482 18703 1058 1 3 . 1 1 60 60 LEU HA H 60 4.242 4.242 4.145 0.097 18703 1059 1 3 . 1 1 60 60 LEU C C 60 178.413 178.413 178.081 0.332 18703 1060 1 3 . 1 1 60 60 LEU CA C 60 57.798 57.798 57.193 0.605 18703 1061 1 3 . 1 1 60 60 LEU CB C 60 41.150 41.150 42.141 -0.991 18703 1062 1 3 . 1 1 60 60 LEU H H 60 7.825 7.825 7.543 0.282 18703 1063 1 3 . 1 1 61 61 GLU N N 61 118.844 118.844 120.142 -1.298 18703 1064 1 3 . 1 1 61 61 GLU HA H 61 3.800 3.800 3.905 -0.105 18703 1065 1 3 . 1 1 61 61 GLU C C 61 179.078 179.078 178.584 0.494 18703 1066 1 3 . 1 1 61 61 GLU CA C 61 60.104 60.104 59.874 0.230 18703 1067 1 3 . 1 1 61 61 GLU CB C 61 29.864 29.864 29.637 0.227 18703 1068 1 3 . 1 1 61 61 GLU H H 61 8.582 8.582 7.714 0.868 18703 1069 1 3 . 1 1 62 62 GLU N N 62 117.659 117.659 118.817 -1.158 18703 1070 1 3 . 1 1 62 62 GLU HA H 62 3.990 3.990 4.044 -0.054 18703 1071 1 3 . 1 1 62 62 GLU C C 62 178.847 178.847 178.915 -0.068 18703 1072 1 3 . 1 1 62 62 GLU CA C 62 59.067 59.067 58.975 0.092 18703 1073 1 3 . 1 1 62 62 GLU CB C 62 29.440 29.440 29.613 -0.173 18703 1074 1 3 . 1 1 62 62 GLU H H 62 8.032 8.032 7.653 0.379 18703 1075 1 3 . 1 1 63 63 GLU N N 63 119.290 119.290 119.186 0.104 18703 1076 1 3 . 1 1 63 63 GLU HA H 63 4.012 4.012 4.061 -0.049 18703 1077 1 3 . 1 1 63 63 GLU C C 63 179.784 179.784 179.140 0.644 18703 1078 1 3 . 1 1 63 63 GLU CA C 63 59.300 59.300 59.455 -0.154 18703 1079 1 3 . 1 1 63 63 GLU CB C 63 29.728 29.728 29.633 0.095 18703 1080 1 3 . 1 1 63 63 GLU H H 63 7.958 7.958 7.485 0.473 18703 1081 1 3 . 1 1 64 64 ILE N N 64 118.453 118.453 118.305 0.148 18703 1082 1 3 . 1 1 64 64 ILE HA H 64 3.711 3.711 3.834 -0.123 18703 1083 1 3 . 1 1 64 64 ILE C C 64 177.655 177.655 178.056 -0.401 18703 1084 1 3 . 1 1 64 64 ILE CA C 64 64.256 64.256 63.922 0.334 18703 1085 1 3 . 1 1 64 64 ILE CB C 64 38.002 38.002 37.711 0.291 18703 1086 1 3 . 1 1 64 64 ILE H H 64 8.160 8.160 7.537 0.623 18703 1087 1 3 . 1 1 65 65 LYS N N 65 118.871 118.871 119.324 -0.453 18703 1088 1 3 . 1 1 65 65 LYS HA H 65 4.111 4.111 4.091 0.020 18703 1089 1 3 . 1 1 65 65 LYS C C 65 177.076 177.076 177.794 -0.718 18703 1090 1 3 . 1 1 65 65 LYS CA C 65 58.421 58.421 58.593 -0.172 18703 1091 1 3 . 1 1 65 65 LYS CB C 65 32.639 32.639 32.146 0.493 18703 1092 1 3 . 1 1 65 65 LYS H H 65 7.664 7.664 7.762 -0.098 18703 1093 1 3 . 1 1 66 66 LYS N N 66 116.944 116.944 118.708 -1.764 18703 1094 1 3 . 1 1 66 66 LYS HA H 66 4.320 4.320 4.102 0.218 18703 1095 1 3 . 1 1 66 66 LYS C C 66 175.897 175.897 177.864 -1.967 18703 1096 1 3 . 1 1 66 66 LYS CA C 66 56.352 56.352 57.884 -1.532 18703 1097 1 3 . 1 1 66 66 LYS CB C 66 33.024 33.024 32.406 0.618 18703 1098 1 3 . 1 1 66 66 LYS H H 66 7.246 7.246 7.486 -0.240 18703 1099 1 4 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.394 -0.148 18703 1100 1 4 . 1 1 3 3 ARG C C 3 178.379 178.379 177.118 1.261 18703 1101 1 4 . 1 1 3 3 ARG CA C 3 58.367 58.367 56.790 1.577 18703 1102 1 4 . 1 1 3 3 ARG CB C 3 30.691 30.691 31.056 -0.365 18703 1103 1 4 . 1 1 3 3 ARG H H 3 7.905 7.905 8.545 -0.640 18703 1104 1 4 . 1 1 4 4 VAL N N 4 118.966 118.966 119.767 -0.801 18703 1105 1 4 . 1 1 4 4 VAL HA H 4 3.803 3.803 3.786 0.017 18703 1106 1 4 . 1 1 4 4 VAL C C 4 176.968 176.968 177.040 -0.072 18703 1107 1 4 . 1 1 4 4 VAL CA C 4 65.441 65.441 65.744 -0.303 18703 1108 1 4 . 1 1 4 4 VAL CB C 4 31.710 31.710 31.534 0.176 18703 1109 1 4 . 1 1 4 4 VAL H H 4 8.070 8.070 8.393 -0.323 18703 1110 1 4 . 1 1 5 5 LYS N N 5 122.058 122.058 120.323 1.735 18703 1111 1 4 . 1 1 5 5 LYS HA H 5 4.154 4.154 4.202 -0.048 18703 1112 1 4 . 1 1 5 5 LYS C C 5 178.553 178.553 178.456 0.097 18703 1113 1 4 . 1 1 5 5 LYS CA C 5 58.712 58.712 59.267 -0.555 18703 1114 1 4 . 1 1 5 5 LYS CB C 5 31.788 31.788 32.063 -0.275 18703 1115 1 4 . 1 1 5 5 LYS H H 5 7.798 7.798 8.365 -0.567 18703 1116 1 4 . 1 1 6 6 ALA N N 6 119.955 119.955 119.758 0.197 18703 1117 1 4 . 1 1 6 6 ALA HA H 6 4.198 4.198 4.259 -0.061 18703 1118 1 4 . 1 1 6 6 ALA C C 6 180.974 180.974 179.896 1.078 18703 1119 1 4 . 1 1 6 6 ALA CA C 6 54.850 54.850 54.326 0.524 18703 1120 1 4 . 1 1 6 6 ALA CB C 6 17.995 17.995 18.193 -0.198 18703 1121 1 4 . 1 1 6 6 ALA H H 6 7.928 7.928 8.189 -0.261 18703 1122 1 4 . 1 1 7 7 LEU N N 7 119.211 119.211 119.724 -0.513 18703 1123 1 4 . 1 1 7 7 LEU HA H 7 4.124 4.124 4.015 0.109 18703 1124 1 4 . 1 1 7 7 LEU C C 7 178.353 178.353 178.527 -0.174 18703 1125 1 4 . 1 1 7 7 LEU CA C 7 57.658 57.658 57.267 0.391 18703 1126 1 4 . 1 1 7 7 LEU CB C 7 41.971 41.971 42.250 -0.279 18703 1127 1 4 . 1 1 7 7 LEU H H 7 7.594 7.594 7.792 -0.198 18703 1128 1 4 . 1 1 8 8 GLU N N 8 120.258 120.258 118.028 2.230 18703 1129 1 4 . 1 1 8 8 GLU HA H 8 3.846 3.846 4.066 -0.220 18703 1130 1 4 . 1 1 8 8 GLU C C 8 179.546 179.546 178.755 0.791 18703 1131 1 4 . 1 1 8 8 GLU CA C 8 60.006 60.006 59.472 0.534 18703 1132 1 4 . 1 1 8 8 GLU CB C 8 29.683 29.683 29.610 0.073 18703 1133 1 4 . 1 1 8 8 GLU H H 8 8.382 8.382 7.816 0.566 18703 1134 1 4 . 1 1 9 9 GLU N N 9 118.584 118.584 119.011 -0.427 18703 1135 1 4 . 1 1 9 9 GLU HA H 9 4.039 4.039 4.146 -0.107 18703 1136 1 4 . 1 1 9 9 GLU C C 9 179.635 179.635 178.570 1.065 18703 1137 1 4 . 1 1 9 9 GLU CA C 9 59.235 59.235 58.501 0.735 18703 1138 1 4 . 1 1 9 9 GLU CB C 9 29.358 29.358 28.955 0.403 18703 1139 1 4 . 1 1 9 9 GLU H H 9 7.908 7.908 7.915 -0.007 18703 1140 1 4 . 1 1 10 10 LYS N N 10 120.956 120.956 119.523 1.433 18703 1141 1 4 . 1 1 10 10 LYS HA H 10 4.190 4.190 4.196 -0.006 18703 1142 1 4 . 1 1 10 10 LYS C C 10 179.395 179.395 178.696 0.699 18703 1143 1 4 . 1 1 10 10 LYS CA C 10 59.231 59.231 59.063 0.168 18703 1144 1 4 . 1 1 10 10 LYS CB C 10 32.211 32.211 32.718 -0.507 18703 1145 1 4 . 1 1 10 10 LYS H H 10 8.009 8.009 7.542 0.467 18703 1146 1 4 . 1 1 11 11 VAL N N 11 119.577 119.577 117.894 1.683 18703 1147 1 4 . 1 1 11 11 VAL HA H 11 3.844 3.844 3.758 0.086 18703 1148 1 4 . 1 1 11 11 VAL C C 11 177.078 177.078 177.527 -0.449 18703 1149 1 4 . 1 1 11 11 VAL CA C 11 66.407 66.407 64.950 1.458 18703 1150 1 4 . 1 1 11 11 VAL CB C 11 31.252 31.252 31.090 0.162 18703 1151 1 4 . 1 1 11 11 VAL H H 11 8.488 8.488 7.518 0.970 18703 1152 1 4 . 1 1 12 12 LYS N N 12 122.864 122.864 119.850 3.014 18703 1153 1 4 . 1 1 12 12 LYS HA H 12 4.189 4.189 4.040 0.149 18703 1154 1 4 . 1 1 12 12 LYS C C 12 178.755 178.755 178.232 0.523 18703 1155 1 4 . 1 1 12 12 LYS CA C 12 59.375 59.375 59.607 -0.232 18703 1156 1 4 . 1 1 12 12 LYS CB C 12 31.991 31.991 31.690 0.301 18703 1157 1 4 . 1 1 12 12 LYS H H 12 7.944 7.944 7.630 0.314 18703 1158 1 4 . 1 1 13 13 ALA N N 13 121.202 121.202 121.114 0.088 18703 1159 1 4 . 1 1 13 13 ALA HA H 13 4.209 4.209 4.311 -0.102 18703 1160 1 4 . 1 1 13 13 ALA C C 13 181.060 181.060 179.295 1.765 18703 1161 1 4 . 1 1 13 13 ALA CA C 13 54.710 54.710 53.830 0.880 18703 1162 1 4 . 1 1 13 13 ALA CB C 13 17.861 17.861 18.178 -0.317 18703 1163 1 4 . 1 1 13 13 ALA H H 13 7.563 7.563 7.545 0.018 18703 1164 1 4 . 1 1 14 14 LEU N N 14 120.014 120.014 119.662 0.352 18703 1165 1 4 . 1 1 14 14 LEU HA H 14 4.072 4.072 4.025 0.047 18703 1166 1 4 . 1 1 14 14 LEU C C 14 177.862 177.862 178.147 -0.285 18703 1167 1 4 . 1 1 14 14 LEU CA C 14 57.864 57.864 57.311 0.553 18703 1168 1 4 . 1 1 14 14 LEU CB C 14 41.539 41.539 42.074 -0.535 18703 1169 1 4 . 1 1 14 14 LEU H H 14 8.087 8.087 7.528 0.559 18703 1170 1 4 . 1 1 15 15 GLU N N 15 121.644 121.644 120.233 1.411 18703 1171 1 4 . 1 1 15 15 GLU HA H 15 3.692 3.692 4.013 -0.321 18703 1172 1 4 . 1 1 15 15 GLU C C 15 177.819 177.819 178.310 -0.491 18703 1173 1 4 . 1 1 15 15 GLU CA C 15 59.239 59.239 59.300 -0.061 18703 1174 1 4 . 1 1 15 15 GLU CB C 15 28.865 28.865 29.617 -0.752 18703 1175 1 4 . 1 1 15 15 GLU H H 15 8.542 8.542 7.660 0.882 18703 1176 1 4 . 1 1 16 16 GLU N N 16 116.016 116.016 118.359 -2.343 18703 1177 1 4 . 1 1 16 16 GLU HA H 16 3.955 3.955 3.999 -0.044 18703 1178 1 4 . 1 1 16 16 GLU C C 16 179.159 179.159 179.188 -0.029 18703 1179 1 4 . 1 1 16 16 GLU CA C 16 59.324 59.324 59.213 0.111 18703 1180 1 4 . 1 1 16 16 GLU CB C 16 29.060 29.060 29.174 -0.114 18703 1181 1 4 . 1 1 16 16 GLU H H 16 7.492 7.492 7.897 -0.405 18703 1182 1 4 . 1 1 17 17 LYS N N 17 118.546 118.546 119.017 -0.471 18703 1183 1 4 . 1 1 17 17 LYS HA H 17 4.117 4.117 4.136 -0.019 18703 1184 1 4 . 1 1 17 17 LYS C C 17 178.976 178.976 178.428 0.548 18703 1185 1 4 . 1 1 17 17 LYS CA C 17 58.837 58.837 59.035 -0.198 18703 1186 1 4 . 1 1 17 17 LYS CB C 17 32.538 32.538 32.572 -0.034 18703 1187 1 4 . 1 1 17 17 LYS H H 17 7.720 7.720 7.487 0.233 18703 1188 1 4 . 1 1 18 18 VAL N N 18 118.376 118.376 118.476 -0.100 18703 1189 1 4 . 1 1 18 18 VAL HA H 18 3.711 3.711 3.780 -0.069 18703 1190 1 4 . 1 1 18 18 VAL C C 18 178.765 178.765 178.586 0.179 18703 1191 1 4 . 1 1 18 18 VAL CA C 18 66.237 66.237 65.527 0.710 18703 1192 1 4 . 1 1 18 18 VAL CB C 18 31.682 31.682 31.754 -0.072 18703 1193 1 4 . 1 1 18 18 VAL H H 18 8.754 8.754 7.289 1.465 18703 1194 1 4 . 1 1 19 19 LYS N N 19 118.817 118.817 118.686 0.131 18703 1195 1 4 . 1 1 19 19 LYS HA H 19 4.078 4.078 3.980 0.098 18703 1196 1 4 . 1 1 19 19 LYS C C 19 178.049 178.049 177.795 0.254 18703 1197 1 4 . 1 1 19 19 LYS CA C 19 59.731 59.731 59.299 0.432 18703 1198 1 4 . 1 1 19 19 LYS CB C 19 32.523 32.523 32.162 0.361 18703 1199 1 4 . 1 1 19 19 LYS H H 19 8.299 8.299 8.534 -0.235 18703 1200 1 4 . 1 1 20 20 ALA N N 20 119.656 119.656 119.543 0.113 18703 1201 1 4 . 1 1 20 20 ALA HA H 20 4.347 4.347 4.345 0.002 18703 1202 1 4 . 1 1 20 20 ALA C C 20 178.532 178.532 178.281 0.251 18703 1203 1 4 . 1 1 20 20 ALA CA C 20 52.853 52.853 52.971 -0.118 18703 1204 1 4 . 1 1 20 20 ALA CB C 20 18.832 18.832 18.842 -0.010 18703 1205 1 4 . 1 1 20 20 ALA H H 20 7.425 7.425 7.595 -0.170 18703 1206 1 4 . 1 1 21 21 LEU N N 21 118.594 118.594 119.003 -0.409 18703 1207 1 4 . 1 1 21 21 LEU HA H 21 4.297 4.297 4.176 0.121 18703 1208 1 4 . 1 1 21 21 LEU C C 21 177.784 177.784 178.029 -0.245 18703 1209 1 4 . 1 1 21 21 LEU CA C 21 55.750 55.750 56.465 -0.715 18703 1210 1 4 . 1 1 21 21 LEU CB C 21 42.898 42.898 42.559 0.339 18703 1211 1 4 . 1 1 21 21 LEU H H 21 7.508 7.508 7.829 -0.321 18703 1212 1 4 . 1 1 22 22 GLY N N 22 106.650 106.650 104.519 2.131 18703 1213 1 4 . 1 1 22 22 GLY C C 22 173.605 173.605 172.924 0.681 18703 1214 1 4 . 1 1 22 22 GLY CA C 22 45.330 45.330 44.556 0.774 18703 1215 1 4 . 1 1 22 22 GLY H H 22 7.814 7.814 7.779 0.035 18703 1216 1 4 . 1 1 23 23 GLY N N 23 108.011 108.011 107.852 0.159 18703 1217 1 4 . 1 1 23 23 GLY C C 23 174.061 174.061 173.180 0.881 18703 1218 1 4 . 1 1 23 23 GLY CA C 23 44.772 44.772 45.231 -0.459 18703 1219 1 4 . 1 1 23 23 GLY H H 23 8.139 8.139 7.812 0.327 18703 1220 1 4 . 1 1 24 24 GLY N N 24 107.826 107.826 108.477 -0.651 18703 1221 1 4 . 1 1 24 24 GLY C C 24 175.046 175.046 174.688 0.358 18703 1222 1 4 . 1 1 24 24 GLY CA C 24 44.422 44.422 44.977 -0.555 18703 1223 1 4 . 1 1 24 24 GLY H H 24 8.497 8.497 8.532 -0.035 18703 1224 1 4 . 1 1 25 25 GLY N N 25 108.830 108.830 109.344 -0.514 18703 1225 1 4 . 1 1 25 25 GLY C C 25 176.272 176.272 175.475 0.797 18703 1226 1 4 . 1 1 25 25 GLY CA C 25 47.101 47.101 45.277 1.824 18703 1227 1 4 . 1 1 25 25 GLY H H 25 8.616 8.616 7.794 0.822 18703 1228 1 4 . 1 1 26 26 ARG N N 26 123.109 123.109 124.126 -1.017 18703 1229 1 4 . 1 1 26 26 ARG HA H 26 4.283 4.283 4.138 0.145 18703 1230 1 4 . 1 1 26 26 ARG C C 26 177.848 177.848 177.983 -0.135 18703 1231 1 4 . 1 1 26 26 ARG CA C 26 57.663 57.663 58.142 -0.480 18703 1232 1 4 . 1 1 26 26 ARG CB C 26 29.811 29.811 29.276 0.536 18703 1233 1 4 . 1 1 26 26 ARG H H 26 8.770 8.770 8.722 0.048 18703 1234 1 4 . 1 1 27 27 ILE N N 27 118.104 118.104 118.976 -0.872 18703 1235 1 4 . 1 1 27 27 ILE HA H 27 3.787 3.787 3.739 0.048 18703 1236 1 4 . 1 1 27 27 ILE C C 27 177.473 177.473 177.844 -0.371 18703 1237 1 4 . 1 1 27 27 ILE CA C 27 63.036 63.036 64.034 -0.998 18703 1238 1 4 . 1 1 27 27 ILE CB C 27 36.664 36.664 37.223 -0.559 18703 1239 1 4 . 1 1 27 27 ILE H H 27 7.708 7.708 8.024 -0.316 18703 1240 1 4 . 1 1 28 28 GLU N N 28 119.934 119.934 119.547 0.387 18703 1241 1 4 . 1 1 28 28 GLU HA H 28 3.954 3.954 3.834 0.120 18703 1242 1 4 . 1 1 28 28 GLU C C 28 179.514 179.514 178.629 0.885 18703 1243 1 4 . 1 1 28 28 GLU CA C 28 59.450 59.450 59.808 -0.358 18703 1244 1 4 . 1 1 28 28 GLU CB C 28 29.600 29.600 29.226 0.374 18703 1245 1 4 . 1 1 28 28 GLU H H 28 7.872 7.872 8.298 -0.426 18703 1246 1 4 . 1 1 29 29 GLU N N 29 118.134 118.134 119.853 -1.719 18703 1247 1 4 . 1 1 29 29 GLU HA H 29 4.028 4.028 4.064 -0.036 18703 1248 1 4 . 1 1 29 29 GLU C C 29 179.182 179.182 179.070 0.112 18703 1249 1 4 . 1 1 29 29 GLU CA C 29 59.173 59.173 59.030 0.143 18703 1250 1 4 . 1 1 29 29 GLU CB C 29 29.503 29.503 29.478 0.025 18703 1251 1 4 . 1 1 29 29 GLU H H 29 8.166 8.166 7.799 0.367 18703 1252 1 4 . 1 1 30 30 LEU N N 30 120.242 120.242 117.514 2.728 18703 1253 1 4 . 1 1 30 30 LEU HA H 30 4.028 4.028 4.068 -0.040 18703 1254 1 4 . 1 1 30 30 LEU C C 30 178.796 178.796 178.522 0.274 18703 1255 1 4 . 1 1 30 30 LEU CA C 30 57.654 57.654 57.072 0.582 18703 1256 1 4 . 1 1 30 30 LEU CB C 30 41.629 41.629 41.873 -0.244 18703 1257 1 4 . 1 1 30 30 LEU H H 30 7.695 7.695 7.580 0.115 18703 1258 1 4 . 1 1 31 31 LYS N N 31 120.506 120.506 119.254 1.252 18703 1259 1 4 . 1 1 31 31 LYS HA H 31 3.532 3.532 4.086 -0.554 18703 1260 1 4 . 1 1 31 31 LYS C C 31 178.919 178.919 178.010 0.909 18703 1261 1 4 . 1 1 31 31 LYS CA C 31 60.240 60.240 59.026 1.214 18703 1262 1 4 . 1 1 31 31 LYS CB C 31 32.015 32.015 32.474 -0.459 18703 1263 1 4 . 1 1 31 31 LYS H H 31 8.561 8.561 7.658 0.903 18703 1264 1 4 . 1 1 32 32 LYS N N 32 118.566 118.566 119.584 -1.018 18703 1265 1 4 . 1 1 32 32 LYS C C 32 179.392 179.392 178.947 0.445 18703 1266 1 4 . 1 1 32 32 LYS CA C 32 59.356 59.356 59.736 -0.380 18703 1267 1 4 . 1 1 32 32 LYS CB C 32 32.117 32.117 32.344 -0.228 18703 1268 1 4 . 1 1 32 32 LYS H H 32 7.699 7.699 7.515 0.184 18703 1269 1 4 . 1 1 33 33 LYS N N 33 118.964 118.964 117.747 1.217 18703 1270 1 4 . 1 1 33 33 LYS HA H 33 4.117 4.117 4.049 0.068 18703 1271 1 4 . 1 1 33 33 LYS C C 33 178.355 178.355 178.740 -0.385 18703 1272 1 4 . 1 1 33 33 LYS CA C 33 58.633 58.633 58.996 -0.363 18703 1273 1 4 . 1 1 33 33 LYS CB C 33 31.904 31.904 32.110 -0.206 18703 1274 1 4 . 1 1 33 33 LYS H H 33 7.752 7.752 7.698 0.054 18703 1275 1 4 . 1 1 34 34 CYS N N 34 119.956 119.956 117.946 2.010 18703 1276 1 4 . 1 1 34 34 CYS HA H 34 3.967 3.967 4.119 -0.152 18703 1277 1 4 . 1 1 34 34 CYS C C 34 175.521 175.521 176.895 -1.374 18703 1278 1 4 . 1 1 34 34 CYS CA C 34 60.987 60.987 62.886 -1.899 18703 1279 1 4 . 1 1 34 34 CYS CB C 34 36.600 36.600 26.840 9.760 18703 1280 1 4 . 1 1 34 34 CYS H H 34 8.393 8.393 7.559 0.834 18703 1281 1 4 . 1 1 35 35 GLU N N 35 120.327 120.327 120.023 0.304 18703 1282 1 4 . 1 1 35 35 GLU HA H 35 3.891 3.891 3.929 -0.038 18703 1283 1 4 . 1 1 35 35 GLU C C 35 179.684 179.684 178.810 0.874 18703 1284 1 4 . 1 1 35 35 GLU CA C 35 60.059 60.059 59.247 0.812 18703 1285 1 4 . 1 1 35 35 GLU CB C 35 29.718 29.718 28.642 1.076 18703 1286 1 4 . 1 1 35 35 GLU H H 35 8.558 8.558 7.815 0.743 18703 1287 1 4 . 1 1 36 36 GLU N N 36 120.190 120.190 119.512 0.678 18703 1288 1 4 . 1 1 36 36 GLU HA H 36 4.051 4.051 3.983 0.068 18703 1289 1 4 . 1 1 36 36 GLU C C 36 179.408 179.408 178.976 0.432 18703 1290 1 4 . 1 1 36 36 GLU CA C 36 59.148 59.148 59.233 -0.084 18703 1291 1 4 . 1 1 36 36 GLU CB C 36 29.766 29.766 29.505 0.261 18703 1292 1 4 . 1 1 36 36 GLU H H 36 8.038 8.038 7.648 0.390 18703 1293 1 4 . 1 1 37 37 LEU N N 37 121.102 121.102 119.217 1.885 18703 1294 1 4 . 1 1 37 37 LEU HA H 37 4.079 4.079 4.147 -0.068 18703 1295 1 4 . 1 1 37 37 LEU C C 37 178.279 178.279 178.294 -0.015 18703 1296 1 4 . 1 1 37 37 LEU CA C 37 57.803 57.803 57.537 0.266 18703 1297 1 4 . 1 1 37 37 LEU CB C 37 41.502 41.502 41.781 -0.279 18703 1298 1 4 . 1 1 37 37 LEU H H 37 8.065 8.065 7.413 0.652 18703 1299 1 4 . 1 1 38 38 LYS N N 38 119.980 119.980 119.112 0.868 18703 1300 1 4 . 1 1 38 38 LYS HA H 38 3.851 3.851 3.890 -0.039 18703 1301 1 4 . 1 1 38 38 LYS C C 38 178.919 178.919 179.183 -0.264 18703 1302 1 4 . 1 1 38 38 LYS CA C 38 60.794 60.794 59.825 0.969 18703 1303 1 4 . 1 1 38 38 LYS CB C 38 32.863 32.863 32.184 0.679 18703 1304 1 4 . 1 1 38 38 LYS H H 38 8.741 8.741 7.960 0.781 18703 1305 1 4 . 1 1 39 39 LYS N N 39 118.307 118.307 117.855 0.452 18703 1306 1 4 . 1 1 39 39 LYS HA H 39 4.125 4.125 3.999 0.126 18703 1307 1 4 . 1 1 39 39 LYS C C 39 178.622 178.622 178.585 0.037 18703 1308 1 4 . 1 1 39 39 LYS CA C 39 58.993 58.993 59.124 -0.131 18703 1309 1 4 . 1 1 39 39 LYS CB C 39 32.097 32.097 31.767 0.330 18703 1310 1 4 . 1 1 39 39 LYS H H 39 7.584 7.584 7.767 -0.183 18703 1311 1 4 . 1 1 40 40 LYS N N 40 118.826 118.826 119.330 -0.504 18703 1312 1 4 . 1 1 40 40 LYS HA H 40 4.069 4.069 4.175 -0.106 18703 1313 1 4 . 1 1 40 40 LYS C C 40 179.802 179.802 178.764 1.038 18703 1314 1 4 . 1 1 40 40 LYS CA C 40 59.322 59.322 58.622 0.700 18703 1315 1 4 . 1 1 40 40 LYS CB C 40 32.505 32.505 32.417 0.088 18703 1316 1 4 . 1 1 40 40 LYS H H 40 7.945 7.945 7.357 0.588 18703 1317 1 4 . 1 1 41 41 ILE N N 41 118.958 118.958 119.031 -0.073 18703 1318 1 4 . 1 1 41 41 ILE HA H 41 3.659 3.659 3.853 -0.194 18703 1319 1 4 . 1 1 41 41 ILE C C 41 178.146 178.146 177.567 0.579 18703 1320 1 4 . 1 1 41 41 ILE CA C 41 65.037 65.037 64.057 0.980 18703 1321 1 4 . 1 1 41 41 ILE CB C 41 37.950 37.950 37.807 0.143 18703 1322 1 4 . 1 1 41 41 ILE H H 41 8.369 8.369 8.196 0.173 18703 1323 1 4 . 1 1 42 42 GLU N N 42 120.331 120.331 118.784 1.547 18703 1324 1 4 . 1 1 42 42 GLU HA H 42 4.094 4.094 4.049 0.045 18703 1325 1 4 . 1 1 42 42 GLU C C 42 178.697 178.697 177.957 0.740 18703 1326 1 4 . 1 1 42 42 GLU CA C 42 58.927 58.927 59.320 -0.393 18703 1327 1 4 . 1 1 42 42 GLU CB C 42 29.399 29.399 29.712 -0.313 18703 1328 1 4 . 1 1 42 42 GLU H H 42 7.805 7.805 7.816 -0.011 18703 1329 1 4 . 1 1 43 43 GLU N N 43 117.120 117.120 116.603 0.517 18703 1330 1 4 . 1 1 43 43 GLU HA H 43 4.291 4.291 4.202 0.089 18703 1331 1 4 . 1 1 43 43 GLU C C 43 177.551 177.551 177.617 -0.066 18703 1332 1 4 . 1 1 43 43 GLU CA C 43 56.800 56.800 56.998 -0.198 18703 1333 1 4 . 1 1 43 43 GLU CB C 43 29.931 29.931 29.725 0.206 18703 1334 1 4 . 1 1 43 43 GLU H H 43 7.701 7.701 7.529 0.172 18703 1335 1 4 . 1 1 44 44 LEU N N 44 120.940 120.940 120.473 0.467 18703 1336 1 4 . 1 1 44 44 LEU HA H 44 4.251 4.251 4.162 0.089 18703 1337 1 4 . 1 1 44 44 LEU C C 44 178.596 178.596 177.729 0.867 18703 1338 1 4 . 1 1 44 44 LEU CA C 44 56.448 56.448 55.628 0.820 18703 1339 1 4 . 1 1 44 44 LEU CB C 44 42.519 42.519 42.526 -0.007 18703 1340 1 4 . 1 1 44 44 LEU H H 44 7.581 7.581 7.370 0.211 18703 1341 1 4 . 1 1 45 45 GLY N N 45 108.689 108.689 106.836 1.853 18703 1342 1 4 . 1 1 45 45 GLY C C 45 174.853 174.853 174.767 0.086 18703 1343 1 4 . 1 1 45 45 GLY CA C 45 46.233 46.233 46.248 -0.015 18703 1344 1 4 . 1 1 45 45 GLY H H 45 8.232 8.232 8.954 -0.722 18703 1345 1 4 . 1 1 46 46 GLY N N 46 108.029 108.029 109.037 -1.008 18703 1346 1 4 . 1 1 46 46 GLY C C 46 174.351 174.351 174.387 -0.036 18703 1347 1 4 . 1 1 46 46 GLY CA C 46 45.105 45.105 45.408 -0.303 18703 1348 1 4 . 1 1 46 46 GLY H H 46 8.176 8.176 8.265 -0.089 18703 1349 1 4 . 1 1 47 47 GLY N N 47 108.183 108.183 107.510 0.673 18703 1350 1 4 . 1 1 47 47 GLY C C 47 174.671 174.671 174.494 0.177 18703 1351 1 4 . 1 1 47 47 GLY CA C 47 45.254 45.254 44.928 0.326 18703 1352 1 4 . 1 1 47 47 GLY H H 47 8.290 8.290 7.616 0.674 18703 1353 1 4 . 1 1 48 48 GLY N N 48 108.616 108.616 110.855 -2.239 18703 1354 1 4 . 1 1 48 48 GLY C C 48 174.321 174.321 174.790 -0.469 18703 1355 1 4 . 1 1 48 48 GLY CA C 48 45.192 45.192 45.779 -0.587 18703 1356 1 4 . 1 1 48 48 GLY H H 48 8.027 8.027 8.362 -0.335 18703 1357 1 4 . 1 1 49 49 GLU N N 49 121.057 121.057 121.959 -0.902 18703 1358 1 4 . 1 1 49 49 GLU HA H 49 4.425 4.425 4.417 0.008 18703 1359 1 4 . 1 1 49 49 GLU C C 49 177.072 177.072 178.418 -1.346 18703 1360 1 4 . 1 1 49 49 GLU CA C 49 56.330 56.330 56.279 0.051 18703 1361 1 4 . 1 1 49 49 GLU CB C 49 29.602 29.602 30.377 -0.775 18703 1362 1 4 . 1 1 49 49 GLU H H 49 8.486 8.486 8.494 -0.008 18703 1363 1 4 . 1 1 50 50 VAL N N 50 122.122 122.122 121.789 0.333 18703 1364 1 4 . 1 1 50 50 VAL HA H 50 3.792 3.792 3.649 0.143 18703 1365 1 4 . 1 1 50 50 VAL C C 50 176.774 176.774 176.798 -0.024 18703 1366 1 4 . 1 1 50 50 VAL CA C 50 64.864 64.864 65.658 -0.794 18703 1367 1 4 . 1 1 50 50 VAL CB C 50 32.179 32.179 31.954 0.225 18703 1368 1 4 . 1 1 50 50 VAL H H 50 8.095 8.095 8.128 -0.033 18703 1369 1 4 . 1 1 51 51 LYS N N 51 120.602 120.602 117.872 2.730 18703 1370 1 4 . 1 1 51 51 LYS HA H 51 4.195 4.195 4.090 0.105 18703 1371 1 4 . 1 1 51 51 LYS C C 51 178.530 178.530 178.589 -0.059 18703 1372 1 4 . 1 1 51 51 LYS CA C 51 59.348 59.348 58.935 0.413 18703 1373 1 4 . 1 1 51 51 LYS CB C 51 32.265 32.265 32.048 0.217 18703 1374 1 4 . 1 1 51 51 LYS H H 51 8.268 8.268 8.270 -0.002 18703 1375 1 4 . 1 1 52 52 LYS N N 52 117.547 117.547 120.457 -2.910 18703 1376 1 4 . 1 1 52 52 LYS HA H 52 4.162 4.162 4.128 0.034 18703 1377 1 4 . 1 1 52 52 LYS C C 52 179.132 179.132 178.792 0.340 18703 1378 1 4 . 1 1 52 52 LYS CA C 52 58.811 58.811 59.408 -0.597 18703 1379 1 4 . 1 1 52 52 LYS CB C 52 32.054 32.054 32.549 -0.495 18703 1380 1 4 . 1 1 52 52 LYS H H 52 7.595 7.595 7.969 -0.374 18703 1381 1 4 . 1 1 53 53 VAL N N 53 119.190 119.190 118.882 0.308 18703 1382 1 4 . 1 1 53 53 VAL HA H 53 3.767 3.767 3.693 0.074 18703 1383 1 4 . 1 1 53 53 VAL C C 53 177.933 177.933 178.106 -0.173 18703 1384 1 4 . 1 1 53 53 VAL CA C 53 66.065 66.065 66.134 -0.069 18703 1385 1 4 . 1 1 53 53 VAL CB C 53 31.248 31.248 31.286 -0.038 18703 1386 1 4 . 1 1 53 53 VAL H H 53 7.597 7.597 7.604 -0.007 18703 1387 1 4 . 1 1 54 54 GLU N N 54 120.226 120.226 119.194 1.032 18703 1388 1 4 . 1 1 54 54 GLU HA H 54 3.833 3.833 3.984 -0.151 18703 1389 1 4 . 1 1 54 54 GLU C C 54 179.352 179.352 178.661 0.691 18703 1390 1 4 . 1 1 54 54 GLU CA C 54 59.153 59.153 59.503 -0.350 18703 1391 1 4 . 1 1 54 54 GLU CB C 54 29.224 29.224 29.452 -0.228 18703 1392 1 4 . 1 1 54 54 GLU H H 54 8.609 8.609 7.760 0.849 18703 1393 1 4 . 1 1 55 55 GLU N N 55 119.148 119.148 119.502 -0.354 18703 1394 1 4 . 1 1 55 55 GLU HA H 55 4.084 4.084 4.110 -0.026 18703 1395 1 4 . 1 1 55 55 GLU C C 55 179.084 179.084 178.877 0.207 18703 1396 1 4 . 1 1 55 55 GLU CA C 55 59.295 59.295 59.020 0.275 18703 1397 1 4 . 1 1 55 55 GLU CB C 55 29.361 29.361 29.554 -0.193 18703 1398 1 4 . 1 1 55 55 GLU H H 55 7.713 7.713 7.768 -0.055 18703 1399 1 4 . 1 1 56 56 GLU N N 56 120.301 120.301 118.923 1.378 18703 1400 1 4 . 1 1 56 56 GLU HA H 56 4.079 4.079 4.148 -0.069 18703 1401 1 4 . 1 1 56 56 GLU C C 56 179.773 179.773 179.154 0.619 18703 1402 1 4 . 1 1 56 56 GLU CA C 56 59.528 59.528 59.295 0.233 18703 1403 1 4 . 1 1 56 56 GLU CB C 56 30.162 30.162 29.734 0.428 18703 1404 1 4 . 1 1 56 56 GLU H H 56 7.899 7.899 7.597 0.302 18703 1405 1 4 . 1 1 57 57 VAL N N 57 121.536 121.536 119.683 1.853 18703 1406 1 4 . 1 1 57 57 VAL HA H 57 3.540 3.540 3.892 -0.352 18703 1407 1 4 . 1 1 57 57 VAL C C 57 176.984 176.984 177.792 -0.808 18703 1408 1 4 . 1 1 57 57 VAL CA C 57 66.734 66.734 65.468 1.266 18703 1409 1 4 . 1 1 57 57 VAL CB C 57 31.425 31.425 30.918 0.507 18703 1410 1 4 . 1 1 57 57 VAL H H 57 8.652 8.652 7.558 1.094 18703 1411 1 4 . 1 1 58 58 LYS N N 58 120.219 120.219 119.994 0.225 18703 1412 1 4 . 1 1 58 58 LYS HA H 58 4.199 4.199 4.113 0.086 18703 1413 1 4 . 1 1 58 58 LYS C C 58 178.972 178.972 178.695 0.277 18703 1414 1 4 . 1 1 58 58 LYS CA C 58 59.357 59.357 59.269 0.088 18703 1415 1 4 . 1 1 58 58 LYS CB C 58 32.186 32.186 32.118 0.068 18703 1416 1 4 . 1 1 58 58 LYS H H 58 7.791 7.791 7.472 0.319 18703 1417 1 4 . 1 1 59 59 LYS N N 59 118.252 118.252 119.480 -1.228 18703 1418 1 4 . 1 1 59 59 LYS HA H 59 4.069 4.069 4.179 -0.110 18703 1419 1 4 . 1 1 59 59 LYS C C 59 179.180 179.180 178.570 0.610 18703 1420 1 4 . 1 1 59 59 LYS CA C 59 59.285 59.285 58.955 0.330 18703 1421 1 4 . 1 1 59 59 LYS CB C 59 32.345 32.345 32.241 0.104 18703 1422 1 4 . 1 1 59 59 LYS H H 59 7.849 7.849 7.525 0.324 18703 1423 1 4 . 1 1 60 60 LEU N N 60 121.243 121.243 119.815 1.428 18703 1424 1 4 . 1 1 60 60 LEU HA H 60 4.242 4.242 4.154 0.088 18703 1425 1 4 . 1 1 60 60 LEU C C 60 178.413 178.413 178.123 0.290 18703 1426 1 4 . 1 1 60 60 LEU CA C 60 57.798 57.798 57.194 0.604 18703 1427 1 4 . 1 1 60 60 LEU CB C 60 41.150 41.150 42.206 -1.056 18703 1428 1 4 . 1 1 60 60 LEU H H 60 7.825 7.825 7.541 0.284 18703 1429 1 4 . 1 1 61 61 GLU N N 61 118.844 118.844 120.150 -1.306 18703 1430 1 4 . 1 1 61 61 GLU HA H 61 3.800 3.800 3.938 -0.138 18703 1431 1 4 . 1 1 61 61 GLU C C 61 179.078 179.078 178.573 0.505 18703 1432 1 4 . 1 1 61 61 GLU CA C 61 60.104 60.104 59.979 0.125 18703 1433 1 4 . 1 1 61 61 GLU CB C 61 29.864 29.864 29.644 0.220 18703 1434 1 4 . 1 1 61 61 GLU H H 61 8.582 8.582 7.722 0.860 18703 1435 1 4 . 1 1 62 62 GLU N N 62 117.659 117.659 118.643 -0.984 18703 1436 1 4 . 1 1 62 62 GLU HA H 62 3.990 3.990 4.051 -0.061 18703 1437 1 4 . 1 1 62 62 GLU C C 62 178.847 178.847 178.958 -0.111 18703 1438 1 4 . 1 1 62 62 GLU CA C 62 59.067 59.067 58.916 0.151 18703 1439 1 4 . 1 1 62 62 GLU CB C 62 29.440 29.440 29.643 -0.203 18703 1440 1 4 . 1 1 62 62 GLU H H 62 8.032 8.032 7.628 0.404 18703 1441 1 4 . 1 1 63 63 GLU N N 63 119.290 119.290 119.161 0.129 18703 1442 1 4 . 1 1 63 63 GLU HA H 63 4.012 4.012 4.075 -0.063 18703 1443 1 4 . 1 1 63 63 GLU C C 63 179.784 179.784 179.418 0.366 18703 1444 1 4 . 1 1 63 63 GLU CA C 63 59.300 59.300 59.244 0.056 18703 1445 1 4 . 1 1 63 63 GLU CB C 63 29.728 29.728 29.433 0.295 18703 1446 1 4 . 1 1 63 63 GLU H H 63 7.958 7.958 7.469 0.489 18703 1447 1 4 . 1 1 64 64 ILE N N 64 118.453 118.453 119.306 -0.853 18703 1448 1 4 . 1 1 64 64 ILE HA H 64 3.711 3.711 3.758 -0.047 18703 1449 1 4 . 1 1 64 64 ILE C C 64 177.655 177.655 178.349 -0.694 18703 1450 1 4 . 1 1 64 64 ILE CA C 64 64.256 64.256 64.276 -0.020 18703 1451 1 4 . 1 1 64 64 ILE CB C 64 38.002 38.002 37.472 0.530 18703 1452 1 4 . 1 1 64 64 ILE H H 64 8.160 8.160 7.604 0.556 18703 1453 1 4 . 1 1 65 65 LYS N N 65 118.871 118.871 119.426 -0.555 18703 1454 1 4 . 1 1 65 65 LYS HA H 65 4.111 4.111 4.079 0.032 18703 1455 1 4 . 1 1 65 65 LYS C C 65 177.076 177.076 177.902 -0.826 18703 1456 1 4 . 1 1 65 65 LYS CA C 65 58.421 58.421 58.638 -0.216 18703 1457 1 4 . 1 1 65 65 LYS CB C 65 32.639 32.639 32.025 0.614 18703 1458 1 4 . 1 1 65 65 LYS H H 65 7.664 7.664 7.590 0.074 18703 1459 1 4 . 1 1 66 66 LYS N N 66 116.944 116.944 116.553 0.391 18703 1460 1 4 . 1 1 66 66 LYS HA H 66 4.320 4.320 4.107 0.213 18703 1461 1 4 . 1 1 66 66 LYS C C 66 175.897 175.897 177.248 -1.351 18703 1462 1 4 . 1 1 66 66 LYS CA C 66 56.352 56.352 57.711 -1.359 18703 1463 1 4 . 1 1 66 66 LYS CB C 66 33.024 33.024 33.069 -0.045 18703 1464 1 4 . 1 1 66 66 LYS H H 66 7.246 7.246 7.863 -0.617 18703 1465 1 5 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.124 0.122 18703 1466 1 5 . 1 1 3 3 ARG C C 3 178.379 178.379 178.367 0.012 18703 1467 1 5 . 1 1 3 3 ARG CA C 3 58.367 58.367 59.170 -0.803 18703 1468 1 5 . 1 1 3 3 ARG CB C 3 30.691 30.691 29.994 0.697 18703 1469 1 5 . 1 1 3 3 ARG H H 3 7.905 7.905 8.374 -0.469 18703 1470 1 5 . 1 1 4 4 VAL N N 4 118.966 118.966 119.385 -0.419 18703 1471 1 5 . 1 1 4 4 VAL HA H 4 3.803 3.803 3.797 0.006 18703 1472 1 5 . 1 1 4 4 VAL C C 4 176.968 176.968 177.340 -0.372 18703 1473 1 5 . 1 1 4 4 VAL CA C 4 65.441 65.441 65.333 0.108 18703 1474 1 5 . 1 1 4 4 VAL CB C 4 31.710 31.710 31.244 0.466 18703 1475 1 5 . 1 1 4 4 VAL H H 4 8.070 8.070 8.082 -0.012 18703 1476 1 5 . 1 1 5 5 LYS N N 5 122.058 122.058 120.023 2.035 18703 1477 1 5 . 1 1 5 5 LYS HA H 5 4.154 4.154 4.007 0.147 18703 1478 1 5 . 1 1 5 5 LYS C C 5 178.553 178.553 178.413 0.140 18703 1479 1 5 . 1 1 5 5 LYS CA C 5 58.712 58.712 59.378 -0.666 18703 1480 1 5 . 1 1 5 5 LYS CB C 5 31.788 31.788 32.128 -0.340 18703 1481 1 5 . 1 1 5 5 LYS H H 5 7.798 7.798 8.438 -0.640 18703 1482 1 5 . 1 1 6 6 ALA N N 6 119.955 119.955 120.781 -0.826 18703 1483 1 5 . 1 1 6 6 ALA HA H 6 4.198 4.198 4.260 -0.062 18703 1484 1 5 . 1 1 6 6 ALA C C 6 180.974 180.974 179.243 1.731 18703 1485 1 5 . 1 1 6 6 ALA CA C 6 54.850 54.850 54.187 0.663 18703 1486 1 5 . 1 1 6 6 ALA CB C 6 17.995 17.995 18.400 -0.405 18703 1487 1 5 . 1 1 6 6 ALA H H 6 7.928 7.928 7.597 0.331 18703 1488 1 5 . 1 1 7 7 LEU N N 7 119.211 119.211 120.050 -0.839 18703 1489 1 5 . 1 1 7 7 LEU HA H 7 4.124 4.124 3.946 0.178 18703 1490 1 5 . 1 1 7 7 LEU C C 7 178.353 178.353 178.619 -0.266 18703 1491 1 5 . 1 1 7 7 LEU CA C 7 57.658 57.658 57.490 0.168 18703 1492 1 5 . 1 1 7 7 LEU CB C 7 41.971 41.971 41.975 -0.004 18703 1493 1 5 . 1 1 7 7 LEU H H 7 7.594 7.594 7.358 0.236 18703 1494 1 5 . 1 1 8 8 GLU N N 8 120.258 120.258 118.232 2.026 18703 1495 1 5 . 1 1 8 8 GLU HA H 8 3.846 3.846 3.975 -0.129 18703 1496 1 5 . 1 1 8 8 GLU C C 8 179.546 179.546 178.562 0.984 18703 1497 1 5 . 1 1 8 8 GLU CA C 8 60.006 60.006 59.885 0.121 18703 1498 1 5 . 1 1 8 8 GLU CB C 8 29.683 29.683 29.488 0.195 18703 1499 1 5 . 1 1 8 8 GLU H H 8 8.382 8.382 7.736 0.646 18703 1500 1 5 . 1 1 9 9 GLU N N 9 118.584 118.584 118.268 0.316 18703 1501 1 5 . 1 1 9 9 GLU HA H 9 4.039 4.039 4.141 -0.102 18703 1502 1 5 . 1 1 9 9 GLU C C 9 179.635 179.635 178.617 1.018 18703 1503 1 5 . 1 1 9 9 GLU CA C 9 59.235 59.235 58.603 0.632 18703 1504 1 5 . 1 1 9 9 GLU CB C 9 29.358 29.358 29.033 0.325 18703 1505 1 5 . 1 1 9 9 GLU H H 9 7.908 7.908 7.703 0.205 18703 1506 1 5 . 1 1 10 10 LYS N N 10 120.956 120.956 119.923 1.033 18703 1507 1 5 . 1 1 10 10 LYS HA H 10 4.190 4.190 4.088 0.102 18703 1508 1 5 . 1 1 10 10 LYS C C 10 179.395 179.395 178.606 0.789 18703 1509 1 5 . 1 1 10 10 LYS CA C 10 59.231 59.231 59.316 -0.085 18703 1510 1 5 . 1 1 10 10 LYS CB C 10 32.211 32.211 32.614 -0.403 18703 1511 1 5 . 1 1 10 10 LYS H H 10 8.009 8.009 7.356 0.653 18703 1512 1 5 . 1 1 11 11 VAL N N 11 119.577 119.577 117.898 1.679 18703 1513 1 5 . 1 1 11 11 VAL HA H 11 3.844 3.844 3.819 0.025 18703 1514 1 5 . 1 1 11 11 VAL C C 11 177.078 177.078 177.509 -0.431 18703 1515 1 5 . 1 1 11 11 VAL CA C 11 66.407 66.407 65.712 0.695 18703 1516 1 5 . 1 1 11 11 VAL CB C 11 31.252 31.252 31.276 -0.024 18703 1517 1 5 . 1 1 11 11 VAL H H 11 8.488 8.488 7.501 0.987 18703 1518 1 5 . 1 1 12 12 LYS N N 12 122.864 122.864 119.823 3.041 18703 1519 1 5 . 1 1 12 12 LYS HA H 12 4.189 4.189 4.001 0.188 18703 1520 1 5 . 1 1 12 12 LYS C C 12 178.755 178.755 178.539 0.216 18703 1521 1 5 . 1 1 12 12 LYS CA C 12 59.375 59.375 59.503 -0.128 18703 1522 1 5 . 1 1 12 12 LYS CB C 12 31.991 31.991 32.197 -0.206 18703 1523 1 5 . 1 1 12 12 LYS H H 12 7.944 7.944 7.595 0.349 18703 1524 1 5 . 1 1 13 13 ALA N N 13 121.202 121.202 120.662 0.540 18703 1525 1 5 . 1 1 13 13 ALA HA H 13 4.209 4.209 4.281 -0.072 18703 1526 1 5 . 1 1 13 13 ALA C C 13 181.060 181.060 179.545 1.515 18703 1527 1 5 . 1 1 13 13 ALA CA C 13 54.710 54.710 54.237 0.473 18703 1528 1 5 . 1 1 13 13 ALA CB C 13 17.861 17.861 18.367 -0.506 18703 1529 1 5 . 1 1 13 13 ALA H H 13 7.563 7.563 7.506 0.057 18703 1530 1 5 . 1 1 14 14 LEU N N 14 120.014 120.014 119.729 0.285 18703 1531 1 5 . 1 1 14 14 LEU HA H 14 4.072 4.072 3.990 0.082 18703 1532 1 5 . 1 1 14 14 LEU C C 14 177.862 177.862 178.194 -0.332 18703 1533 1 5 . 1 1 14 14 LEU CA C 14 57.864 57.864 57.297 0.567 18703 1534 1 5 . 1 1 14 14 LEU CB C 14 41.539 41.539 41.983 -0.444 18703 1535 1 5 . 1 1 14 14 LEU H H 14 8.087 8.087 7.528 0.559 18703 1536 1 5 . 1 1 15 15 GLU N N 15 121.644 121.644 120.190 1.454 18703 1537 1 5 . 1 1 15 15 GLU HA H 15 3.692 3.692 4.020 -0.328 18703 1538 1 5 . 1 1 15 15 GLU C C 15 177.819 177.819 178.178 -0.359 18703 1539 1 5 . 1 1 15 15 GLU CA C 15 59.239 59.239 59.303 -0.064 18703 1540 1 5 . 1 1 15 15 GLU CB C 15 28.865 28.865 29.728 -0.863 18703 1541 1 5 . 1 1 15 15 GLU H H 15 8.542 8.542 7.687 0.855 18703 1542 1 5 . 1 1 16 16 GLU N N 16 116.016 116.016 118.678 -2.662 18703 1543 1 5 . 1 1 16 16 GLU HA H 16 3.955 3.955 3.979 -0.024 18703 1544 1 5 . 1 1 16 16 GLU C C 16 179.159 179.159 179.025 0.134 18703 1545 1 5 . 1 1 16 16 GLU CA C 16 59.324 59.324 59.009 0.315 18703 1546 1 5 . 1 1 16 16 GLU CB C 16 29.060 29.060 29.000 0.060 18703 1547 1 5 . 1 1 16 16 GLU H H 16 7.492 7.492 7.951 -0.459 18703 1548 1 5 . 1 1 17 17 LYS N N 17 118.546 118.546 118.270 0.276 18703 1549 1 5 . 1 1 17 17 LYS HA H 17 4.117 4.117 4.133 -0.016 18703 1550 1 5 . 1 1 17 17 LYS C C 17 178.976 178.976 178.041 0.935 18703 1551 1 5 . 1 1 17 17 LYS CA C 17 58.837 58.837 58.928 -0.091 18703 1552 1 5 . 1 1 17 17 LYS CB C 17 32.538 32.538 32.669 -0.131 18703 1553 1 5 . 1 1 17 17 LYS H H 17 7.720 7.720 7.474 0.246 18703 1554 1 5 . 1 1 18 18 VAL N N 18 118.376 118.376 119.347 -0.971 18703 1555 1 5 . 1 1 18 18 VAL HA H 18 3.711 3.711 3.836 -0.125 18703 1556 1 5 . 1 1 18 18 VAL C C 18 178.765 178.765 178.460 0.305 18703 1557 1 5 . 1 1 18 18 VAL CA C 18 66.237 66.237 65.245 0.993 18703 1558 1 5 . 1 1 18 18 VAL CB C 18 31.682 31.682 31.480 0.202 18703 1559 1 5 . 1 1 18 18 VAL H H 18 8.754 8.754 7.653 1.101 18703 1560 1 5 . 1 1 19 19 LYS N N 19 118.817 118.817 119.809 -0.992 18703 1561 1 5 . 1 1 19 19 LYS HA H 19 4.078 4.078 4.024 0.054 18703 1562 1 5 . 1 1 19 19 LYS C C 19 178.049 178.049 177.938 0.111 18703 1563 1 5 . 1 1 19 19 LYS CA C 19 59.731 59.731 59.145 0.586 18703 1564 1 5 . 1 1 19 19 LYS CB C 19 32.523 32.523 31.916 0.607 18703 1565 1 5 . 1 1 19 19 LYS H H 19 8.299 8.299 8.516 -0.217 18703 1566 1 5 . 1 1 20 20 ALA N N 20 119.656 119.656 119.013 0.643 18703 1567 1 5 . 1 1 20 20 ALA HA H 20 4.347 4.347 4.369 -0.022 18703 1568 1 5 . 1 1 20 20 ALA C C 20 178.532 178.532 177.673 0.859 18703 1569 1 5 . 1 1 20 20 ALA CA C 20 52.853 52.853 52.249 0.604 18703 1570 1 5 . 1 1 20 20 ALA CB C 20 18.832 18.832 19.568 -0.736 18703 1571 1 5 . 1 1 20 20 ALA H H 20 7.425 7.425 7.790 -0.365 18703 1572 1 5 . 1 1 21 21 LEU N N 21 118.594 118.594 118.009 0.585 18703 1573 1 5 . 1 1 21 21 LEU HA H 21 4.297 4.297 4.700 -0.403 18703 1574 1 5 . 1 1 21 21 LEU C C 21 177.784 177.784 175.848 1.936 18703 1575 1 5 . 1 1 21 21 LEU CA C 21 55.750 55.750 54.675 1.075 18703 1576 1 5 . 1 1 21 21 LEU CB C 21 42.898 42.898 43.842 -0.944 18703 1577 1 5 . 1 1 21 21 LEU H H 21 7.508 7.508 7.465 0.043 18703 1578 1 5 . 1 1 22 22 GLY N N 22 106.650 106.650 106.261 0.389 18703 1579 1 5 . 1 1 22 22 GLY C C 22 173.605 173.605 173.558 0.047 18703 1580 1 5 . 1 1 22 22 GLY CA C 22 45.330 45.330 44.365 0.965 18703 1581 1 5 . 1 1 22 22 GLY H H 22 7.814 7.814 8.061 -0.247 18703 1582 1 5 . 1 1 23 23 GLY N N 23 108.011 108.011 107.004 1.007 18703 1583 1 5 . 1 1 23 23 GLY C C 23 174.061 174.061 172.777 1.284 18703 1584 1 5 . 1 1 23 23 GLY CA C 23 44.772 44.772 45.459 -0.687 18703 1585 1 5 . 1 1 23 23 GLY H H 23 8.139 8.139 8.206 -0.067 18703 1586 1 5 . 1 1 24 24 GLY N N 24 107.826 107.826 107.822 0.004 18703 1587 1 5 . 1 1 24 24 GLY C C 24 175.046 175.046 173.421 1.625 18703 1588 1 5 . 1 1 24 24 GLY CA C 24 44.422 44.422 45.186 -0.764 18703 1589 1 5 . 1 1 24 24 GLY H H 24 8.497 8.497 8.084 0.413 18703 1590 1 5 . 1 1 25 25 GLY N N 25 108.830 108.830 110.229 -1.399 18703 1591 1 5 . 1 1 25 25 GLY C C 25 176.272 176.272 176.091 0.181 18703 1592 1 5 . 1 1 25 25 GLY CA C 25 47.101 47.101 45.210 1.891 18703 1593 1 5 . 1 1 25 25 GLY H H 25 8.616 8.616 8.245 0.371 18703 1594 1 5 . 1 1 26 26 ARG N N 26 123.109 123.109 124.056 -0.947 18703 1595 1 5 . 1 1 26 26 ARG HA H 26 4.283 4.283 4.100 0.183 18703 1596 1 5 . 1 1 26 26 ARG C C 26 177.848 177.848 178.010 -0.162 18703 1597 1 5 . 1 1 26 26 ARG CA C 26 57.663 57.663 58.096 -0.433 18703 1598 1 5 . 1 1 26 26 ARG CB C 26 29.811 29.811 29.370 0.441 18703 1599 1 5 . 1 1 26 26 ARG H H 26 8.770 8.770 8.455 0.315 18703 1600 1 5 . 1 1 27 27 ILE N N 27 118.104 118.104 119.189 -1.085 18703 1601 1 5 . 1 1 27 27 ILE HA H 27 3.787 3.787 3.815 -0.028 18703 1602 1 5 . 1 1 27 27 ILE C C 27 177.473 177.473 177.943 -0.470 18703 1603 1 5 . 1 1 27 27 ILE CA C 27 63.036 63.036 64.088 -1.052 18703 1604 1 5 . 1 1 27 27 ILE CB C 27 36.664 36.664 37.292 -0.628 18703 1605 1 5 . 1 1 27 27 ILE H H 27 7.708 7.708 7.955 -0.247 18703 1606 1 5 . 1 1 28 28 GLU N N 28 119.934 119.934 120.364 -0.430 18703 1607 1 5 . 1 1 28 28 GLU HA H 28 3.954 3.954 3.935 0.019 18703 1608 1 5 . 1 1 28 28 GLU C C 28 179.514 179.514 178.595 0.919 18703 1609 1 5 . 1 1 28 28 GLU CA C 28 59.450 59.450 59.881 -0.431 18703 1610 1 5 . 1 1 28 28 GLU CB C 28 29.600 29.600 29.323 0.277 18703 1611 1 5 . 1 1 28 28 GLU H H 28 7.872 7.872 7.822 0.050 18703 1612 1 5 . 1 1 29 29 GLU N N 29 118.134 118.134 119.532 -1.398 18703 1613 1 5 . 1 1 29 29 GLU HA H 29 4.028 4.028 4.104 -0.076 18703 1614 1 5 . 1 1 29 29 GLU C C 29 179.182 179.182 179.253 -0.071 18703 1615 1 5 . 1 1 29 29 GLU CA C 29 59.173 59.173 59.056 0.117 18703 1616 1 5 . 1 1 29 29 GLU CB C 29 29.503 29.503 29.390 0.113 18703 1617 1 5 . 1 1 29 29 GLU H H 29 8.166 8.166 7.666 0.500 18703 1618 1 5 . 1 1 30 30 LEU N N 30 120.242 120.242 117.719 2.523 18703 1619 1 5 . 1 1 30 30 LEU HA H 30 4.028 4.028 4.100 -0.072 18703 1620 1 5 . 1 1 30 30 LEU C C 30 178.796 178.796 178.391 0.405 18703 1621 1 5 . 1 1 30 30 LEU CA C 30 57.654 57.654 56.919 0.735 18703 1622 1 5 . 1 1 30 30 LEU CB C 30 41.629 41.629 41.955 -0.326 18703 1623 1 5 . 1 1 30 30 LEU H H 30 7.695 7.695 7.479 0.216 18703 1624 1 5 . 1 1 31 31 LYS N N 31 120.506 120.506 119.565 0.941 18703 1625 1 5 . 1 1 31 31 LYS HA H 31 3.532 3.532 4.066 -0.534 18703 1626 1 5 . 1 1 31 31 LYS C C 31 178.919 178.919 178.239 0.680 18703 1627 1 5 . 1 1 31 31 LYS CA C 31 60.240 60.240 59.202 1.038 18703 1628 1 5 . 1 1 31 31 LYS CB C 31 32.015 32.015 32.518 -0.503 18703 1629 1 5 . 1 1 31 31 LYS H H 31 8.561 8.561 7.713 0.848 18703 1630 1 5 . 1 1 32 32 LYS N N 32 118.566 118.566 119.275 -0.709 18703 1631 1 5 . 1 1 32 32 LYS C C 32 179.392 179.392 178.773 0.619 18703 1632 1 5 . 1 1 32 32 LYS CA C 32 59.356 59.356 59.380 -0.024 18703 1633 1 5 . 1 1 32 32 LYS CB C 32 32.117 32.117 32.195 -0.078 18703 1634 1 5 . 1 1 32 32 LYS H H 32 7.699 7.699 7.544 0.155 18703 1635 1 5 . 1 1 33 33 LYS N N 33 118.964 118.964 118.356 0.608 18703 1636 1 5 . 1 1 33 33 LYS HA H 33 4.117 4.117 4.023 0.094 18703 1637 1 5 . 1 1 33 33 LYS C C 33 178.355 178.355 178.555 -0.200 18703 1638 1 5 . 1 1 33 33 LYS CA C 33 58.633 58.633 59.378 -0.745 18703 1639 1 5 . 1 1 33 33 LYS CB C 33 31.904 31.904 32.342 -0.438 18703 1640 1 5 . 1 1 33 33 LYS H H 33 7.752 7.752 7.658 0.094 18703 1641 1 5 . 1 1 34 34 CYS N N 34 119.956 119.956 117.917 2.039 18703 1642 1 5 . 1 1 34 34 CYS HA H 34 3.967 3.967 4.110 -0.143 18703 1643 1 5 . 1 1 34 34 CYS C C 34 175.521 175.521 176.961 -1.440 18703 1644 1 5 . 1 1 34 34 CYS CA C 34 60.987 60.987 62.774 -1.787 18703 1645 1 5 . 1 1 34 34 CYS CB C 34 36.600 36.600 26.678 9.922 18703 1646 1 5 . 1 1 34 34 CYS H H 34 8.393 8.393 7.508 0.885 18703 1647 1 5 . 1 1 35 35 GLU N N 35 120.327 120.327 119.930 0.397 18703 1648 1 5 . 1 1 35 35 GLU HA H 35 3.891 3.891 3.935 -0.044 18703 1649 1 5 . 1 1 35 35 GLU C C 35 179.684 179.684 178.814 0.870 18703 1650 1 5 . 1 1 35 35 GLU CA C 35 60.059 60.059 59.095 0.964 18703 1651 1 5 . 1 1 35 35 GLU CB C 35 29.718 29.718 28.689 1.029 18703 1652 1 5 . 1 1 35 35 GLU H H 35 8.558 8.558 7.751 0.807 18703 1653 1 5 . 1 1 36 36 GLU N N 36 120.190 120.190 119.878 0.312 18703 1654 1 5 . 1 1 36 36 GLU HA H 36 4.051 4.051 3.991 0.060 18703 1655 1 5 . 1 1 36 36 GLU C C 36 179.408 179.408 179.008 0.400 18703 1656 1 5 . 1 1 36 36 GLU CA C 36 59.148 59.148 59.046 0.102 18703 1657 1 5 . 1 1 36 36 GLU CB C 36 29.766 29.766 29.767 -0.001 18703 1658 1 5 . 1 1 36 36 GLU H H 36 8.038 8.038 7.626 0.412 18703 1659 1 5 . 1 1 37 37 LEU N N 37 121.102 121.102 119.488 1.614 18703 1660 1 5 . 1 1 37 37 LEU HA H 37 4.079 4.079 4.187 -0.108 18703 1661 1 5 . 1 1 37 37 LEU C C 37 178.279 178.279 178.416 -0.137 18703 1662 1 5 . 1 1 37 37 LEU CA C 37 57.803 57.803 57.250 0.553 18703 1663 1 5 . 1 1 37 37 LEU CB C 37 41.502 41.502 41.719 -0.217 18703 1664 1 5 . 1 1 37 37 LEU H H 37 8.065 8.065 7.595 0.470 18703 1665 1 5 . 1 1 38 38 LYS N N 38 119.980 119.980 119.088 0.892 18703 1666 1 5 . 1 1 38 38 LYS HA H 38 3.851 3.851 3.944 -0.093 18703 1667 1 5 . 1 1 38 38 LYS C C 38 178.919 178.919 179.118 -0.199 18703 1668 1 5 . 1 1 38 38 LYS CA C 38 60.794 60.794 60.056 0.738 18703 1669 1 5 . 1 1 38 38 LYS CB C 38 32.863 32.863 32.306 0.557 18703 1670 1 5 . 1 1 38 38 LYS H H 38 8.741 8.741 8.102 0.639 18703 1671 1 5 . 1 1 39 39 LYS N N 39 118.307 118.307 118.006 0.301 18703 1672 1 5 . 1 1 39 39 LYS HA H 39 4.125 4.125 4.243 -0.118 18703 1673 1 5 . 1 1 39 39 LYS C C 39 178.622 178.622 178.654 -0.032 18703 1674 1 5 . 1 1 39 39 LYS CA C 39 58.993 58.993 59.041 -0.048 18703 1675 1 5 . 1 1 39 39 LYS CB C 39 32.097 32.097 31.803 0.294 18703 1676 1 5 . 1 1 39 39 LYS H H 39 7.584 7.584 7.686 -0.102 18703 1677 1 5 . 1 1 40 40 LYS N N 40 118.826 118.826 119.616 -0.790 18703 1678 1 5 . 1 1 40 40 LYS HA H 40 4.069 4.069 4.116 -0.047 18703 1679 1 5 . 1 1 40 40 LYS C C 40 179.802 179.802 179.023 0.779 18703 1680 1 5 . 1 1 40 40 LYS CA C 40 59.322 59.322 58.780 0.542 18703 1681 1 5 . 1 1 40 40 LYS CB C 40 32.505 32.505 32.368 0.137 18703 1682 1 5 . 1 1 40 40 LYS H H 40 7.945 7.945 7.345 0.600 18703 1683 1 5 . 1 1 41 41 ILE N N 41 118.958 118.958 117.073 1.885 18703 1684 1 5 . 1 1 41 41 ILE HA H 41 3.659 3.659 3.806 -0.147 18703 1685 1 5 . 1 1 41 41 ILE C C 41 178.146 178.146 176.600 1.546 18703 1686 1 5 . 1 1 41 41 ILE CA C 41 65.037 65.037 63.775 1.262 18703 1687 1 5 . 1 1 41 41 ILE CB C 41 37.950 37.950 38.089 -0.139 18703 1688 1 5 . 1 1 41 41 ILE H H 41 8.369 8.369 8.028 0.341 18703 1689 1 5 . 1 1 42 42 GLU N N 42 120.331 120.331 116.496 3.835 18703 1690 1 5 . 1 1 42 42 GLU HA H 42 4.094 4.094 4.092 0.002 18703 1691 1 5 . 1 1 42 42 GLU C C 42 178.697 178.697 177.693 1.004 18703 1692 1 5 . 1 1 42 42 GLU CA C 42 58.927 58.927 58.380 0.547 18703 1693 1 5 . 1 1 42 42 GLU CB C 42 29.399 29.399 30.041 -0.642 18703 1694 1 5 . 1 1 42 42 GLU H H 42 7.805 7.805 7.671 0.134 18703 1695 1 5 . 1 1 43 43 GLU N N 43 117.120 117.120 116.780 0.340 18703 1696 1 5 . 1 1 43 43 GLU HA H 43 4.291 4.291 4.150 0.141 18703 1697 1 5 . 1 1 43 43 GLU C C 43 177.551 177.551 177.547 0.004 18703 1698 1 5 . 1 1 43 43 GLU CA C 43 56.800 56.800 57.115 -0.315 18703 1699 1 5 . 1 1 43 43 GLU CB C 43 29.931 29.931 29.675 0.255 18703 1700 1 5 . 1 1 43 43 GLU H H 43 7.701 7.701 7.632 0.069 18703 1701 1 5 . 1 1 44 44 LEU N N 44 120.940 120.940 120.673 0.267 18703 1702 1 5 . 1 1 44 44 LEU HA H 44 4.251 4.251 4.149 0.102 18703 1703 1 5 . 1 1 44 44 LEU C C 44 178.596 178.596 176.698 1.898 18703 1704 1 5 . 1 1 44 44 LEU CA C 44 56.448 56.448 55.669 0.779 18703 1705 1 5 . 1 1 44 44 LEU CB C 44 42.519 42.519 42.645 -0.126 18703 1706 1 5 . 1 1 44 44 LEU H H 44 7.581 7.581 7.377 0.204 18703 1707 1 5 . 1 1 45 45 GLY N N 45 108.689 108.689 108.013 0.676 18703 1708 1 5 . 1 1 45 45 GLY C C 45 174.853 174.853 174.027 0.826 18703 1709 1 5 . 1 1 45 45 GLY CA C 45 46.233 46.233 44.728 1.505 18703 1710 1 5 . 1 1 45 45 GLY H H 45 8.232 8.232 8.411 -0.179 18703 1711 1 5 . 1 1 46 46 GLY N N 46 108.029 108.029 109.761 -1.732 18703 1712 1 5 . 1 1 46 46 GLY C C 46 174.351 174.351 174.140 0.211 18703 1713 1 5 . 1 1 46 46 GLY CA C 46 45.105 45.105 44.550 0.555 18703 1714 1 5 . 1 1 46 46 GLY H H 46 8.176 8.176 8.123 0.053 18703 1715 1 5 . 1 1 47 47 GLY N N 47 108.183 108.183 105.818 2.365 18703 1716 1 5 . 1 1 47 47 GLY C C 47 174.671 174.671 174.933 -0.262 18703 1717 1 5 . 1 1 47 47 GLY CA C 47 45.254 45.254 44.738 0.516 18703 1718 1 5 . 1 1 47 47 GLY H H 47 8.290 8.290 8.146 0.144 18703 1719 1 5 . 1 1 48 48 GLY N N 48 108.616 108.616 110.996 -2.380 18703 1720 1 5 . 1 1 48 48 GLY C C 48 174.321 174.321 175.186 -0.865 18703 1721 1 5 . 1 1 48 48 GLY CA C 48 45.192 45.192 45.279 -0.087 18703 1722 1 5 . 1 1 48 48 GLY H H 48 8.027 8.027 8.459 -0.432 18703 1723 1 5 . 1 1 49 49 GLU N N 49 121.057 121.057 122.162 -1.105 18703 1724 1 5 . 1 1 49 49 GLU HA H 49 4.425 4.425 4.454 -0.029 18703 1725 1 5 . 1 1 49 49 GLU C C 49 177.072 177.072 178.295 -1.223 18703 1726 1 5 . 1 1 49 49 GLU CA C 49 56.330 56.330 56.484 -0.154 18703 1727 1 5 . 1 1 49 49 GLU CB C 49 29.602 29.602 30.098 -0.496 18703 1728 1 5 . 1 1 49 49 GLU H H 49 8.486 8.486 8.495 -0.009 18703 1729 1 5 . 1 1 50 50 VAL N N 50 122.122 122.122 121.757 0.365 18703 1730 1 5 . 1 1 50 50 VAL HA H 50 3.792 3.792 3.646 0.146 18703 1731 1 5 . 1 1 50 50 VAL C C 50 176.774 176.774 176.785 -0.011 18703 1732 1 5 . 1 1 50 50 VAL CA C 50 64.864 64.864 66.363 -1.499 18703 1733 1 5 . 1 1 50 50 VAL CB C 50 32.179 32.179 31.871 0.308 18703 1734 1 5 . 1 1 50 50 VAL H H 50 8.095 8.095 8.440 -0.345 18703 1735 1 5 . 1 1 51 51 LYS N N 51 120.602 120.602 116.230 4.372 18703 1736 1 5 . 1 1 51 51 LYS HA H 51 4.195 4.195 4.095 0.100 18703 1737 1 5 . 1 1 51 51 LYS C C 51 178.530 178.530 178.287 0.243 18703 1738 1 5 . 1 1 51 51 LYS CA C 51 59.348 59.348 58.753 0.595 18703 1739 1 5 . 1 1 51 51 LYS CB C 51 32.265 32.265 31.611 0.654 18703 1740 1 5 . 1 1 51 51 LYS H H 51 8.268 8.268 8.269 -0.001 18703 1741 1 5 . 1 1 52 52 LYS N N 52 117.547 117.547 121.302 -3.755 18703 1742 1 5 . 1 1 52 52 LYS HA H 52 4.162 4.162 4.055 0.107 18703 1743 1 5 . 1 1 52 52 LYS C C 52 179.132 179.132 178.745 0.387 18703 1744 1 5 . 1 1 52 52 LYS CA C 52 58.811 58.811 59.461 -0.650 18703 1745 1 5 . 1 1 52 52 LYS CB C 52 32.054 32.054 32.507 -0.453 18703 1746 1 5 . 1 1 52 52 LYS H H 52 7.595 7.595 7.822 -0.227 18703 1747 1 5 . 1 1 53 53 VAL N N 53 119.190 119.190 117.998 1.192 18703 1748 1 5 . 1 1 53 53 VAL HA H 53 3.767 3.767 3.702 0.065 18703 1749 1 5 . 1 1 53 53 VAL C C 53 177.933 177.933 177.914 0.019 18703 1750 1 5 . 1 1 53 53 VAL CA C 53 66.065 66.065 66.128 -0.063 18703 1751 1 5 . 1 1 53 53 VAL CB C 53 31.248 31.248 31.294 -0.046 18703 1752 1 5 . 1 1 53 53 VAL H H 53 7.597 7.597 7.550 0.047 18703 1753 1 5 . 1 1 54 54 GLU N N 54 120.226 120.226 119.218 1.008 18703 1754 1 5 . 1 1 54 54 GLU HA H 54 3.833 3.833 4.017 -0.184 18703 1755 1 5 . 1 1 54 54 GLU C C 54 179.352 179.352 178.556 0.796 18703 1756 1 5 . 1 1 54 54 GLU CA C 54 59.153 59.153 59.766 -0.613 18703 1757 1 5 . 1 1 54 54 GLU CB C 54 29.224 29.224 29.357 -0.133 18703 1758 1 5 . 1 1 54 54 GLU H H 54 8.609 8.609 7.658 0.951 18703 1759 1 5 . 1 1 55 55 GLU N N 55 119.148 119.148 119.155 -0.007 18703 1760 1 5 . 1 1 55 55 GLU HA H 55 4.084 4.084 4.112 -0.028 18703 1761 1 5 . 1 1 55 55 GLU C C 55 179.084 179.084 178.819 0.265 18703 1762 1 5 . 1 1 55 55 GLU CA C 55 59.295 59.295 59.109 0.186 18703 1763 1 5 . 1 1 55 55 GLU CB C 55 29.361 29.361 29.618 -0.257 18703 1764 1 5 . 1 1 55 55 GLU H H 55 7.713 7.713 7.707 0.006 18703 1765 1 5 . 1 1 56 56 GLU N N 56 120.301 120.301 118.919 1.382 18703 1766 1 5 . 1 1 56 56 GLU HA H 56 4.079 4.079 4.146 -0.067 18703 1767 1 5 . 1 1 56 56 GLU C C 56 179.773 179.773 179.182 0.591 18703 1768 1 5 . 1 1 56 56 GLU CA C 56 59.528 59.528 59.129 0.399 18703 1769 1 5 . 1 1 56 56 GLU CB C 56 30.162 30.162 29.689 0.473 18703 1770 1 5 . 1 1 56 56 GLU H H 56 7.899 7.899 7.570 0.329 18703 1771 1 5 . 1 1 57 57 VAL N N 57 121.536 121.536 118.185 3.351 18703 1772 1 5 . 1 1 57 57 VAL HA H 57 3.540 3.540 3.865 -0.325 18703 1773 1 5 . 1 1 57 57 VAL C C 57 176.984 176.984 177.664 -0.680 18703 1774 1 5 . 1 1 57 57 VAL CA C 57 66.734 66.734 64.657 2.077 18703 1775 1 5 . 1 1 57 57 VAL CB C 57 31.425 31.425 31.123 0.302 18703 1776 1 5 . 1 1 57 57 VAL H H 57 8.652 8.652 7.486 1.166 18703 1777 1 5 . 1 1 58 58 LYS N N 58 120.219 120.219 120.388 -0.169 18703 1778 1 5 . 1 1 58 58 LYS HA H 58 4.199 4.199 4.120 0.079 18703 1779 1 5 . 1 1 58 58 LYS C C 58 178.972 178.972 178.727 0.245 18703 1780 1 5 . 1 1 58 58 LYS CA C 58 59.357 59.357 59.622 -0.265 18703 1781 1 5 . 1 1 58 58 LYS CB C 58 32.186 32.186 32.234 -0.048 18703 1782 1 5 . 1 1 58 58 LYS H H 58 7.791 7.791 7.432 0.359 18703 1783 1 5 . 1 1 59 59 LYS N N 59 118.252 118.252 119.839 -1.587 18703 1784 1 5 . 1 1 59 59 LYS HA H 59 4.069 4.069 4.155 -0.086 18703 1785 1 5 . 1 1 59 59 LYS C C 59 179.180 179.180 178.306 0.874 18703 1786 1 5 . 1 1 59 59 LYS CA C 59 59.285 59.285 58.934 0.352 18703 1787 1 5 . 1 1 59 59 LYS CB C 59 32.345 32.345 32.395 -0.050 18703 1788 1 5 . 1 1 59 59 LYS H H 59 7.849 7.849 7.519 0.330 18703 1789 1 5 . 1 1 60 60 LEU N N 60 121.243 121.243 119.646 1.597 18703 1790 1 5 . 1 1 60 60 LEU HA H 60 4.242 4.242 4.109 0.133 18703 1791 1 5 . 1 1 60 60 LEU C C 60 178.413 178.413 178.184 0.229 18703 1792 1 5 . 1 1 60 60 LEU CA C 60 57.798 57.798 57.278 0.520 18703 1793 1 5 . 1 1 60 60 LEU CB C 60 41.150 41.150 42.150 -1.000 18703 1794 1 5 . 1 1 60 60 LEU H H 60 7.825 7.825 7.545 0.280 18703 1795 1 5 . 1 1 61 61 GLU N N 61 118.844 118.844 120.052 -1.208 18703 1796 1 5 . 1 1 61 61 GLU HA H 61 3.800 3.800 3.902 -0.102 18703 1797 1 5 . 1 1 61 61 GLU C C 61 179.078 179.078 178.505 0.573 18703 1798 1 5 . 1 1 61 61 GLU CA C 61 60.104 60.104 59.795 0.309 18703 1799 1 5 . 1 1 61 61 GLU CB C 61 29.864 29.864 29.634 0.230 18703 1800 1 5 . 1 1 61 61 GLU H H 61 8.582 8.582 7.733 0.849 18703 1801 1 5 . 1 1 62 62 GLU N N 62 117.659 117.659 118.924 -1.265 18703 1802 1 5 . 1 1 62 62 GLU HA H 62 3.990 3.990 4.019 -0.029 18703 1803 1 5 . 1 1 62 62 GLU C C 62 178.847 178.847 178.968 -0.121 18703 1804 1 5 . 1 1 62 62 GLU CA C 62 59.067 59.067 59.074 -0.007 18703 1805 1 5 . 1 1 62 62 GLU CB C 62 29.440 29.440 29.597 -0.157 18703 1806 1 5 . 1 1 62 62 GLU H H 62 8.032 8.032 7.631 0.401 18703 1807 1 5 . 1 1 63 63 GLU N N 63 119.290 119.290 119.100 0.190 18703 1808 1 5 . 1 1 63 63 GLU HA H 63 4.012 4.012 4.090 -0.078 18703 1809 1 5 . 1 1 63 63 GLU C C 63 179.784 179.784 179.203 0.581 18703 1810 1 5 . 1 1 63 63 GLU CA C 63 59.300 59.300 59.449 -0.149 18703 1811 1 5 . 1 1 63 63 GLU CB C 63 29.728 29.728 29.637 0.091 18703 1812 1 5 . 1 1 63 63 GLU H H 63 7.958 7.958 7.462 0.496 18703 1813 1 5 . 1 1 64 64 ILE N N 64 118.453 118.453 118.756 -0.303 18703 1814 1 5 . 1 1 64 64 ILE HA H 64 3.711 3.711 3.820 -0.109 18703 1815 1 5 . 1 1 64 64 ILE C C 64 177.655 177.655 177.308 0.347 18703 1816 1 5 . 1 1 64 64 ILE CA C 64 64.256 64.256 63.606 0.650 18703 1817 1 5 . 1 1 64 64 ILE CB C 64 38.002 38.002 37.714 0.288 18703 1818 1 5 . 1 1 64 64 ILE H H 64 8.160 8.160 7.478 0.682 18703 1819 1 5 . 1 1 65 65 LYS N N 65 118.871 118.871 118.292 0.579 18703 1820 1 5 . 1 1 65 65 LYS HA H 65 4.111 4.111 4.135 -0.024 18703 1821 1 5 . 1 1 65 65 LYS C C 65 177.076 177.076 177.770 -0.694 18703 1822 1 5 . 1 1 65 65 LYS CA C 65 58.421 58.421 58.220 0.201 18703 1823 1 5 . 1 1 65 65 LYS CB C 65 32.639 32.639 32.181 0.458 18703 1824 1 5 . 1 1 65 65 LYS H H 65 7.664 7.664 7.519 0.145 18703 1825 1 5 . 1 1 66 66 LYS N N 66 116.944 116.944 118.563 -1.619 18703 1826 1 5 . 1 1 66 66 LYS HA H 66 4.320 4.320 4.100 0.220 18703 1827 1 5 . 1 1 66 66 LYS C C 66 175.897 175.897 177.771 -1.874 18703 1828 1 5 . 1 1 66 66 LYS CA C 66 56.352 56.352 58.021 -1.669 18703 1829 1 5 . 1 1 66 66 LYS CB C 66 33.024 33.024 32.569 0.455 18703 1830 1 5 . 1 1 66 66 LYS H H 66 7.246 7.246 7.497 -0.251 18703 1831 1 6 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.287 -0.041 18703 1832 1 6 . 1 1 3 3 ARG C C 3 178.379 178.379 176.192 2.187 18703 1833 1 6 . 1 1 3 3 ARG CA C 3 58.367 58.367 57.420 0.947 18703 1834 1 6 . 1 1 3 3 ARG CB C 3 30.691 30.691 30.933 -0.242 18703 1835 1 6 . 1 1 3 3 ARG H H 3 7.905 7.905 8.423 -0.518 18703 1836 1 6 . 1 1 4 4 VAL N N 4 118.966 118.966 121.649 -2.683 18703 1837 1 6 . 1 1 4 4 VAL HA H 4 3.803 3.803 3.797 0.006 18703 1838 1 6 . 1 1 4 4 VAL C C 4 176.968 176.968 176.399 0.569 18703 1839 1 6 . 1 1 4 4 VAL CA C 4 65.441 65.441 64.751 0.690 18703 1840 1 6 . 1 1 4 4 VAL CB C 4 31.710 31.710 31.954 -0.244 18703 1841 1 6 . 1 1 4 4 VAL H H 4 8.070 8.070 8.517 -0.447 18703 1842 1 6 . 1 1 5 5 LYS N N 5 122.058 122.058 119.407 2.651 18703 1843 1 6 . 1 1 5 5 LYS HA H 5 4.154 4.154 3.969 0.185 18703 1844 1 6 . 1 1 5 5 LYS C C 5 178.553 178.553 178.100 0.453 18703 1845 1 6 . 1 1 5 5 LYS CA C 5 58.712 58.712 59.567 -0.855 18703 1846 1 6 . 1 1 5 5 LYS CB C 5 31.788 31.788 31.779 0.009 18703 1847 1 6 . 1 1 5 5 LYS H H 5 7.798 7.798 8.359 -0.561 18703 1848 1 6 . 1 1 6 6 ALA N N 6 119.955 119.955 120.565 -0.610 18703 1849 1 6 . 1 1 6 6 ALA HA H 6 4.198 4.198 4.244 -0.046 18703 1850 1 6 . 1 1 6 6 ALA C C 6 180.974 180.974 179.298 1.676 18703 1851 1 6 . 1 1 6 6 ALA CA C 6 54.850 54.850 54.266 0.584 18703 1852 1 6 . 1 1 6 6 ALA CB C 6 17.995 17.995 18.395 -0.400 18703 1853 1 6 . 1 1 6 6 ALA H H 6 7.928 7.928 7.576 0.352 18703 1854 1 6 . 1 1 7 7 LEU N N 7 119.211 119.211 119.573 -0.362 18703 1855 1 6 . 1 1 7 7 LEU HA H 7 4.124 4.124 3.968 0.156 18703 1856 1 6 . 1 1 7 7 LEU C C 7 178.353 178.353 178.333 0.020 18703 1857 1 6 . 1 1 7 7 LEU CA C 7 57.658 57.658 57.214 0.444 18703 1858 1 6 . 1 1 7 7 LEU CB C 7 41.971 41.971 41.996 -0.025 18703 1859 1 6 . 1 1 7 7 LEU H H 7 7.594 7.594 7.518 0.076 18703 1860 1 6 . 1 1 8 8 GLU N N 8 120.258 120.258 118.051 2.207 18703 1861 1 6 . 1 1 8 8 GLU HA H 8 3.846 3.846 4.031 -0.185 18703 1862 1 6 . 1 1 8 8 GLU C C 8 179.546 179.546 178.767 0.779 18703 1863 1 6 . 1 1 8 8 GLU CA C 8 60.006 60.006 59.484 0.522 18703 1864 1 6 . 1 1 8 8 GLU CB C 8 29.683 29.683 29.570 0.113 18703 1865 1 6 . 1 1 8 8 GLU H H 8 8.382 8.382 7.814 0.568 18703 1866 1 6 . 1 1 9 9 GLU N N 9 118.584 118.584 118.906 -0.322 18703 1867 1 6 . 1 1 9 9 GLU HA H 9 4.039 4.039 4.140 -0.101 18703 1868 1 6 . 1 1 9 9 GLU C C 9 179.635 179.635 178.634 1.001 18703 1869 1 6 . 1 1 9 9 GLU CA C 9 59.235 59.235 58.583 0.652 18703 1870 1 6 . 1 1 9 9 GLU CB C 9 29.358 29.358 29.185 0.173 18703 1871 1 6 . 1 1 9 9 GLU H H 9 7.908 7.908 7.806 0.102 18703 1872 1 6 . 1 1 10 10 LYS N N 10 120.956 120.956 120.432 0.524 18703 1873 1 6 . 1 1 10 10 LYS HA H 10 4.190 4.190 4.138 0.052 18703 1874 1 6 . 1 1 10 10 LYS C C 10 179.395 179.395 178.988 0.407 18703 1875 1 6 . 1 1 10 10 LYS CA C 10 59.231 59.231 59.310 -0.079 18703 1876 1 6 . 1 1 10 10 LYS CB C 10 32.211 32.211 32.645 -0.434 18703 1877 1 6 . 1 1 10 10 LYS H H 10 8.009 8.009 7.498 0.511 18703 1878 1 6 . 1 1 11 11 VAL N N 11 119.577 119.577 118.280 1.297 18703 1879 1 6 . 1 1 11 11 VAL HA H 11 3.844 3.844 3.618 0.226 18703 1880 1 6 . 1 1 11 11 VAL C C 11 177.078 177.078 177.323 -0.245 18703 1881 1 6 . 1 1 11 11 VAL CA C 11 66.407 66.407 66.108 0.299 18703 1882 1 6 . 1 1 11 11 VAL CB C 11 31.252 31.252 31.417 -0.165 18703 1883 1 6 . 1 1 11 11 VAL H H 11 8.488 8.488 7.456 1.032 18703 1884 1 6 . 1 1 12 12 LYS N N 12 122.864 122.864 119.538 3.326 18703 1885 1 6 . 1 1 12 12 LYS HA H 12 4.189 4.189 4.009 0.180 18703 1886 1 6 . 1 1 12 12 LYS C C 12 178.755 178.755 178.193 0.562 18703 1887 1 6 . 1 1 12 12 LYS CA C 12 59.375 59.375 59.624 -0.249 18703 1888 1 6 . 1 1 12 12 LYS CB C 12 31.991 31.991 32.314 -0.323 18703 1889 1 6 . 1 1 12 12 LYS H H 12 7.944 7.944 7.621 0.323 18703 1890 1 6 . 1 1 13 13 ALA N N 13 121.202 121.202 120.253 0.949 18703 1891 1 6 . 1 1 13 13 ALA HA H 13 4.209 4.209 4.524 -0.315 18703 1892 1 6 . 1 1 13 13 ALA C C 13 181.060 181.060 179.433 1.627 18703 1893 1 6 . 1 1 13 13 ALA CA C 13 54.710 54.710 54.052 0.658 18703 1894 1 6 . 1 1 13 13 ALA CB C 13 17.861 17.861 18.475 -0.614 18703 1895 1 6 . 1 1 13 13 ALA H H 13 7.563 7.563 7.398 0.165 18703 1896 1 6 . 1 1 14 14 LEU N N 14 120.014 120.014 119.742 0.272 18703 1897 1 6 . 1 1 14 14 LEU HA H 14 4.072 4.072 3.990 0.082 18703 1898 1 6 . 1 1 14 14 LEU C C 14 177.862 177.862 178.181 -0.319 18703 1899 1 6 . 1 1 14 14 LEU CA C 14 57.864 57.864 57.236 0.628 18703 1900 1 6 . 1 1 14 14 LEU CB C 14 41.539 41.539 41.977 -0.438 18703 1901 1 6 . 1 1 14 14 LEU H H 14 8.087 8.087 7.442 0.645 18703 1902 1 6 . 1 1 15 15 GLU N N 15 121.644 121.644 120.237 1.407 18703 1903 1 6 . 1 1 15 15 GLU HA H 15 3.692 3.692 3.973 -0.281 18703 1904 1 6 . 1 1 15 15 GLU C C 15 177.819 177.819 178.225 -0.406 18703 1905 1 6 . 1 1 15 15 GLU CA C 15 59.239 59.239 59.362 -0.123 18703 1906 1 6 . 1 1 15 15 GLU CB C 15 28.865 28.865 29.651 -0.786 18703 1907 1 6 . 1 1 15 15 GLU H H 15 8.542 8.542 7.647 0.895 18703 1908 1 6 . 1 1 16 16 GLU N N 16 116.016 116.016 118.259 -2.243 18703 1909 1 6 . 1 1 16 16 GLU HA H 16 3.955 3.955 4.006 -0.051 18703 1910 1 6 . 1 1 16 16 GLU C C 16 179.159 179.159 178.758 0.401 18703 1911 1 6 . 1 1 16 16 GLU CA C 16 59.324 59.324 58.938 0.386 18703 1912 1 6 . 1 1 16 16 GLU CB C 16 29.060 29.060 28.942 0.118 18703 1913 1 6 . 1 1 16 16 GLU H H 16 7.492 7.492 8.002 -0.510 18703 1914 1 6 . 1 1 17 17 LYS N N 17 118.546 118.546 118.802 -0.256 18703 1915 1 6 . 1 1 17 17 LYS HA H 17 4.117 4.117 4.148 -0.031 18703 1916 1 6 . 1 1 17 17 LYS C C 17 178.976 178.976 178.295 0.681 18703 1917 1 6 . 1 1 17 17 LYS CA C 17 58.837 58.837 58.977 -0.140 18703 1918 1 6 . 1 1 17 17 LYS CB C 17 32.538 32.538 32.631 -0.093 18703 1919 1 6 . 1 1 17 17 LYS H H 17 7.720 7.720 7.529 0.191 18703 1920 1 6 . 1 1 18 18 VAL N N 18 118.376 118.376 119.127 -0.751 18703 1921 1 6 . 1 1 18 18 VAL HA H 18 3.711 3.711 3.833 -0.122 18703 1922 1 6 . 1 1 18 18 VAL C C 18 178.765 178.765 178.462 0.303 18703 1923 1 6 . 1 1 18 18 VAL CA C 18 66.237 66.237 65.387 0.850 18703 1924 1 6 . 1 1 18 18 VAL CB C 18 31.682 31.682 31.413 0.269 18703 1925 1 6 . 1 1 18 18 VAL H H 18 8.754 8.754 7.560 1.194 18703 1926 1 6 . 1 1 19 19 LYS N N 19 118.817 118.817 118.740 0.077 18703 1927 1 6 . 1 1 19 19 LYS HA H 19 4.078 4.078 3.990 0.088 18703 1928 1 6 . 1 1 19 19 LYS C C 19 178.049 178.049 177.472 0.577 18703 1929 1 6 . 1 1 19 19 LYS CA C 19 59.731 59.731 58.975 0.756 18703 1930 1 6 . 1 1 19 19 LYS CB C 19 32.523 32.523 32.071 0.452 18703 1931 1 6 . 1 1 19 19 LYS H H 19 8.299 8.299 8.419 -0.120 18703 1932 1 6 . 1 1 20 20 ALA N N 20 119.656 119.656 118.932 0.724 18703 1933 1 6 . 1 1 20 20 ALA HA H 20 4.347 4.347 4.333 0.014 18703 1934 1 6 . 1 1 20 20 ALA C C 20 178.532 178.532 177.792 0.740 18703 1935 1 6 . 1 1 20 20 ALA CA C 20 52.853 52.853 52.595 0.258 18703 1936 1 6 . 1 1 20 20 ALA CB C 20 18.832 18.832 19.791 -0.959 18703 1937 1 6 . 1 1 20 20 ALA H H 20 7.425 7.425 7.577 -0.152 18703 1938 1 6 . 1 1 21 21 LEU N N 21 118.594 118.594 117.599 0.995 18703 1939 1 6 . 1 1 21 21 LEU HA H 21 4.297 4.297 4.680 -0.383 18703 1940 1 6 . 1 1 21 21 LEU C C 21 177.784 177.784 176.053 1.731 18703 1941 1 6 . 1 1 21 21 LEU CA C 21 55.750 55.750 54.506 1.244 18703 1942 1 6 . 1 1 21 21 LEU CB C 21 42.898 42.898 43.858 -0.960 18703 1943 1 6 . 1 1 21 21 LEU H H 21 7.508 7.508 7.487 0.021 18703 1944 1 6 . 1 1 22 22 GLY N N 22 106.650 106.650 106.685 -0.035 18703 1945 1 6 . 1 1 22 22 GLY C C 22 173.605 173.605 173.243 0.362 18703 1946 1 6 . 1 1 22 22 GLY CA C 22 45.330 45.330 44.898 0.433 18703 1947 1 6 . 1 1 22 22 GLY H H 22 7.814 7.814 8.124 -0.310 18703 1948 1 6 . 1 1 23 23 GLY N N 23 108.011 108.011 107.901 0.110 18703 1949 1 6 . 1 1 23 23 GLY C C 23 174.061 174.061 172.746 1.315 18703 1950 1 6 . 1 1 23 23 GLY CA C 23 44.772 44.772 45.664 -0.892 18703 1951 1 6 . 1 1 23 23 GLY H H 23 8.139 8.139 8.055 0.084 18703 1952 1 6 . 1 1 24 24 GLY N N 24 107.826 107.826 107.863 -0.037 18703 1953 1 6 . 1 1 24 24 GLY C C 24 175.046 175.046 173.296 1.750 18703 1954 1 6 . 1 1 24 24 GLY CA C 24 44.422 44.422 45.222 -0.800 18703 1955 1 6 . 1 1 24 24 GLY H H 24 8.497 8.497 8.215 0.282 18703 1956 1 6 . 1 1 25 25 GLY N N 25 108.830 108.830 110.634 -1.804 18703 1957 1 6 . 1 1 25 25 GLY C C 25 176.272 176.272 175.085 1.187 18703 1958 1 6 . 1 1 25 25 GLY CA C 25 47.101 47.101 45.520 1.581 18703 1959 1 6 . 1 1 25 25 GLY H H 25 8.616 8.616 8.375 0.241 18703 1960 1 6 . 1 1 26 26 ARG N N 26 123.109 123.109 123.925 -0.816 18703 1961 1 6 . 1 1 26 26 ARG HA H 26 4.283 4.283 4.121 0.162 18703 1962 1 6 . 1 1 26 26 ARG C C 26 177.848 177.848 177.898 -0.050 18703 1963 1 6 . 1 1 26 26 ARG CA C 26 57.663 57.663 58.513 -0.850 18703 1964 1 6 . 1 1 26 26 ARG CB C 26 29.811 29.811 29.647 0.164 18703 1965 1 6 . 1 1 26 26 ARG H H 26 8.770 8.770 8.414 0.356 18703 1966 1 6 . 1 1 27 27 ILE N N 27 118.104 118.104 117.873 0.231 18703 1967 1 6 . 1 1 27 27 ILE HA H 27 3.787 3.787 3.896 -0.109 18703 1968 1 6 . 1 1 27 27 ILE C C 27 177.473 177.473 177.559 -0.086 18703 1969 1 6 . 1 1 27 27 ILE CA C 27 63.036 63.036 63.782 -0.746 18703 1970 1 6 . 1 1 27 27 ILE CB C 27 36.664 36.664 37.712 -1.048 18703 1971 1 6 . 1 1 27 27 ILE H H 27 7.708 7.708 7.704 0.004 18703 1972 1 6 . 1 1 28 28 GLU N N 28 119.934 119.934 120.252 -0.318 18703 1973 1 6 . 1 1 28 28 GLU HA H 28 3.954 3.954 3.939 0.015 18703 1974 1 6 . 1 1 28 28 GLU C C 28 179.514 179.514 178.458 1.056 18703 1975 1 6 . 1 1 28 28 GLU CA C 28 59.450 59.450 60.038 -0.588 18703 1976 1 6 . 1 1 28 28 GLU CB C 28 29.600 29.600 29.385 0.215 18703 1977 1 6 . 1 1 28 28 GLU H H 28 7.872 7.872 7.827 0.045 18703 1978 1 6 . 1 1 29 29 GLU N N 29 118.134 118.134 119.724 -1.590 18703 1979 1 6 . 1 1 29 29 GLU HA H 29 4.028 4.028 4.086 -0.058 18703 1980 1 6 . 1 1 29 29 GLU C C 29 179.182 179.182 179.176 0.006 18703 1981 1 6 . 1 1 29 29 GLU CA C 29 59.173 59.173 59.262 -0.089 18703 1982 1 6 . 1 1 29 29 GLU CB C 29 29.503 29.503 29.537 -0.034 18703 1983 1 6 . 1 1 29 29 GLU H H 29 8.166 8.166 7.589 0.577 18703 1984 1 6 . 1 1 30 30 LEU N N 30 120.242 120.242 117.907 2.335 18703 1985 1 6 . 1 1 30 30 LEU HA H 30 4.028 4.028 4.072 -0.044 18703 1986 1 6 . 1 1 30 30 LEU C C 30 178.796 178.796 178.826 -0.030 18703 1987 1 6 . 1 1 30 30 LEU CA C 30 57.654 57.654 56.744 0.910 18703 1988 1 6 . 1 1 30 30 LEU CB C 30 41.629 41.629 41.775 -0.146 18703 1989 1 6 . 1 1 30 30 LEU H H 30 7.695 7.695 7.632 0.063 18703 1990 1 6 . 1 1 31 31 LYS N N 31 120.506 120.506 120.304 0.202 18703 1991 1 6 . 1 1 31 31 LYS HA H 31 3.532 3.532 4.039 -0.507 18703 1992 1 6 . 1 1 31 31 LYS C C 31 178.919 178.919 178.265 0.654 18703 1993 1 6 . 1 1 31 31 LYS CA C 31 60.240 60.240 59.271 0.969 18703 1994 1 6 . 1 1 31 31 LYS CB C 31 32.015 32.015 32.297 -0.282 18703 1995 1 6 . 1 1 31 31 LYS H H 31 8.561 8.561 7.585 0.976 18703 1996 1 6 . 1 1 32 32 LYS N N 32 118.566 118.566 118.955 -0.389 18703 1997 1 6 . 1 1 32 32 LYS C C 32 179.392 179.392 179.505 -0.113 18703 1998 1 6 . 1 1 32 32 LYS CA C 32 59.356 59.356 59.724 -0.368 18703 1999 1 6 . 1 1 32 32 LYS CB C 32 32.117 32.117 32.410 -0.293 18703 2000 1 6 . 1 1 32 32 LYS H H 32 7.699 7.699 7.574 0.125 18703 2001 1 6 . 1 1 33 33 LYS N N 33 118.964 118.964 118.255 0.709 18703 2002 1 6 . 1 1 33 33 LYS HA H 33 4.117 4.117 4.295 -0.178 18703 2003 1 6 . 1 1 33 33 LYS C C 33 178.355 178.355 178.306 0.049 18703 2004 1 6 . 1 1 33 33 LYS CA C 33 58.633 58.633 57.974 0.659 18703 2005 1 6 . 1 1 33 33 LYS CB C 33 31.904 31.904 32.118 -0.214 18703 2006 1 6 . 1 1 33 33 LYS H H 33 7.752 7.752 7.586 0.166 18703 2007 1 6 . 1 1 34 34 CYS N N 34 119.956 119.956 119.434 0.522 18703 2008 1 6 . 1 1 34 34 CYS HA H 34 3.967 3.967 4.125 -0.158 18703 2009 1 6 . 1 1 34 34 CYS C C 34 175.521 175.521 176.594 -1.073 18703 2010 1 6 . 1 1 34 34 CYS CA C 34 60.987 60.987 63.111 -2.124 18703 2011 1 6 . 1 1 34 34 CYS CB C 34 36.600 36.600 26.673 9.927 18703 2012 1 6 . 1 1 34 34 CYS H H 34 8.393 8.393 7.791 0.602 18703 2013 1 6 . 1 1 35 35 GLU N N 35 120.327 120.327 119.518 0.809 18703 2014 1 6 . 1 1 35 35 GLU HA H 35 3.891 3.891 3.942 -0.051 18703 2015 1 6 . 1 1 35 35 GLU C C 35 179.684 179.684 178.494 1.190 18703 2016 1 6 . 1 1 35 35 GLU CA C 35 60.059 60.059 59.385 0.674 18703 2017 1 6 . 1 1 35 35 GLU CB C 35 29.718 29.718 28.816 0.902 18703 2018 1 6 . 1 1 35 35 GLU H H 35 8.558 8.558 7.897 0.661 18703 2019 1 6 . 1 1 36 36 GLU N N 36 120.190 120.190 119.964 0.226 18703 2020 1 6 . 1 1 36 36 GLU HA H 36 4.051 4.051 4.018 0.033 18703 2021 1 6 . 1 1 36 36 GLU C C 36 179.408 179.408 178.857 0.551 18703 2022 1 6 . 1 1 36 36 GLU CA C 36 59.148 59.148 58.875 0.273 18703 2023 1 6 . 1 1 36 36 GLU CB C 36 29.766 29.766 29.803 -0.037 18703 2024 1 6 . 1 1 36 36 GLU H H 36 8.038 8.038 7.622 0.416 18703 2025 1 6 . 1 1 37 37 LEU N N 37 121.102 121.102 119.691 1.411 18703 2026 1 6 . 1 1 37 37 LEU HA H 37 4.079 4.079 4.208 -0.129 18703 2027 1 6 . 1 1 37 37 LEU C C 37 178.279 178.279 178.389 -0.110 18703 2028 1 6 . 1 1 37 37 LEU CA C 37 57.803 57.803 57.569 0.234 18703 2029 1 6 . 1 1 37 37 LEU CB C 37 41.502 41.502 41.689 -0.187 18703 2030 1 6 . 1 1 37 37 LEU H H 37 8.065 8.065 7.512 0.553 18703 2031 1 6 . 1 1 38 38 LYS N N 38 119.980 119.980 118.958 1.022 18703 2032 1 6 . 1 1 38 38 LYS HA H 38 3.851 3.851 3.882 -0.031 18703 2033 1 6 . 1 1 38 38 LYS C C 38 178.919 178.919 179.132 -0.213 18703 2034 1 6 . 1 1 38 38 LYS CA C 38 60.794 60.794 60.345 0.449 18703 2035 1 6 . 1 1 38 38 LYS CB C 38 32.863 32.863 32.154 0.709 18703 2036 1 6 . 1 1 38 38 LYS H H 38 8.741 8.741 7.641 1.100 18703 2037 1 6 . 1 1 39 39 LYS N N 39 118.307 118.307 117.938 0.369 18703 2038 1 6 . 1 1 39 39 LYS HA H 39 4.125 4.125 4.141 -0.016 18703 2039 1 6 . 1 1 39 39 LYS C C 39 178.622 178.622 178.456 0.166 18703 2040 1 6 . 1 1 39 39 LYS CA C 39 58.993 58.993 59.034 -0.041 18703 2041 1 6 . 1 1 39 39 LYS CB C 39 32.097 32.097 31.805 0.292 18703 2042 1 6 . 1 1 39 39 LYS H H 39 7.584 7.584 7.667 -0.083 18703 2043 1 6 . 1 1 40 40 LYS N N 40 118.826 118.826 119.629 -0.803 18703 2044 1 6 . 1 1 40 40 LYS HA H 40 4.069 4.069 4.114 -0.045 18703 2045 1 6 . 1 1 40 40 LYS C C 40 179.802 179.802 179.001 0.801 18703 2046 1 6 . 1 1 40 40 LYS CA C 40 59.322 59.322 58.809 0.513 18703 2047 1 6 . 1 1 40 40 LYS CB C 40 32.505 32.505 32.374 0.131 18703 2048 1 6 . 1 1 40 40 LYS H H 40 7.945 7.945 7.348 0.597 18703 2049 1 6 . 1 1 41 41 ILE N N 41 118.958 118.958 117.137 1.821 18703 2050 1 6 . 1 1 41 41 ILE HA H 41 3.659 3.659 3.820 -0.161 18703 2051 1 6 . 1 1 41 41 ILE C C 41 178.146 178.146 176.644 1.502 18703 2052 1 6 . 1 1 41 41 ILE CA C 41 65.037 65.037 63.833 1.204 18703 2053 1 6 . 1 1 41 41 ILE CB C 41 37.950 37.950 38.050 -0.100 18703 2054 1 6 . 1 1 41 41 ILE H H 41 8.369 8.369 7.988 0.381 18703 2055 1 6 . 1 1 42 42 GLU N N 42 120.331 120.331 116.566 3.765 18703 2056 1 6 . 1 1 42 42 GLU HA H 42 4.094 4.094 4.119 -0.025 18703 2057 1 6 . 1 1 42 42 GLU C C 42 178.697 178.697 177.625 1.072 18703 2058 1 6 . 1 1 42 42 GLU CA C 42 58.927 58.927 58.389 0.538 18703 2059 1 6 . 1 1 42 42 GLU CB C 42 29.399 29.399 29.898 -0.499 18703 2060 1 6 . 1 1 42 42 GLU H H 42 7.805 7.805 7.783 0.022 18703 2061 1 6 . 1 1 43 43 GLU N N 43 117.120 117.120 116.953 0.167 18703 2062 1 6 . 1 1 43 43 GLU HA H 43 4.291 4.291 4.171 0.120 18703 2063 1 6 . 1 1 43 43 GLU C C 43 177.551 177.551 177.572 -0.021 18703 2064 1 6 . 1 1 43 43 GLU CA C 43 56.800 56.800 57.032 -0.232 18703 2065 1 6 . 1 1 43 43 GLU CB C 43 29.931 29.931 29.686 0.245 18703 2066 1 6 . 1 1 43 43 GLU H H 43 7.701 7.701 7.547 0.154 18703 2067 1 6 . 1 1 44 44 LEU N N 44 120.940 120.940 120.453 0.487 18703 2068 1 6 . 1 1 44 44 LEU HA H 44 4.251 4.251 4.128 0.123 18703 2069 1 6 . 1 1 44 44 LEU C C 44 178.596 178.596 177.344 1.252 18703 2070 1 6 . 1 1 44 44 LEU CA C 44 56.448 56.448 55.407 1.041 18703 2071 1 6 . 1 1 44 44 LEU CB C 44 42.519 42.519 42.584 -0.065 18703 2072 1 6 . 1 1 44 44 LEU H H 44 7.581 7.581 7.371 0.210 18703 2073 1 6 . 1 1 45 45 GLY N N 45 108.689 108.689 104.687 4.002 18703 2074 1 6 . 1 1 45 45 GLY C C 45 174.853 174.853 173.332 1.521 18703 2075 1 6 . 1 1 45 45 GLY CA C 45 46.233 46.233 45.365 0.868 18703 2076 1 6 . 1 1 45 45 GLY H H 45 8.232 8.232 8.546 -0.314 18703 2077 1 6 . 1 1 46 46 GLY N N 46 108.029 108.029 107.252 0.777 18703 2078 1 6 . 1 1 46 46 GLY C C 46 174.351 174.351 172.807 1.544 18703 2079 1 6 . 1 1 46 46 GLY CA C 46 45.105 45.105 45.005 0.100 18703 2080 1 6 . 1 1 46 46 GLY H H 46 8.176 8.176 8.027 0.149 18703 2081 1 6 . 1 1 47 47 GLY N N 47 108.183 108.183 105.899 2.284 18703 2082 1 6 . 1 1 47 47 GLY C C 47 174.671 174.671 174.458 0.213 18703 2083 1 6 . 1 1 47 47 GLY CA C 47 45.254 45.254 44.915 0.339 18703 2084 1 6 . 1 1 47 47 GLY H H 47 8.290 8.290 7.551 0.740 18703 2085 1 6 . 1 1 48 48 GLY N N 48 108.616 108.616 111.865 -3.249 18703 2086 1 6 . 1 1 48 48 GLY C C 48 174.321 174.321 174.995 -0.674 18703 2087 1 6 . 1 1 48 48 GLY CA C 48 45.192 45.192 45.771 -0.579 18703 2088 1 6 . 1 1 48 48 GLY H H 48 8.027 8.027 8.490 -0.463 18703 2089 1 6 . 1 1 49 49 GLU N N 49 121.057 121.057 122.024 -0.967 18703 2090 1 6 . 1 1 49 49 GLU HA H 49 4.425 4.425 4.519 -0.094 18703 2091 1 6 . 1 1 49 49 GLU C C 49 177.072 177.072 178.446 -1.374 18703 2092 1 6 . 1 1 49 49 GLU CA C 49 56.330 56.330 56.485 -0.155 18703 2093 1 6 . 1 1 49 49 GLU CB C 49 29.602 29.602 30.227 -0.625 18703 2094 1 6 . 1 1 49 49 GLU H H 49 8.486 8.486 8.232 0.254 18703 2095 1 6 . 1 1 50 50 VAL N N 50 122.122 122.122 119.769 2.353 18703 2096 1 6 . 1 1 50 50 VAL HA H 50 3.792 3.792 3.655 0.137 18703 2097 1 6 . 1 1 50 50 VAL C C 50 176.774 176.774 176.633 0.141 18703 2098 1 6 . 1 1 50 50 VAL CA C 50 64.864 64.864 65.487 -0.623 18703 2099 1 6 . 1 1 50 50 VAL CB C 50 32.179 32.179 31.936 0.242 18703 2100 1 6 . 1 1 50 50 VAL H H 50 8.095 8.095 8.096 -0.001 18703 2101 1 6 . 1 1 51 51 LYS N N 51 120.602 120.602 116.539 4.063 18703 2102 1 6 . 1 1 51 51 LYS HA H 51 4.195 4.195 3.981 0.214 18703 2103 1 6 . 1 1 51 51 LYS C C 51 178.530 178.530 178.393 0.137 18703 2104 1 6 . 1 1 51 51 LYS CA C 51 59.348 59.348 59.002 0.346 18703 2105 1 6 . 1 1 51 51 LYS CB C 51 32.265 32.265 31.763 0.502 18703 2106 1 6 . 1 1 51 51 LYS H H 51 8.268 8.268 7.996 0.272 18703 2107 1 6 . 1 1 52 52 LYS N N 52 117.547 117.547 120.810 -3.263 18703 2108 1 6 . 1 1 52 52 LYS HA H 52 4.162 4.162 4.097 0.065 18703 2109 1 6 . 1 1 52 52 LYS C C 52 179.132 179.132 179.154 -0.022 18703 2110 1 6 . 1 1 52 52 LYS CA C 52 58.811 58.811 58.378 0.433 18703 2111 1 6 . 1 1 52 52 LYS CB C 52 32.054 32.054 32.003 0.051 18703 2112 1 6 . 1 1 52 52 LYS H H 52 7.595 7.595 7.881 -0.286 18703 2113 1 6 . 1 1 53 53 VAL N N 53 119.190 119.190 119.326 -0.136 18703 2114 1 6 . 1 1 53 53 VAL HA H 53 3.767 3.767 3.668 0.099 18703 2115 1 6 . 1 1 53 53 VAL C C 53 177.933 177.933 177.976 -0.043 18703 2116 1 6 . 1 1 53 53 VAL CA C 53 66.065 66.065 66.226 -0.161 18703 2117 1 6 . 1 1 53 53 VAL CB C 53 31.248 31.248 31.500 -0.252 18703 2118 1 6 . 1 1 53 53 VAL H H 53 7.597 7.597 7.543 0.054 18703 2119 1 6 . 1 1 54 54 GLU N N 54 120.226 120.226 118.779 1.447 18703 2120 1 6 . 1 1 54 54 GLU HA H 54 3.833 3.833 3.986 -0.153 18703 2121 1 6 . 1 1 54 54 GLU C C 54 179.352 179.352 178.802 0.550 18703 2122 1 6 . 1 1 54 54 GLU CA C 54 59.153 59.153 59.570 -0.417 18703 2123 1 6 . 1 1 54 54 GLU CB C 54 29.224 29.224 29.326 -0.102 18703 2124 1 6 . 1 1 54 54 GLU H H 54 8.609 8.609 7.660 0.949 18703 2125 1 6 . 1 1 55 55 GLU N N 55 119.148 119.148 119.609 -0.461 18703 2126 1 6 . 1 1 55 55 GLU HA H 55 4.084 4.084 4.134 -0.050 18703 2127 1 6 . 1 1 55 55 GLU C C 55 179.084 179.084 178.687 0.397 18703 2128 1 6 . 1 1 55 55 GLU CA C 55 59.295 59.295 58.736 0.559 18703 2129 1 6 . 1 1 55 55 GLU CB C 55 29.361 29.361 29.463 -0.102 18703 2130 1 6 . 1 1 55 55 GLU H H 55 7.713 7.713 7.920 -0.207 18703 2131 1 6 . 1 1 56 56 GLU N N 56 120.301 120.301 118.858 1.443 18703 2132 1 6 . 1 1 56 56 GLU HA H 56 4.079 4.079 4.112 -0.033 18703 2133 1 6 . 1 1 56 56 GLU C C 56 179.773 179.773 179.057 0.716 18703 2134 1 6 . 1 1 56 56 GLU CA C 56 59.528 59.528 59.110 0.418 18703 2135 1 6 . 1 1 56 56 GLU CB C 56 30.162 30.162 29.754 0.408 18703 2136 1 6 . 1 1 56 56 GLU H H 56 7.899 7.899 7.579 0.320 18703 2137 1 6 . 1 1 57 57 VAL N N 57 121.536 121.536 118.109 3.427 18703 2138 1 6 . 1 1 57 57 VAL HA H 57 3.540 3.540 3.745 -0.205 18703 2139 1 6 . 1 1 57 57 VAL C C 57 176.984 176.984 177.618 -0.634 18703 2140 1 6 . 1 1 57 57 VAL CA C 57 66.734 66.734 65.491 1.243 18703 2141 1 6 . 1 1 57 57 VAL CB C 57 31.425 31.425 31.553 -0.128 18703 2142 1 6 . 1 1 57 57 VAL H H 57 8.652 8.652 7.452 1.200 18703 2143 1 6 . 1 1 58 58 LYS N N 58 120.219 120.219 119.888 0.331 18703 2144 1 6 . 1 1 58 58 LYS HA H 58 4.199 4.199 4.079 0.120 18703 2145 1 6 . 1 1 58 58 LYS C C 58 178.972 178.972 178.506 0.466 18703 2146 1 6 . 1 1 58 58 LYS CA C 58 59.357 59.357 59.554 -0.197 18703 2147 1 6 . 1 1 58 58 LYS CB C 58 32.186 32.186 32.113 0.073 18703 2148 1 6 . 1 1 58 58 LYS H H 58 7.791 7.791 7.460 0.331 18703 2149 1 6 . 1 1 59 59 LYS N N 59 118.252 118.252 120.041 -1.789 18703 2150 1 6 . 1 1 59 59 LYS HA H 59 4.069 4.069 4.103 -0.034 18703 2151 1 6 . 1 1 59 59 LYS C C 59 179.180 179.180 178.206 0.974 18703 2152 1 6 . 1 1 59 59 LYS CA C 59 59.285 59.285 59.134 0.151 18703 2153 1 6 . 1 1 59 59 LYS CB C 59 32.345 32.345 32.404 -0.059 18703 2154 1 6 . 1 1 59 59 LYS H H 59 7.849 7.849 7.505 0.344 18703 2155 1 6 . 1 1 60 60 LEU N N 60 121.243 121.243 119.711 1.532 18703 2156 1 6 . 1 1 60 60 LEU HA H 60 4.242 4.242 4.149 0.093 18703 2157 1 6 . 1 1 60 60 LEU C C 60 178.413 178.413 178.214 0.199 18703 2158 1 6 . 1 1 60 60 LEU CA C 60 57.798 57.798 57.282 0.516 18703 2159 1 6 . 1 1 60 60 LEU CB C 60 41.150 41.150 42.260 -1.110 18703 2160 1 6 . 1 1 60 60 LEU H H 60 7.825 7.825 7.565 0.260 18703 2161 1 6 . 1 1 61 61 GLU N N 61 118.844 118.844 119.606 -0.762 18703 2162 1 6 . 1 1 61 61 GLU HA H 61 3.800 3.800 3.964 -0.164 18703 2163 1 6 . 1 1 61 61 GLU C C 61 179.078 179.078 178.522 0.556 18703 2164 1 6 . 1 1 61 61 GLU CA C 61 60.104 60.104 59.811 0.293 18703 2165 1 6 . 1 1 61 61 GLU CB C 61 29.864 29.864 29.679 0.185 18703 2166 1 6 . 1 1 61 61 GLU H H 61 8.582 8.582 7.747 0.835 18703 2167 1 6 . 1 1 62 62 GLU N N 62 117.659 117.659 118.569 -0.910 18703 2168 1 6 . 1 1 62 62 GLU HA H 62 3.990 3.990 4.113 -0.123 18703 2169 1 6 . 1 1 62 62 GLU C C 62 178.847 178.847 178.799 0.048 18703 2170 1 6 . 1 1 62 62 GLU CA C 62 59.067 59.067 58.720 0.347 18703 2171 1 6 . 1 1 62 62 GLU CB C 62 29.440 29.440 29.762 -0.322 18703 2172 1 6 . 1 1 62 62 GLU H H 62 8.032 8.032 7.620 0.412 18703 2173 1 6 . 1 1 63 63 GLU N N 63 119.290 119.290 119.683 -0.393 18703 2174 1 6 . 1 1 63 63 GLU HA H 63 4.012 4.012 4.098 -0.086 18703 2175 1 6 . 1 1 63 63 GLU C C 63 179.784 179.784 179.294 0.490 18703 2176 1 6 . 1 1 63 63 GLU CA C 63 59.300 59.300 59.285 0.015 18703 2177 1 6 . 1 1 63 63 GLU CB C 63 29.728 29.728 29.655 0.073 18703 2178 1 6 . 1 1 63 63 GLU H H 63 7.958 7.958 7.428 0.530 18703 2179 1 6 . 1 1 64 64 ILE N N 64 118.453 118.453 118.769 -0.316 18703 2180 1 6 . 1 1 64 64 ILE HA H 64 3.711 3.711 3.757 -0.046 18703 2181 1 6 . 1 1 64 64 ILE C C 64 177.655 177.655 178.729 -1.074 18703 2182 1 6 . 1 1 64 64 ILE CA C 64 64.256 64.256 64.096 0.160 18703 2183 1 6 . 1 1 64 64 ILE CB C 64 38.002 38.002 37.546 0.456 18703 2184 1 6 . 1 1 64 64 ILE H H 64 8.160 8.160 7.625 0.535 18703 2185 1 6 . 1 1 65 65 LYS N N 65 118.871 118.871 119.332 -0.461 18703 2186 1 6 . 1 1 65 65 LYS HA H 65 4.111 4.111 4.060 0.051 18703 2187 1 6 . 1 1 65 65 LYS C C 65 177.076 177.076 177.635 -0.559 18703 2188 1 6 . 1 1 65 65 LYS CA C 65 58.421 58.421 58.888 -0.467 18703 2189 1 6 . 1 1 65 65 LYS CB C 65 32.639 32.639 32.218 0.422 18703 2190 1 6 . 1 1 65 65 LYS H H 65 7.664 7.664 7.831 -0.167 18703 2191 1 6 . 1 1 66 66 LYS N N 66 116.944 116.944 116.456 0.488 18703 2192 1 6 . 1 1 66 66 LYS HA H 66 4.320 4.320 4.359 -0.039 18703 2193 1 6 . 1 1 66 66 LYS C C 66 175.897 175.897 177.367 -1.470 18703 2194 1 6 . 1 1 66 66 LYS CA C 66 56.352 56.352 56.502 -0.150 18703 2195 1 6 . 1 1 66 66 LYS CB C 66 33.024 33.024 33.727 -0.703 18703 2196 1 6 . 1 1 66 66 LYS H H 66 7.246 7.246 7.820 -0.574 18703 2197 1 7 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.386 -0.140 18703 2198 1 7 . 1 1 3 3 ARG C C 3 178.379 178.379 176.565 1.814 18703 2199 1 7 . 1 1 3 3 ARG CA C 3 58.367 58.367 56.728 1.639 18703 2200 1 7 . 1 1 3 3 ARG CB C 3 30.691 30.691 31.037 -0.346 18703 2201 1 7 . 1 1 3 3 ARG H H 3 7.905 7.905 8.784 -0.879 18703 2202 1 7 . 1 1 4 4 VAL N N 4 118.966 118.966 119.849 -0.883 18703 2203 1 7 . 1 1 4 4 VAL HA H 4 3.803 3.803 3.914 -0.111 18703 2204 1 7 . 1 1 4 4 VAL C C 4 176.968 176.968 177.337 -0.369 18703 2205 1 7 . 1 1 4 4 VAL CA C 4 65.441 65.441 65.031 0.410 18703 2206 1 7 . 1 1 4 4 VAL CB C 4 31.710 31.710 31.692 0.018 18703 2207 1 7 . 1 1 4 4 VAL H H 4 8.070 8.070 8.443 -0.373 18703 2208 1 7 . 1 1 5 5 LYS N N 5 122.058 122.058 120.490 1.568 18703 2209 1 7 . 1 1 5 5 LYS HA H 5 4.154 4.154 4.020 0.134 18703 2210 1 7 . 1 1 5 5 LYS C C 5 178.553 178.553 178.376 0.177 18703 2211 1 7 . 1 1 5 5 LYS CA C 5 58.712 58.712 59.738 -1.026 18703 2212 1 7 . 1 1 5 5 LYS CB C 5 31.788 31.788 31.741 0.047 18703 2213 1 7 . 1 1 5 5 LYS H H 5 7.798 7.798 8.286 -0.488 18703 2214 1 7 . 1 1 6 6 ALA N N 6 119.955 119.955 120.100 -0.145 18703 2215 1 7 . 1 1 6 6 ALA HA H 6 4.198 4.198 4.254 -0.056 18703 2216 1 7 . 1 1 6 6 ALA C C 6 180.974 180.974 179.215 1.759 18703 2217 1 7 . 1 1 6 6 ALA CA C 6 54.850 54.850 54.318 0.532 18703 2218 1 7 . 1 1 6 6 ALA CB C 6 17.995 17.995 18.077 -0.082 18703 2219 1 7 . 1 1 6 6 ALA H H 6 7.928 7.928 8.222 -0.294 18703 2220 1 7 . 1 1 7 7 LEU N N 7 119.211 119.211 119.670 -0.459 18703 2221 1 7 . 1 1 7 7 LEU HA H 7 4.124 4.124 3.969 0.155 18703 2222 1 7 . 1 1 7 7 LEU C C 7 178.353 178.353 178.416 -0.063 18703 2223 1 7 . 1 1 7 7 LEU CA C 7 57.658 57.658 57.251 0.407 18703 2224 1 7 . 1 1 7 7 LEU CB C 7 41.971 41.971 42.085 -0.114 18703 2225 1 7 . 1 1 7 7 LEU H H 7 7.594 7.594 7.891 -0.297 18703 2226 1 7 . 1 1 8 8 GLU N N 8 120.258 120.258 117.952 2.306 18703 2227 1 7 . 1 1 8 8 GLU HA H 8 3.846 3.846 4.000 -0.154 18703 2228 1 7 . 1 1 8 8 GLU C C 8 179.546 179.546 178.887 0.659 18703 2229 1 7 . 1 1 8 8 GLU CA C 8 60.006 60.006 59.555 0.451 18703 2230 1 7 . 1 1 8 8 GLU CB C 8 29.683 29.683 29.451 0.232 18703 2231 1 7 . 1 1 8 8 GLU H H 8 8.382 8.382 7.814 0.568 18703 2232 1 7 . 1 1 9 9 GLU N N 9 118.584 118.584 118.902 -0.318 18703 2233 1 7 . 1 1 9 9 GLU HA H 9 4.039 4.039 4.128 -0.089 18703 2234 1 7 . 1 1 9 9 GLU C C 9 179.635 179.635 178.611 1.024 18703 2235 1 7 . 1 1 9 9 GLU CA C 9 59.235 59.235 58.522 0.713 18703 2236 1 7 . 1 1 9 9 GLU CB C 9 29.358 29.358 29.224 0.133 18703 2237 1 7 . 1 1 9 9 GLU H H 9 7.908 7.908 7.710 0.198 18703 2238 1 7 . 1 1 10 10 LYS N N 10 120.956 120.956 120.328 0.628 18703 2239 1 7 . 1 1 10 10 LYS HA H 10 4.190 4.190 4.087 0.103 18703 2240 1 7 . 1 1 10 10 LYS C C 10 179.395 179.395 179.085 0.310 18703 2241 1 7 . 1 1 10 10 LYS CA C 10 59.231 59.231 59.351 -0.120 18703 2242 1 7 . 1 1 10 10 LYS CB C 10 32.211 32.211 32.518 -0.307 18703 2243 1 7 . 1 1 10 10 LYS H H 10 8.009 8.009 7.384 0.625 18703 2244 1 7 . 1 1 11 11 VAL N N 11 119.577 119.577 118.017 1.560 18703 2245 1 7 . 1 1 11 11 VAL HA H 11 3.844 3.844 3.688 0.156 18703 2246 1 7 . 1 1 11 11 VAL C C 11 177.078 177.078 177.549 -0.471 18703 2247 1 7 . 1 1 11 11 VAL CA C 11 66.407 66.407 65.349 1.058 18703 2248 1 7 . 1 1 11 11 VAL CB C 11 31.252 31.252 31.061 0.191 18703 2249 1 7 . 1 1 11 11 VAL H H 11 8.488 8.488 7.497 0.991 18703 2250 1 7 . 1 1 12 12 LYS N N 12 122.864 122.864 119.557 3.307 18703 2251 1 7 . 1 1 12 12 LYS HA H 12 4.189 4.189 3.999 0.190 18703 2252 1 7 . 1 1 12 12 LYS C C 12 178.755 178.755 178.104 0.651 18703 2253 1 7 . 1 1 12 12 LYS CA C 12 59.375 59.375 59.368 0.007 18703 2254 1 7 . 1 1 12 12 LYS CB C 12 31.991 31.991 32.120 -0.129 18703 2255 1 7 . 1 1 12 12 LYS H H 12 7.944 7.944 7.563 0.381 18703 2256 1 7 . 1 1 13 13 ALA N N 13 121.202 121.202 120.420 0.782 18703 2257 1 7 . 1 1 13 13 ALA HA H 13 4.209 4.209 4.386 -0.177 18703 2258 1 7 . 1 1 13 13 ALA C C 13 181.060 181.060 179.533 1.527 18703 2259 1 7 . 1 1 13 13 ALA CA C 13 54.710 54.710 54.087 0.623 18703 2260 1 7 . 1 1 13 13 ALA CB C 13 17.861 17.861 18.429 -0.568 18703 2261 1 7 . 1 1 13 13 ALA H H 13 7.563 7.563 7.428 0.135 18703 2262 1 7 . 1 1 14 14 LEU N N 14 120.014 120.014 119.548 0.466 18703 2263 1 7 . 1 1 14 14 LEU HA H 14 4.072 4.072 4.025 0.047 18703 2264 1 7 . 1 1 14 14 LEU C C 14 177.862 177.862 178.250 -0.388 18703 2265 1 7 . 1 1 14 14 LEU CA C 14 57.864 57.864 57.355 0.509 18703 2266 1 7 . 1 1 14 14 LEU CB C 14 41.539 41.539 42.062 -0.523 18703 2267 1 7 . 1 1 14 14 LEU H H 14 8.087 8.087 7.451 0.636 18703 2268 1 7 . 1 1 15 15 GLU N N 15 121.644 121.644 120.444 1.200 18703 2269 1 7 . 1 1 15 15 GLU HA H 15 3.692 3.692 4.033 -0.341 18703 2270 1 7 . 1 1 15 15 GLU C C 15 177.819 177.819 178.289 -0.470 18703 2271 1 7 . 1 1 15 15 GLU CA C 15 59.239 59.239 59.362 -0.123 18703 2272 1 7 . 1 1 15 15 GLU CB C 15 28.865 28.865 29.601 -0.736 18703 2273 1 7 . 1 1 15 15 GLU H H 15 8.542 8.542 7.656 0.886 18703 2274 1 7 . 1 1 16 16 GLU N N 16 116.016 116.016 118.565 -2.549 18703 2275 1 7 . 1 1 16 16 GLU HA H 16 3.955 3.955 3.956 -0.001 18703 2276 1 7 . 1 1 16 16 GLU C C 16 179.159 179.159 179.076 0.083 18703 2277 1 7 . 1 1 16 16 GLU CA C 16 59.324 59.324 58.988 0.336 18703 2278 1 7 . 1 1 16 16 GLU CB C 16 29.060 29.060 28.910 0.150 18703 2279 1 7 . 1 1 16 16 GLU H H 16 7.492 7.492 7.979 -0.487 18703 2280 1 7 . 1 1 17 17 LYS N N 17 118.546 118.546 118.997 -0.451 18703 2281 1 7 . 1 1 17 17 LYS HA H 17 4.117 4.117 4.138 -0.021 18703 2282 1 7 . 1 1 17 17 LYS C C 17 178.976 178.976 177.852 1.124 18703 2283 1 7 . 1 1 17 17 LYS CA C 17 58.837 58.837 58.939 -0.102 18703 2284 1 7 . 1 1 17 17 LYS CB C 17 32.538 32.538 32.609 -0.071 18703 2285 1 7 . 1 1 17 17 LYS H H 17 7.720 7.720 7.417 0.303 18703 2286 1 7 . 1 1 18 18 VAL N N 18 118.376 118.376 119.051 -0.675 18703 2287 1 7 . 1 1 18 18 VAL HA H 18 3.711 3.711 3.867 -0.156 18703 2288 1 7 . 1 1 18 18 VAL C C 18 178.765 178.765 178.513 0.252 18703 2289 1 7 . 1 1 18 18 VAL CA C 18 66.237 66.237 65.073 1.164 18703 2290 1 7 . 1 1 18 18 VAL CB C 18 31.682 31.682 31.526 0.156 18703 2291 1 7 . 1 1 18 18 VAL H H 18 8.754 8.754 7.725 1.029 18703 2292 1 7 . 1 1 19 19 LYS N N 19 118.817 118.817 119.017 -0.200 18703 2293 1 7 . 1 1 19 19 LYS HA H 19 4.078 4.078 3.944 0.134 18703 2294 1 7 . 1 1 19 19 LYS C C 19 178.049 178.049 177.919 0.130 18703 2295 1 7 . 1 1 19 19 LYS CA C 19 59.731 59.731 59.302 0.429 18703 2296 1 7 . 1 1 19 19 LYS CB C 19 32.523 32.523 31.915 0.609 18703 2297 1 7 . 1 1 19 19 LYS H H 19 8.299 8.299 8.637 -0.338 18703 2298 1 7 . 1 1 20 20 ALA N N 20 119.656 119.656 118.953 0.703 18703 2299 1 7 . 1 1 20 20 ALA HA H 20 4.347 4.347 4.346 0.001 18703 2300 1 7 . 1 1 20 20 ALA C C 20 178.532 178.532 178.662 -0.130 18703 2301 1 7 . 1 1 20 20 ALA CA C 20 52.853 52.853 52.917 -0.064 18703 2302 1 7 . 1 1 20 20 ALA CB C 20 18.832 18.832 18.864 -0.032 18703 2303 1 7 . 1 1 20 20 ALA H H 20 7.425 7.425 7.587 -0.162 18703 2304 1 7 . 1 1 21 21 LEU N N 21 118.594 118.594 119.046 -0.452 18703 2305 1 7 . 1 1 21 21 LEU HA H 21 4.297 4.297 4.064 0.233 18703 2306 1 7 . 1 1 21 21 LEU C C 21 177.784 177.784 178.153 -0.369 18703 2307 1 7 . 1 1 21 21 LEU CA C 21 55.750 55.750 56.716 -0.966 18703 2308 1 7 . 1 1 21 21 LEU CB C 21 42.898 42.898 42.596 0.302 18703 2309 1 7 . 1 1 21 21 LEU H H 21 7.508 7.508 7.930 -0.422 18703 2310 1 7 . 1 1 22 22 GLY N N 22 106.650 106.650 104.924 1.726 18703 2311 1 7 . 1 1 22 22 GLY C C 22 173.605 173.605 173.367 0.238 18703 2312 1 7 . 1 1 22 22 GLY CA C 22 45.330 45.330 44.641 0.689 18703 2313 1 7 . 1 1 22 22 GLY H H 22 7.814 7.814 7.903 -0.089 18703 2314 1 7 . 1 1 23 23 GLY N N 23 108.011 108.011 108.385 -0.374 18703 2315 1 7 . 1 1 23 23 GLY C C 23 174.061 174.061 172.653 1.408 18703 2316 1 7 . 1 1 23 23 GLY CA C 23 44.772 44.772 45.484 -0.712 18703 2317 1 7 . 1 1 23 23 GLY H H 23 8.139 8.139 7.659 0.480 18703 2318 1 7 . 1 1 24 24 GLY N N 24 107.826 107.826 107.671 0.155 18703 2319 1 7 . 1 1 24 24 GLY C C 24 175.046 175.046 175.334 -0.288 18703 2320 1 7 . 1 1 24 24 GLY CA C 24 44.422 44.422 44.991 -0.569 18703 2321 1 7 . 1 1 24 24 GLY H H 24 8.497 8.497 8.593 -0.096 18703 2322 1 7 . 1 1 25 25 GLY N N 25 108.830 108.830 110.473 -1.643 18703 2323 1 7 . 1 1 25 25 GLY C C 25 176.272 176.272 175.529 0.743 18703 2324 1 7 . 1 1 25 25 GLY CA C 25 47.101 47.101 45.649 1.452 18703 2325 1 7 . 1 1 25 25 GLY H H 25 8.616 8.616 8.084 0.532 18703 2326 1 7 . 1 1 26 26 ARG N N 26 123.109 123.109 122.873 0.236 18703 2327 1 7 . 1 1 26 26 ARG HA H 26 4.283 4.283 4.212 0.071 18703 2328 1 7 . 1 1 26 26 ARG C C 26 177.848 177.848 178.507 -0.659 18703 2329 1 7 . 1 1 26 26 ARG CA C 26 57.663 57.663 57.997 -0.334 18703 2330 1 7 . 1 1 26 26 ARG CB C 26 29.811 29.811 29.887 -0.076 18703 2331 1 7 . 1 1 26 26 ARG H H 26 8.770 8.770 7.909 0.861 18703 2332 1 7 . 1 1 27 27 ILE N N 27 118.104 118.104 117.800 0.304 18703 2333 1 7 . 1 1 27 27 ILE HA H 27 3.787 3.787 3.732 0.055 18703 2334 1 7 . 1 1 27 27 ILE C C 27 177.473 177.473 177.466 0.007 18703 2335 1 7 . 1 1 27 27 ILE CA C 27 63.036 63.036 64.209 -1.173 18703 2336 1 7 . 1 1 27 27 ILE CB C 27 36.664 36.664 37.594 -0.930 18703 2337 1 7 . 1 1 27 27 ILE H H 27 7.708 7.708 8.018 -0.310 18703 2338 1 7 . 1 1 28 28 GLU N N 28 119.934 119.934 119.942 -0.008 18703 2339 1 7 . 1 1 28 28 GLU HA H 28 3.954 3.954 3.785 0.169 18703 2340 1 7 . 1 1 28 28 GLU C C 28 179.514 179.514 178.542 0.972 18703 2341 1 7 . 1 1 28 28 GLU CA C 28 59.450 59.450 60.308 -0.858 18703 2342 1 7 . 1 1 28 28 GLU CB C 28 29.600 29.600 29.514 0.086 18703 2343 1 7 . 1 1 28 28 GLU H H 28 7.872 7.872 7.683 0.189 18703 2344 1 7 . 1 1 29 29 GLU N N 29 118.134 118.134 118.545 -0.411 18703 2345 1 7 . 1 1 29 29 GLU HA H 29 4.028 4.028 4.092 -0.064 18703 2346 1 7 . 1 1 29 29 GLU C C 29 179.182 179.182 178.941 0.241 18703 2347 1 7 . 1 1 29 29 GLU CA C 29 59.173 59.173 59.010 0.163 18703 2348 1 7 . 1 1 29 29 GLU CB C 29 29.503 29.503 28.958 0.545 18703 2349 1 7 . 1 1 29 29 GLU H H 29 8.166 8.166 8.406 -0.240 18703 2350 1 7 . 1 1 30 30 LEU N N 30 120.242 120.242 117.071 3.171 18703 2351 1 7 . 1 1 30 30 LEU HA H 30 4.028 4.028 4.110 -0.082 18703 2352 1 7 . 1 1 30 30 LEU C C 30 178.796 178.796 178.858 -0.062 18703 2353 1 7 . 1 1 30 30 LEU CA C 30 57.654 57.654 57.184 0.471 18703 2354 1 7 . 1 1 30 30 LEU CB C 30 41.629 41.629 41.823 -0.194 18703 2355 1 7 . 1 1 30 30 LEU H H 30 7.695 7.695 7.333 0.362 18703 2356 1 7 . 1 1 31 31 LYS N N 31 120.506 120.506 120.057 0.449 18703 2357 1 7 . 1 1 31 31 LYS HA H 31 3.532 3.532 4.053 -0.521 18703 2358 1 7 . 1 1 31 31 LYS C C 31 178.919 178.919 178.244 0.675 18703 2359 1 7 . 1 1 31 31 LYS CA C 31 60.240 60.240 59.343 0.897 18703 2360 1 7 . 1 1 31 31 LYS CB C 31 32.015 32.015 32.295 -0.280 18703 2361 1 7 . 1 1 31 31 LYS H H 31 8.561 8.561 7.819 0.742 18703 2362 1 7 . 1 1 32 32 LYS N N 32 118.566 118.566 118.923 -0.357 18703 2363 1 7 . 1 1 32 32 LYS C C 32 179.392 179.392 178.926 0.466 18703 2364 1 7 . 1 1 32 32 LYS CA C 32 59.356 59.356 59.366 -0.010 18703 2365 1 7 . 1 1 32 32 LYS CB C 32 32.117 32.117 32.263 -0.146 18703 2366 1 7 . 1 1 32 32 LYS H H 32 7.699 7.699 7.541 0.158 18703 2367 1 7 . 1 1 33 33 LYS N N 33 118.964 118.964 118.263 0.701 18703 2368 1 7 . 1 1 33 33 LYS HA H 33 4.117 4.117 4.185 -0.068 18703 2369 1 7 . 1 1 33 33 LYS C C 33 178.355 178.355 178.849 -0.494 18703 2370 1 7 . 1 1 33 33 LYS CA C 33 58.633 58.633 58.721 -0.088 18703 2371 1 7 . 1 1 33 33 LYS CB C 33 31.904 31.904 32.138 -0.234 18703 2372 1 7 . 1 1 33 33 LYS H H 33 7.752 7.752 7.625 0.127 18703 2373 1 7 . 1 1 34 34 CYS N N 34 119.956 119.956 118.373 1.583 18703 2374 1 7 . 1 1 34 34 CYS HA H 34 3.967 3.967 4.200 -0.233 18703 2375 1 7 . 1 1 34 34 CYS C C 34 175.521 175.521 177.054 -1.533 18703 2376 1 7 . 1 1 34 34 CYS CA C 34 60.987 60.987 62.654 -1.667 18703 2377 1 7 . 1 1 34 34 CYS CB C 34 36.600 36.600 26.636 9.964 18703 2378 1 7 . 1 1 34 34 CYS H H 34 8.393 8.393 7.506 0.887 18703 2379 1 7 . 1 1 35 35 GLU N N 35 120.327 120.327 119.670 0.657 18703 2380 1 7 . 1 1 35 35 GLU HA H 35 3.891 3.891 3.935 -0.044 18703 2381 1 7 . 1 1 35 35 GLU C C 35 179.684 179.684 178.594 1.090 18703 2382 1 7 . 1 1 35 35 GLU CA C 35 60.059 60.059 59.409 0.650 18703 2383 1 7 . 1 1 35 35 GLU CB C 35 29.718 29.718 28.821 0.897 18703 2384 1 7 . 1 1 35 35 GLU H H 35 8.558 8.558 7.827 0.731 18703 2385 1 7 . 1 1 36 36 GLU N N 36 120.190 120.190 120.000 0.190 18703 2386 1 7 . 1 1 36 36 GLU HA H 36 4.051 4.051 4.029 0.022 18703 2387 1 7 . 1 1 36 36 GLU C C 36 179.408 179.408 178.858 0.550 18703 2388 1 7 . 1 1 36 36 GLU CA C 36 59.148 59.148 58.965 0.183 18703 2389 1 7 . 1 1 36 36 GLU CB C 36 29.766 29.766 29.814 -0.048 18703 2390 1 7 . 1 1 36 36 GLU H H 36 8.038 8.038 7.628 0.410 18703 2391 1 7 . 1 1 37 37 LEU N N 37 121.102 121.102 119.846 1.256 18703 2392 1 7 . 1 1 37 37 LEU HA H 37 4.079 4.079 4.208 -0.129 18703 2393 1 7 . 1 1 37 37 LEU C C 37 178.279 178.279 178.280 -0.001 18703 2394 1 7 . 1 1 37 37 LEU CA C 37 57.803 57.803 57.264 0.540 18703 2395 1 7 . 1 1 37 37 LEU CB C 37 41.502 41.502 41.712 -0.210 18703 2396 1 7 . 1 1 37 37 LEU H H 37 8.065 8.065 7.505 0.560 18703 2397 1 7 . 1 1 38 38 LYS N N 38 119.980 119.980 118.947 1.033 18703 2398 1 7 . 1 1 38 38 LYS HA H 38 3.851 3.851 3.892 -0.041 18703 2399 1 7 . 1 1 38 38 LYS C C 38 178.919 178.919 179.173 -0.254 18703 2400 1 7 . 1 1 38 38 LYS CA C 38 60.794 60.794 59.724 1.070 18703 2401 1 7 . 1 1 38 38 LYS CB C 38 32.863 32.863 32.189 0.674 18703 2402 1 7 . 1 1 38 38 LYS H H 38 8.741 8.741 7.712 1.029 18703 2403 1 7 . 1 1 39 39 LYS N N 39 118.307 118.307 116.844 1.463 18703 2404 1 7 . 1 1 39 39 LYS HA H 39 4.125 4.125 4.066 0.059 18703 2405 1 7 . 1 1 39 39 LYS C C 39 178.622 178.622 178.376 0.246 18703 2406 1 7 . 1 1 39 39 LYS CA C 39 58.993 58.993 59.131 -0.138 18703 2407 1 7 . 1 1 39 39 LYS CB C 39 32.097 32.097 31.757 0.340 18703 2408 1 7 . 1 1 39 39 LYS H H 39 7.584 7.584 7.657 -0.073 18703 2409 1 7 . 1 1 40 40 LYS N N 40 118.826 118.826 119.507 -0.681 18703 2410 1 7 . 1 1 40 40 LYS HA H 40 4.069 4.069 4.160 -0.091 18703 2411 1 7 . 1 1 40 40 LYS C C 40 179.802 179.802 178.834 0.968 18703 2412 1 7 . 1 1 40 40 LYS CA C 40 59.322 59.322 58.583 0.739 18703 2413 1 7 . 1 1 40 40 LYS CB C 40 32.505 32.505 32.126 0.379 18703 2414 1 7 . 1 1 40 40 LYS H H 40 7.945 7.945 7.380 0.565 18703 2415 1 7 . 1 1 41 41 ILE N N 41 118.958 118.958 118.898 0.060 18703 2416 1 7 . 1 1 41 41 ILE HA H 41 3.659 3.659 3.820 -0.161 18703 2417 1 7 . 1 1 41 41 ILE C C 41 178.146 178.146 177.765 0.381 18703 2418 1 7 . 1 1 41 41 ILE CA C 41 65.037 65.037 64.157 0.880 18703 2419 1 7 . 1 1 41 41 ILE CB C 41 37.950 37.950 37.812 0.138 18703 2420 1 7 . 1 1 41 41 ILE H H 41 8.369 8.369 7.643 0.726 18703 2421 1 7 . 1 1 42 42 GLU N N 42 120.331 120.331 118.804 1.527 18703 2422 1 7 . 1 1 42 42 GLU HA H 42 4.094 4.094 4.046 0.048 18703 2423 1 7 . 1 1 42 42 GLU C C 42 178.697 178.697 177.773 0.924 18703 2424 1 7 . 1 1 42 42 GLU CA C 42 58.927 58.927 59.271 -0.344 18703 2425 1 7 . 1 1 42 42 GLU CB C 42 29.399 29.399 29.894 -0.495 18703 2426 1 7 . 1 1 42 42 GLU H H 42 7.805 7.805 7.792 0.013 18703 2427 1 7 . 1 1 43 43 GLU N N 43 117.120 117.120 116.379 0.741 18703 2428 1 7 . 1 1 43 43 GLU HA H 43 4.291 4.291 4.184 0.107 18703 2429 1 7 . 1 1 43 43 GLU C C 43 177.551 177.551 177.585 -0.034 18703 2430 1 7 . 1 1 43 43 GLU CA C 43 56.800 56.800 57.014 -0.214 18703 2431 1 7 . 1 1 43 43 GLU CB C 43 29.931 29.931 29.784 0.147 18703 2432 1 7 . 1 1 43 43 GLU H H 43 7.701 7.701 7.553 0.148 18703 2433 1 7 . 1 1 44 44 LEU N N 44 120.940 120.940 120.985 -0.045 18703 2434 1 7 . 1 1 44 44 LEU HA H 44 4.251 4.251 4.110 0.141 18703 2435 1 7 . 1 1 44 44 LEU C C 44 178.596 178.596 176.931 1.665 18703 2436 1 7 . 1 1 44 44 LEU CA C 44 56.448 56.448 55.147 1.301 18703 2437 1 7 . 1 1 44 44 LEU CB C 44 42.519 42.519 42.550 -0.031 18703 2438 1 7 . 1 1 44 44 LEU H H 44 7.581 7.581 7.377 0.204 18703 2439 1 7 . 1 1 45 45 GLY N N 45 108.689 108.689 106.462 2.227 18703 2440 1 7 . 1 1 45 45 GLY C C 45 174.853 174.853 174.160 0.693 18703 2441 1 7 . 1 1 45 45 GLY CA C 45 46.233 46.233 45.155 1.078 18703 2442 1 7 . 1 1 45 45 GLY H H 45 8.232 8.232 8.579 -0.347 18703 2443 1 7 . 1 1 46 46 GLY N N 46 108.029 108.029 106.935 1.094 18703 2444 1 7 . 1 1 46 46 GLY C C 46 174.351 174.351 173.234 1.117 18703 2445 1 7 . 1 1 46 46 GLY CA C 46 45.105 45.105 45.320 -0.215 18703 2446 1 7 . 1 1 46 46 GLY H H 46 8.176 8.176 8.090 0.086 18703 2447 1 7 . 1 1 47 47 GLY N N 47 108.183 108.183 106.825 1.358 18703 2448 1 7 . 1 1 47 47 GLY C C 47 174.671 174.671 174.443 0.228 18703 2449 1 7 . 1 1 47 47 GLY CA C 47 45.254 45.254 44.879 0.375 18703 2450 1 7 . 1 1 47 47 GLY H H 47 8.290 8.290 7.810 0.480 18703 2451 1 7 . 1 1 48 48 GLY N N 48 108.616 108.616 111.321 -2.705 18703 2452 1 7 . 1 1 48 48 GLY C C 48 174.321 174.321 175.253 -0.932 18703 2453 1 7 . 1 1 48 48 GLY CA C 48 45.192 45.192 45.714 -0.522 18703 2454 1 7 . 1 1 48 48 GLY H H 48 8.027 8.027 8.319 -0.292 18703 2455 1 7 . 1 1 49 49 GLU N N 49 121.057 121.057 123.085 -2.028 18703 2456 1 7 . 1 1 49 49 GLU HA H 49 4.425 4.425 4.392 0.033 18703 2457 1 7 . 1 1 49 49 GLU C C 49 177.072 177.072 179.069 -1.997 18703 2458 1 7 . 1 1 49 49 GLU CA C 49 56.330 56.330 57.073 -0.743 18703 2459 1 7 . 1 1 49 49 GLU CB C 49 29.602 29.602 29.961 -0.359 18703 2460 1 7 . 1 1 49 49 GLU H H 49 8.486 8.486 8.385 0.101 18703 2461 1 7 . 1 1 50 50 VAL N N 50 122.122 122.122 119.389 2.733 18703 2462 1 7 . 1 1 50 50 VAL HA H 50 3.792 3.792 3.551 0.241 18703 2463 1 7 . 1 1 50 50 VAL C C 50 176.774 176.774 177.266 -0.492 18703 2464 1 7 . 1 1 50 50 VAL CA C 50 64.864 64.864 65.445 -0.581 18703 2465 1 7 . 1 1 50 50 VAL CB C 50 32.179 32.179 31.591 0.588 18703 2466 1 7 . 1 1 50 50 VAL H H 50 8.095 8.095 8.015 0.080 18703 2467 1 7 . 1 1 51 51 LYS N N 51 120.602 120.602 118.657 1.945 18703 2468 1 7 . 1 1 51 51 LYS HA H 51 4.195 4.195 4.038 0.157 18703 2469 1 7 . 1 1 51 51 LYS C C 51 178.530 178.530 178.261 0.269 18703 2470 1 7 . 1 1 51 51 LYS CA C 51 59.348 59.348 58.931 0.417 18703 2471 1 7 . 1 1 51 51 LYS CB C 51 32.265 32.265 32.237 0.028 18703 2472 1 7 . 1 1 51 51 LYS H H 51 8.268 8.268 7.835 0.433 18703 2473 1 7 . 1 1 52 52 LYS N N 52 117.547 117.547 119.973 -2.426 18703 2474 1 7 . 1 1 52 52 LYS HA H 52 4.162 4.162 4.146 0.016 18703 2475 1 7 . 1 1 52 52 LYS C C 52 179.132 179.132 179.153 -0.021 18703 2476 1 7 . 1 1 52 52 LYS CA C 52 58.811 58.811 58.590 0.221 18703 2477 1 7 . 1 1 52 52 LYS CB C 52 32.054 32.054 32.049 0.005 18703 2478 1 7 . 1 1 52 52 LYS H H 52 7.595 7.595 7.796 -0.201 18703 2479 1 7 . 1 1 53 53 VAL N N 53 119.190 119.190 119.704 -0.514 18703 2480 1 7 . 1 1 53 53 VAL HA H 53 3.767 3.767 3.645 0.122 18703 2481 1 7 . 1 1 53 53 VAL C C 53 177.933 177.933 177.669 0.264 18703 2482 1 7 . 1 1 53 53 VAL CA C 53 66.065 66.065 66.652 -0.587 18703 2483 1 7 . 1 1 53 53 VAL CB C 53 31.248 31.248 31.259 -0.011 18703 2484 1 7 . 1 1 53 53 VAL H H 53 7.597 7.597 7.627 -0.030 18703 2485 1 7 . 1 1 54 54 GLU N N 54 120.226 120.226 119.112 1.114 18703 2486 1 7 . 1 1 54 54 GLU HA H 54 3.833 3.833 3.963 -0.130 18703 2487 1 7 . 1 1 54 54 GLU C C 54 179.352 179.352 178.526 0.826 18703 2488 1 7 . 1 1 54 54 GLU CA C 54 59.153 59.153 59.226 -0.073 18703 2489 1 7 . 1 1 54 54 GLU CB C 54 29.224 29.224 29.595 -0.371 18703 2490 1 7 . 1 1 54 54 GLU H H 54 8.609 8.609 7.687 0.922 18703 2491 1 7 . 1 1 55 55 GLU N N 55 119.148 119.148 118.992 0.156 18703 2492 1 7 . 1 1 55 55 GLU HA H 55 4.084 4.084 4.169 -0.085 18703 2493 1 7 . 1 1 55 55 GLU C C 55 179.084 179.084 178.749 0.335 18703 2494 1 7 . 1 1 55 55 GLU CA C 55 59.295 59.295 58.474 0.821 18703 2495 1 7 . 1 1 55 55 GLU CB C 55 29.361 29.361 29.582 -0.221 18703 2496 1 7 . 1 1 55 55 GLU H H 55 7.713 7.713 8.072 -0.359 18703 2497 1 7 . 1 1 56 56 GLU N N 56 120.301 120.301 119.005 1.296 18703 2498 1 7 . 1 1 56 56 GLU HA H 56 4.079 4.079 4.111 -0.032 18703 2499 1 7 . 1 1 56 56 GLU C C 56 179.773 179.773 179.210 0.563 18703 2500 1 7 . 1 1 56 56 GLU CA C 56 59.528 59.528 59.270 0.258 18703 2501 1 7 . 1 1 56 56 GLU CB C 56 30.162 30.162 29.646 0.516 18703 2502 1 7 . 1 1 56 56 GLU H H 56 7.899 7.899 7.597 0.302 18703 2503 1 7 . 1 1 57 57 VAL N N 57 121.536 121.536 118.644 2.892 18703 2504 1 7 . 1 1 57 57 VAL HA H 57 3.540 3.540 3.782 -0.242 18703 2505 1 7 . 1 1 57 57 VAL C C 57 176.984 176.984 177.349 -0.365 18703 2506 1 7 . 1 1 57 57 VAL CA C 57 66.734 66.734 65.854 0.880 18703 2507 1 7 . 1 1 57 57 VAL CB C 57 31.425 31.425 31.357 0.068 18703 2508 1 7 . 1 1 57 57 VAL H H 57 8.652 8.652 7.649 1.003 18703 2509 1 7 . 1 1 58 58 LYS N N 58 120.219 120.219 120.183 0.036 18703 2510 1 7 . 1 1 58 58 LYS HA H 58 4.199 4.199 4.112 0.087 18703 2511 1 7 . 1 1 58 58 LYS C C 58 178.972 178.972 178.345 0.627 18703 2512 1 7 . 1 1 58 58 LYS CA C 58 59.357 59.357 59.369 -0.012 18703 2513 1 7 . 1 1 58 58 LYS CB C 58 32.186 32.186 32.219 -0.033 18703 2514 1 7 . 1 1 58 58 LYS H H 58 7.791 7.791 7.497 0.294 18703 2515 1 7 . 1 1 59 59 LYS N N 59 118.252 118.252 119.833 -1.581 18703 2516 1 7 . 1 1 59 59 LYS HA H 59 4.069 4.069 4.140 -0.071 18703 2517 1 7 . 1 1 59 59 LYS C C 59 179.180 179.180 178.722 0.458 18703 2518 1 7 . 1 1 59 59 LYS CA C 59 59.285 59.285 58.869 0.416 18703 2519 1 7 . 1 1 59 59 LYS CB C 59 32.345 32.345 32.488 -0.143 18703 2520 1 7 . 1 1 59 59 LYS H H 59 7.849 7.849 7.510 0.340 18703 2521 1 7 . 1 1 60 60 LEU N N 60 121.243 121.243 119.866 1.377 18703 2522 1 7 . 1 1 60 60 LEU HA H 60 4.242 4.242 4.127 0.115 18703 2523 1 7 . 1 1 60 60 LEU C C 60 178.413 178.413 178.097 0.316 18703 2524 1 7 . 1 1 60 60 LEU CA C 60 57.798 57.798 57.307 0.491 18703 2525 1 7 . 1 1 60 60 LEU CB C 60 41.150 41.150 42.124 -0.974 18703 2526 1 7 . 1 1 60 60 LEU H H 60 7.825 7.825 7.537 0.288 18703 2527 1 7 . 1 1 61 61 GLU N N 61 118.844 118.844 120.009 -1.165 18703 2528 1 7 . 1 1 61 61 GLU HA H 61 3.800 3.800 3.887 -0.087 18703 2529 1 7 . 1 1 61 61 GLU C C 61 179.078 179.078 178.621 0.457 18703 2530 1 7 . 1 1 61 61 GLU CA C 61 60.104 60.104 59.804 0.300 18703 2531 1 7 . 1 1 61 61 GLU CB C 61 29.864 29.864 29.615 0.249 18703 2532 1 7 . 1 1 61 61 GLU H H 61 8.582 8.582 7.681 0.901 18703 2533 1 7 . 1 1 62 62 GLU N N 62 117.659 117.659 118.640 -0.981 18703 2534 1 7 . 1 1 62 62 GLU HA H 62 3.990 3.990 4.047 -0.057 18703 2535 1 7 . 1 1 62 62 GLU C C 62 178.847 178.847 178.973 -0.126 18703 2536 1 7 . 1 1 62 62 GLU CA C 62 59.067 59.067 58.974 0.093 18703 2537 1 7 . 1 1 62 62 GLU CB C 62 29.440 29.440 29.625 -0.185 18703 2538 1 7 . 1 1 62 62 GLU H H 62 8.032 8.032 7.623 0.409 18703 2539 1 7 . 1 1 63 63 GLU N N 63 119.290 119.290 118.601 0.689 18703 2540 1 7 . 1 1 63 63 GLU HA H 63 4.012 4.012 4.091 -0.079 18703 2541 1 7 . 1 1 63 63 GLU C C 63 179.784 179.784 179.032 0.752 18703 2542 1 7 . 1 1 63 63 GLU CA C 63 59.300 59.300 59.438 -0.138 18703 2543 1 7 . 1 1 63 63 GLU CB C 63 29.728 29.728 29.545 0.183 18703 2544 1 7 . 1 1 63 63 GLU H H 63 7.958 7.958 7.555 0.403 18703 2545 1 7 . 1 1 64 64 ILE N N 64 118.453 118.453 118.505 -0.052 18703 2546 1 7 . 1 1 64 64 ILE HA H 64 3.711 3.711 3.850 -0.139 18703 2547 1 7 . 1 1 64 64 ILE C C 64 177.655 177.655 177.690 -0.035 18703 2548 1 7 . 1 1 64 64 ILE CA C 64 64.256 64.256 63.778 0.478 18703 2549 1 7 . 1 1 64 64 ILE CB C 64 38.002 38.002 37.732 0.270 18703 2550 1 7 . 1 1 64 64 ILE H H 64 8.160 8.160 7.520 0.640 18703 2551 1 7 . 1 1 65 65 LYS N N 65 118.871 118.871 119.621 -0.750 18703 2552 1 7 . 1 1 65 65 LYS HA H 65 4.111 4.111 4.110 0.001 18703 2553 1 7 . 1 1 65 65 LYS C C 65 177.076 177.076 177.370 -0.294 18703 2554 1 7 . 1 1 65 65 LYS CA C 65 58.421 58.421 58.790 -0.369 18703 2555 1 7 . 1 1 65 65 LYS CB C 65 32.639 32.639 32.407 0.232 18703 2556 1 7 . 1 1 65 65 LYS H H 65 7.664 7.664 7.653 0.011 18703 2557 1 7 . 1 1 66 66 LYS N N 66 116.944 116.944 118.926 -1.982 18703 2558 1 7 . 1 1 66 66 LYS HA H 66 4.320 4.320 4.114 0.206 18703 2559 1 7 . 1 1 66 66 LYS C C 66 175.897 175.897 177.811 -1.914 18703 2560 1 7 . 1 1 66 66 LYS CA C 66 56.352 56.352 58.026 -1.673 18703 2561 1 7 . 1 1 66 66 LYS CB C 66 33.024 33.024 32.605 0.419 18703 2562 1 7 . 1 1 66 66 LYS H H 66 7.246 7.246 7.465 -0.219 18703 2563 1 8 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.261 -0.015 18703 2564 1 8 . 1 1 3 3 ARG C C 3 178.379 178.379 177.026 1.353 18703 2565 1 8 . 1 1 3 3 ARG CA C 3 58.367 58.367 57.001 1.366 18703 2566 1 8 . 1 1 3 3 ARG CB C 3 30.691 30.691 30.576 0.115 18703 2567 1 8 . 1 1 3 3 ARG H H 3 7.905 7.905 8.397 -0.492 18703 2568 1 8 . 1 1 4 4 VAL N N 4 118.966 118.966 122.062 -3.096 18703 2569 1 8 . 1 1 4 4 VAL HA H 4 3.803 3.803 3.855 -0.052 18703 2570 1 8 . 1 1 4 4 VAL C C 4 176.968 176.968 176.543 0.425 18703 2571 1 8 . 1 1 4 4 VAL CA C 4 65.441 65.441 64.796 0.645 18703 2572 1 8 . 1 1 4 4 VAL CB C 4 31.710 31.710 32.105 -0.395 18703 2573 1 8 . 1 1 4 4 VAL H H 4 8.070 8.070 8.302 -0.232 18703 2574 1 8 . 1 1 5 5 LYS N N 5 122.058 122.058 118.524 3.534 18703 2575 1 8 . 1 1 5 5 LYS HA H 5 4.154 4.154 4.013 0.141 18703 2576 1 8 . 1 1 5 5 LYS C C 5 178.553 178.553 178.558 -0.005 18703 2577 1 8 . 1 1 5 5 LYS CA C 5 58.712 58.712 59.343 -0.631 18703 2578 1 8 . 1 1 5 5 LYS CB C 5 31.788 31.788 32.245 -0.457 18703 2579 1 8 . 1 1 5 5 LYS H H 5 7.798 7.798 8.428 -0.630 18703 2580 1 8 . 1 1 6 6 ALA N N 6 119.955 119.955 120.918 -0.963 18703 2581 1 8 . 1 1 6 6 ALA HA H 6 4.198 4.198 4.243 -0.045 18703 2582 1 8 . 1 1 6 6 ALA C C 6 180.974 180.974 179.186 1.788 18703 2583 1 8 . 1 1 6 6 ALA CA C 6 54.850 54.850 54.203 0.646 18703 2584 1 8 . 1 1 6 6 ALA CB C 6 17.995 17.995 18.531 -0.536 18703 2585 1 8 . 1 1 6 6 ALA H H 6 7.928 7.928 7.518 0.410 18703 2586 1 8 . 1 1 7 7 LEU N N 7 119.211 119.211 119.875 -0.664 18703 2587 1 8 . 1 1 7 7 LEU HA H 7 4.124 4.124 3.943 0.181 18703 2588 1 8 . 1 1 7 7 LEU C C 7 178.353 178.353 178.619 -0.266 18703 2589 1 8 . 1 1 7 7 LEU CA C 7 57.658 57.658 57.457 0.201 18703 2590 1 8 . 1 1 7 7 LEU CB C 7 41.971 41.971 42.068 -0.097 18703 2591 1 8 . 1 1 7 7 LEU H H 7 7.594 7.594 7.456 0.138 18703 2592 1 8 . 1 1 8 8 GLU N N 8 120.258 120.258 118.005 2.253 18703 2593 1 8 . 1 1 8 8 GLU HA H 8 3.846 3.846 3.993 -0.147 18703 2594 1 8 . 1 1 8 8 GLU C C 8 179.546 179.546 178.564 0.982 18703 2595 1 8 . 1 1 8 8 GLU CA C 8 60.006 60.006 59.708 0.298 18703 2596 1 8 . 1 1 8 8 GLU CB C 8 29.683 29.683 29.438 0.246 18703 2597 1 8 . 1 1 8 8 GLU H H 8 8.382 8.382 7.849 0.533 18703 2598 1 8 . 1 1 9 9 GLU N N 9 118.584 118.584 118.543 0.041 18703 2599 1 8 . 1 1 9 9 GLU HA H 9 4.039 4.039 4.150 -0.111 18703 2600 1 8 . 1 1 9 9 GLU C C 9 179.635 179.635 178.662 0.973 18703 2601 1 8 . 1 1 9 9 GLU CA C 9 59.235 59.235 58.597 0.638 18703 2602 1 8 . 1 1 9 9 GLU CB C 9 29.358 29.358 29.148 0.210 18703 2603 1 8 . 1 1 9 9 GLU H H 9 7.908 7.908 7.659 0.249 18703 2604 1 8 . 1 1 10 10 LYS N N 10 120.956 120.956 119.853 1.103 18703 2605 1 8 . 1 1 10 10 LYS HA H 10 4.190 4.190 4.128 0.062 18703 2606 1 8 . 1 1 10 10 LYS C C 10 179.395 179.395 178.731 0.664 18703 2607 1 8 . 1 1 10 10 LYS CA C 10 59.231 59.231 59.061 0.170 18703 2608 1 8 . 1 1 10 10 LYS CB C 10 32.211 32.211 32.818 -0.607 18703 2609 1 8 . 1 1 10 10 LYS H H 10 8.009 8.009 7.352 0.657 18703 2610 1 8 . 1 1 11 11 VAL N N 11 119.577 119.577 117.629 1.948 18703 2611 1 8 . 1 1 11 11 VAL HA H 11 3.844 3.844 3.691 0.153 18703 2612 1 8 . 1 1 11 11 VAL C C 11 177.078 177.078 177.275 -0.197 18703 2613 1 8 . 1 1 11 11 VAL CA C 11 66.407 66.407 66.646 -0.239 18703 2614 1 8 . 1 1 11 11 VAL CB C 11 31.252 31.252 31.808 -0.556 18703 2615 1 8 . 1 1 11 11 VAL H H 11 8.488 8.488 7.522 0.966 18703 2616 1 8 . 1 1 12 12 LYS N N 12 122.864 122.864 119.351 3.513 18703 2617 1 8 . 1 1 12 12 LYS HA H 12 4.189 4.189 4.030 0.159 18703 2618 1 8 . 1 1 12 12 LYS C C 12 178.755 178.755 178.206 0.549 18703 2619 1 8 . 1 1 12 12 LYS CA C 12 59.375 59.375 59.480 -0.105 18703 2620 1 8 . 1 1 12 12 LYS CB C 12 31.991 31.991 31.751 0.240 18703 2621 1 8 . 1 1 12 12 LYS H H 12 7.944 7.944 7.567 0.377 18703 2622 1 8 . 1 1 13 13 ALA N N 13 121.202 121.202 121.351 -0.149 18703 2623 1 8 . 1 1 13 13 ALA HA H 13 4.209 4.209 4.300 -0.091 18703 2624 1 8 . 1 1 13 13 ALA C C 13 181.060 181.060 179.304 1.756 18703 2625 1 8 . 1 1 13 13 ALA CA C 13 54.710 54.710 54.013 0.697 18703 2626 1 8 . 1 1 13 13 ALA CB C 13 17.861 17.861 18.454 -0.593 18703 2627 1 8 . 1 1 13 13 ALA H H 13 7.563 7.563 7.547 0.016 18703 2628 1 8 . 1 1 14 14 LEU N N 14 120.014 120.014 119.735 0.279 18703 2629 1 8 . 1 1 14 14 LEU HA H 14 4.072 4.072 3.995 0.077 18703 2630 1 8 . 1 1 14 14 LEU C C 14 177.862 177.862 178.194 -0.332 18703 2631 1 8 . 1 1 14 14 LEU CA C 14 57.864 57.864 57.379 0.485 18703 2632 1 8 . 1 1 14 14 LEU CB C 14 41.539 41.539 42.057 -0.518 18703 2633 1 8 . 1 1 14 14 LEU H H 14 8.087 8.087 7.539 0.548 18703 2634 1 8 . 1 1 15 15 GLU N N 15 121.644 121.644 119.959 1.685 18703 2635 1 8 . 1 1 15 15 GLU HA H 15 3.692 3.692 4.005 -0.313 18703 2636 1 8 . 1 1 15 15 GLU C C 15 177.819 177.819 178.299 -0.480 18703 2637 1 8 . 1 1 15 15 GLU CA C 15 59.239 59.239 59.276 -0.037 18703 2638 1 8 . 1 1 15 15 GLU CB C 15 28.865 28.865 29.569 -0.704 18703 2639 1 8 . 1 1 15 15 GLU H H 15 8.542 8.542 7.667 0.875 18703 2640 1 8 . 1 1 16 16 GLU N N 16 116.016 116.016 118.562 -2.546 18703 2641 1 8 . 1 1 16 16 GLU HA H 16 3.955 3.955 3.995 -0.040 18703 2642 1 8 . 1 1 16 16 GLU C C 16 179.159 179.159 179.191 -0.032 18703 2643 1 8 . 1 1 16 16 GLU CA C 16 59.324 59.324 59.344 -0.020 18703 2644 1 8 . 1 1 16 16 GLU CB C 16 29.060 29.060 29.259 -0.199 18703 2645 1 8 . 1 1 16 16 GLU H H 16 7.492 7.492 7.943 -0.451 18703 2646 1 8 . 1 1 17 17 LYS N N 17 118.546 118.546 119.214 -0.668 18703 2647 1 8 . 1 1 17 17 LYS HA H 17 4.117 4.117 4.147 -0.030 18703 2648 1 8 . 1 1 17 17 LYS C C 17 178.976 178.976 178.951 0.025 18703 2649 1 8 . 1 1 17 17 LYS CA C 17 58.837 58.837 58.968 -0.131 18703 2650 1 8 . 1 1 17 17 LYS CB C 17 32.538 32.538 32.572 -0.034 18703 2651 1 8 . 1 1 17 17 LYS H H 17 7.720 7.720 7.412 0.308 18703 2652 1 8 . 1 1 18 18 VAL N N 18 118.376 118.376 119.374 -0.998 18703 2653 1 8 . 1 1 18 18 VAL HA H 18 3.711 3.711 3.681 0.030 18703 2654 1 8 . 1 1 18 18 VAL C C 18 178.765 178.765 178.569 0.196 18703 2655 1 8 . 1 1 18 18 VAL CA C 18 66.237 66.237 66.185 0.052 18703 2656 1 8 . 1 1 18 18 VAL CB C 18 31.682 31.682 31.629 0.053 18703 2657 1 8 . 1 1 18 18 VAL H H 18 8.754 8.754 7.375 1.379 18703 2658 1 8 . 1 1 19 19 LYS N N 19 118.817 118.817 118.493 0.324 18703 2659 1 8 . 1 1 19 19 LYS HA H 19 4.078 4.078 3.972 0.106 18703 2660 1 8 . 1 1 19 19 LYS C C 19 178.049 178.049 177.830 0.219 18703 2661 1 8 . 1 1 19 19 LYS CA C 19 59.731 59.731 59.278 0.453 18703 2662 1 8 . 1 1 19 19 LYS CB C 19 32.523 32.523 32.077 0.446 18703 2663 1 8 . 1 1 19 19 LYS H H 19 8.299 8.299 8.574 -0.275 18703 2664 1 8 . 1 1 20 20 ALA N N 20 119.656 119.656 119.525 0.131 18703 2665 1 8 . 1 1 20 20 ALA HA H 20 4.347 4.347 4.325 0.022 18703 2666 1 8 . 1 1 20 20 ALA C C 20 178.532 178.532 178.505 0.027 18703 2667 1 8 . 1 1 20 20 ALA CA C 20 52.853 52.853 52.972 -0.119 18703 2668 1 8 . 1 1 20 20 ALA CB C 20 18.832 18.832 18.784 0.048 18703 2669 1 8 . 1 1 20 20 ALA H H 20 7.425 7.425 7.572 -0.147 18703 2670 1 8 . 1 1 21 21 LEU N N 21 118.594 118.594 119.070 -0.476 18703 2671 1 8 . 1 1 21 21 LEU HA H 21 4.297 4.297 4.118 0.179 18703 2672 1 8 . 1 1 21 21 LEU C C 21 177.784 177.784 177.781 0.003 18703 2673 1 8 . 1 1 21 21 LEU CA C 21 55.750 55.750 56.605 -0.855 18703 2674 1 8 . 1 1 21 21 LEU CB C 21 42.898 42.898 42.530 0.368 18703 2675 1 8 . 1 1 21 21 LEU H H 21 7.508 7.508 7.929 -0.421 18703 2676 1 8 . 1 1 22 22 GLY N N 22 106.650 106.650 103.749 2.901 18703 2677 1 8 . 1 1 22 22 GLY C C 22 173.605 173.605 172.554 1.051 18703 2678 1 8 . 1 1 22 22 GLY CA C 22 45.330 45.330 44.429 0.901 18703 2679 1 8 . 1 1 22 22 GLY H H 22 7.814 7.814 7.621 0.193 18703 2680 1 8 . 1 1 23 23 GLY N N 23 108.011 108.011 107.200 0.811 18703 2681 1 8 . 1 1 23 23 GLY C C 23 174.061 174.061 173.542 0.519 18703 2682 1 8 . 1 1 23 23 GLY CA C 23 44.772 44.772 44.808 -0.036 18703 2683 1 8 . 1 1 23 23 GLY H H 23 8.139 8.139 7.980 0.159 18703 2684 1 8 . 1 1 24 24 GLY N N 24 107.826 107.826 107.971 -0.145 18703 2685 1 8 . 1 1 24 24 GLY C C 24 175.046 175.046 174.067 0.979 18703 2686 1 8 . 1 1 24 24 GLY CA C 24 44.422 44.422 45.702 -1.280 18703 2687 1 8 . 1 1 24 24 GLY H H 24 8.497 8.497 8.062 0.435 18703 2688 1 8 . 1 1 25 25 GLY N N 25 108.830 108.830 109.796 -0.966 18703 2689 1 8 . 1 1 25 25 GLY C C 25 176.272 176.272 176.010 0.262 18703 2690 1 8 . 1 1 25 25 GLY CA C 25 47.101 47.101 44.939 2.162 18703 2691 1 8 . 1 1 25 25 GLY H H 25 8.616 8.616 8.532 0.084 18703 2692 1 8 . 1 1 26 26 ARG N N 26 123.109 123.109 122.212 0.897 18703 2693 1 8 . 1 1 26 26 ARG HA H 26 4.283 4.283 4.108 0.175 18703 2694 1 8 . 1 1 26 26 ARG C C 26 177.848 177.848 178.480 -0.632 18703 2695 1 8 . 1 1 26 26 ARG CA C 26 57.663 57.663 58.151 -0.488 18703 2696 1 8 . 1 1 26 26 ARG CB C 26 29.811 29.811 29.662 0.149 18703 2697 1 8 . 1 1 26 26 ARG H H 26 8.770 8.770 8.506 0.264 18703 2698 1 8 . 1 1 27 27 ILE N N 27 118.104 118.104 118.889 -0.785 18703 2699 1 8 . 1 1 27 27 ILE HA H 27 3.787 3.787 3.819 -0.032 18703 2700 1 8 . 1 1 27 27 ILE C C 27 177.473 177.473 178.139 -0.666 18703 2701 1 8 . 1 1 27 27 ILE CA C 27 63.036 63.036 64.826 -1.790 18703 2702 1 8 . 1 1 27 27 ILE CB C 27 36.664 36.664 37.557 -0.893 18703 2703 1 8 . 1 1 27 27 ILE H H 27 7.708 7.708 8.252 -0.544 18703 2704 1 8 . 1 1 28 28 GLU N N 28 119.934 119.934 118.257 1.677 18703 2705 1 8 . 1 1 28 28 GLU HA H 28 3.954 3.954 3.912 0.042 18703 2706 1 8 . 1 1 28 28 GLU C C 28 179.514 179.514 178.877 0.637 18703 2707 1 8 . 1 1 28 28 GLU CA C 28 59.450 59.450 59.689 -0.239 18703 2708 1 8 . 1 1 28 28 GLU CB C 28 29.600 29.600 28.939 0.661 18703 2709 1 8 . 1 1 28 28 GLU H H 28 7.872 7.872 8.514 -0.642 18703 2710 1 8 . 1 1 29 29 GLU N N 29 118.134 118.134 120.251 -2.117 18703 2711 1 8 . 1 1 29 29 GLU HA H 29 4.028 4.028 4.093 -0.065 18703 2712 1 8 . 1 1 29 29 GLU C C 29 179.182 179.182 179.078 0.104 18703 2713 1 8 . 1 1 29 29 GLU CA C 29 59.173 59.173 59.225 -0.052 18703 2714 1 8 . 1 1 29 29 GLU CB C 29 29.503 29.503 29.269 0.234 18703 2715 1 8 . 1 1 29 29 GLU H H 29 8.166 8.166 7.679 0.487 18703 2716 1 8 . 1 1 30 30 LEU N N 30 120.242 120.242 117.805 2.437 18703 2717 1 8 . 1 1 30 30 LEU HA H 30 4.028 4.028 3.983 0.045 18703 2718 1 8 . 1 1 30 30 LEU C C 30 178.796 178.796 179.131 -0.335 18703 2719 1 8 . 1 1 30 30 LEU CA C 30 57.654 57.654 57.115 0.539 18703 2720 1 8 . 1 1 30 30 LEU CB C 30 41.629 41.629 41.516 0.113 18703 2721 1 8 . 1 1 30 30 LEU H H 30 7.695 7.695 7.690 0.005 18703 2722 1 8 . 1 1 31 31 LYS N N 31 120.506 120.506 119.858 0.648 18703 2723 1 8 . 1 1 31 31 LYS HA H 31 3.532 3.532 4.030 -0.498 18703 2724 1 8 . 1 1 31 31 LYS C C 31 178.919 178.919 178.327 0.592 18703 2725 1 8 . 1 1 31 31 LYS CA C 31 60.240 60.240 59.211 1.029 18703 2726 1 8 . 1 1 31 31 LYS CB C 31 32.015 32.015 32.274 -0.259 18703 2727 1 8 . 1 1 31 31 LYS H H 31 8.561 8.561 7.332 1.229 18703 2728 1 8 . 1 1 32 32 LYS N N 32 118.566 118.566 118.939 -0.373 18703 2729 1 8 . 1 1 32 32 LYS C C 32 179.392 179.392 179.289 0.103 18703 2730 1 8 . 1 1 32 32 LYS CA C 32 59.356 59.356 59.882 -0.526 18703 2731 1 8 . 1 1 32 32 LYS CB C 32 32.117 32.117 32.425 -0.308 18703 2732 1 8 . 1 1 32 32 LYS H H 32 7.699 7.699 7.553 0.146 18703 2733 1 8 . 1 1 33 33 LYS N N 33 118.964 118.964 118.004 0.960 18703 2734 1 8 . 1 1 33 33 LYS HA H 33 4.117 4.117 4.132 -0.015 18703 2735 1 8 . 1 1 33 33 LYS C C 33 178.355 178.355 177.955 0.400 18703 2736 1 8 . 1 1 33 33 LYS CA C 33 58.633 58.633 58.923 -0.290 18703 2737 1 8 . 1 1 33 33 LYS CB C 33 31.904 31.904 32.437 -0.533 18703 2738 1 8 . 1 1 33 33 LYS H H 33 7.752 7.752 7.547 0.205 18703 2739 1 8 . 1 1 34 34 CYS N N 34 119.956 119.956 119.335 0.621 18703 2740 1 8 . 1 1 34 34 CYS HA H 34 3.967 3.967 4.105 -0.138 18703 2741 1 8 . 1 1 34 34 CYS C C 34 175.521 175.521 176.774 -1.253 18703 2742 1 8 . 1 1 34 34 CYS CA C 34 60.987 60.987 63.072 -2.086 18703 2743 1 8 . 1 1 34 34 CYS CB C 34 36.600 36.600 26.642 9.958 18703 2744 1 8 . 1 1 34 34 CYS H H 34 8.393 8.393 7.585 0.808 18703 2745 1 8 . 1 1 35 35 GLU N N 35 120.327 120.327 119.534 0.793 18703 2746 1 8 . 1 1 35 35 GLU HA H 35 3.891 3.891 3.937 -0.046 18703 2747 1 8 . 1 1 35 35 GLU C C 35 179.684 179.684 178.610 1.074 18703 2748 1 8 . 1 1 35 35 GLU CA C 35 60.059 60.059 59.219 0.840 18703 2749 1 8 . 1 1 35 35 GLU CB C 35 29.718 29.718 28.637 1.081 18703 2750 1 8 . 1 1 35 35 GLU H H 35 8.558 8.558 7.845 0.713 18703 2751 1 8 . 1 1 36 36 GLU N N 36 120.190 120.190 119.935 0.255 18703 2752 1 8 . 1 1 36 36 GLU HA H 36 4.051 4.051 4.023 0.028 18703 2753 1 8 . 1 1 36 36 GLU C C 36 179.408 179.408 178.885 0.523 18703 2754 1 8 . 1 1 36 36 GLU CA C 36 59.148 59.148 58.933 0.215 18703 2755 1 8 . 1 1 36 36 GLU CB C 36 29.766 29.766 29.807 -0.041 18703 2756 1 8 . 1 1 36 36 GLU H H 36 8.038 8.038 7.620 0.418 18703 2757 1 8 . 1 1 37 37 LEU N N 37 121.102 121.102 119.738 1.364 18703 2758 1 8 . 1 1 37 37 LEU HA H 37 4.079 4.079 4.194 -0.115 18703 2759 1 8 . 1 1 37 37 LEU C C 37 178.279 178.279 178.291 -0.012 18703 2760 1 8 . 1 1 37 37 LEU CA C 37 57.803 57.803 57.438 0.365 18703 2761 1 8 . 1 1 37 37 LEU CB C 37 41.502 41.502 41.693 -0.191 18703 2762 1 8 . 1 1 37 37 LEU H H 37 8.065 8.065 7.480 0.585 18703 2763 1 8 . 1 1 38 38 LYS N N 38 119.980 119.980 118.711 1.269 18703 2764 1 8 . 1 1 38 38 LYS HA H 38 3.851 3.851 3.915 -0.064 18703 2765 1 8 . 1 1 38 38 LYS C C 38 178.919 178.919 179.210 -0.291 18703 2766 1 8 . 1 1 38 38 LYS CA C 38 60.794 60.794 59.777 1.017 18703 2767 1 8 . 1 1 38 38 LYS CB C 38 32.863 32.863 32.144 0.719 18703 2768 1 8 . 1 1 38 38 LYS H H 38 8.741 8.741 7.659 1.082 18703 2769 1 8 . 1 1 39 39 LYS N N 39 118.307 118.307 118.121 0.186 18703 2770 1 8 . 1 1 39 39 LYS HA H 39 4.125 4.125 3.990 0.135 18703 2771 1 8 . 1 1 39 39 LYS C C 39 178.622 178.622 178.674 -0.052 18703 2772 1 8 . 1 1 39 39 LYS CA C 39 58.993 58.993 59.090 -0.097 18703 2773 1 8 . 1 1 39 39 LYS CB C 39 32.097 32.097 31.826 0.271 18703 2774 1 8 . 1 1 39 39 LYS H H 39 7.584 7.584 7.776 -0.192 18703 2775 1 8 . 1 1 40 40 LYS N N 40 118.826 118.826 119.275 -0.449 18703 2776 1 8 . 1 1 40 40 LYS HA H 40 4.069 4.069 4.170 -0.101 18703 2777 1 8 . 1 1 40 40 LYS C C 40 179.802 179.802 178.816 0.986 18703 2778 1 8 . 1 1 40 40 LYS CA C 40 59.322 59.322 58.731 0.591 18703 2779 1 8 . 1 1 40 40 LYS CB C 40 32.505 32.505 32.294 0.211 18703 2780 1 8 . 1 1 40 40 LYS H H 40 7.945 7.945 7.359 0.586 18703 2781 1 8 . 1 1 41 41 ILE N N 41 118.958 118.958 119.467 -0.509 18703 2782 1 8 . 1 1 41 41 ILE HA H 41 3.659 3.659 3.792 -0.133 18703 2783 1 8 . 1 1 41 41 ILE C C 41 178.146 178.146 177.754 0.392 18703 2784 1 8 . 1 1 41 41 ILE CA C 41 65.037 65.037 64.226 0.811 18703 2785 1 8 . 1 1 41 41 ILE CB C 41 37.950 37.950 37.729 0.221 18703 2786 1 8 . 1 1 41 41 ILE H H 41 8.369 8.369 8.096 0.273 18703 2787 1 8 . 1 1 42 42 GLU N N 42 120.331 120.331 118.914 1.417 18703 2788 1 8 . 1 1 42 42 GLU HA H 42 4.094 4.094 4.035 0.059 18703 2789 1 8 . 1 1 42 42 GLU C C 42 178.697 178.697 177.892 0.805 18703 2790 1 8 . 1 1 42 42 GLU CA C 42 58.927 58.927 59.349 -0.422 18703 2791 1 8 . 1 1 42 42 GLU CB C 42 29.399 29.399 29.799 -0.400 18703 2792 1 8 . 1 1 42 42 GLU H H 42 7.805 7.805 7.751 0.054 18703 2793 1 8 . 1 1 43 43 GLU N N 43 117.120 117.120 116.471 0.649 18703 2794 1 8 . 1 1 43 43 GLU HA H 43 4.291 4.291 4.183 0.108 18703 2795 1 8 . 1 1 43 43 GLU C C 43 177.551 177.551 177.572 -0.021 18703 2796 1 8 . 1 1 43 43 GLU CA C 43 56.800 56.800 56.980 -0.180 18703 2797 1 8 . 1 1 43 43 GLU CB C 43 29.931 29.931 29.704 0.227 18703 2798 1 8 . 1 1 43 43 GLU H H 43 7.701 7.701 7.610 0.091 18703 2799 1 8 . 1 1 44 44 LEU N N 44 120.940 120.940 121.103 -0.163 18703 2800 1 8 . 1 1 44 44 LEU HA H 44 4.251 4.251 4.121 0.130 18703 2801 1 8 . 1 1 44 44 LEU C C 44 178.596 178.596 177.381 1.215 18703 2802 1 8 . 1 1 44 44 LEU CA C 44 56.448 56.448 55.413 1.036 18703 2803 1 8 . 1 1 44 44 LEU CB C 44 42.519 42.519 42.635 -0.116 18703 2804 1 8 . 1 1 44 44 LEU H H 44 7.581 7.581 7.361 0.220 18703 2805 1 8 . 1 1 45 45 GLY N N 45 108.689 108.689 107.935 0.754 18703 2806 1 8 . 1 1 45 45 GLY C C 45 174.853 174.853 174.335 0.518 18703 2807 1 8 . 1 1 45 45 GLY CA C 45 46.233 46.233 45.235 0.998 18703 2808 1 8 . 1 1 45 45 GLY H H 45 8.232 8.232 8.608 -0.376 18703 2809 1 8 . 1 1 46 46 GLY N N 46 108.029 108.029 106.935 1.094 18703 2810 1 8 . 1 1 46 46 GLY C C 46 174.351 174.351 174.224 0.127 18703 2811 1 8 . 1 1 46 46 GLY CA C 46 45.105 45.105 45.574 -0.469 18703 2812 1 8 . 1 1 46 46 GLY H H 46 8.176 8.176 8.838 -0.662 18703 2813 1 8 . 1 1 47 47 GLY N N 47 108.183 108.183 107.280 0.903 18703 2814 1 8 . 1 1 47 47 GLY C C 47 174.671 174.671 175.033 -0.362 18703 2815 1 8 . 1 1 47 47 GLY CA C 47 45.254 45.254 44.759 0.495 18703 2816 1 8 . 1 1 47 47 GLY H H 47 8.290 8.290 7.941 0.349 18703 2817 1 8 . 1 1 48 48 GLY N N 48 108.616 108.616 112.671 -4.055 18703 2818 1 8 . 1 1 48 48 GLY C C 48 174.321 174.321 174.818 -0.497 18703 2819 1 8 . 1 1 48 48 GLY CA C 48 45.192 45.192 45.645 -0.453 18703 2820 1 8 . 1 1 48 48 GLY H H 48 8.027 8.027 8.474 -0.447 18703 2821 1 8 . 1 1 49 49 GLU N N 49 121.057 121.057 121.668 -0.611 18703 2822 1 8 . 1 1 49 49 GLU HA H 49 4.425 4.425 4.497 -0.072 18703 2823 1 8 . 1 1 49 49 GLU C C 49 177.072 177.072 178.864 -1.792 18703 2824 1 8 . 1 1 49 49 GLU CA C 49 56.330 56.330 56.269 0.062 18703 2825 1 8 . 1 1 49 49 GLU CB C 49 29.602 29.602 30.338 -0.736 18703 2826 1 8 . 1 1 49 49 GLU H H 49 8.486 8.486 8.269 0.217 18703 2827 1 8 . 1 1 50 50 VAL N N 50 122.122 122.122 120.490 1.632 18703 2828 1 8 . 1 1 50 50 VAL HA H 50 3.792 3.792 3.612 0.180 18703 2829 1 8 . 1 1 50 50 VAL C C 50 176.774 176.774 176.840 -0.066 18703 2830 1 8 . 1 1 50 50 VAL CA C 50 64.864 64.864 65.300 -0.436 18703 2831 1 8 . 1 1 50 50 VAL CB C 50 32.179 32.179 31.645 0.534 18703 2832 1 8 . 1 1 50 50 VAL H H 50 8.095 8.095 8.201 -0.106 18703 2833 1 8 . 1 1 51 51 LYS N N 51 120.602 120.602 117.626 2.976 18703 2834 1 8 . 1 1 51 51 LYS HA H 51 4.195 4.195 4.045 0.150 18703 2835 1 8 . 1 1 51 51 LYS C C 51 178.530 178.530 178.565 -0.035 18703 2836 1 8 . 1 1 51 51 LYS CA C 51 59.348 59.348 58.971 0.376 18703 2837 1 8 . 1 1 51 51 LYS CB C 51 32.265 32.265 32.011 0.254 18703 2838 1 8 . 1 1 51 51 LYS H H 51 8.268 8.268 8.137 0.131 18703 2839 1 8 . 1 1 52 52 LYS N N 52 117.547 117.547 120.622 -3.075 18703 2840 1 8 . 1 1 52 52 LYS HA H 52 4.162 4.162 4.123 0.039 18703 2841 1 8 . 1 1 52 52 LYS C C 52 179.132 179.132 179.302 -0.170 18703 2842 1 8 . 1 1 52 52 LYS CA C 52 58.811 58.811 58.715 0.096 18703 2843 1 8 . 1 1 52 52 LYS CB C 52 32.054 32.054 31.930 0.124 18703 2844 1 8 . 1 1 52 52 LYS H H 52 7.595 7.595 7.962 -0.367 18703 2845 1 8 . 1 1 53 53 VAL N N 53 119.190 119.190 118.901 0.289 18703 2846 1 8 . 1 1 53 53 VAL HA H 53 3.767 3.767 3.714 0.053 18703 2847 1 8 . 1 1 53 53 VAL C C 53 177.933 177.933 177.755 0.178 18703 2848 1 8 . 1 1 53 53 VAL CA C 53 66.065 66.065 65.706 0.359 18703 2849 1 8 . 1 1 53 53 VAL CB C 53 31.248 31.248 30.711 0.537 18703 2850 1 8 . 1 1 53 53 VAL H H 53 7.597 7.597 7.610 -0.013 18703 2851 1 8 . 1 1 54 54 GLU N N 54 120.226 120.226 119.568 0.658 18703 2852 1 8 . 1 1 54 54 GLU HA H 54 3.833 3.833 3.981 -0.148 18703 2853 1 8 . 1 1 54 54 GLU C C 54 179.352 179.352 178.711 0.641 18703 2854 1 8 . 1 1 54 54 GLU CA C 54 59.153 59.153 59.463 -0.310 18703 2855 1 8 . 1 1 54 54 GLU CB C 54 29.224 29.224 29.497 -0.272 18703 2856 1 8 . 1 1 54 54 GLU H H 54 8.609 8.609 7.630 0.979 18703 2857 1 8 . 1 1 55 55 GLU N N 55 119.148 119.148 119.226 -0.078 18703 2858 1 8 . 1 1 55 55 GLU HA H 55 4.084 4.084 4.144 -0.060 18703 2859 1 8 . 1 1 55 55 GLU C C 55 179.084 179.084 178.749 0.335 18703 2860 1 8 . 1 1 55 55 GLU CA C 55 59.295 59.295 58.601 0.694 18703 2861 1 8 . 1 1 55 55 GLU CB C 55 29.361 29.361 29.503 -0.142 18703 2862 1 8 . 1 1 55 55 GLU H H 55 7.713 7.713 7.831 -0.118 18703 2863 1 8 . 1 1 56 56 GLU N N 56 120.301 120.301 118.844 1.457 18703 2864 1 8 . 1 1 56 56 GLU HA H 56 4.079 4.079 4.109 -0.030 18703 2865 1 8 . 1 1 56 56 GLU C C 56 179.773 179.773 179.089 0.684 18703 2866 1 8 . 1 1 56 56 GLU CA C 56 59.528 59.528 59.200 0.328 18703 2867 1 8 . 1 1 56 56 GLU CB C 56 30.162 30.162 29.691 0.471 18703 2868 1 8 . 1 1 56 56 GLU H H 56 7.899 7.899 7.581 0.318 18703 2869 1 8 . 1 1 57 57 VAL N N 57 121.536 121.536 118.738 2.798 18703 2870 1 8 . 1 1 57 57 VAL HA H 57 3.540 3.540 3.834 -0.294 18703 2871 1 8 . 1 1 57 57 VAL C C 57 176.984 176.984 177.465 -0.481 18703 2872 1 8 . 1 1 57 57 VAL CA C 57 66.734 66.734 65.524 1.210 18703 2873 1 8 . 1 1 57 57 VAL CB C 57 31.425 31.425 31.427 -0.002 18703 2874 1 8 . 1 1 57 57 VAL H H 57 8.652 8.652 7.599 1.053 18703 2875 1 8 . 1 1 58 58 LYS N N 58 120.219 120.219 120.280 -0.061 18703 2876 1 8 . 1 1 58 58 LYS HA H 58 4.199 4.199 4.082 0.117 18703 2877 1 8 . 1 1 58 58 LYS C C 58 178.972 178.972 178.406 0.566 18703 2878 1 8 . 1 1 58 58 LYS CA C 58 59.357 59.357 59.571 -0.214 18703 2879 1 8 . 1 1 58 58 LYS CB C 58 32.186 32.186 32.199 -0.013 18703 2880 1 8 . 1 1 58 58 LYS H H 58 7.791 7.791 7.427 0.364 18703 2881 1 8 . 1 1 59 59 LYS N N 59 118.252 118.252 119.922 -1.670 18703 2882 1 8 . 1 1 59 59 LYS HA H 59 4.069 4.069 4.133 -0.064 18703 2883 1 8 . 1 1 59 59 LYS C C 59 179.180 179.180 178.644 0.536 18703 2884 1 8 . 1 1 59 59 LYS CA C 59 59.285 59.285 58.943 0.342 18703 2885 1 8 . 1 1 59 59 LYS CB C 59 32.345 32.345 32.486 -0.141 18703 2886 1 8 . 1 1 59 59 LYS H H 59 7.849 7.849 7.518 0.331 18703 2887 1 8 . 1 1 60 60 LEU N N 60 121.243 121.243 119.785 1.458 18703 2888 1 8 . 1 1 60 60 LEU HA H 60 4.242 4.242 4.139 0.103 18703 2889 1 8 . 1 1 60 60 LEU C C 60 178.413 178.413 178.218 0.195 18703 2890 1 8 . 1 1 60 60 LEU CA C 60 57.798 57.798 57.242 0.556 18703 2891 1 8 . 1 1 60 60 LEU CB C 60 41.150 41.150 42.208 -1.058 18703 2892 1 8 . 1 1 60 60 LEU H H 60 7.825 7.825 7.566 0.259 18703 2893 1 8 . 1 1 61 61 GLU N N 61 118.844 118.844 120.038 -1.194 18703 2894 1 8 . 1 1 61 61 GLU HA H 61 3.800 3.800 3.933 -0.133 18703 2895 1 8 . 1 1 61 61 GLU C C 61 179.078 179.078 178.551 0.527 18703 2896 1 8 . 1 1 61 61 GLU CA C 61 60.104 60.104 59.955 0.149 18703 2897 1 8 . 1 1 61 61 GLU CB C 61 29.864 29.864 29.678 0.186 18703 2898 1 8 . 1 1 61 61 GLU H H 61 8.582 8.582 7.724 0.858 18703 2899 1 8 . 1 1 62 62 GLU N N 62 117.659 117.659 118.627 -0.968 18703 2900 1 8 . 1 1 62 62 GLU HA H 62 3.990 3.990 4.044 -0.054 18703 2901 1 8 . 1 1 62 62 GLU C C 62 178.847 178.847 178.967 -0.120 18703 2902 1 8 . 1 1 62 62 GLU CA C 62 59.067 59.067 58.949 0.118 18703 2903 1 8 . 1 1 62 62 GLU CB C 62 29.440 29.440 29.653 -0.213 18703 2904 1 8 . 1 1 62 62 GLU H H 62 8.032 8.032 7.617 0.415 18703 2905 1 8 . 1 1 63 63 GLU N N 63 119.290 119.290 119.343 -0.053 18703 2906 1 8 . 1 1 63 63 GLU HA H 63 4.012 4.012 4.092 -0.080 18703 2907 1 8 . 1 1 63 63 GLU C C 63 179.784 179.784 179.356 0.428 18703 2908 1 8 . 1 1 63 63 GLU CA C 63 59.300 59.300 58.992 0.307 18703 2909 1 8 . 1 1 63 63 GLU CB C 63 29.728 29.728 29.433 0.295 18703 2910 1 8 . 1 1 63 63 GLU H H 63 7.958 7.958 7.447 0.511 18703 2911 1 8 . 1 1 64 64 ILE N N 64 118.453 118.453 119.487 -1.034 18703 2912 1 8 . 1 1 64 64 ILE HA H 64 3.711 3.711 3.769 -0.058 18703 2913 1 8 . 1 1 64 64 ILE C C 64 177.655 177.655 177.845 -0.190 18703 2914 1 8 . 1 1 64 64 ILE CA C 64 64.256 64.256 64.216 0.040 18703 2915 1 8 . 1 1 64 64 ILE CB C 64 38.002 38.002 37.480 0.522 18703 2916 1 8 . 1 1 64 64 ILE H H 64 8.160 8.160 7.572 0.588 18703 2917 1 8 . 1 1 65 65 LYS N N 65 118.871 118.871 119.351 -0.480 18703 2918 1 8 . 1 1 65 65 LYS HA H 65 4.111 4.111 4.087 0.024 18703 2919 1 8 . 1 1 65 65 LYS C C 65 177.076 177.076 177.722 -0.646 18703 2920 1 8 . 1 1 65 65 LYS CA C 65 58.421 58.421 58.535 -0.113 18703 2921 1 8 . 1 1 65 65 LYS CB C 65 32.639 32.639 32.203 0.437 18703 2922 1 8 . 1 1 65 65 LYS H H 65 7.664 7.664 7.722 -0.058 18703 2923 1 8 . 1 1 66 66 LYS N N 66 116.944 116.944 116.762 0.182 18703 2924 1 8 . 1 1 66 66 LYS HA H 66 4.320 4.320 4.364 -0.044 18703 2925 1 8 . 1 1 66 66 LYS C C 66 175.897 175.897 177.071 -1.174 18703 2926 1 8 . 1 1 66 66 LYS CA C 66 56.352 56.352 56.248 0.104 18703 2927 1 8 . 1 1 66 66 LYS CB C 66 33.024 33.024 34.094 -1.070 18703 2928 1 8 . 1 1 66 66 LYS H H 66 7.246 7.246 7.536 -0.290 18703 2929 1 9 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.338 -0.092 18703 2930 1 9 . 1 1 3 3 ARG C C 3 178.379 178.379 176.409 1.970 18703 2931 1 9 . 1 1 3 3 ARG CA C 3 58.367 58.367 57.007 1.360 18703 2932 1 9 . 1 1 3 3 ARG CB C 3 30.691 30.691 30.577 0.114 18703 2933 1 9 . 1 1 3 3 ARG H H 3 7.905 7.905 7.989 -0.084 18703 2934 1 9 . 1 1 4 4 VAL N N 4 118.966 118.966 121.688 -2.722 18703 2935 1 9 . 1 1 4 4 VAL HA H 4 3.803 3.803 3.813 -0.010 18703 2936 1 9 . 1 1 4 4 VAL C C 4 176.968 176.968 177.575 -0.607 18703 2937 1 9 . 1 1 4 4 VAL CA C 4 65.441 65.441 65.587 -0.146 18703 2938 1 9 . 1 1 4 4 VAL CB C 4 31.710 31.710 31.674 0.036 18703 2939 1 9 . 1 1 4 4 VAL H H 4 8.070 8.070 8.356 -0.286 18703 2940 1 9 . 1 1 5 5 LYS N N 5 122.058 122.058 119.694 2.364 18703 2941 1 9 . 1 1 5 5 LYS HA H 5 4.154 4.154 4.062 0.092 18703 2942 1 9 . 1 1 5 5 LYS C C 5 178.553 178.553 178.521 0.032 18703 2943 1 9 . 1 1 5 5 LYS CA C 5 58.712 58.712 59.287 -0.575 18703 2944 1 9 . 1 1 5 5 LYS CB C 5 31.788 31.788 32.295 -0.507 18703 2945 1 9 . 1 1 5 5 LYS H H 5 7.798 7.798 8.437 -0.639 18703 2946 1 9 . 1 1 6 6 ALA N N 6 119.955 119.955 121.024 -1.069 18703 2947 1 9 . 1 1 6 6 ALA HA H 6 4.198 4.198 4.379 -0.181 18703 2948 1 9 . 1 1 6 6 ALA C C 6 180.974 180.974 179.339 1.635 18703 2949 1 9 . 1 1 6 6 ALA CA C 6 54.850 54.850 54.178 0.672 18703 2950 1 9 . 1 1 6 6 ALA CB C 6 17.995 17.995 18.458 -0.463 18703 2951 1 9 . 1 1 6 6 ALA H H 6 7.928 7.928 7.261 0.667 18703 2952 1 9 . 1 1 7 7 LEU N N 7 119.211 119.211 119.591 -0.380 18703 2953 1 9 . 1 1 7 7 LEU HA H 7 4.124 4.124 3.979 0.145 18703 2954 1 9 . 1 1 7 7 LEU C C 7 178.353 178.353 178.675 -0.322 18703 2955 1 9 . 1 1 7 7 LEU CA C 7 57.658 57.658 57.466 0.192 18703 2956 1 9 . 1 1 7 7 LEU CB C 7 41.971 41.971 42.069 -0.098 18703 2957 1 9 . 1 1 7 7 LEU H H 7 7.594 7.594 7.338 0.256 18703 2958 1 9 . 1 1 8 8 GLU N N 8 120.258 120.258 117.641 2.617 18703 2959 1 9 . 1 1 8 8 GLU HA H 8 3.846 3.846 3.988 -0.142 18703 2960 1 9 . 1 1 8 8 GLU C C 8 179.546 179.546 178.839 0.707 18703 2961 1 9 . 1 1 8 8 GLU CA C 8 60.006 60.006 59.529 0.477 18703 2962 1 9 . 1 1 8 8 GLU CB C 8 29.683 29.683 29.474 0.209 18703 2963 1 9 . 1 1 8 8 GLU H H 8 8.382 8.382 7.798 0.584 18703 2964 1 9 . 1 1 9 9 GLU N N 9 118.584 118.584 118.519 0.065 18703 2965 1 9 . 1 1 9 9 GLU HA H 9 4.039 4.039 4.141 -0.102 18703 2966 1 9 . 1 1 9 9 GLU C C 9 179.635 179.635 178.612 1.023 18703 2967 1 9 . 1 1 9 9 GLU CA C 9 59.235 59.235 58.460 0.775 18703 2968 1 9 . 1 1 9 9 GLU CB C 9 29.358 29.358 29.232 0.126 18703 2969 1 9 . 1 1 9 9 GLU H H 9 7.908 7.908 7.824 0.084 18703 2970 1 9 . 1 1 10 10 LYS N N 10 120.956 120.956 120.385 0.571 18703 2971 1 9 . 1 1 10 10 LYS HA H 10 4.190 4.190 4.116 0.074 18703 2972 1 9 . 1 1 10 10 LYS C C 10 179.395 179.395 179.030 0.365 18703 2973 1 9 . 1 1 10 10 LYS CA C 10 59.231 59.231 59.242 -0.011 18703 2974 1 9 . 1 1 10 10 LYS CB C 10 32.211 32.211 32.614 -0.403 18703 2975 1 9 . 1 1 10 10 LYS H H 10 8.009 8.009 7.370 0.639 18703 2976 1 9 . 1 1 11 11 VAL N N 11 119.577 119.577 117.920 1.657 18703 2977 1 9 . 1 1 11 11 VAL HA H 11 3.844 3.844 3.731 0.113 18703 2978 1 9 . 1 1 11 11 VAL C C 11 177.078 177.078 177.733 -0.655 18703 2979 1 9 . 1 1 11 11 VAL CA C 11 66.407 66.407 64.860 1.547 18703 2980 1 9 . 1 1 11 11 VAL CB C 11 31.252 31.252 30.921 0.331 18703 2981 1 9 . 1 1 11 11 VAL H H 11 8.488 8.488 7.491 0.997 18703 2982 1 9 . 1 1 12 12 LYS N N 12 122.864 122.864 119.411 3.453 18703 2983 1 9 . 1 1 12 12 LYS HA H 12 4.189 4.189 3.992 0.197 18703 2984 1 9 . 1 1 12 12 LYS C C 12 178.755 178.755 178.403 0.352 18703 2985 1 9 . 1 1 12 12 LYS CA C 12 59.375 59.375 59.739 -0.364 18703 2986 1 9 . 1 1 12 12 LYS CB C 12 31.991 31.991 32.194 -0.203 18703 2987 1 9 . 1 1 12 12 LYS H H 12 7.944 7.944 7.627 0.317 18703 2988 1 9 . 1 1 13 13 ALA N N 13 121.202 121.202 120.541 0.661 18703 2989 1 9 . 1 1 13 13 ALA HA H 13 4.209 4.209 4.204 0.005 18703 2990 1 9 . 1 1 13 13 ALA C C 13 181.060 181.060 179.108 1.952 18703 2991 1 9 . 1 1 13 13 ALA CA C 13 54.710 54.710 54.078 0.632 18703 2992 1 9 . 1 1 13 13 ALA CB C 13 17.861 17.861 18.517 -0.656 18703 2993 1 9 . 1 1 13 13 ALA H H 13 7.563 7.563 7.431 0.132 18703 2994 1 9 . 1 1 14 14 LEU N N 14 120.014 120.014 119.810 0.204 18703 2995 1 9 . 1 1 14 14 LEU HA H 14 4.072 4.072 4.003 0.069 18703 2996 1 9 . 1 1 14 14 LEU C C 14 177.862 177.862 178.127 -0.265 18703 2997 1 9 . 1 1 14 14 LEU CA C 14 57.864 57.864 57.557 0.307 18703 2998 1 9 . 1 1 14 14 LEU CB C 14 41.539 41.539 42.134 -0.595 18703 2999 1 9 . 1 1 14 14 LEU H H 14 8.087 8.087 7.503 0.584 18703 3000 1 9 . 1 1 15 15 GLU N N 15 121.644 121.644 120.031 1.613 18703 3001 1 9 . 1 1 15 15 GLU HA H 15 3.692 3.692 3.992 -0.300 18703 3002 1 9 . 1 1 15 15 GLU C C 15 177.819 177.819 178.287 -0.468 18703 3003 1 9 . 1 1 15 15 GLU CA C 15 59.239 59.239 59.370 -0.131 18703 3004 1 9 . 1 1 15 15 GLU CB C 15 28.865 28.865 29.528 -0.663 18703 3005 1 9 . 1 1 15 15 GLU H H 15 8.542 8.542 7.685 0.857 18703 3006 1 9 . 1 1 16 16 GLU N N 16 116.016 116.016 118.561 -2.545 18703 3007 1 9 . 1 1 16 16 GLU HA H 16 3.955 3.955 4.012 -0.057 18703 3008 1 9 . 1 1 16 16 GLU C C 16 179.159 179.159 178.942 0.217 18703 3009 1 9 . 1 1 16 16 GLU CA C 16 59.324 59.324 59.160 0.165 18703 3010 1 9 . 1 1 16 16 GLU CB C 16 29.060 29.060 29.138 -0.078 18703 3011 1 9 . 1 1 16 16 GLU H H 16 7.492 7.492 7.887 -0.395 18703 3012 1 9 . 1 1 17 17 LYS N N 17 118.546 118.546 118.884 -0.338 18703 3013 1 9 . 1 1 17 17 LYS HA H 17 4.117 4.117 4.173 -0.056 18703 3014 1 9 . 1 1 17 17 LYS C C 17 178.976 178.976 179.030 -0.054 18703 3015 1 9 . 1 1 17 17 LYS CA C 17 58.837 58.837 58.634 0.203 18703 3016 1 9 . 1 1 17 17 LYS CB C 17 32.538 32.538 32.799 -0.261 18703 3017 1 9 . 1 1 17 17 LYS H H 17 7.720 7.720 7.452 0.268 18703 3018 1 9 . 1 1 18 18 VAL N N 18 118.376 118.376 119.590 -1.214 18703 3019 1 9 . 1 1 18 18 VAL HA H 18 3.711 3.711 3.676 0.035 18703 3020 1 9 . 1 1 18 18 VAL C C 18 178.765 178.765 178.644 0.121 18703 3021 1 9 . 1 1 18 18 VAL CA C 18 66.237 66.237 66.322 -0.085 18703 3022 1 9 . 1 1 18 18 VAL CB C 18 31.682 31.682 31.759 -0.077 18703 3023 1 9 . 1 1 18 18 VAL H H 18 8.754 8.754 7.455 1.299 18703 3024 1 9 . 1 1 19 19 LYS N N 19 118.817 118.817 118.513 0.304 18703 3025 1 9 . 1 1 19 19 LYS HA H 19 4.078 4.078 4.001 0.077 18703 3026 1 9 . 1 1 19 19 LYS C C 19 178.049 178.049 177.535 0.514 18703 3027 1 9 . 1 1 19 19 LYS CA C 19 59.731 59.731 58.950 0.781 18703 3028 1 9 . 1 1 19 19 LYS CB C 19 32.523 32.523 32.184 0.340 18703 3029 1 9 . 1 1 19 19 LYS H H 19 8.299 8.299 8.455 -0.156 18703 3030 1 9 . 1 1 20 20 ALA N N 20 119.656 119.656 118.912 0.744 18703 3031 1 9 . 1 1 20 20 ALA HA H 20 4.347 4.347 4.360 -0.013 18703 3032 1 9 . 1 1 20 20 ALA C C 20 178.532 178.532 177.960 0.572 18703 3033 1 9 . 1 1 20 20 ALA CA C 20 52.853 52.853 52.072 0.781 18703 3034 1 9 . 1 1 20 20 ALA CB C 20 18.832 18.832 19.573 -0.741 18703 3035 1 9 . 1 1 20 20 ALA H H 20 7.425 7.425 7.396 0.029 18703 3036 1 9 . 1 1 21 21 LEU N N 21 118.594 118.594 120.979 -2.385 18703 3037 1 9 . 1 1 21 21 LEU HA H 21 4.297 4.297 4.409 -0.112 18703 3038 1 9 . 1 1 21 21 LEU C C 21 177.784 177.784 177.836 -0.052 18703 3039 1 9 . 1 1 21 21 LEU CA C 21 55.750 55.750 55.296 0.454 18703 3040 1 9 . 1 1 21 21 LEU CB C 21 42.898 42.898 42.509 0.389 18703 3041 1 9 . 1 1 21 21 LEU H H 21 7.508 7.508 7.603 -0.095 18703 3042 1 9 . 1 1 22 22 GLY N N 22 106.650 106.650 111.716 -5.066 18703 3043 1 9 . 1 1 22 22 GLY C C 22 173.605 173.605 174.043 -0.438 18703 3044 1 9 . 1 1 22 22 GLY CA C 22 45.330 45.330 45.914 -0.584 18703 3045 1 9 . 1 1 22 22 GLY H H 22 7.814 7.814 8.536 -0.722 18703 3046 1 9 . 1 1 23 23 GLY N N 23 108.011 108.011 107.031 0.980 18703 3047 1 9 . 1 1 23 23 GLY C C 23 174.061 174.061 172.819 1.242 18703 3048 1 9 . 1 1 23 23 GLY CA C 23 44.772 44.772 44.822 -0.050 18703 3049 1 9 . 1 1 23 23 GLY H H 23 8.139 8.139 7.748 0.391 18703 3050 1 9 . 1 1 24 24 GLY N N 24 107.826 107.826 108.014 -0.188 18703 3051 1 9 . 1 1 24 24 GLY C C 24 175.046 175.046 173.622 1.424 18703 3052 1 9 . 1 1 24 24 GLY CA C 24 44.422 44.422 45.298 -0.876 18703 3053 1 9 . 1 1 24 24 GLY H H 24 8.497 8.497 7.754 0.743 18703 3054 1 9 . 1 1 25 25 GLY N N 25 108.830 108.830 106.523 2.307 18703 3055 1 9 . 1 1 25 25 GLY C C 25 176.272 176.272 175.933 0.339 18703 3056 1 9 . 1 1 25 25 GLY CA C 25 47.101 47.101 45.203 1.898 18703 3057 1 9 . 1 1 25 25 GLY H H 25 8.616 8.616 8.528 0.088 18703 3058 1 9 . 1 1 26 26 ARG N N 26 123.109 123.109 121.819 1.290 18703 3059 1 9 . 1 1 26 26 ARG HA H 26 4.283 4.283 4.091 0.192 18703 3060 1 9 . 1 1 26 26 ARG C C 26 177.848 177.848 178.414 -0.566 18703 3061 1 9 . 1 1 26 26 ARG CA C 26 57.663 57.663 58.028 -0.365 18703 3062 1 9 . 1 1 26 26 ARG CB C 26 29.811 29.811 29.514 0.297 18703 3063 1 9 . 1 1 26 26 ARG H H 26 8.770 8.770 8.391 0.379 18703 3064 1 9 . 1 1 27 27 ILE N N 27 118.104 118.104 116.774 1.330 18703 3065 1 9 . 1 1 27 27 ILE HA H 27 3.787 3.787 3.736 0.051 18703 3066 1 9 . 1 1 27 27 ILE C C 27 177.473 177.473 177.757 -0.284 18703 3067 1 9 . 1 1 27 27 ILE CA C 27 63.036 63.036 64.741 -1.705 18703 3068 1 9 . 1 1 27 27 ILE CB C 27 36.664 36.664 37.407 -0.743 18703 3069 1 9 . 1 1 27 27 ILE H H 27 7.708 7.708 8.240 -0.532 18703 3070 1 9 . 1 1 28 28 GLU N N 28 119.934 119.934 118.967 0.967 18703 3071 1 9 . 1 1 28 28 GLU HA H 28 3.954 3.954 3.901 0.053 18703 3072 1 9 . 1 1 28 28 GLU C C 28 179.514 179.514 178.563 0.951 18703 3073 1 9 . 1 1 28 28 GLU CA C 28 59.450 59.450 59.961 -0.511 18703 3074 1 9 . 1 1 28 28 GLU CB C 28 29.600 29.600 29.168 0.432 18703 3075 1 9 . 1 1 28 28 GLU H H 28 7.872 7.872 7.661 0.211 18703 3076 1 9 . 1 1 29 29 GLU N N 29 118.134 118.134 119.532 -1.398 18703 3077 1 9 . 1 1 29 29 GLU HA H 29 4.028 4.028 4.086 -0.058 18703 3078 1 9 . 1 1 29 29 GLU C C 29 179.182 179.182 179.040 0.142 18703 3079 1 9 . 1 1 29 29 GLU CA C 29 59.173 59.173 59.083 0.090 18703 3080 1 9 . 1 1 29 29 GLU CB C 29 29.503 29.503 29.328 0.175 18703 3081 1 9 . 1 1 29 29 GLU H H 29 8.166 8.166 7.733 0.433 18703 3082 1 9 . 1 1 30 30 LEU N N 30 120.242 120.242 117.488 2.754 18703 3083 1 9 . 1 1 30 30 LEU HA H 30 4.028 4.028 4.108 -0.080 18703 3084 1 9 . 1 1 30 30 LEU C C 30 178.796 178.796 178.686 0.110 18703 3085 1 9 . 1 1 30 30 LEU CA C 30 57.654 57.654 57.378 0.276 18703 3086 1 9 . 1 1 30 30 LEU CB C 30 41.629 41.629 41.865 -0.236 18703 3087 1 9 . 1 1 30 30 LEU H H 30 7.695 7.695 7.494 0.201 18703 3088 1 9 . 1 1 31 31 LYS N N 31 120.506 120.506 119.829 0.677 18703 3089 1 9 . 1 1 31 31 LYS HA H 31 3.532 3.532 4.062 -0.530 18703 3090 1 9 . 1 1 31 31 LYS C C 31 178.919 178.919 178.164 0.755 18703 3091 1 9 . 1 1 31 31 LYS CA C 31 60.240 60.240 59.193 1.048 18703 3092 1 9 . 1 1 31 31 LYS CB C 31 32.015 32.015 32.331 -0.316 18703 3093 1 9 . 1 1 31 31 LYS H H 31 8.561 8.561 7.724 0.837 18703 3094 1 9 . 1 1 32 32 LYS N N 32 118.566 118.566 119.030 -0.464 18703 3095 1 9 . 1 1 32 32 LYS C C 32 179.392 179.392 178.797 0.595 18703 3096 1 9 . 1 1 32 32 LYS CA C 32 59.356 59.356 59.822 -0.466 18703 3097 1 9 . 1 1 32 32 LYS CB C 32 32.117 32.117 32.451 -0.334 18703 3098 1 9 . 1 1 32 32 LYS H H 32 7.699 7.699 7.487 0.212 18703 3099 1 9 . 1 1 33 33 LYS N N 33 118.964 118.964 118.529 0.435 18703 3100 1 9 . 1 1 33 33 LYS HA H 33 4.117 4.117 4.067 0.050 18703 3101 1 9 . 1 1 33 33 LYS C C 33 178.355 178.355 178.705 -0.350 18703 3102 1 9 . 1 1 33 33 LYS CA C 33 58.633 58.633 59.255 -0.622 18703 3103 1 9 . 1 1 33 33 LYS CB C 33 31.904 31.904 32.231 -0.327 18703 3104 1 9 . 1 1 33 33 LYS H H 33 7.752 7.752 7.557 0.195 18703 3105 1 9 . 1 1 34 34 CYS N N 34 119.956 119.956 118.286 1.670 18703 3106 1 9 . 1 1 34 34 CYS HA H 34 3.967 3.967 4.099 -0.132 18703 3107 1 9 . 1 1 34 34 CYS C C 34 175.521 175.521 176.918 -1.397 18703 3108 1 9 . 1 1 34 34 CYS CA C 34 60.987 60.987 62.920 -1.933 18703 3109 1 9 . 1 1 34 34 CYS CB C 34 36.600 36.600 26.660 9.940 18703 3110 1 9 . 1 1 34 34 CYS H H 34 8.393 8.393 7.496 0.897 18703 3111 1 9 . 1 1 35 35 GLU N N 35 120.327 120.327 119.763 0.564 18703 3112 1 9 . 1 1 35 35 GLU HA H 35 3.891 3.891 3.905 -0.014 18703 3113 1 9 . 1 1 35 35 GLU C C 35 179.684 179.684 178.728 0.956 18703 3114 1 9 . 1 1 35 35 GLU CA C 35 60.059 60.059 59.289 0.770 18703 3115 1 9 . 1 1 35 35 GLU CB C 35 29.718 29.718 28.576 1.142 18703 3116 1 9 . 1 1 35 35 GLU H H 35 8.558 8.558 7.764 0.794 18703 3117 1 9 . 1 1 36 36 GLU N N 36 120.190 120.190 119.933 0.257 18703 3118 1 9 . 1 1 36 36 GLU HA H 36 4.051 4.051 4.002 0.049 18703 3119 1 9 . 1 1 36 36 GLU C C 36 179.408 179.408 178.973 0.435 18703 3120 1 9 . 1 1 36 36 GLU CA C 36 59.148 59.148 59.053 0.095 18703 3121 1 9 . 1 1 36 36 GLU CB C 36 29.766 29.766 29.753 0.013 18703 3122 1 9 . 1 1 36 36 GLU H H 36 8.038 8.038 7.604 0.434 18703 3123 1 9 . 1 1 37 37 LEU N N 37 121.102 121.102 119.597 1.505 18703 3124 1 9 . 1 1 37 37 LEU HA H 37 4.079 4.079 4.199 -0.120 18703 3125 1 9 . 1 1 37 37 LEU C C 37 178.279 178.279 178.334 -0.055 18703 3126 1 9 . 1 1 37 37 LEU CA C 37 57.803 57.803 57.422 0.381 18703 3127 1 9 . 1 1 37 37 LEU CB C 37 41.502 41.502 41.730 -0.228 18703 3128 1 9 . 1 1 37 37 LEU H H 37 8.065 8.065 7.471 0.594 18703 3129 1 9 . 1 1 38 38 LYS N N 38 119.980 119.980 119.195 0.785 18703 3130 1 9 . 1 1 38 38 LYS HA H 38 3.851 3.851 3.898 -0.047 18703 3131 1 9 . 1 1 38 38 LYS C C 38 178.919 178.919 179.163 -0.244 18703 3132 1 9 . 1 1 38 38 LYS CA C 38 60.794 60.794 59.681 1.113 18703 3133 1 9 . 1 1 38 38 LYS CB C 38 32.863 32.863 32.124 0.739 18703 3134 1 9 . 1 1 38 38 LYS H H 38 8.741 8.741 7.814 0.927 18703 3135 1 9 . 1 1 39 39 LYS N N 39 118.307 118.307 117.427 0.880 18703 3136 1 9 . 1 1 39 39 LYS HA H 39 4.125 4.125 3.898 0.227 18703 3137 1 9 . 1 1 39 39 LYS C C 39 178.622 178.622 178.412 0.210 18703 3138 1 9 . 1 1 39 39 LYS CA C 39 58.993 58.993 59.560 -0.567 18703 3139 1 9 . 1 1 39 39 LYS CB C 39 32.097 32.097 31.596 0.501 18703 3140 1 9 . 1 1 39 39 LYS H H 39 7.584 7.584 7.739 -0.155 18703 3141 1 9 . 1 1 40 40 LYS N N 40 118.826 118.826 119.374 -0.548 18703 3142 1 9 . 1 1 40 40 LYS HA H 40 4.069 4.069 4.154 -0.085 18703 3143 1 9 . 1 1 40 40 LYS C C 40 179.802 179.802 178.837 0.965 18703 3144 1 9 . 1 1 40 40 LYS CA C 40 59.322 59.322 58.838 0.484 18703 3145 1 9 . 1 1 40 40 LYS CB C 40 32.505 32.505 32.324 0.181 18703 3146 1 9 . 1 1 40 40 LYS H H 40 7.945 7.945 7.366 0.579 18703 3147 1 9 . 1 1 41 41 ILE N N 41 118.958 118.958 118.733 0.225 18703 3148 1 9 . 1 1 41 41 ILE HA H 41 3.659 3.659 3.800 -0.141 18703 3149 1 9 . 1 1 41 41 ILE C C 41 178.146 178.146 176.849 1.297 18703 3150 1 9 . 1 1 41 41 ILE CA C 41 65.037 65.037 64.091 0.946 18703 3151 1 9 . 1 1 41 41 ILE CB C 41 37.950 37.950 37.786 0.164 18703 3152 1 9 . 1 1 41 41 ILE H H 41 8.369 8.369 8.086 0.283 18703 3153 1 9 . 1 1 42 42 GLU N N 42 120.331 120.331 116.218 4.113 18703 3154 1 9 . 1 1 42 42 GLU HA H 42 4.094 4.094 4.114 -0.020 18703 3155 1 9 . 1 1 42 42 GLU C C 42 178.697 178.697 177.694 1.003 18703 3156 1 9 . 1 1 42 42 GLU CA C 42 58.927 58.927 58.434 0.493 18703 3157 1 9 . 1 1 42 42 GLU CB C 42 29.399 29.399 30.004 -0.605 18703 3158 1 9 . 1 1 42 42 GLU H H 42 7.805 7.805 7.656 0.149 18703 3159 1 9 . 1 1 43 43 GLU N N 43 117.120 117.120 116.810 0.310 18703 3160 1 9 . 1 1 43 43 GLU HA H 43 4.291 4.291 4.218 0.073 18703 3161 1 9 . 1 1 43 43 GLU C C 43 177.551 177.551 177.562 -0.011 18703 3162 1 9 . 1 1 43 43 GLU CA C 43 56.800 56.800 57.038 -0.238 18703 3163 1 9 . 1 1 43 43 GLU CB C 43 29.931 29.931 29.786 0.145 18703 3164 1 9 . 1 1 43 43 GLU H H 43 7.701 7.701 7.541 0.160 18703 3165 1 9 . 1 1 44 44 LEU N N 44 120.940 120.940 121.208 -0.268 18703 3166 1 9 . 1 1 44 44 LEU HA H 44 4.251 4.251 4.182 0.069 18703 3167 1 9 . 1 1 44 44 LEU C C 44 178.596 178.596 176.921 1.675 18703 3168 1 9 . 1 1 44 44 LEU CA C 44 56.448 56.448 55.562 0.886 18703 3169 1 9 . 1 1 44 44 LEU CB C 44 42.519 42.519 42.606 -0.087 18703 3170 1 9 . 1 1 44 44 LEU H H 44 7.581 7.581 7.356 0.225 18703 3171 1 9 . 1 1 45 45 GLY N N 45 108.689 108.689 108.422 0.267 18703 3172 1 9 . 1 1 45 45 GLY C C 45 174.853 174.853 174.354 0.499 18703 3173 1 9 . 1 1 45 45 GLY CA C 45 46.233 46.233 44.812 1.421 18703 3174 1 9 . 1 1 45 45 GLY H H 45 8.232 8.232 8.472 -0.240 18703 3175 1 9 . 1 1 46 46 GLY N N 46 108.029 108.029 110.035 -2.006 18703 3176 1 9 . 1 1 46 46 GLY C C 46 174.351 174.351 174.269 0.082 18703 3177 1 9 . 1 1 46 46 GLY CA C 46 45.105 45.105 45.063 0.042 18703 3178 1 9 . 1 1 46 46 GLY H H 46 8.176 8.176 8.142 0.034 18703 3179 1 9 . 1 1 47 47 GLY N N 47 108.183 108.183 107.147 1.036 18703 3180 1 9 . 1 1 47 47 GLY C C 47 174.671 174.671 174.532 0.139 18703 3181 1 9 . 1 1 47 47 GLY CA C 47 45.254 45.254 44.435 0.819 18703 3182 1 9 . 1 1 47 47 GLY H H 47 8.290 8.290 8.282 0.008 18703 3183 1 9 . 1 1 48 48 GLY N N 48 108.616 108.616 109.101 -0.485 18703 3184 1 9 . 1 1 48 48 GLY C C 48 174.321 174.321 175.167 -0.846 18703 3185 1 9 . 1 1 48 48 GLY CA C 48 45.192 45.192 45.809 -0.617 18703 3186 1 9 . 1 1 48 48 GLY H H 48 8.027 8.027 8.389 -0.362 18703 3187 1 9 . 1 1 49 49 GLU N N 49 121.057 121.057 121.417 -0.360 18703 3188 1 9 . 1 1 49 49 GLU HA H 49 4.425 4.425 4.480 -0.055 18703 3189 1 9 . 1 1 49 49 GLU C C 49 177.072 177.072 178.779 -1.707 18703 3190 1 9 . 1 1 49 49 GLU CA C 49 56.330 56.330 56.427 -0.097 18703 3191 1 9 . 1 1 49 49 GLU CB C 49 29.602 29.602 30.267 -0.665 18703 3192 1 9 . 1 1 49 49 GLU H H 49 8.486 8.486 8.178 0.308 18703 3193 1 9 . 1 1 50 50 VAL N N 50 122.122 122.122 121.159 0.963 18703 3194 1 9 . 1 1 50 50 VAL HA H 50 3.792 3.792 3.669 0.123 18703 3195 1 9 . 1 1 50 50 VAL C C 50 176.774 176.774 176.939 -0.165 18703 3196 1 9 . 1 1 50 50 VAL CA C 50 64.864 64.864 65.373 -0.509 18703 3197 1 9 . 1 1 50 50 VAL CB C 50 32.179 32.179 31.696 0.483 18703 3198 1 9 . 1 1 50 50 VAL H H 50 8.095 8.095 8.138 -0.043 18703 3199 1 9 . 1 1 51 51 LYS N N 51 120.602 120.602 118.701 1.901 18703 3200 1 9 . 1 1 51 51 LYS HA H 51 4.195 4.195 4.043 0.152 18703 3201 1 9 . 1 1 51 51 LYS C C 51 178.530 178.530 178.401 0.129 18703 3202 1 9 . 1 1 51 51 LYS CA C 51 59.348 59.348 59.177 0.171 18703 3203 1 9 . 1 1 51 51 LYS CB C 51 32.265 32.265 32.046 0.219 18703 3204 1 9 . 1 1 51 51 LYS H H 51 8.268 8.268 8.291 -0.023 18703 3205 1 9 . 1 1 52 52 LYS N N 52 117.547 117.547 120.049 -2.502 18703 3206 1 9 . 1 1 52 52 LYS HA H 52 4.162 4.162 4.058 0.104 18703 3207 1 9 . 1 1 52 52 LYS C C 52 179.132 179.132 179.124 0.008 18703 3208 1 9 . 1 1 52 52 LYS CA C 52 58.811 58.811 59.364 -0.553 18703 3209 1 9 . 1 1 52 52 LYS CB C 52 32.054 32.054 32.249 -0.195 18703 3210 1 9 . 1 1 52 52 LYS H H 52 7.595 7.595 7.742 -0.147 18703 3211 1 9 . 1 1 53 53 VAL N N 53 119.190 119.190 118.931 0.259 18703 3212 1 9 . 1 1 53 53 VAL HA H 53 3.767 3.767 3.909 -0.142 18703 3213 1 9 . 1 1 53 53 VAL C C 53 177.933 177.933 178.179 -0.246 18703 3214 1 9 . 1 1 53 53 VAL CA C 53 66.065 66.065 65.454 0.611 18703 3215 1 9 . 1 1 53 53 VAL CB C 53 31.248 31.248 30.942 0.306 18703 3216 1 9 . 1 1 53 53 VAL H H 53 7.597 7.597 7.627 -0.030 18703 3217 1 9 . 1 1 54 54 GLU N N 54 120.226 120.226 119.679 0.547 18703 3218 1 9 . 1 1 54 54 GLU HA H 54 3.833 3.833 3.970 -0.137 18703 3219 1 9 . 1 1 54 54 GLU C C 54 179.352 179.352 178.552 0.800 18703 3220 1 9 . 1 1 54 54 GLU CA C 54 59.153 59.153 59.434 -0.281 18703 3221 1 9 . 1 1 54 54 GLU CB C 54 29.224 29.224 29.477 -0.253 18703 3222 1 9 . 1 1 54 54 GLU H H 54 8.609 8.609 7.671 0.938 18703 3223 1 9 . 1 1 55 55 GLU N N 55 119.148 119.148 119.294 -0.146 18703 3224 1 9 . 1 1 55 55 GLU HA H 55 4.084 4.084 4.091 -0.007 18703 3225 1 9 . 1 1 55 55 GLU C C 55 179.084 179.084 178.948 0.136 18703 3226 1 9 . 1 1 55 55 GLU CA C 55 59.295 59.295 59.046 0.249 18703 3227 1 9 . 1 1 55 55 GLU CB C 55 29.361 29.361 29.607 -0.246 18703 3228 1 9 . 1 1 55 55 GLU H H 55 7.713 7.713 7.950 -0.237 18703 3229 1 9 . 1 1 56 56 GLU N N 56 120.301 120.301 118.944 1.357 18703 3230 1 9 . 1 1 56 56 GLU HA H 56 4.079 4.079 4.112 -0.033 18703 3231 1 9 . 1 1 56 56 GLU C C 56 179.773 179.773 179.260 0.513 18703 3232 1 9 . 1 1 56 56 GLU CA C 56 59.528 59.528 59.277 0.251 18703 3233 1 9 . 1 1 56 56 GLU CB C 56 30.162 30.162 29.617 0.544 18703 3234 1 9 . 1 1 56 56 GLU H H 56 7.899 7.899 7.594 0.305 18703 3235 1 9 . 1 1 57 57 VAL N N 57 121.536 121.536 119.455 2.081 18703 3236 1 9 . 1 1 57 57 VAL HA H 57 3.540 3.540 3.811 -0.271 18703 3237 1 9 . 1 1 57 57 VAL C C 57 176.984 176.984 177.296 -0.312 18703 3238 1 9 . 1 1 57 57 VAL CA C 57 66.734 66.734 65.874 0.860 18703 3239 1 9 . 1 1 57 57 VAL CB C 57 31.425 31.425 31.417 0.008 18703 3240 1 9 . 1 1 57 57 VAL H H 57 8.652 8.652 7.498 1.154 18703 3241 1 9 . 1 1 58 58 LYS N N 58 120.219 120.219 120.081 0.138 18703 3242 1 9 . 1 1 58 58 LYS HA H 58 4.199 4.199 4.074 0.125 18703 3243 1 9 . 1 1 58 58 LYS C C 58 178.972 178.972 178.381 0.591 18703 3244 1 9 . 1 1 58 58 LYS CA C 58 59.357 59.357 59.598 -0.241 18703 3245 1 9 . 1 1 58 58 LYS CB C 58 32.186 32.186 32.136 0.050 18703 3246 1 9 . 1 1 58 58 LYS H H 58 7.791 7.791 7.479 0.312 18703 3247 1 9 . 1 1 59 59 LYS N N 59 118.252 118.252 119.828 -1.576 18703 3248 1 9 . 1 1 59 59 LYS HA H 59 4.069 4.069 4.143 -0.074 18703 3249 1 9 . 1 1 59 59 LYS C C 59 179.180 179.180 178.718 0.462 18703 3250 1 9 . 1 1 59 59 LYS CA C 59 59.285 59.285 58.937 0.348 18703 3251 1 9 . 1 1 59 59 LYS CB C 59 32.345 32.345 32.513 -0.168 18703 3252 1 9 . 1 1 59 59 LYS H H 59 7.849 7.849 7.517 0.332 18703 3253 1 9 . 1 1 60 60 LEU N N 60 121.243 121.243 119.727 1.516 18703 3254 1 9 . 1 1 60 60 LEU HA H 60 4.242 4.242 4.149 0.093 18703 3255 1 9 . 1 1 60 60 LEU C C 60 178.413 178.413 178.143 0.270 18703 3256 1 9 . 1 1 60 60 LEU CA C 60 57.798 57.798 57.201 0.597 18703 3257 1 9 . 1 1 60 60 LEU CB C 60 41.150 41.150 42.185 -1.035 18703 3258 1 9 . 1 1 60 60 LEU H H 60 7.825 7.825 7.560 0.265 18703 3259 1 9 . 1 1 61 61 GLU N N 61 118.844 118.844 120.111 -1.267 18703 3260 1 9 . 1 1 61 61 GLU HA H 61 3.800 3.800 3.931 -0.131 18703 3261 1 9 . 1 1 61 61 GLU C C 61 179.078 179.078 178.580 0.498 18703 3262 1 9 . 1 1 61 61 GLU CA C 61 60.104 60.104 60.012 0.092 18703 3263 1 9 . 1 1 61 61 GLU CB C 61 29.864 29.864 29.639 0.225 18703 3264 1 9 . 1 1 61 61 GLU H H 61 8.582 8.582 7.718 0.864 18703 3265 1 9 . 1 1 62 62 GLU N N 62 117.659 117.659 118.506 -0.847 18703 3266 1 9 . 1 1 62 62 GLU HA H 62 3.990 3.990 4.104 -0.114 18703 3267 1 9 . 1 1 62 62 GLU C C 62 178.847 178.847 179.638 -0.791 18703 3268 1 9 . 1 1 62 62 GLU CA C 62 59.067 59.067 58.944 0.123 18703 3269 1 9 . 1 1 62 62 GLU CB C 62 29.440 29.440 29.602 -0.163 18703 3270 1 9 . 1 1 62 62 GLU H H 62 8.032 8.032 7.677 0.355 18703 3271 1 9 . 1 1 63 63 GLU N N 63 119.290 119.290 120.374 -1.084 18703 3272 1 9 . 1 1 63 63 GLU HA H 63 4.012 4.012 4.070 -0.058 18703 3273 1 9 . 1 1 63 63 GLU C C 63 179.784 179.784 178.873 0.911 18703 3274 1 9 . 1 1 63 63 GLU CA C 63 59.300 59.300 59.544 -0.243 18703 3275 1 9 . 1 1 63 63 GLU CB C 63 29.728 29.728 29.672 0.056 18703 3276 1 9 . 1 1 63 63 GLU H H 63 7.958 7.958 7.555 0.403 18703 3277 1 9 . 1 1 64 64 ILE N N 64 118.453 118.453 118.380 0.073 18703 3278 1 9 . 1 1 64 64 ILE HA H 64 3.711 3.711 3.802 -0.091 18703 3279 1 9 . 1 1 64 64 ILE C C 64 177.655 177.655 177.342 0.313 18703 3280 1 9 . 1 1 64 64 ILE CA C 64 64.256 64.256 63.811 0.445 18703 3281 1 9 . 1 1 64 64 ILE CB C 64 38.002 38.002 37.706 0.296 18703 3282 1 9 . 1 1 64 64 ILE H H 64 8.160 8.160 7.474 0.686 18703 3283 1 9 . 1 1 65 65 LYS N N 65 118.871 118.871 118.037 0.834 18703 3284 1 9 . 1 1 65 65 LYS HA H 65 4.111 4.111 4.153 -0.042 18703 3285 1 9 . 1 1 65 65 LYS C C 65 177.076 177.076 177.504 -0.428 18703 3286 1 9 . 1 1 65 65 LYS CA C 65 58.421 58.421 58.255 0.166 18703 3287 1 9 . 1 1 65 65 LYS CB C 65 32.639 32.639 32.268 0.371 18703 3288 1 9 . 1 1 65 65 LYS H H 65 7.664 7.664 7.621 0.043 18703 3289 1 9 . 1 1 66 66 LYS N N 66 116.944 116.944 118.654 -1.710 18703 3290 1 9 . 1 1 66 66 LYS HA H 66 4.320 4.320 4.095 0.225 18703 3291 1 9 . 1 1 66 66 LYS C C 66 175.897 175.897 177.769 -1.872 18703 3292 1 9 . 1 1 66 66 LYS CA C 66 56.352 56.352 58.100 -1.748 18703 3293 1 9 . 1 1 66 66 LYS CB C 66 33.024 33.024 32.706 0.318 18703 3294 1 9 . 1 1 66 66 LYS H H 66 7.246 7.246 7.519 -0.273 18703 3295 1 10 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.319 -0.073 18703 3296 1 10 . 1 1 3 3 ARG C C 3 178.379 178.379 176.955 1.424 18703 3297 1 10 . 1 1 3 3 ARG CA C 3 58.367 58.367 57.200 1.167 18703 3298 1 10 . 1 1 3 3 ARG CB C 3 30.691 30.691 30.645 0.046 18703 3299 1 10 . 1 1 3 3 ARG H H 3 7.905 7.905 8.517 -0.612 18703 3300 1 10 . 1 1 4 4 VAL N N 4 118.966 118.966 122.384 -3.418 18703 3301 1 10 . 1 1 4 4 VAL HA H 4 3.803 3.803 3.783 0.020 18703 3302 1 10 . 1 1 4 4 VAL C C 4 176.968 176.968 177.037 -0.069 18703 3303 1 10 . 1 1 4 4 VAL CA C 4 65.441 65.441 65.221 0.220 18703 3304 1 10 . 1 1 4 4 VAL CB C 4 31.710 31.710 31.393 0.317 18703 3305 1 10 . 1 1 4 4 VAL H H 4 8.070 8.070 8.454 -0.384 18703 3306 1 10 . 1 1 5 5 LYS N N 5 122.058 122.058 119.692 2.366 18703 3307 1 10 . 1 1 5 5 LYS HA H 5 4.154 4.154 4.229 -0.075 18703 3308 1 10 . 1 1 5 5 LYS C C 5 178.553 178.553 178.884 -0.331 18703 3309 1 10 . 1 1 5 5 LYS CA C 5 58.712 58.712 59.602 -0.890 18703 3310 1 10 . 1 1 5 5 LYS CB C 5 31.788 31.788 32.103 -0.315 18703 3311 1 10 . 1 1 5 5 LYS H H 5 7.798 7.798 8.397 -0.599 18703 3312 1 10 . 1 1 6 6 ALA N N 6 119.955 119.955 120.882 -0.927 18703 3313 1 10 . 1 1 6 6 ALA HA H 6 4.198 4.198 4.191 0.007 18703 3314 1 10 . 1 1 6 6 ALA C C 6 180.974 180.974 179.580 1.394 18703 3315 1 10 . 1 1 6 6 ALA CA C 6 54.850 54.850 54.423 0.426 18703 3316 1 10 . 1 1 6 6 ALA CB C 6 17.995 17.995 18.292 -0.297 18703 3317 1 10 . 1 1 6 6 ALA H H 6 7.928 7.928 7.618 0.310 18703 3318 1 10 . 1 1 7 7 LEU N N 7 119.211 119.211 118.031 1.180 18703 3319 1 10 . 1 1 7 7 LEU HA H 7 4.124 4.124 4.046 0.078 18703 3320 1 10 . 1 1 7 7 LEU C C 7 178.353 178.353 178.489 -0.136 18703 3321 1 10 . 1 1 7 7 LEU CA C 7 57.658 57.658 57.173 0.485 18703 3322 1 10 . 1 1 7 7 LEU CB C 7 41.971 41.971 42.094 -0.123 18703 3323 1 10 . 1 1 7 7 LEU H H 7 7.594 7.594 7.851 -0.257 18703 3324 1 10 . 1 1 8 8 GLU N N 8 120.258 120.258 118.232 2.026 18703 3325 1 10 . 1 1 8 8 GLU HA H 8 3.846 3.846 4.037 -0.191 18703 3326 1 10 . 1 1 8 8 GLU C C 8 179.546 179.546 178.735 0.811 18703 3327 1 10 . 1 1 8 8 GLU CA C 8 60.006 60.006 59.456 0.550 18703 3328 1 10 . 1 1 8 8 GLU CB C 8 29.683 29.683 29.598 0.085 18703 3329 1 10 . 1 1 8 8 GLU H H 8 8.382 8.382 7.574 0.808 18703 3330 1 10 . 1 1 9 9 GLU N N 9 118.584 118.584 119.021 -0.437 18703 3331 1 10 . 1 1 9 9 GLU HA H 9 4.039 4.039 4.088 -0.049 18703 3332 1 10 . 1 1 9 9 GLU C C 9 179.635 179.635 178.659 0.976 18703 3333 1 10 . 1 1 9 9 GLU CA C 9 59.235 59.235 58.711 0.524 18703 3334 1 10 . 1 1 9 9 GLU CB C 9 29.358 29.358 29.061 0.297 18703 3335 1 10 . 1 1 9 9 GLU H H 9 7.908 7.908 7.848 0.060 18703 3336 1 10 . 1 1 10 10 LYS N N 10 120.956 120.956 120.146 0.810 18703 3337 1 10 . 1 1 10 10 LYS HA H 10 4.190 4.190 4.108 0.082 18703 3338 1 10 . 1 1 10 10 LYS C C 10 179.395 179.395 178.977 0.418 18703 3339 1 10 . 1 1 10 10 LYS CA C 10 59.231 59.231 59.330 -0.099 18703 3340 1 10 . 1 1 10 10 LYS CB C 10 32.211 32.211 32.563 -0.352 18703 3341 1 10 . 1 1 10 10 LYS H H 10 8.009 8.009 7.400 0.609 18703 3342 1 10 . 1 1 11 11 VAL N N 11 119.577 119.577 118.378 1.199 18703 3343 1 10 . 1 1 11 11 VAL HA H 11 3.844 3.844 3.612 0.232 18703 3344 1 10 . 1 1 11 11 VAL C C 11 177.078 177.078 177.344 -0.266 18703 3345 1 10 . 1 1 11 11 VAL CA C 11 66.407 66.407 66.237 0.170 18703 3346 1 10 . 1 1 11 11 VAL CB C 11 31.252 31.252 31.369 -0.117 18703 3347 1 10 . 1 1 11 11 VAL H H 11 8.488 8.488 7.438 1.050 18703 3348 1 10 . 1 1 12 12 LYS N N 12 122.864 122.864 119.504 3.360 18703 3349 1 10 . 1 1 12 12 LYS HA H 12 4.189 4.189 3.953 0.236 18703 3350 1 10 . 1 1 12 12 LYS C C 12 178.755 178.755 178.330 0.425 18703 3351 1 10 . 1 1 12 12 LYS CA C 12 59.375 59.375 59.852 -0.477 18703 3352 1 10 . 1 1 12 12 LYS CB C 12 31.991 31.991 32.238 -0.247 18703 3353 1 10 . 1 1 12 12 LYS H H 12 7.944 7.944 7.616 0.328 18703 3354 1 10 . 1 1 13 13 ALA N N 13 121.202 121.202 120.738 0.464 18703 3355 1 10 . 1 1 13 13 ALA HA H 13 4.209 4.209 4.250 -0.041 18703 3356 1 10 . 1 1 13 13 ALA C C 13 181.060 181.060 179.550 1.510 18703 3357 1 10 . 1 1 13 13 ALA CA C 13 54.710 54.710 54.222 0.488 18703 3358 1 10 . 1 1 13 13 ALA CB C 13 17.861 17.861 18.347 -0.486 18703 3359 1 10 . 1 1 13 13 ALA H H 13 7.563 7.563 7.414 0.149 18703 3360 1 10 . 1 1 14 14 LEU N N 14 120.014 120.014 119.565 0.449 18703 3361 1 10 . 1 1 14 14 LEU HA H 14 4.072 4.072 4.005 0.067 18703 3362 1 10 . 1 1 14 14 LEU C C 14 177.862 177.862 178.297 -0.435 18703 3363 1 10 . 1 1 14 14 LEU CA C 14 57.864 57.864 57.430 0.434 18703 3364 1 10 . 1 1 14 14 LEU CB C 14 41.539 41.539 42.070 -0.531 18703 3365 1 10 . 1 1 14 14 LEU H H 14 8.087 8.087 7.510 0.577 18703 3366 1 10 . 1 1 15 15 GLU N N 15 121.644 121.644 120.139 1.505 18703 3367 1 10 . 1 1 15 15 GLU HA H 15 3.692 3.692 4.025 -0.333 18703 3368 1 10 . 1 1 15 15 GLU C C 15 177.819 177.819 178.333 -0.514 18703 3369 1 10 . 1 1 15 15 GLU CA C 15 59.239 59.239 59.223 0.016 18703 3370 1 10 . 1 1 15 15 GLU CB C 15 28.865 28.865 29.609 -0.744 18703 3371 1 10 . 1 1 15 15 GLU H H 15 8.542 8.542 7.665 0.877 18703 3372 1 10 . 1 1 16 16 GLU N N 16 116.016 116.016 118.778 -2.762 18703 3373 1 10 . 1 1 16 16 GLU HA H 16 3.955 3.955 3.973 -0.018 18703 3374 1 10 . 1 1 16 16 GLU C C 16 179.159 179.159 179.111 0.048 18703 3375 1 10 . 1 1 16 16 GLU CA C 16 59.324 59.324 59.264 0.060 18703 3376 1 10 . 1 1 16 16 GLU CB C 16 29.060 29.060 29.322 -0.262 18703 3377 1 10 . 1 1 16 16 GLU H H 16 7.492 7.492 7.815 -0.323 18703 3378 1 10 . 1 1 17 17 LYS N N 17 118.546 118.546 118.786 -0.240 18703 3379 1 10 . 1 1 17 17 LYS HA H 17 4.117 4.117 4.135 -0.018 18703 3380 1 10 . 1 1 17 17 LYS C C 17 178.976 178.976 178.582 0.394 18703 3381 1 10 . 1 1 17 17 LYS CA C 17 58.837 58.837 58.934 -0.097 18703 3382 1 10 . 1 1 17 17 LYS CB C 17 32.538 32.538 32.568 -0.030 18703 3383 1 10 . 1 1 17 17 LYS H H 17 7.720 7.720 7.485 0.235 18703 3384 1 10 . 1 1 18 18 VAL N N 18 118.376 118.376 119.251 -0.875 18703 3385 1 10 . 1 1 18 18 VAL HA H 18 3.711 3.711 3.754 -0.043 18703 3386 1 10 . 1 1 18 18 VAL C C 18 178.765 178.765 178.427 0.338 18703 3387 1 10 . 1 1 18 18 VAL CA C 18 66.237 66.237 65.747 0.490 18703 3388 1 10 . 1 1 18 18 VAL CB C 18 31.682 31.682 31.835 -0.153 18703 3389 1 10 . 1 1 18 18 VAL H H 18 8.754 8.754 7.390 1.364 18703 3390 1 10 . 1 1 19 19 LYS N N 19 118.817 118.817 118.459 0.358 18703 3391 1 10 . 1 1 19 19 LYS HA H 19 4.078 4.078 4.015 0.063 18703 3392 1 10 . 1 1 19 19 LYS C C 19 178.049 178.049 177.511 0.538 18703 3393 1 10 . 1 1 19 19 LYS CA C 19 59.731 59.731 58.973 0.758 18703 3394 1 10 . 1 1 19 19 LYS CB C 19 32.523 32.523 32.122 0.401 18703 3395 1 10 . 1 1 19 19 LYS H H 19 8.299 8.299 8.463 -0.164 18703 3396 1 10 . 1 1 20 20 ALA N N 20 119.656 119.656 118.920 0.736 18703 3397 1 10 . 1 1 20 20 ALA HA H 20 4.347 4.347 4.354 -0.007 18703 3398 1 10 . 1 1 20 20 ALA C C 20 178.532 178.532 177.762 0.770 18703 3399 1 10 . 1 1 20 20 ALA CA C 20 52.853 52.853 52.517 0.336 18703 3400 1 10 . 1 1 20 20 ALA CB C 20 18.832 18.832 19.880 -1.048 18703 3401 1 10 . 1 1 20 20 ALA H H 20 7.425 7.425 7.587 -0.162 18703 3402 1 10 . 1 1 21 21 LEU N N 21 118.594 118.594 117.599 0.995 18703 3403 1 10 . 1 1 21 21 LEU HA H 21 4.297 4.297 4.679 -0.382 18703 3404 1 10 . 1 1 21 21 LEU C C 21 177.784 177.784 175.513 2.271 18703 3405 1 10 . 1 1 21 21 LEU CA C 21 55.750 55.750 54.628 1.122 18703 3406 1 10 . 1 1 21 21 LEU CB C 21 42.898 42.898 44.074 -1.176 18703 3407 1 10 . 1 1 21 21 LEU H H 21 7.508 7.508 7.498 0.010 18703 3408 1 10 . 1 1 22 22 GLY N N 22 106.650 106.650 105.419 1.231 18703 3409 1 10 . 1 1 22 22 GLY C C 22 173.605 173.605 173.581 0.024 18703 3410 1 10 . 1 1 22 22 GLY CA C 22 45.330 45.330 44.870 0.460 18703 3411 1 10 . 1 1 22 22 GLY H H 22 7.814 7.814 7.962 -0.148 18703 3412 1 10 . 1 1 23 23 GLY N N 23 108.011 108.011 107.937 0.074 18703 3413 1 10 . 1 1 23 23 GLY C C 23 174.061 174.061 174.671 -0.610 18703 3414 1 10 . 1 1 23 23 GLY CA C 23 44.772 44.772 45.582 -0.810 18703 3415 1 10 . 1 1 23 23 GLY H H 23 8.139 8.139 10.156 -2.017 18703 3416 1 10 . 1 1 24 24 GLY N N 24 107.826 107.826 109.550 -1.724 18703 3417 1 10 . 1 1 24 24 GLY C C 24 175.046 175.046 174.961 0.085 18703 3418 1 10 . 1 1 24 24 GLY CA C 24 44.422 44.422 44.575 -0.153 18703 3419 1 10 . 1 1 24 24 GLY H H 24 8.497 8.497 7.967 0.530 18703 3420 1 10 . 1 1 25 25 GLY N N 25 108.830 108.830 106.651 2.179 18703 3421 1 10 . 1 1 25 25 GLY C C 25 176.272 176.272 175.805 0.467 18703 3422 1 10 . 1 1 25 25 GLY CA C 25 47.101 47.101 45.608 1.494 18703 3423 1 10 . 1 1 25 25 GLY H H 25 8.616 8.616 8.436 0.180 18703 3424 1 10 . 1 1 26 26 ARG N N 26 123.109 123.109 121.293 1.816 18703 3425 1 10 . 1 1 26 26 ARG HA H 26 4.283 4.283 4.098 0.185 18703 3426 1 10 . 1 1 26 26 ARG C C 26 177.848 177.848 178.422 -0.574 18703 3427 1 10 . 1 1 26 26 ARG CA C 26 57.663 57.663 58.153 -0.490 18703 3428 1 10 . 1 1 26 26 ARG CB C 26 29.811 29.811 29.930 -0.119 18703 3429 1 10 . 1 1 26 26 ARG H H 26 8.770 8.770 8.523 0.247 18703 3430 1 10 . 1 1 27 27 ILE N N 27 118.104 118.104 118.270 -0.166 18703 3431 1 10 . 1 1 27 27 ILE HA H 27 3.787 3.787 3.775 0.012 18703 3432 1 10 . 1 1 27 27 ILE C C 27 177.473 177.473 177.864 -0.391 18703 3433 1 10 . 1 1 27 27 ILE CA C 27 63.036 63.036 64.276 -1.240 18703 3434 1 10 . 1 1 27 27 ILE CB C 27 36.664 36.664 37.584 -0.919 18703 3435 1 10 . 1 1 27 27 ILE H H 27 7.708 7.708 7.740 -0.032 18703 3436 1 10 . 1 1 28 28 GLU N N 28 119.934 119.934 119.529 0.405 18703 3437 1 10 . 1 1 28 28 GLU HA H 28 3.954 3.954 3.936 0.018 18703 3438 1 10 . 1 1 28 28 GLU C C 28 179.514 179.514 178.699 0.815 18703 3439 1 10 . 1 1 28 28 GLU CA C 28 59.450 59.450 59.835 -0.385 18703 3440 1 10 . 1 1 28 28 GLU CB C 28 29.600 29.600 29.270 0.330 18703 3441 1 10 . 1 1 28 28 GLU H H 28 7.872 7.872 7.738 0.134 18703 3442 1 10 . 1 1 29 29 GLU N N 29 118.134 118.134 119.603 -1.469 18703 3443 1 10 . 1 1 29 29 GLU HA H 29 4.028 4.028 4.110 -0.082 18703 3444 1 10 . 1 1 29 29 GLU C C 29 179.182 179.182 179.333 -0.151 18703 3445 1 10 . 1 1 29 29 GLU CA C 29 59.173 59.173 59.017 0.156 18703 3446 1 10 . 1 1 29 29 GLU CB C 29 29.503 29.503 29.430 0.073 18703 3447 1 10 . 1 1 29 29 GLU H H 29 8.166 8.166 7.616 0.550 18703 3448 1 10 . 1 1 30 30 LEU N N 30 120.242 120.242 117.484 2.758 18703 3449 1 10 . 1 1 30 30 LEU HA H 30 4.028 4.028 4.191 -0.163 18703 3450 1 10 . 1 1 30 30 LEU C C 30 178.796 178.796 178.652 0.144 18703 3451 1 10 . 1 1 30 30 LEU CA C 30 57.654 57.654 56.654 1.000 18703 3452 1 10 . 1 1 30 30 LEU CB C 30 41.629 41.629 41.785 -0.156 18703 3453 1 10 . 1 1 30 30 LEU H H 30 7.695 7.695 7.524 0.171 18703 3454 1 10 . 1 1 31 31 LYS N N 31 120.506 120.506 120.637 -0.131 18703 3455 1 10 . 1 1 31 31 LYS HA H 31 3.532 3.532 4.045 -0.513 18703 3456 1 10 . 1 1 31 31 LYS C C 31 178.919 178.919 178.253 0.666 18703 3457 1 10 . 1 1 31 31 LYS CA C 31 60.240 60.240 59.363 0.877 18703 3458 1 10 . 1 1 31 31 LYS CB C 31 32.015 32.015 32.322 -0.307 18703 3459 1 10 . 1 1 31 31 LYS H H 31 8.561 8.561 7.761 0.800 18703 3460 1 10 . 1 1 32 32 LYS N N 32 118.566 118.566 118.282 0.284 18703 3461 1 10 . 1 1 32 32 LYS C C 32 179.392 179.392 179.144 0.248 18703 3462 1 10 . 1 1 32 32 LYS CA C 32 59.356 59.356 59.795 -0.439 18703 3463 1 10 . 1 1 32 32 LYS CB C 32 32.117 32.117 32.419 -0.302 18703 3464 1 10 . 1 1 32 32 LYS H H 32 7.699 7.699 7.605 0.094 18703 3465 1 10 . 1 1 33 33 LYS N N 33 118.964 118.964 117.963 1.001 18703 3466 1 10 . 1 1 33 33 LYS HA H 33 4.117 4.117 4.232 -0.115 18703 3467 1 10 . 1 1 33 33 LYS C C 33 178.355 178.355 178.139 0.216 18703 3468 1 10 . 1 1 33 33 LYS CA C 33 58.633 58.633 57.690 0.943 18703 3469 1 10 . 1 1 33 33 LYS CB C 33 31.904 31.904 32.032 -0.128 18703 3470 1 10 . 1 1 33 33 LYS H H 33 7.752 7.752 7.611 0.141 18703 3471 1 10 . 1 1 34 34 CYS N N 34 119.956 119.956 119.255 0.701 18703 3472 1 10 . 1 1 34 34 CYS HA H 34 3.967 3.967 4.124 -0.157 18703 3473 1 10 . 1 1 34 34 CYS C C 34 175.521 175.521 176.634 -1.113 18703 3474 1 10 . 1 1 34 34 CYS CA C 34 60.987 60.987 63.097 -2.111 18703 3475 1 10 . 1 1 34 34 CYS CB C 34 36.600 36.600 26.739 9.861 18703 3476 1 10 . 1 1 34 34 CYS H H 34 8.393 8.393 7.632 0.761 18703 3477 1 10 . 1 1 35 35 GLU N N 35 120.327 120.327 119.534 0.793 18703 3478 1 10 . 1 1 35 35 GLU HA H 35 3.891 3.891 3.934 -0.043 18703 3479 1 10 . 1 1 35 35 GLU C C 35 179.684 179.684 178.417 1.267 18703 3480 1 10 . 1 1 35 35 GLU CA C 35 60.059 60.059 59.367 0.692 18703 3481 1 10 . 1 1 35 35 GLU CB C 35 29.718 29.718 28.818 0.900 18703 3482 1 10 . 1 1 35 35 GLU H H 35 8.558 8.558 7.933 0.625 18703 3483 1 10 . 1 1 36 36 GLU N N 36 120.190 120.190 119.977 0.213 18703 3484 1 10 . 1 1 36 36 GLU HA H 36 4.051 4.051 4.010 0.041 18703 3485 1 10 . 1 1 36 36 GLU C C 36 179.408 179.408 178.883 0.525 18703 3486 1 10 . 1 1 36 36 GLU CA C 36 59.148 59.148 58.757 0.391 18703 3487 1 10 . 1 1 36 36 GLU CB C 36 29.766 29.766 29.737 0.029 18703 3488 1 10 . 1 1 36 36 GLU H H 36 8.038 8.038 7.631 0.407 18703 3489 1 10 . 1 1 37 37 LEU N N 37 121.102 121.102 119.723 1.379 18703 3490 1 10 . 1 1 37 37 LEU HA H 37 4.079 4.079 4.188 -0.109 18703 3491 1 10 . 1 1 37 37 LEU C C 37 178.279 178.279 178.318 -0.039 18703 3492 1 10 . 1 1 37 37 LEU CA C 37 57.803 57.803 57.514 0.290 18703 3493 1 10 . 1 1 37 37 LEU CB C 37 41.502 41.502 41.733 -0.231 18703 3494 1 10 . 1 1 37 37 LEU H H 37 8.065 8.065 7.451 0.614 18703 3495 1 10 . 1 1 38 38 LYS N N 38 119.980 119.980 119.098 0.882 18703 3496 1 10 . 1 1 38 38 LYS HA H 38 3.851 3.851 3.870 -0.019 18703 3497 1 10 . 1 1 38 38 LYS C C 38 178.919 178.919 179.129 -0.210 18703 3498 1 10 . 1 1 38 38 LYS CA C 38 60.794 60.794 59.861 0.933 18703 3499 1 10 . 1 1 38 38 LYS CB C 38 32.863 32.863 32.178 0.685 18703 3500 1 10 . 1 1 38 38 LYS H H 38 8.741 8.741 7.596 1.145 18703 3501 1 10 . 1 1 39 39 LYS N N 39 118.307 118.307 117.384 0.923 18703 3502 1 10 . 1 1 39 39 LYS HA H 39 4.125 4.125 4.123 0.002 18703 3503 1 10 . 1 1 39 39 LYS C C 39 178.622 178.622 178.318 0.304 18703 3504 1 10 . 1 1 39 39 LYS CA C 39 58.993 58.993 59.255 -0.262 18703 3505 1 10 . 1 1 39 39 LYS CB C 39 32.097 32.097 31.967 0.130 18703 3506 1 10 . 1 1 39 39 LYS H H 39 7.584 7.584 7.689 -0.105 18703 3507 1 10 . 1 1 40 40 LYS N N 40 118.826 118.826 119.571 -0.745 18703 3508 1 10 . 1 1 40 40 LYS HA H 40 4.069 4.069 4.447 -0.378 18703 3509 1 10 . 1 1 40 40 LYS C C 40 179.802 179.802 178.499 1.303 18703 3510 1 10 . 1 1 40 40 LYS CA C 40 59.322 59.322 58.571 0.751 18703 3511 1 10 . 1 1 40 40 LYS CB C 40 32.505 32.505 32.255 0.250 18703 3512 1 10 . 1 1 40 40 LYS H H 40 7.945 7.945 7.360 0.585 18703 3513 1 10 . 1 1 41 41 ILE N N 41 118.958 118.958 118.271 0.687 18703 3514 1 10 . 1 1 41 41 ILE HA H 41 3.659 3.659 3.776 -0.117 18703 3515 1 10 . 1 1 41 41 ILE C C 41 178.146 178.146 176.945 1.201 18703 3516 1 10 . 1 1 41 41 ILE CA C 41 65.037 65.037 64.014 1.023 18703 3517 1 10 . 1 1 41 41 ILE CB C 41 37.950 37.950 37.851 0.099 18703 3518 1 10 . 1 1 41 41 ILE H H 41 8.369 8.369 8.026 0.343 18703 3519 1 10 . 1 1 42 42 GLU N N 42 120.331 120.331 117.309 3.022 18703 3520 1 10 . 1 1 42 42 GLU HA H 42 4.094 4.094 4.019 0.075 18703 3521 1 10 . 1 1 42 42 GLU C C 42 178.697 178.697 177.964 0.733 18703 3522 1 10 . 1 1 42 42 GLU CA C 42 58.927 58.927 59.055 -0.128 18703 3523 1 10 . 1 1 42 42 GLU CB C 42 29.399 29.399 30.059 -0.660 18703 3524 1 10 . 1 1 42 42 GLU H H 42 7.805 7.805 7.640 0.165 18703 3525 1 10 . 1 1 43 43 GLU N N 43 117.120 117.120 117.093 0.027 18703 3526 1 10 . 1 1 43 43 GLU HA H 43 4.291 4.291 4.109 0.182 18703 3527 1 10 . 1 1 43 43 GLU C C 43 177.551 177.551 177.607 -0.056 18703 3528 1 10 . 1 1 43 43 GLU CA C 43 56.800 56.800 57.188 -0.388 18703 3529 1 10 . 1 1 43 43 GLU CB C 43 29.931 29.931 29.775 0.156 18703 3530 1 10 . 1 1 43 43 GLU H H 43 7.701 7.701 7.665 0.036 18703 3531 1 10 . 1 1 44 44 LEU N N 44 120.940 120.940 119.795 1.145 18703 3532 1 10 . 1 1 44 44 LEU HA H 44 4.251 4.251 4.069 0.182 18703 3533 1 10 . 1 1 44 44 LEU C C 44 178.596 178.596 178.122 0.474 18703 3534 1 10 . 1 1 44 44 LEU CA C 44 56.448 56.448 55.875 0.573 18703 3535 1 10 . 1 1 44 44 LEU CB C 44 42.519 42.519 42.391 0.128 18703 3536 1 10 . 1 1 44 44 LEU H H 44 7.581 7.581 7.361 0.220 18703 3537 1 10 . 1 1 45 45 GLY N N 45 108.689 108.689 105.860 2.829 18703 3538 1 10 . 1 1 45 45 GLY C C 45 174.853 174.853 173.346 1.507 18703 3539 1 10 . 1 1 45 45 GLY CA C 45 46.233 46.233 45.488 0.745 18703 3540 1 10 . 1 1 45 45 GLY H H 45 8.232 8.232 8.521 -0.289 18703 3541 1 10 . 1 1 46 46 GLY N N 46 108.029 108.029 107.838 0.191 18703 3542 1 10 . 1 1 46 46 GLY C C 46 174.351 174.351 173.929 0.422 18703 3543 1 10 . 1 1 46 46 GLY CA C 46 45.105 45.105 44.998 0.107 18703 3544 1 10 . 1 1 46 46 GLY H H 46 8.176 8.176 7.743 0.433 18703 3545 1 10 . 1 1 47 47 GLY N N 47 108.183 108.183 108.487 -0.304 18703 3546 1 10 . 1 1 47 47 GLY C C 47 174.671 174.671 175.286 -0.615 18703 3547 1 10 . 1 1 47 47 GLY CA C 47 45.254 45.254 46.134 -0.880 18703 3548 1 10 . 1 1 47 47 GLY H H 47 8.290 8.290 9.238 -0.948 18703 3549 1 10 . 1 1 48 48 GLY N N 48 108.616 108.616 109.019 -0.403 18703 3550 1 10 . 1 1 48 48 GLY C C 48 174.321 174.321 175.193 -0.872 18703 3551 1 10 . 1 1 48 48 GLY CA C 48 45.192 45.192 45.366 -0.174 18703 3552 1 10 . 1 1 48 48 GLY H H 48 8.027 8.027 7.972 0.055 18703 3553 1 10 . 1 1 49 49 GLU N N 49 121.057 121.057 122.141 -1.084 18703 3554 1 10 . 1 1 49 49 GLU HA H 49 4.425 4.425 4.308 0.117 18703 3555 1 10 . 1 1 49 49 GLU C C 49 177.072 177.072 177.453 -0.381 18703 3556 1 10 . 1 1 49 49 GLU CA C 49 56.330 56.330 57.784 -1.454 18703 3557 1 10 . 1 1 49 49 GLU CB C 49 29.602 29.602 29.739 -0.137 18703 3558 1 10 . 1 1 49 49 GLU H H 49 8.486 8.486 8.784 -0.298 18703 3559 1 10 . 1 1 50 50 VAL N N 50 122.122 122.122 119.174 2.948 18703 3560 1 10 . 1 1 50 50 VAL HA H 50 3.792 3.792 3.742 0.050 18703 3561 1 10 . 1 1 50 50 VAL C C 50 176.774 176.774 177.593 -0.819 18703 3562 1 10 . 1 1 50 50 VAL CA C 50 64.864 64.864 64.617 0.247 18703 3563 1 10 . 1 1 50 50 VAL CB C 50 32.179 32.179 31.138 1.041 18703 3564 1 10 . 1 1 50 50 VAL H H 50 8.095 8.095 7.924 0.171 18703 3565 1 10 . 1 1 51 51 LYS N N 51 120.602 120.602 120.134 0.468 18703 3566 1 10 . 1 1 51 51 LYS HA H 51 4.195 4.195 4.045 0.150 18703 3567 1 10 . 1 1 51 51 LYS C C 51 178.530 178.530 178.218 0.312 18703 3568 1 10 . 1 1 51 51 LYS CA C 51 59.348 59.348 59.854 -0.506 18703 3569 1 10 . 1 1 51 51 LYS CB C 51 32.265 32.265 32.508 -0.243 18703 3570 1 10 . 1 1 51 51 LYS H H 51 8.268 8.268 7.810 0.458 18703 3571 1 10 . 1 1 52 52 LYS N N 52 117.547 117.547 118.676 -1.129 18703 3572 1 10 . 1 1 52 52 LYS HA H 52 4.162 4.162 4.081 0.081 18703 3573 1 10 . 1 1 52 52 LYS C C 52 179.132 179.132 179.309 -0.177 18703 3574 1 10 . 1 1 52 52 LYS CA C 52 58.811 58.811 58.995 -0.183 18703 3575 1 10 . 1 1 52 52 LYS CB C 52 32.054 32.054 31.552 0.502 18703 3576 1 10 . 1 1 52 52 LYS H H 52 7.595 7.595 7.754 -0.159 18703 3577 1 10 . 1 1 53 53 VAL N N 53 119.190 119.190 120.370 -1.180 18703 3578 1 10 . 1 1 53 53 VAL HA H 53 3.767 3.767 3.661 0.106 18703 3579 1 10 . 1 1 53 53 VAL C C 53 177.933 177.933 177.924 0.009 18703 3580 1 10 . 1 1 53 53 VAL CA C 53 66.065 66.065 66.651 -0.586 18703 3581 1 10 . 1 1 53 53 VAL CB C 53 31.248 31.248 31.267 -0.019 18703 3582 1 10 . 1 1 53 53 VAL H H 53 7.597 7.597 7.676 -0.079 18703 3583 1 10 . 1 1 54 54 GLU N N 54 120.226 120.226 118.494 1.732 18703 3584 1 10 . 1 1 54 54 GLU HA H 54 3.833 3.833 4.013 -0.180 18703 3585 1 10 . 1 1 54 54 GLU C C 54 179.352 179.352 178.783 0.569 18703 3586 1 10 . 1 1 54 54 GLU CA C 54 59.153 59.153 59.275 -0.122 18703 3587 1 10 . 1 1 54 54 GLU CB C 54 29.224 29.224 29.280 -0.056 18703 3588 1 10 . 1 1 54 54 GLU H H 54 8.609 8.609 7.734 0.875 18703 3589 1 10 . 1 1 55 55 GLU N N 55 119.148 119.148 119.278 -0.130 18703 3590 1 10 . 1 1 55 55 GLU HA H 55 4.084 4.084 4.141 -0.057 18703 3591 1 10 . 1 1 55 55 GLU C C 55 179.084 179.084 178.700 0.384 18703 3592 1 10 . 1 1 55 55 GLU CA C 55 59.295 59.295 58.815 0.480 18703 3593 1 10 . 1 1 55 55 GLU CB C 55 29.361 29.361 29.761 -0.400 18703 3594 1 10 . 1 1 55 55 GLU H H 55 7.713 7.713 7.882 -0.169 18703 3595 1 10 . 1 1 56 56 GLU N N 56 120.301 120.301 119.071 1.230 18703 3596 1 10 . 1 1 56 56 GLU HA H 56 4.079 4.079 4.116 -0.037 18703 3597 1 10 . 1 1 56 56 GLU C C 56 179.773 179.773 179.224 0.549 18703 3598 1 10 . 1 1 56 56 GLU CA C 56 59.528 59.528 59.248 0.279 18703 3599 1 10 . 1 1 56 56 GLU CB C 56 30.162 30.162 29.820 0.342 18703 3600 1 10 . 1 1 56 56 GLU H H 56 7.899 7.899 7.551 0.348 18703 3601 1 10 . 1 1 57 57 VAL N N 57 121.536 121.536 118.084 3.452 18703 3602 1 10 . 1 1 57 57 VAL HA H 57 3.540 3.540 3.765 -0.225 18703 3603 1 10 . 1 1 57 57 VAL C C 57 176.984 176.984 177.398 -0.414 18703 3604 1 10 . 1 1 57 57 VAL CA C 57 66.734 66.734 65.529 1.205 18703 3605 1 10 . 1 1 57 57 VAL CB C 57 31.425 31.425 31.646 -0.221 18703 3606 1 10 . 1 1 57 57 VAL H H 57 8.652 8.652 7.553 1.099 18703 3607 1 10 . 1 1 58 58 LYS N N 58 120.219 120.219 119.969 0.250 18703 3608 1 10 . 1 1 58 58 LYS HA H 58 4.199 4.199 4.096 0.103 18703 3609 1 10 . 1 1 58 58 LYS C C 58 178.972 178.972 178.489 0.483 18703 3610 1 10 . 1 1 58 58 LYS CA C 58 59.357 59.357 59.018 0.339 18703 3611 1 10 . 1 1 58 58 LYS CB C 58 32.186 32.186 32.040 0.146 18703 3612 1 10 . 1 1 58 58 LYS H H 58 7.791 7.791 7.412 0.379 18703 3613 1 10 . 1 1 59 59 LYS N N 59 118.252 118.252 119.492 -1.240 18703 3614 1 10 . 1 1 59 59 LYS HA H 59 4.069 4.069 4.163 -0.094 18703 3615 1 10 . 1 1 59 59 LYS C C 59 179.180 179.180 178.606 0.574 18703 3616 1 10 . 1 1 59 59 LYS CA C 59 59.285 59.285 59.059 0.226 18703 3617 1 10 . 1 1 59 59 LYS CB C 59 32.345 32.345 32.203 0.142 18703 3618 1 10 . 1 1 59 59 LYS H H 59 7.849 7.849 7.502 0.347 18703 3619 1 10 . 1 1 60 60 LEU N N 60 121.243 121.243 120.360 0.883 18703 3620 1 10 . 1 1 60 60 LEU HA H 60 4.242 4.242 4.437 -0.195 18703 3621 1 10 . 1 1 60 60 LEU C C 60 178.413 178.413 178.584 -0.171 18703 3622 1 10 . 1 1 60 60 LEU CA C 60 57.798 57.798 57.016 0.782 18703 3623 1 10 . 1 1 60 60 LEU CB C 60 41.150 41.150 42.238 -1.088 18703 3624 1 10 . 1 1 60 60 LEU H H 60 7.825 7.825 7.592 0.233 18703 3625 1 10 . 1 1 61 61 GLU N N 61 118.844 118.844 120.165 -1.321 18703 3626 1 10 . 1 1 61 61 GLU HA H 61 3.800 3.800 3.921 -0.121 18703 3627 1 10 . 1 1 61 61 GLU C C 61 179.078 179.078 178.566 0.512 18703 3628 1 10 . 1 1 61 61 GLU CA C 61 60.104 60.104 59.851 0.253 18703 3629 1 10 . 1 1 61 61 GLU CB C 61 29.864 29.864 29.669 0.195 18703 3630 1 10 . 1 1 61 61 GLU H H 61 8.582 8.582 7.720 0.862 18703 3631 1 10 . 1 1 62 62 GLU N N 62 117.659 117.659 118.726 -1.067 18703 3632 1 10 . 1 1 62 62 GLU HA H 62 3.990 3.990 4.053 -0.063 18703 3633 1 10 . 1 1 62 62 GLU C C 62 178.847 178.847 178.949 -0.102 18703 3634 1 10 . 1 1 62 62 GLU CA C 62 59.067 59.067 58.917 0.150 18703 3635 1 10 . 1 1 62 62 GLU CB C 62 29.440 29.440 29.664 -0.224 18703 3636 1 10 . 1 1 62 62 GLU H H 62 8.032 8.032 7.676 0.356 18703 3637 1 10 . 1 1 63 63 GLU N N 63 119.290 119.290 119.513 -0.223 18703 3638 1 10 . 1 1 63 63 GLU HA H 63 4.012 4.012 4.056 -0.044 18703 3639 1 10 . 1 1 63 63 GLU C C 63 179.784 179.784 179.095 0.689 18703 3640 1 10 . 1 1 63 63 GLU CA C 63 59.300 59.300 59.207 0.093 18703 3641 1 10 . 1 1 63 63 GLU CB C 63 29.728 29.728 29.629 0.099 18703 3642 1 10 . 1 1 63 63 GLU H H 63 7.958 7.958 7.473 0.485 18703 3643 1 10 . 1 1 64 64 ILE N N 64 118.453 118.453 118.629 -0.176 18703 3644 1 10 . 1 1 64 64 ILE HA H 64 3.711 3.711 3.771 -0.060 18703 3645 1 10 . 1 1 64 64 ILE C C 64 177.655 177.655 178.336 -0.681 18703 3646 1 10 . 1 1 64 64 ILE CA C 64 64.256 64.256 64.106 0.150 18703 3647 1 10 . 1 1 64 64 ILE CB C 64 38.002 38.002 37.720 0.282 18703 3648 1 10 . 1 1 64 64 ILE H H 64 8.160 8.160 7.481 0.679 18703 3649 1 10 . 1 1 65 65 LYS N N 65 118.871 118.871 118.702 0.169 18703 3650 1 10 . 1 1 65 65 LYS HA H 65 4.111 4.111 4.148 -0.037 18703 3651 1 10 . 1 1 65 65 LYS C C 65 177.076 177.076 177.624 -0.548 18703 3652 1 10 . 1 1 65 65 LYS CA C 65 58.421 58.421 58.313 0.108 18703 3653 1 10 . 1 1 65 65 LYS CB C 65 32.639 32.639 32.067 0.572 18703 3654 1 10 . 1 1 65 65 LYS H H 65 7.664 7.664 7.637 0.027 18703 3655 1 10 . 1 1 66 66 LYS N N 66 116.944 116.944 118.552 -1.608 18703 3656 1 10 . 1 1 66 66 LYS HA H 66 4.320 4.320 4.117 0.203 18703 3657 1 10 . 1 1 66 66 LYS C C 66 175.897 175.897 177.646 -1.749 18703 3658 1 10 . 1 1 66 66 LYS CA C 66 56.352 56.352 58.165 -1.813 18703 3659 1 10 . 1 1 66 66 LYS CB C 66 33.024 33.024 32.946 0.078 18703 3660 1 10 . 1 1 66 66 LYS H H 66 7.246 7.246 7.576 -0.330 18703 3661 1 11 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.488 -0.242 18703 3662 1 11 . 1 1 3 3 ARG C C 3 178.379 178.379 177.434 0.945 18703 3663 1 11 . 1 1 3 3 ARG CA C 3 58.367 58.367 57.107 1.260 18703 3664 1 11 . 1 1 3 3 ARG CB C 3 30.691 30.691 30.456 0.235 18703 3665 1 11 . 1 1 3 3 ARG H H 3 7.905 7.905 8.444 -0.539 18703 3666 1 11 . 1 1 4 4 VAL N N 4 118.966 118.966 120.384 -1.418 18703 3667 1 11 . 1 1 4 4 VAL HA H 4 3.803 3.803 3.834 -0.031 18703 3668 1 11 . 1 1 4 4 VAL C C 4 176.968 176.968 177.313 -0.345 18703 3669 1 11 . 1 1 4 4 VAL CA C 4 65.441 65.441 65.090 0.351 18703 3670 1 11 . 1 1 4 4 VAL CB C 4 31.710 31.710 31.683 0.027 18703 3671 1 11 . 1 1 4 4 VAL H H 4 8.070 8.070 7.991 0.079 18703 3672 1 11 . 1 1 5 5 LYS N N 5 122.058 122.058 120.723 1.335 18703 3673 1 11 . 1 1 5 5 LYS HA H 5 4.154 4.154 4.100 0.054 18703 3674 1 11 . 1 1 5 5 LYS C C 5 178.553 178.553 178.861 -0.308 18703 3675 1 11 . 1 1 5 5 LYS CA C 5 58.712 58.712 59.202 -0.489 18703 3676 1 11 . 1 1 5 5 LYS CB C 5 31.788 31.788 31.422 0.366 18703 3677 1 11 . 1 1 5 5 LYS H H 5 7.798 7.798 8.477 -0.679 18703 3678 1 11 . 1 1 6 6 ALA N N 6 119.955 119.955 119.644 0.311 18703 3679 1 11 . 1 1 6 6 ALA HA H 6 4.198 4.198 4.262 -0.064 18703 3680 1 11 . 1 1 6 6 ALA C C 6 180.974 180.974 180.199 0.775 18703 3681 1 11 . 1 1 6 6 ALA CA C 6 54.850 54.850 54.343 0.507 18703 3682 1 11 . 1 1 6 6 ALA CB C 6 17.995 17.995 18.025 -0.030 18703 3683 1 11 . 1 1 6 6 ALA H H 6 7.928 7.928 8.347 -0.419 18703 3684 1 11 . 1 1 7 7 LEU N N 7 119.211 119.211 120.270 -1.059 18703 3685 1 11 . 1 1 7 7 LEU HA H 7 4.124 4.124 3.986 0.138 18703 3686 1 11 . 1 1 7 7 LEU C C 7 178.353 178.353 178.321 0.032 18703 3687 1 11 . 1 1 7 7 LEU CA C 7 57.658 57.658 57.258 0.400 18703 3688 1 11 . 1 1 7 7 LEU CB C 7 41.971 41.971 42.172 -0.201 18703 3689 1 11 . 1 1 7 7 LEU H H 7 7.594 7.594 7.729 -0.135 18703 3690 1 11 . 1 1 8 8 GLU N N 8 120.258 120.258 118.219 2.039 18703 3691 1 11 . 1 1 8 8 GLU HA H 8 3.846 3.846 3.981 -0.135 18703 3692 1 11 . 1 1 8 8 GLU C C 8 179.546 179.546 178.628 0.918 18703 3693 1 11 . 1 1 8 8 GLU CA C 8 60.006 60.006 59.650 0.356 18703 3694 1 11 . 1 1 8 8 GLU CB C 8 29.683 29.683 29.635 0.048 18703 3695 1 11 . 1 1 8 8 GLU H H 8 8.382 8.382 7.767 0.615 18703 3696 1 11 . 1 1 9 9 GLU N N 9 118.584 118.584 118.396 0.188 18703 3697 1 11 . 1 1 9 9 GLU HA H 9 4.039 4.039 4.140 -0.101 18703 3698 1 11 . 1 1 9 9 GLU C C 9 179.635 179.635 178.756 0.879 18703 3699 1 11 . 1 1 9 9 GLU CA C 9 59.235 59.235 58.703 0.532 18703 3700 1 11 . 1 1 9 9 GLU CB C 9 29.358 29.358 29.151 0.207 18703 3701 1 11 . 1 1 9 9 GLU H H 9 7.908 7.908 7.833 0.075 18703 3702 1 11 . 1 1 10 10 LYS N N 10 120.956 120.956 119.612 1.344 18703 3703 1 11 . 1 1 10 10 LYS HA H 10 4.190 4.190 4.160 0.030 18703 3704 1 11 . 1 1 10 10 LYS C C 10 179.395 179.395 178.840 0.555 18703 3705 1 11 . 1 1 10 10 LYS CA C 10 59.231 59.231 59.095 0.136 18703 3706 1 11 . 1 1 10 10 LYS CB C 10 32.211 32.211 32.651 -0.440 18703 3707 1 11 . 1 1 10 10 LYS H H 10 8.009 8.009 7.446 0.563 18703 3708 1 11 . 1 1 11 11 VAL N N 11 119.577 119.577 118.208 1.369 18703 3709 1 11 . 1 1 11 11 VAL HA H 11 3.844 3.844 3.768 0.076 18703 3710 1 11 . 1 1 11 11 VAL C C 11 177.078 177.078 177.470 -0.392 18703 3711 1 11 . 1 1 11 11 VAL CA C 11 66.407 66.407 64.728 1.679 18703 3712 1 11 . 1 1 11 11 VAL CB C 11 31.252 31.252 31.036 0.216 18703 3713 1 11 . 1 1 11 11 VAL H H 11 8.488 8.488 7.503 0.985 18703 3714 1 11 . 1 1 12 12 LYS N N 12 122.864 122.864 120.353 2.511 18703 3715 1 11 . 1 1 12 12 LYS HA H 12 4.189 4.189 3.948 0.241 18703 3716 1 11 . 1 1 12 12 LYS C C 12 178.755 178.755 178.390 0.365 18703 3717 1 11 . 1 1 12 12 LYS CA C 12 59.375 59.375 59.761 -0.386 18703 3718 1 11 . 1 1 12 12 LYS CB C 12 31.991 31.991 32.185 -0.195 18703 3719 1 11 . 1 1 12 12 LYS H H 12 7.944 7.944 7.565 0.379 18703 3720 1 11 . 1 1 13 13 ALA N N 13 121.202 121.202 120.566 0.636 18703 3721 1 11 . 1 1 13 13 ALA HA H 13 4.209 4.209 4.269 -0.060 18703 3722 1 11 . 1 1 13 13 ALA C C 13 181.060 181.060 179.421 1.639 18703 3723 1 11 . 1 1 13 13 ALA CA C 13 54.710 54.710 54.167 0.543 18703 3724 1 11 . 1 1 13 13 ALA CB C 13 17.861 17.861 18.434 -0.573 18703 3725 1 11 . 1 1 13 13 ALA H H 13 7.563 7.563 7.469 0.094 18703 3726 1 11 . 1 1 14 14 LEU N N 14 120.014 120.014 119.686 0.328 18703 3727 1 11 . 1 1 14 14 LEU HA H 14 4.072 4.072 4.015 0.057 18703 3728 1 11 . 1 1 14 14 LEU C C 14 177.862 177.862 178.157 -0.295 18703 3729 1 11 . 1 1 14 14 LEU CA C 14 57.864 57.864 57.340 0.524 18703 3730 1 11 . 1 1 14 14 LEU CB C 14 41.539 41.539 42.112 -0.573 18703 3731 1 11 . 1 1 14 14 LEU H H 14 8.087 8.087 7.516 0.571 18703 3732 1 11 . 1 1 15 15 GLU N N 15 121.644 121.644 119.790 1.854 18703 3733 1 11 . 1 1 15 15 GLU HA H 15 3.692 3.692 3.992 -0.300 18703 3734 1 11 . 1 1 15 15 GLU C C 15 177.819 177.819 178.204 -0.385 18703 3735 1 11 . 1 1 15 15 GLU CA C 15 59.239 59.239 59.265 -0.026 18703 3736 1 11 . 1 1 15 15 GLU CB C 15 28.865 28.865 29.510 -0.645 18703 3737 1 11 . 1 1 15 15 GLU H H 15 8.542 8.542 7.677 0.865 18703 3738 1 11 . 1 1 16 16 GLU N N 16 116.016 116.016 118.210 -2.194 18703 3739 1 11 . 1 1 16 16 GLU HA H 16 3.955 3.955 4.015 -0.060 18703 3740 1 11 . 1 1 16 16 GLU C C 16 179.159 179.159 179.037 0.122 18703 3741 1 11 . 1 1 16 16 GLU CA C 16 59.324 59.324 59.407 -0.083 18703 3742 1 11 . 1 1 16 16 GLU CB C 16 29.060 29.060 29.137 -0.078 18703 3743 1 11 . 1 1 16 16 GLU H H 16 7.492 7.492 8.209 -0.717 18703 3744 1 11 . 1 1 17 17 LYS N N 17 118.546 118.546 119.077 -0.531 18703 3745 1 11 . 1 1 17 17 LYS HA H 17 4.117 4.117 4.129 -0.012 18703 3746 1 11 . 1 1 17 17 LYS C C 17 178.976 178.976 177.376 1.600 18703 3747 1 11 . 1 1 17 17 LYS CA C 17 58.837 58.837 58.605 0.232 18703 3748 1 11 . 1 1 17 17 LYS CB C 17 32.538 32.538 31.963 0.575 18703 3749 1 11 . 1 1 17 17 LYS H H 17 7.720 7.720 7.660 0.060 18703 3750 1 11 . 1 1 18 18 VAL N N 18 118.376 118.376 117.790 0.586 18703 3751 1 11 . 1 1 18 18 VAL HA H 18 3.711 3.711 3.887 -0.176 18703 3752 1 11 . 1 1 18 18 VAL C C 18 178.765 178.765 178.311 0.454 18703 3753 1 11 . 1 1 18 18 VAL CA C 18 66.237 66.237 66.036 0.201 18703 3754 1 11 . 1 1 18 18 VAL CB C 18 31.682 31.682 31.845 -0.163 18703 3755 1 11 . 1 1 18 18 VAL H H 18 8.754 8.754 7.501 1.253 18703 3756 1 11 . 1 1 19 19 LYS N N 19 118.817 118.817 119.456 -0.639 18703 3757 1 11 . 1 1 19 19 LYS HA H 19 4.078 4.078 3.929 0.149 18703 3758 1 11 . 1 1 19 19 LYS C C 19 178.049 178.049 177.585 0.464 18703 3759 1 11 . 1 1 19 19 LYS CA C 19 59.731 59.731 59.439 0.292 18703 3760 1 11 . 1 1 19 19 LYS CB C 19 32.523 32.523 32.052 0.471 18703 3761 1 11 . 1 1 19 19 LYS H H 19 8.299 8.299 8.641 -0.342 18703 3762 1 11 . 1 1 20 20 ALA N N 20 119.656 119.656 119.078 0.578 18703 3763 1 11 . 1 1 20 20 ALA HA H 20 4.347 4.347 4.264 0.083 18703 3764 1 11 . 1 1 20 20 ALA C C 20 178.532 178.532 178.549 -0.017 18703 3765 1 11 . 1 1 20 20 ALA CA C 20 52.853 52.853 52.620 0.233 18703 3766 1 11 . 1 1 20 20 ALA CB C 20 18.832 18.832 19.221 -0.389 18703 3767 1 11 . 1 1 20 20 ALA H H 20 7.425 7.425 7.508 -0.083 18703 3768 1 11 . 1 1 21 21 LEU N N 21 118.594 118.594 117.156 1.438 18703 3769 1 11 . 1 1 21 21 LEU HA H 21 4.297 4.297 4.211 0.086 18703 3770 1 11 . 1 1 21 21 LEU C C 21 177.784 177.784 177.019 0.765 18703 3771 1 11 . 1 1 21 21 LEU CA C 21 55.750 55.750 55.338 0.412 18703 3772 1 11 . 1 1 21 21 LEU CB C 21 42.898 42.898 41.419 1.479 18703 3773 1 11 . 1 1 21 21 LEU H H 21 7.508 7.508 7.690 -0.182 18703 3774 1 11 . 1 1 22 22 GLY N N 22 106.650 106.650 108.345 -1.695 18703 3775 1 11 . 1 1 22 22 GLY C C 22 173.605 173.605 174.309 -0.704 18703 3776 1 11 . 1 1 22 22 GLY CA C 22 45.330 45.330 45.392 -0.062 18703 3777 1 11 . 1 1 22 22 GLY H H 22 7.814 7.814 8.762 -0.948 18703 3778 1 11 . 1 1 23 23 GLY N N 23 108.011 108.011 108.222 -0.211 18703 3779 1 11 . 1 1 23 23 GLY C C 23 174.061 174.061 173.557 0.504 18703 3780 1 11 . 1 1 23 23 GLY CA C 23 44.772 44.772 45.411 -0.639 18703 3781 1 11 . 1 1 23 23 GLY H H 23 8.139 8.139 7.847 0.292 18703 3782 1 11 . 1 1 24 24 GLY N N 24 107.826 107.826 108.127 -0.301 18703 3783 1 11 . 1 1 24 24 GLY C C 24 175.046 175.046 173.276 1.770 18703 3784 1 11 . 1 1 24 24 GLY CA C 24 44.422 44.422 45.610 -1.188 18703 3785 1 11 . 1 1 24 24 GLY H H 24 8.497 8.497 7.797 0.700 18703 3786 1 11 . 1 1 25 25 GLY N N 25 108.830 108.830 108.315 0.515 18703 3787 1 11 . 1 1 25 25 GLY C C 25 176.272 176.272 176.006 0.266 18703 3788 1 11 . 1 1 25 25 GLY CA C 25 47.101 47.101 45.002 2.099 18703 3789 1 11 . 1 1 25 25 GLY H H 25 8.616 8.616 8.259 0.357 18703 3790 1 11 . 1 1 26 26 ARG N N 26 123.109 123.109 122.488 0.621 18703 3791 1 11 . 1 1 26 26 ARG HA H 26 4.283 4.283 4.046 0.237 18703 3792 1 11 . 1 1 26 26 ARG C C 26 177.848 177.848 178.225 -0.377 18703 3793 1 11 . 1 1 26 26 ARG CA C 26 57.663 57.663 58.247 -0.584 18703 3794 1 11 . 1 1 26 26 ARG CB C 26 29.811 29.811 28.711 1.100 18703 3795 1 11 . 1 1 26 26 ARG H H 26 8.770 8.770 8.765 0.005 18703 3796 1 11 . 1 1 27 27 ILE N N 27 118.104 118.104 118.739 -0.635 18703 3797 1 11 . 1 1 27 27 ILE HA H 27 3.787 3.787 3.739 0.048 18703 3798 1 11 . 1 1 27 27 ILE C C 27 177.473 177.473 177.812 -0.339 18703 3799 1 11 . 1 1 27 27 ILE CA C 27 63.036 63.036 64.069 -1.033 18703 3800 1 11 . 1 1 27 27 ILE CB C 27 36.664 36.664 37.205 -0.541 18703 3801 1 11 . 1 1 27 27 ILE H H 27 7.708 7.708 7.989 -0.281 18703 3802 1 11 . 1 1 28 28 GLU N N 28 119.934 119.934 119.721 0.213 18703 3803 1 11 . 1 1 28 28 GLU HA H 28 3.954 3.954 3.903 0.051 18703 3804 1 11 . 1 1 28 28 GLU C C 28 179.514 179.514 178.784 0.730 18703 3805 1 11 . 1 1 28 28 GLU CA C 28 59.450 59.450 59.532 -0.082 18703 3806 1 11 . 1 1 28 28 GLU CB C 28 29.600 29.600 29.216 0.384 18703 3807 1 11 . 1 1 28 28 GLU H H 28 7.872 7.872 8.390 -0.518 18703 3808 1 11 . 1 1 29 29 GLU N N 29 118.134 118.134 119.388 -1.254 18703 3809 1 11 . 1 1 29 29 GLU HA H 29 4.028 4.028 4.098 -0.070 18703 3810 1 11 . 1 1 29 29 GLU C C 29 179.182 179.182 178.953 0.229 18703 3811 1 11 . 1 1 29 29 GLU CA C 29 59.173 59.173 58.528 0.645 18703 3812 1 11 . 1 1 29 29 GLU CB C 29 29.503 29.503 29.268 0.235 18703 3813 1 11 . 1 1 29 29 GLU H H 29 8.166 8.166 7.809 0.357 18703 3814 1 11 . 1 1 30 30 LEU N N 30 120.242 120.242 118.406 1.836 18703 3815 1 11 . 1 1 30 30 LEU HA H 30 4.028 4.028 4.098 -0.070 18703 3816 1 11 . 1 1 30 30 LEU C C 30 178.796 178.796 178.651 0.145 18703 3817 1 11 . 1 1 30 30 LEU CA C 30 57.654 57.654 56.848 0.806 18703 3818 1 11 . 1 1 30 30 LEU CB C 30 41.629 41.629 41.980 -0.351 18703 3819 1 11 . 1 1 30 30 LEU H H 30 7.695 7.695 7.510 0.185 18703 3820 1 11 . 1 1 31 31 LYS N N 31 120.506 120.506 120.363 0.143 18703 3821 1 11 . 1 1 31 31 LYS HA H 31 3.532 3.532 4.044 -0.512 18703 3822 1 11 . 1 1 31 31 LYS C C 31 178.919 178.919 178.390 0.529 18703 3823 1 11 . 1 1 31 31 LYS CA C 31 60.240 60.240 59.369 0.871 18703 3824 1 11 . 1 1 31 31 LYS CB C 31 32.015 32.015 32.287 -0.272 18703 3825 1 11 . 1 1 31 31 LYS H H 31 8.561 8.561 7.825 0.736 18703 3826 1 11 . 1 1 32 32 LYS N N 32 118.566 118.566 117.854 0.712 18703 3827 1 11 . 1 1 32 32 LYS C C 32 179.392 179.392 179.221 0.171 18703 3828 1 11 . 1 1 32 32 LYS CA C 32 59.356 59.356 59.531 -0.175 18703 3829 1 11 . 1 1 32 32 LYS CB C 32 32.117 32.117 32.284 -0.167 18703 3830 1 11 . 1 1 32 32 LYS H H 32 7.699 7.699 7.595 0.104 18703 3831 1 11 . 1 1 33 33 LYS N N 33 118.964 118.964 118.310 0.654 18703 3832 1 11 . 1 1 33 33 LYS HA H 33 4.117 4.117 4.316 -0.199 18703 3833 1 11 . 1 1 33 33 LYS C C 33 178.355 178.355 178.788 -0.433 18703 3834 1 11 . 1 1 33 33 LYS CA C 33 58.633 58.633 57.934 0.699 18703 3835 1 11 . 1 1 33 33 LYS CB C 33 31.904 31.904 32.378 -0.474 18703 3836 1 11 . 1 1 33 33 LYS H H 33 7.752 7.752 7.585 0.167 18703 3837 1 11 . 1 1 34 34 CYS N N 34 119.956 119.956 119.481 0.475 18703 3838 1 11 . 1 1 34 34 CYS HA H 34 3.967 3.967 4.121 -0.154 18703 3839 1 11 . 1 1 34 34 CYS C C 34 175.521 175.521 176.551 -1.030 18703 3840 1 11 . 1 1 34 34 CYS CA C 34 60.987 60.987 63.212 -2.225 18703 3841 1 11 . 1 1 34 34 CYS CB C 34 36.600 36.600 26.672 9.928 18703 3842 1 11 . 1 1 34 34 CYS H H 34 8.393 8.393 7.825 0.568 18703 3843 1 11 . 1 1 35 35 GLU N N 35 120.327 120.327 119.519 0.808 18703 3844 1 11 . 1 1 35 35 GLU HA H 35 3.891 3.891 3.954 -0.063 18703 3845 1 11 . 1 1 35 35 GLU C C 35 179.684 179.684 178.557 1.127 18703 3846 1 11 . 1 1 35 35 GLU CA C 35 60.059 60.059 59.284 0.775 18703 3847 1 11 . 1 1 35 35 GLU CB C 35 29.718 29.718 28.618 1.100 18703 3848 1 11 . 1 1 35 35 GLU H H 35 8.558 8.558 7.926 0.632 18703 3849 1 11 . 1 1 36 36 GLU N N 36 120.190 120.190 119.729 0.461 18703 3850 1 11 . 1 1 36 36 GLU HA H 36 4.051 4.051 4.031 0.020 18703 3851 1 11 . 1 1 36 36 GLU C C 36 179.408 179.408 178.896 0.512 18703 3852 1 11 . 1 1 36 36 GLU CA C 36 59.148 59.148 58.780 0.368 18703 3853 1 11 . 1 1 36 36 GLU CB C 36 29.766 29.766 29.818 -0.052 18703 3854 1 11 . 1 1 36 36 GLU H H 36 8.038 8.038 7.625 0.413 18703 3855 1 11 . 1 1 37 37 LEU N N 37 121.102 121.102 120.780 0.322 18703 3856 1 11 . 1 1 37 37 LEU HA H 37 4.079 4.079 4.167 -0.088 18703 3857 1 11 . 1 1 37 37 LEU C C 37 178.279 178.279 178.427 -0.148 18703 3858 1 11 . 1 1 37 37 LEU CA C 37 57.803 57.803 57.346 0.457 18703 3859 1 11 . 1 1 37 37 LEU CB C 37 41.502 41.502 41.668 -0.166 18703 3860 1 11 . 1 1 37 37 LEU H H 37 8.065 8.065 7.441 0.624 18703 3861 1 11 . 1 1 38 38 LYS N N 38 119.980 119.980 119.033 0.947 18703 3862 1 11 . 1 1 38 38 LYS HA H 38 3.851 3.851 3.881 -0.030 18703 3863 1 11 . 1 1 38 38 LYS C C 38 178.919 178.919 179.253 -0.334 18703 3864 1 11 . 1 1 38 38 LYS CA C 38 60.794 60.794 60.227 0.567 18703 3865 1 11 . 1 1 38 38 LYS CB C 38 32.863 32.863 32.317 0.546 18703 3866 1 11 . 1 1 38 38 LYS H H 38 8.741 8.741 7.496 1.245 18703 3867 1 11 . 1 1 39 39 LYS N N 39 118.307 118.307 117.576 0.731 18703 3868 1 11 . 1 1 39 39 LYS HA H 39 4.125 4.125 3.910 0.215 18703 3869 1 11 . 1 1 39 39 LYS C C 39 178.622 178.622 178.194 0.428 18703 3870 1 11 . 1 1 39 39 LYS CA C 39 58.993 58.993 59.674 -0.681 18703 3871 1 11 . 1 1 39 39 LYS CB C 39 32.097 32.097 31.884 0.214 18703 3872 1 11 . 1 1 39 39 LYS H H 39 7.584 7.584 7.709 -0.125 18703 3873 1 11 . 1 1 40 40 LYS N N 40 118.826 118.826 119.256 -0.430 18703 3874 1 11 . 1 1 40 40 LYS HA H 40 4.069 4.069 4.143 -0.074 18703 3875 1 11 . 1 1 40 40 LYS C C 40 179.802 179.802 178.693 1.109 18703 3876 1 11 . 1 1 40 40 LYS CA C 40 59.322 59.322 58.557 0.765 18703 3877 1 11 . 1 1 40 40 LYS CB C 40 32.505 32.505 32.301 0.204 18703 3878 1 11 . 1 1 40 40 LYS H H 40 7.945 7.945 7.294 0.651 18703 3879 1 11 . 1 1 41 41 ILE N N 41 118.958 118.958 118.906 0.052 18703 3880 1 11 . 1 1 41 41 ILE HA H 41 3.659 3.659 3.878 -0.219 18703 3881 1 11 . 1 1 41 41 ILE C C 41 178.146 178.146 177.645 0.501 18703 3882 1 11 . 1 1 41 41 ILE CA C 41 65.037 65.037 64.369 0.668 18703 3883 1 11 . 1 1 41 41 ILE CB C 41 37.950 37.950 37.919 0.031 18703 3884 1 11 . 1 1 41 41 ILE H H 41 8.369 8.369 8.143 0.226 18703 3885 1 11 . 1 1 42 42 GLU N N 42 120.331 120.331 119.034 1.297 18703 3886 1 11 . 1 1 42 42 GLU HA H 42 4.094 4.094 4.055 0.039 18703 3887 1 11 . 1 1 42 42 GLU C C 42 178.697 178.697 177.883 0.814 18703 3888 1 11 . 1 1 42 42 GLU CA C 42 58.927 58.927 59.139 -0.212 18703 3889 1 11 . 1 1 42 42 GLU CB C 42 29.399 29.399 29.825 -0.425 18703 3890 1 11 . 1 1 42 42 GLU H H 42 7.805 7.805 7.710 0.095 18703 3891 1 11 . 1 1 43 43 GLU N N 43 117.120 117.120 116.806 0.314 18703 3892 1 11 . 1 1 43 43 GLU HA H 43 4.291 4.291 4.219 0.072 18703 3893 1 11 . 1 1 43 43 GLU C C 43 177.551 177.551 177.602 -0.051 18703 3894 1 11 . 1 1 43 43 GLU CA C 43 56.800 56.800 57.071 -0.271 18703 3895 1 11 . 1 1 43 43 GLU CB C 43 29.931 29.931 29.688 0.243 18703 3896 1 11 . 1 1 43 43 GLU H H 43 7.701 7.701 7.616 0.085 18703 3897 1 11 . 1 1 44 44 LEU N N 44 120.940 120.940 121.150 -0.210 18703 3898 1 11 . 1 1 44 44 LEU HA H 44 4.251 4.251 4.085 0.166 18703 3899 1 11 . 1 1 44 44 LEU C C 44 178.596 178.596 177.450 1.146 18703 3900 1 11 . 1 1 44 44 LEU CA C 44 56.448 56.448 55.381 1.067 18703 3901 1 11 . 1 1 44 44 LEU CB C 44 42.519 42.519 42.600 -0.081 18703 3902 1 11 . 1 1 44 44 LEU H H 44 7.581 7.581 7.373 0.208 18703 3903 1 11 . 1 1 45 45 GLY N N 45 108.689 108.689 108.380 0.309 18703 3904 1 11 . 1 1 45 45 GLY C C 45 174.853 174.853 174.326 0.527 18703 3905 1 11 . 1 1 45 45 GLY CA C 45 46.233 46.233 45.222 1.011 18703 3906 1 11 . 1 1 45 45 GLY H H 45 8.232 8.232 8.510 -0.278 18703 3907 1 11 . 1 1 46 46 GLY N N 46 108.029 108.029 107.565 0.464 18703 3908 1 11 . 1 1 46 46 GLY C C 46 174.351 174.351 174.911 -0.560 18703 3909 1 11 . 1 1 46 46 GLY CA C 46 45.105 45.105 46.062 -0.957 18703 3910 1 11 . 1 1 46 46 GLY H H 46 8.176 8.176 8.938 -0.762 18703 3911 1 11 . 1 1 47 47 GLY N N 47 108.183 108.183 107.317 0.866 18703 3912 1 11 . 1 1 47 47 GLY C C 47 174.671 174.671 174.400 0.271 18703 3913 1 11 . 1 1 47 47 GLY CA C 47 45.254 45.254 44.304 0.950 18703 3914 1 11 . 1 1 47 47 GLY H H 47 8.290 8.290 7.941 0.349 18703 3915 1 11 . 1 1 48 48 GLY N N 48 108.616 108.616 109.913 -1.297 18703 3916 1 11 . 1 1 48 48 GLY C C 48 174.321 174.321 175.964 -1.643 18703 3917 1 11 . 1 1 48 48 GLY CA C 48 45.192 45.192 45.727 -0.535 18703 3918 1 11 . 1 1 48 48 GLY H H 48 8.027 8.027 8.369 -0.342 18703 3919 1 11 . 1 1 49 49 GLU N N 49 121.057 121.057 122.596 -1.539 18703 3920 1 11 . 1 1 49 49 GLU HA H 49 4.425 4.425 4.345 0.080 18703 3921 1 11 . 1 1 49 49 GLU C C 49 177.072 177.072 178.517 -1.445 18703 3922 1 11 . 1 1 49 49 GLU CA C 49 56.330 56.330 57.536 -1.206 18703 3923 1 11 . 1 1 49 49 GLU CB C 49 29.602 29.602 29.818 -0.216 18703 3924 1 11 . 1 1 49 49 GLU H H 49 8.486 8.486 8.248 0.238 18703 3925 1 11 . 1 1 50 50 VAL N N 50 122.122 122.122 120.204 1.918 18703 3926 1 11 . 1 1 50 50 VAL HA H 50 3.792 3.792 3.726 0.066 18703 3927 1 11 . 1 1 50 50 VAL C C 50 176.774 176.774 177.507 -0.733 18703 3928 1 11 . 1 1 50 50 VAL CA C 50 64.864 64.864 65.179 -0.315 18703 3929 1 11 . 1 1 50 50 VAL CB C 50 32.179 32.179 30.802 1.377 18703 3930 1 11 . 1 1 50 50 VAL H H 50 8.095 8.095 8.050 0.045 18703 3931 1 11 . 1 1 51 51 LYS N N 51 120.602 120.602 119.203 1.399 18703 3932 1 11 . 1 1 51 51 LYS HA H 51 4.195 4.195 4.106 0.089 18703 3933 1 11 . 1 1 51 51 LYS C C 51 178.530 178.530 178.276 0.254 18703 3934 1 11 . 1 1 51 51 LYS CA C 51 59.348 59.348 58.868 0.480 18703 3935 1 11 . 1 1 51 51 LYS CB C 51 32.265 32.265 32.397 -0.132 18703 3936 1 11 . 1 1 51 51 LYS H H 51 8.268 8.268 7.498 0.770 18703 3937 1 11 . 1 1 52 52 LYS N N 52 117.547 117.547 120.491 -2.944 18703 3938 1 11 . 1 1 52 52 LYS HA H 52 4.162 4.162 4.126 0.036 18703 3939 1 11 . 1 1 52 52 LYS C C 52 179.132 179.132 178.774 0.358 18703 3940 1 11 . 1 1 52 52 LYS CA C 52 58.811 58.811 59.337 -0.526 18703 3941 1 11 . 1 1 52 52 LYS CB C 52 32.054 32.054 32.445 -0.391 18703 3942 1 11 . 1 1 52 52 LYS H H 52 7.595 7.595 7.797 -0.202 18703 3943 1 11 . 1 1 53 53 VAL N N 53 119.190 119.190 119.197 -0.007 18703 3944 1 11 . 1 1 53 53 VAL HA H 53 3.767 3.767 3.617 0.150 18703 3945 1 11 . 1 1 53 53 VAL C C 53 177.933 177.933 177.661 0.272 18703 3946 1 11 . 1 1 53 53 VAL CA C 53 66.065 66.065 67.009 -0.944 18703 3947 1 11 . 1 1 53 53 VAL CB C 53 31.248 31.248 31.639 -0.391 18703 3948 1 11 . 1 1 53 53 VAL H H 53 7.597 7.597 7.603 -0.006 18703 3949 1 11 . 1 1 54 54 GLU N N 54 120.226 120.226 119.099 1.127 18703 3950 1 11 . 1 1 54 54 GLU HA H 54 3.833 3.833 3.970 -0.137 18703 3951 1 11 . 1 1 54 54 GLU C C 54 179.352 179.352 178.509 0.843 18703 3952 1 11 . 1 1 54 54 GLU CA C 54 59.153 59.153 59.693 -0.540 18703 3953 1 11 . 1 1 54 54 GLU CB C 54 29.224 29.224 29.435 -0.211 18703 3954 1 11 . 1 1 54 54 GLU H H 54 8.609 8.609 7.760 0.849 18703 3955 1 11 . 1 1 55 55 GLU N N 55 119.148 119.148 119.160 -0.012 18703 3956 1 11 . 1 1 55 55 GLU HA H 55 4.084 4.084 4.113 -0.029 18703 3957 1 11 . 1 1 55 55 GLU C C 55 179.084 179.084 178.849 0.235 18703 3958 1 11 . 1 1 55 55 GLU CA C 55 59.295 59.295 58.937 0.358 18703 3959 1 11 . 1 1 55 55 GLU CB C 55 29.361 29.361 29.613 -0.252 18703 3960 1 11 . 1 1 55 55 GLU H H 55 7.713 7.713 7.715 -0.002 18703 3961 1 11 . 1 1 56 56 GLU N N 56 120.301 120.301 118.734 1.567 18703 3962 1 11 . 1 1 56 56 GLU HA H 56 4.079 4.079 4.127 -0.048 18703 3963 1 11 . 1 1 56 56 GLU C C 56 179.773 179.773 179.227 0.546 18703 3964 1 11 . 1 1 56 56 GLU CA C 56 59.528 59.528 59.229 0.299 18703 3965 1 11 . 1 1 56 56 GLU CB C 56 30.162 30.162 29.800 0.362 18703 3966 1 11 . 1 1 56 56 GLU H H 56 7.899 7.899 7.559 0.340 18703 3967 1 11 . 1 1 57 57 VAL N N 57 121.536 121.536 118.453 3.083 18703 3968 1 11 . 1 1 57 57 VAL HA H 57 3.540 3.540 3.765 -0.225 18703 3969 1 11 . 1 1 57 57 VAL C C 57 176.984 176.984 177.529 -0.545 18703 3970 1 11 . 1 1 57 57 VAL CA C 57 66.734 66.734 65.508 1.226 18703 3971 1 11 . 1 1 57 57 VAL CB C 57 31.425 31.425 31.627 -0.202 18703 3972 1 11 . 1 1 57 57 VAL H H 57 8.652 8.652 7.453 1.199 18703 3973 1 11 . 1 1 58 58 LYS N N 58 120.219 120.219 120.036 0.183 18703 3974 1 11 . 1 1 58 58 LYS HA H 58 4.199 4.199 4.097 0.102 18703 3975 1 11 . 1 1 58 58 LYS C C 58 178.972 178.972 178.424 0.548 18703 3976 1 11 . 1 1 58 58 LYS CA C 58 59.357 59.357 59.590 -0.233 18703 3977 1 11 . 1 1 58 58 LYS CB C 58 32.186 32.186 32.219 -0.033 18703 3978 1 11 . 1 1 58 58 LYS H H 58 7.791 7.791 7.476 0.315 18703 3979 1 11 . 1 1 59 59 LYS N N 59 118.252 118.252 119.933 -1.681 18703 3980 1 11 . 1 1 59 59 LYS HA H 59 4.069 4.069 4.130 -0.061 18703 3981 1 11 . 1 1 59 59 LYS C C 59 179.180 179.180 178.688 0.492 18703 3982 1 11 . 1 1 59 59 LYS CA C 59 59.285 59.285 58.988 0.297 18703 3983 1 11 . 1 1 59 59 LYS CB C 59 32.345 32.345 32.532 -0.188 18703 3984 1 11 . 1 1 59 59 LYS H H 59 7.849 7.849 7.512 0.337 18703 3985 1 11 . 1 1 60 60 LEU N N 60 121.243 121.243 119.785 1.458 18703 3986 1 11 . 1 1 60 60 LEU HA H 60 4.242 4.242 4.108 0.134 18703 3987 1 11 . 1 1 60 60 LEU C C 60 178.413 178.413 178.133 0.280 18703 3988 1 11 . 1 1 60 60 LEU CA C 60 57.798 57.798 57.317 0.481 18703 3989 1 11 . 1 1 60 60 LEU CB C 60 41.150 41.150 42.128 -0.978 18703 3990 1 11 . 1 1 60 60 LEU H H 60 7.825 7.825 7.551 0.274 18703 3991 1 11 . 1 1 61 61 GLU N N 61 118.844 118.844 119.976 -1.132 18703 3992 1 11 . 1 1 61 61 GLU HA H 61 3.800 3.800 3.904 -0.104 18703 3993 1 11 . 1 1 61 61 GLU C C 61 179.078 179.078 178.593 0.485 18703 3994 1 11 . 1 1 61 61 GLU CA C 61 60.104 60.104 59.990 0.114 18703 3995 1 11 . 1 1 61 61 GLU CB C 61 29.864 29.864 29.620 0.244 18703 3996 1 11 . 1 1 61 61 GLU H H 61 8.582 8.582 7.687 0.895 18703 3997 1 11 . 1 1 62 62 GLU N N 62 117.659 117.659 118.788 -1.129 18703 3998 1 11 . 1 1 62 62 GLU HA H 62 3.990 3.990 4.037 -0.047 18703 3999 1 11 . 1 1 62 62 GLU C C 62 178.847 178.847 178.955 -0.108 18703 4000 1 11 . 1 1 62 62 GLU CA C 62 59.067 59.067 58.985 0.082 18703 4001 1 11 . 1 1 62 62 GLU CB C 62 29.440 29.440 29.620 -0.180 18703 4002 1 11 . 1 1 62 62 GLU H H 62 8.032 8.032 7.627 0.405 18703 4003 1 11 . 1 1 63 63 GLU N N 63 119.290 119.290 119.016 0.274 18703 4004 1 11 . 1 1 63 63 GLU HA H 63 4.012 4.012 4.099 -0.087 18703 4005 1 11 . 1 1 63 63 GLU C C 63 179.784 179.784 179.467 0.317 18703 4006 1 11 . 1 1 63 63 GLU CA C 63 59.300 59.300 59.372 -0.072 18703 4007 1 11 . 1 1 63 63 GLU CB C 63 29.728 29.728 29.623 0.105 18703 4008 1 11 . 1 1 63 63 GLU H H 63 7.958 7.958 7.460 0.498 18703 4009 1 11 . 1 1 64 64 ILE N N 64 118.453 118.453 119.358 -0.905 18703 4010 1 11 . 1 1 64 64 ILE HA H 64 3.711 3.711 3.816 -0.105 18703 4011 1 11 . 1 1 64 64 ILE C C 64 177.655 177.655 177.706 -0.051 18703 4012 1 11 . 1 1 64 64 ILE CA C 64 64.256 64.256 64.097 0.158 18703 4013 1 11 . 1 1 64 64 ILE CB C 64 38.002 38.002 37.543 0.459 18703 4014 1 11 . 1 1 64 64 ILE H H 64 8.160 8.160 7.580 0.580 18703 4015 1 11 . 1 1 65 65 LYS N N 65 118.871 118.871 119.202 -0.331 18703 4016 1 11 . 1 1 65 65 LYS HA H 65 4.111 4.111 4.059 0.052 18703 4017 1 11 . 1 1 65 65 LYS C C 65 177.076 177.076 178.046 -0.970 18703 4018 1 11 . 1 1 65 65 LYS CA C 65 58.421 58.421 58.121 0.300 18703 4019 1 11 . 1 1 65 65 LYS CB C 65 32.639 32.639 31.763 0.876 18703 4020 1 11 . 1 1 65 65 LYS H H 65 7.664 7.664 7.657 0.007 18703 4021 1 11 . 1 1 66 66 LYS N N 66 116.944 116.944 118.444 -1.500 18703 4022 1 11 . 1 1 66 66 LYS HA H 66 4.320 4.320 4.133 0.187 18703 4023 1 11 . 1 1 66 66 LYS C C 66 175.897 175.897 177.730 -1.833 18703 4024 1 11 . 1 1 66 66 LYS CA C 66 56.352 56.352 57.826 -1.474 18703 4025 1 11 . 1 1 66 66 LYS CB C 66 33.024 33.024 32.919 0.105 18703 4026 1 11 . 1 1 66 66 LYS H H 66 7.246 7.246 7.578 -0.332 18703 4027 1 12 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.344 -0.098 18703 4028 1 12 . 1 1 3 3 ARG C C 3 178.379 178.379 176.768 1.611 18703 4029 1 12 . 1 1 3 3 ARG CA C 3 58.367 58.367 57.019 1.348 18703 4030 1 12 . 1 1 3 3 ARG CB C 3 30.691 30.691 30.798 -0.107 18703 4031 1 12 . 1 1 3 3 ARG H H 3 7.905 7.905 8.617 -0.712 18703 4032 1 12 . 1 1 4 4 VAL N N 4 118.966 118.966 120.569 -1.603 18703 4033 1 12 . 1 1 4 4 VAL HA H 4 3.803 3.803 3.866 -0.063 18703 4034 1 12 . 1 1 4 4 VAL C C 4 176.968 176.968 177.499 -0.531 18703 4035 1 12 . 1 1 4 4 VAL CA C 4 65.441 65.441 64.629 0.812 18703 4036 1 12 . 1 1 4 4 VAL CB C 4 31.710 31.710 31.935 -0.225 18703 4037 1 12 . 1 1 4 4 VAL H H 4 8.070 8.070 8.279 -0.209 18703 4038 1 12 . 1 1 5 5 LYS N N 5 122.058 122.058 120.791 1.267 18703 4039 1 12 . 1 1 5 5 LYS HA H 5 4.154 4.154 4.356 -0.202 18703 4040 1 12 . 1 1 5 5 LYS C C 5 178.553 178.553 178.879 -0.326 18703 4041 1 12 . 1 1 5 5 LYS CA C 5 58.712 58.712 59.374 -0.662 18703 4042 1 12 . 1 1 5 5 LYS CB C 5 31.788 31.788 32.363 -0.575 18703 4043 1 12 . 1 1 5 5 LYS H H 5 7.798 7.798 8.340 -0.542 18703 4044 1 12 . 1 1 6 6 ALA N N 6 119.955 119.955 120.808 -0.853 18703 4045 1 12 . 1 1 6 6 ALA HA H 6 4.198 4.198 4.222 -0.024 18703 4046 1 12 . 1 1 6 6 ALA C C 6 180.974 180.974 179.300 1.674 18703 4047 1 12 . 1 1 6 6 ALA CA C 6 54.850 54.850 54.278 0.572 18703 4048 1 12 . 1 1 6 6 ALA CB C 6 17.995 17.995 18.167 -0.172 18703 4049 1 12 . 1 1 6 6 ALA H H 6 7.928 7.928 8.112 -0.184 18703 4050 1 12 . 1 1 7 7 LEU N N 7 119.211 119.211 119.113 0.098 18703 4051 1 12 . 1 1 7 7 LEU HA H 7 4.124 4.124 3.952 0.172 18703 4052 1 12 . 1 1 7 7 LEU C C 7 178.353 178.353 178.441 -0.088 18703 4053 1 12 . 1 1 7 7 LEU CA C 7 57.658 57.658 57.178 0.480 18703 4054 1 12 . 1 1 7 7 LEU CB C 7 41.971 41.971 41.977 -0.006 18703 4055 1 12 . 1 1 7 7 LEU H H 7 7.594 7.594 7.396 0.198 18703 4056 1 12 . 1 1 8 8 GLU N N 8 120.258 120.258 118.099 2.159 18703 4057 1 12 . 1 1 8 8 GLU HA H 8 3.846 3.846 4.004 -0.158 18703 4058 1 12 . 1 1 8 8 GLU C C 8 179.546 179.546 178.497 1.049 18703 4059 1 12 . 1 1 8 8 GLU CA C 8 60.006 60.006 59.718 0.288 18703 4060 1 12 . 1 1 8 8 GLU CB C 8 29.683 29.683 29.370 0.313 18703 4061 1 12 . 1 1 8 8 GLU H H 8 8.382 8.382 7.787 0.595 18703 4062 1 12 . 1 1 9 9 GLU N N 9 118.584 118.584 118.790 -0.206 18703 4063 1 12 . 1 1 9 9 GLU HA H 9 4.039 4.039 4.138 -0.099 18703 4064 1 12 . 1 1 9 9 GLU C C 9 179.635 179.635 178.573 1.062 18703 4065 1 12 . 1 1 9 9 GLU CA C 9 59.235 59.235 58.495 0.741 18703 4066 1 12 . 1 1 9 9 GLU CB C 9 29.358 29.358 29.044 0.314 18703 4067 1 12 . 1 1 9 9 GLU H H 9 7.908 7.908 7.723 0.185 18703 4068 1 12 . 1 1 10 10 LYS N N 10 120.956 120.956 120.272 0.684 18703 4069 1 12 . 1 1 10 10 LYS HA H 10 4.190 4.190 4.104 0.086 18703 4070 1 12 . 1 1 10 10 LYS C C 10 179.395 179.395 179.091 0.304 18703 4071 1 12 . 1 1 10 10 LYS CA C 10 59.231 59.231 59.217 0.014 18703 4072 1 12 . 1 1 10 10 LYS CB C 10 32.211 32.211 32.630 -0.419 18703 4073 1 12 . 1 1 10 10 LYS H H 10 8.009 8.009 7.458 0.551 18703 4074 1 12 . 1 1 11 11 VAL N N 11 119.577 119.577 118.196 1.381 18703 4075 1 12 . 1 1 11 11 VAL HA H 11 3.844 3.844 3.652 0.192 18703 4076 1 12 . 1 1 11 11 VAL C C 11 177.078 177.078 177.367 -0.289 18703 4077 1 12 . 1 1 11 11 VAL CA C 11 66.407 66.407 66.163 0.244 18703 4078 1 12 . 1 1 11 11 VAL CB C 11 31.252 31.252 31.735 -0.483 18703 4079 1 12 . 1 1 11 11 VAL H H 11 8.488 8.488 7.457 1.031 18703 4080 1 12 . 1 1 12 12 LYS N N 12 122.864 122.864 119.907 2.957 18703 4081 1 12 . 1 1 12 12 LYS HA H 12 4.189 4.189 4.006 0.183 18703 4082 1 12 . 1 1 12 12 LYS C C 12 178.755 178.755 178.240 0.515 18703 4083 1 12 . 1 1 12 12 LYS CA C 12 59.375 59.375 59.554 -0.179 18703 4084 1 12 . 1 1 12 12 LYS CB C 12 31.991 31.991 32.368 -0.377 18703 4085 1 12 . 1 1 12 12 LYS H H 12 7.944 7.944 7.533 0.411 18703 4086 1 12 . 1 1 13 13 ALA N N 13 121.202 121.202 120.222 0.980 18703 4087 1 12 . 1 1 13 13 ALA HA H 13 4.209 4.209 4.465 -0.256 18703 4088 1 12 . 1 1 13 13 ALA C C 13 181.060 181.060 179.332 1.728 18703 4089 1 12 . 1 1 13 13 ALA CA C 13 54.710 54.710 54.020 0.690 18703 4090 1 12 . 1 1 13 13 ALA CB C 13 17.861 17.861 18.481 -0.620 18703 4091 1 12 . 1 1 13 13 ALA H H 13 7.563 7.563 7.451 0.112 18703 4092 1 12 . 1 1 14 14 LEU N N 14 120.014 120.014 119.647 0.367 18703 4093 1 12 . 1 1 14 14 LEU HA H 14 4.072 4.072 4.011 0.061 18703 4094 1 12 . 1 1 14 14 LEU C C 14 177.862 177.862 178.183 -0.321 18703 4095 1 12 . 1 1 14 14 LEU CA C 14 57.864 57.864 57.498 0.366 18703 4096 1 12 . 1 1 14 14 LEU CB C 14 41.539 41.539 42.138 -0.598 18703 4097 1 12 . 1 1 14 14 LEU H H 14 8.087 8.087 7.541 0.546 18703 4098 1 12 . 1 1 15 15 GLU N N 15 121.644 121.644 120.293 1.351 18703 4099 1 12 . 1 1 15 15 GLU HA H 15 3.692 3.692 3.988 -0.296 18703 4100 1 12 . 1 1 15 15 GLU C C 15 177.819 177.819 178.255 -0.436 18703 4101 1 12 . 1 1 15 15 GLU CA C 15 59.239 59.239 59.433 -0.194 18703 4102 1 12 . 1 1 15 15 GLU CB C 15 28.865 28.865 29.625 -0.760 18703 4103 1 12 . 1 1 15 15 GLU H H 15 8.542 8.542 7.675 0.867 18703 4104 1 12 . 1 1 16 16 GLU N N 16 116.016 116.016 118.490 -2.474 18703 4105 1 12 . 1 1 16 16 GLU HA H 16 3.955 3.955 3.936 0.019 18703 4106 1 12 . 1 1 16 16 GLU C C 16 179.159 179.159 179.141 0.018 18703 4107 1 12 . 1 1 16 16 GLU CA C 16 59.324 59.324 58.963 0.361 18703 4108 1 12 . 1 1 16 16 GLU CB C 16 29.060 29.060 29.004 0.056 18703 4109 1 12 . 1 1 16 16 GLU H H 16 7.492 7.492 8.003 -0.511 18703 4110 1 12 . 1 1 17 17 LYS N N 17 118.546 118.546 118.924 -0.378 18703 4111 1 12 . 1 1 17 17 LYS HA H 17 4.117 4.117 4.145 -0.028 18703 4112 1 12 . 1 1 17 17 LYS C C 17 178.976 178.976 177.782 1.194 18703 4113 1 12 . 1 1 17 17 LYS CA C 17 58.837 58.837 58.566 0.271 18703 4114 1 12 . 1 1 17 17 LYS CB C 17 32.538 32.538 32.428 0.110 18703 4115 1 12 . 1 1 17 17 LYS H H 17 7.720 7.720 7.459 0.261 18703 4116 1 12 . 1 1 18 18 VAL N N 18 118.376 118.376 119.023 -0.647 18703 4117 1 12 . 1 1 18 18 VAL HA H 18 3.711 3.711 3.857 -0.146 18703 4118 1 12 . 1 1 18 18 VAL C C 18 178.765 178.765 178.521 0.244 18703 4119 1 12 . 1 1 18 18 VAL CA C 18 66.237 66.237 65.203 1.034 18703 4120 1 12 . 1 1 18 18 VAL CB C 18 31.682 31.682 31.569 0.113 18703 4121 1 12 . 1 1 18 18 VAL H H 18 8.754 8.754 7.711 1.043 18703 4122 1 12 . 1 1 19 19 LYS N N 19 118.817 118.817 118.937 -0.120 18703 4123 1 12 . 1 1 19 19 LYS HA H 19 4.078 4.078 3.972 0.106 18703 4124 1 12 . 1 1 19 19 LYS C C 19 178.049 178.049 177.792 0.257 18703 4125 1 12 . 1 1 19 19 LYS CA C 19 59.731 59.731 59.360 0.371 18703 4126 1 12 . 1 1 19 19 LYS CB C 19 32.523 32.523 32.068 0.455 18703 4127 1 12 . 1 1 19 19 LYS H H 19 8.299 8.299 8.524 -0.225 18703 4128 1 12 . 1 1 20 20 ALA N N 20 119.656 119.656 118.797 0.859 18703 4129 1 12 . 1 1 20 20 ALA HA H 20 4.347 4.347 4.353 -0.006 18703 4130 1 12 . 1 1 20 20 ALA C C 20 178.532 178.532 178.427 0.105 18703 4131 1 12 . 1 1 20 20 ALA CA C 20 52.853 52.853 52.827 0.026 18703 4132 1 12 . 1 1 20 20 ALA CB C 20 18.832 18.832 18.873 -0.041 18703 4133 1 12 . 1 1 20 20 ALA H H 20 7.425 7.425 7.466 -0.041 18703 4134 1 12 . 1 1 21 21 LEU N N 21 118.594 118.594 119.348 -0.754 18703 4135 1 12 . 1 1 21 21 LEU HA H 21 4.297 4.297 4.106 0.191 18703 4136 1 12 . 1 1 21 21 LEU C C 21 177.784 177.784 177.583 0.201 18703 4137 1 12 . 1 1 21 21 LEU CA C 21 55.750 55.750 56.539 -0.789 18703 4138 1 12 . 1 1 21 21 LEU CB C 21 42.898 42.898 42.773 0.125 18703 4139 1 12 . 1 1 21 21 LEU H H 21 7.508 7.508 7.857 -0.349 18703 4140 1 12 . 1 1 22 22 GLY N N 22 106.650 106.650 104.238 2.412 18703 4141 1 12 . 1 1 22 22 GLY C C 22 173.605 173.605 172.025 1.580 18703 4142 1 12 . 1 1 22 22 GLY CA C 22 45.330 45.330 44.618 0.712 18703 4143 1 12 . 1 1 22 22 GLY H H 22 7.814 7.814 7.742 0.072 18703 4144 1 12 . 1 1 23 23 GLY N N 23 108.011 108.011 106.416 1.595 18703 4145 1 12 . 1 1 23 23 GLY C C 23 174.061 174.061 172.913 1.148 18703 4146 1 12 . 1 1 23 23 GLY CA C 23 44.772 44.772 45.590 -0.818 18703 4147 1 12 . 1 1 23 23 GLY H H 23 8.139 8.139 8.134 0.005 18703 4148 1 12 . 1 1 24 24 GLY N N 24 107.826 107.826 108.265 -0.439 18703 4149 1 12 . 1 1 24 24 GLY C C 24 175.046 175.046 174.404 0.642 18703 4150 1 12 . 1 1 24 24 GLY CA C 24 44.422 44.422 44.619 -0.197 18703 4151 1 12 . 1 1 24 24 GLY H H 24 8.497 8.497 8.443 0.054 18703 4152 1 12 . 1 1 25 25 GLY N N 25 108.830 108.830 111.354 -2.524 18703 4153 1 12 . 1 1 25 25 GLY C C 25 176.272 176.272 175.296 0.976 18703 4154 1 12 . 1 1 25 25 GLY CA C 25 47.101 47.101 44.811 2.290 18703 4155 1 12 . 1 1 25 25 GLY H H 25 8.616 8.616 8.015 0.601 18703 4156 1 12 . 1 1 26 26 ARG N N 26 123.109 123.109 123.714 -0.605 18703 4157 1 12 . 1 1 26 26 ARG HA H 26 4.283 4.283 4.148 0.135 18703 4158 1 12 . 1 1 26 26 ARG C C 26 177.848 177.848 177.263 0.585 18703 4159 1 12 . 1 1 26 26 ARG CA C 26 57.663 57.663 58.274 -0.611 18703 4160 1 12 . 1 1 26 26 ARG CB C 26 29.811 29.811 29.497 0.314 18703 4161 1 12 . 1 1 26 26 ARG H H 26 8.770 8.770 8.658 0.112 18703 4162 1 12 . 1 1 27 27 ILE N N 27 118.104 118.104 119.508 -1.404 18703 4163 1 12 . 1 1 27 27 ILE HA H 27 3.787 3.787 3.869 -0.082 18703 4164 1 12 . 1 1 27 27 ILE C C 27 177.473 177.473 177.564 -0.091 18703 4165 1 12 . 1 1 27 27 ILE CA C 27 63.036 63.036 64.037 -1.000 18703 4166 1 12 . 1 1 27 27 ILE CB C 27 36.664 36.664 37.594 -0.930 18703 4167 1 12 . 1 1 27 27 ILE H H 27 7.708 7.708 7.775 -0.067 18703 4168 1 12 . 1 1 28 28 GLU N N 28 119.934 119.934 120.848 -0.914 18703 4169 1 12 . 1 1 28 28 GLU HA H 28 3.954 3.954 3.829 0.125 18703 4170 1 12 . 1 1 28 28 GLU C C 28 179.514 179.514 178.306 1.208 18703 4171 1 12 . 1 1 28 28 GLU CA C 28 59.450 59.450 60.059 -0.609 18703 4172 1 12 . 1 1 28 28 GLU CB C 28 29.600 29.600 29.523 0.077 18703 4173 1 12 . 1 1 28 28 GLU H H 28 7.872 7.872 7.954 -0.082 18703 4174 1 12 . 1 1 29 29 GLU N N 29 118.134 118.134 119.424 -1.290 18703 4175 1 12 . 1 1 29 29 GLU HA H 29 4.028 4.028 4.087 -0.059 18703 4176 1 12 . 1 1 29 29 GLU C C 29 179.182 179.182 179.246 -0.064 18703 4177 1 12 . 1 1 29 29 GLU CA C 29 59.173 59.173 59.125 0.048 18703 4178 1 12 . 1 1 29 29 GLU CB C 29 29.503 29.503 29.445 0.058 18703 4179 1 12 . 1 1 29 29 GLU H H 29 8.166 8.166 7.629 0.537 18703 4180 1 12 . 1 1 30 30 LEU N N 30 120.242 120.242 117.584 2.658 18703 4181 1 12 . 1 1 30 30 LEU HA H 30 4.028 4.028 4.093 -0.065 18703 4182 1 12 . 1 1 30 30 LEU C C 30 178.796 178.796 178.514 0.282 18703 4183 1 12 . 1 1 30 30 LEU CA C 30 57.654 57.654 56.886 0.768 18703 4184 1 12 . 1 1 30 30 LEU CB C 30 41.629 41.629 41.922 -0.293 18703 4185 1 12 . 1 1 30 30 LEU H H 30 7.695 7.695 7.463 0.232 18703 4186 1 12 . 1 1 31 31 LYS N N 31 120.506 120.506 119.514 0.992 18703 4187 1 12 . 1 1 31 31 LYS HA H 31 3.532 3.532 4.101 -0.569 18703 4188 1 12 . 1 1 31 31 LYS C C 31 178.919 178.919 178.188 0.731 18703 4189 1 12 . 1 1 31 31 LYS CA C 31 60.240 60.240 59.022 1.218 18703 4190 1 12 . 1 1 31 31 LYS CB C 31 32.015 32.015 32.435 -0.420 18703 4191 1 12 . 1 1 31 31 LYS H H 31 8.561 8.561 7.675 0.886 18703 4192 1 12 . 1 1 32 32 LYS N N 32 118.566 118.566 118.994 -0.428 18703 4193 1 12 . 1 1 32 32 LYS C C 32 179.392 179.392 178.787 0.605 18703 4194 1 12 . 1 1 32 32 LYS CA C 32 59.356 59.356 59.873 -0.517 18703 4195 1 12 . 1 1 32 32 LYS CB C 32 32.117 32.117 32.391 -0.274 18703 4196 1 12 . 1 1 32 32 LYS H H 32 7.699 7.699 7.519 0.180 18703 4197 1 12 . 1 1 33 33 LYS N N 33 118.964 118.964 118.350 0.614 18703 4198 1 12 . 1 1 33 33 LYS HA H 33 4.117 4.117 3.996 0.121 18703 4199 1 12 . 1 1 33 33 LYS C C 33 178.355 178.355 178.717 -0.362 18703 4200 1 12 . 1 1 33 33 LYS CA C 33 58.633 58.633 59.411 -0.778 18703 4201 1 12 . 1 1 33 33 LYS CB C 33 31.904 31.904 32.294 -0.390 18703 4202 1 12 . 1 1 33 33 LYS H H 33 7.752 7.752 7.667 0.085 18703 4203 1 12 . 1 1 34 34 CYS N N 34 119.956 119.956 118.043 1.913 18703 4204 1 12 . 1 1 34 34 CYS HA H 34 3.967 3.967 4.103 -0.136 18703 4205 1 12 . 1 1 34 34 CYS C C 34 175.521 175.521 176.902 -1.381 18703 4206 1 12 . 1 1 34 34 CYS CA C 34 60.987 60.987 62.784 -1.797 18703 4207 1 12 . 1 1 34 34 CYS CB C 34 36.600 36.600 26.673 9.927 18703 4208 1 12 . 1 1 34 34 CYS H H 34 8.393 8.393 7.524 0.869 18703 4209 1 12 . 1 1 35 35 GLU N N 35 120.327 120.327 120.128 0.199 18703 4210 1 12 . 1 1 35 35 GLU HA H 35 3.891 3.891 3.910 -0.019 18703 4211 1 12 . 1 1 35 35 GLU C C 35 179.684 179.684 178.678 1.006 18703 4212 1 12 . 1 1 35 35 GLU CA C 35 60.059 60.059 59.272 0.787 18703 4213 1 12 . 1 1 35 35 GLU CB C 35 29.718 29.718 28.636 1.082 18703 4214 1 12 . 1 1 35 35 GLU H H 35 8.558 8.558 7.813 0.745 18703 4215 1 12 . 1 1 36 36 GLU N N 36 120.190 120.190 119.970 0.220 18703 4216 1 12 . 1 1 36 36 GLU HA H 36 4.051 4.051 3.972 0.079 18703 4217 1 12 . 1 1 36 36 GLU C C 36 179.408 179.408 179.050 0.358 18703 4218 1 12 . 1 1 36 36 GLU CA C 36 59.148 59.148 58.901 0.246 18703 4219 1 12 . 1 1 36 36 GLU CB C 36 29.766 29.766 29.696 0.070 18703 4220 1 12 . 1 1 36 36 GLU H H 36 8.038 8.038 7.612 0.426 18703 4221 1 12 . 1 1 37 37 LEU N N 37 121.102 121.102 119.865 1.237 18703 4222 1 12 . 1 1 37 37 LEU HA H 37 4.079 4.079 4.116 -0.037 18703 4223 1 12 . 1 1 37 37 LEU C C 37 178.279 178.279 178.377 -0.098 18703 4224 1 12 . 1 1 37 37 LEU CA C 37 57.803 57.803 57.643 0.160 18703 4225 1 12 . 1 1 37 37 LEU CB C 37 41.502 41.502 41.760 -0.258 18703 4226 1 12 . 1 1 37 37 LEU H H 37 8.065 8.065 7.480 0.585 18703 4227 1 12 . 1 1 38 38 LYS N N 38 119.980 119.980 118.983 0.997 18703 4228 1 12 . 1 1 38 38 LYS HA H 38 3.851 3.851 3.969 -0.118 18703 4229 1 12 . 1 1 38 38 LYS C C 38 178.919 178.919 179.155 -0.236 18703 4230 1 12 . 1 1 38 38 LYS CA C 38 60.794 60.794 59.475 1.319 18703 4231 1 12 . 1 1 38 38 LYS CB C 38 32.863 32.863 32.266 0.598 18703 4232 1 12 . 1 1 38 38 LYS H H 38 8.741 8.741 7.834 0.907 18703 4233 1 12 . 1 1 39 39 LYS N N 39 118.307 118.307 117.341 0.966 18703 4234 1 12 . 1 1 39 39 LYS HA H 39 4.125 4.125 4.205 -0.080 18703 4235 1 12 . 1 1 39 39 LYS C C 39 178.622 178.622 178.610 0.012 18703 4236 1 12 . 1 1 39 39 LYS CA C 39 58.993 58.993 59.136 -0.143 18703 4237 1 12 . 1 1 39 39 LYS CB C 39 32.097 32.097 31.664 0.433 18703 4238 1 12 . 1 1 39 39 LYS H H 39 7.584 7.584 7.705 -0.121 18703 4239 1 12 . 1 1 40 40 LYS N N 40 118.826 118.826 119.592 -0.766 18703 4240 1 12 . 1 1 40 40 LYS HA H 40 4.069 4.069 4.132 -0.063 18703 4241 1 12 . 1 1 40 40 LYS C C 40 179.802 179.802 178.961 0.841 18703 4242 1 12 . 1 1 40 40 LYS CA C 40 59.322 59.322 58.758 0.563 18703 4243 1 12 . 1 1 40 40 LYS CB C 40 32.505 32.505 32.398 0.107 18703 4244 1 12 . 1 1 40 40 LYS H H 40 7.945 7.945 7.370 0.575 18703 4245 1 12 . 1 1 41 41 ILE N N 41 118.958 118.958 117.994 0.964 18703 4246 1 12 . 1 1 41 41 ILE HA H 41 3.659 3.659 3.818 -0.159 18703 4247 1 12 . 1 1 41 41 ILE C C 41 178.146 178.146 176.952 1.194 18703 4248 1 12 . 1 1 41 41 ILE CA C 41 65.037 65.037 64.123 0.914 18703 4249 1 12 . 1 1 41 41 ILE CB C 41 37.950 37.950 38.074 -0.124 18703 4250 1 12 . 1 1 41 41 ILE H H 41 8.369 8.369 7.995 0.374 18703 4251 1 12 . 1 1 42 42 GLU N N 42 120.331 120.331 116.397 3.934 18703 4252 1 12 . 1 1 42 42 GLU HA H 42 4.094 4.094 4.065 0.029 18703 4253 1 12 . 1 1 42 42 GLU C C 42 178.697 178.697 177.658 1.039 18703 4254 1 12 . 1 1 42 42 GLU CA C 42 58.927 58.927 58.454 0.473 18703 4255 1 12 . 1 1 42 42 GLU CB C 42 29.399 29.399 30.147 -0.748 18703 4256 1 12 . 1 1 42 42 GLU H H 42 7.805 7.805 7.581 0.224 18703 4257 1 12 . 1 1 43 43 GLU N N 43 117.120 117.120 116.682 0.438 18703 4258 1 12 . 1 1 43 43 GLU HA H 43 4.291 4.291 4.171 0.120 18703 4259 1 12 . 1 1 43 43 GLU C C 43 177.551 177.551 177.531 0.020 18703 4260 1 12 . 1 1 43 43 GLU CA C 43 56.800 56.800 57.004 -0.204 18703 4261 1 12 . 1 1 43 43 GLU CB C 43 29.931 29.931 29.728 0.203 18703 4262 1 12 . 1 1 43 43 GLU H H 43 7.701 7.701 7.635 0.066 18703 4263 1 12 . 1 1 44 44 LEU N N 44 120.940 120.940 120.730 0.210 18703 4264 1 12 . 1 1 44 44 LEU HA H 44 4.251 4.251 4.084 0.167 18703 4265 1 12 . 1 1 44 44 LEU C C 44 178.596 178.596 176.977 1.619 18703 4266 1 12 . 1 1 44 44 LEU CA C 44 56.448 56.448 55.563 0.885 18703 4267 1 12 . 1 1 44 44 LEU CB C 44 42.519 42.519 42.617 -0.098 18703 4268 1 12 . 1 1 44 44 LEU H H 44 7.581 7.581 7.344 0.237 18703 4269 1 12 . 1 1 45 45 GLY N N 45 108.689 108.689 108.190 0.499 18703 4270 1 12 . 1 1 45 45 GLY C C 45 174.853 174.853 174.663 0.190 18703 4271 1 12 . 1 1 45 45 GLY CA C 45 46.233 46.233 44.966 1.267 18703 4272 1 12 . 1 1 45 45 GLY H H 45 8.232 8.232 8.578 -0.346 18703 4273 1 12 . 1 1 46 46 GLY N N 46 108.029 108.029 109.464 -1.435 18703 4274 1 12 . 1 1 46 46 GLY C C 46 174.351 174.351 174.170 0.181 18703 4275 1 12 . 1 1 46 46 GLY CA C 46 45.105 45.105 45.077 0.028 18703 4276 1 12 . 1 1 46 46 GLY H H 46 8.176 8.176 8.098 0.078 18703 4277 1 12 . 1 1 47 47 GLY N N 47 108.183 108.183 107.565 0.618 18703 4278 1 12 . 1 1 47 47 GLY C C 47 174.671 174.671 174.832 -0.161 18703 4279 1 12 . 1 1 47 47 GLY CA C 47 45.254 45.254 44.693 0.561 18703 4280 1 12 . 1 1 47 47 GLY H H 47 8.290 8.290 8.256 0.034 18703 4281 1 12 . 1 1 48 48 GLY N N 48 108.616 108.616 109.882 -1.266 18703 4282 1 12 . 1 1 48 48 GLY C C 48 174.321 174.321 176.546 -2.225 18703 4283 1 12 . 1 1 48 48 GLY CA C 48 45.192 45.192 46.254 -1.062 18703 4284 1 12 . 1 1 48 48 GLY H H 48 8.027 8.027 8.259 -0.232 18703 4285 1 12 . 1 1 49 49 GLU N N 49 121.057 121.057 123.876 -2.819 18703 4286 1 12 . 1 1 49 49 GLU HA H 49 4.425 4.425 4.204 0.221 18703 4287 1 12 . 1 1 49 49 GLU C C 49 177.072 177.072 178.273 -1.201 18703 4288 1 12 . 1 1 49 49 GLU CA C 49 56.330 56.330 58.252 -1.922 18703 4289 1 12 . 1 1 49 49 GLU CB C 49 29.602 29.602 29.899 -0.297 18703 4290 1 12 . 1 1 49 49 GLU H H 49 8.486 8.486 8.235 0.251 18703 4291 1 12 . 1 1 50 50 VAL N N 50 122.122 122.122 118.861 3.261 18703 4292 1 12 . 1 1 50 50 VAL HA H 50 3.792 3.792 3.658 0.134 18703 4293 1 12 . 1 1 50 50 VAL C C 50 176.774 176.774 177.550 -0.776 18703 4294 1 12 . 1 1 50 50 VAL CA C 50 64.864 64.864 65.154 -0.290 18703 4295 1 12 . 1 1 50 50 VAL CB C 50 32.179 32.179 31.575 0.604 18703 4296 1 12 . 1 1 50 50 VAL H H 50 8.095 8.095 7.329 0.766 18703 4297 1 12 . 1 1 51 51 LYS N N 51 120.602 120.602 119.309 1.293 18703 4298 1 12 . 1 1 51 51 LYS HA H 51 4.195 4.195 4.040 0.155 18703 4299 1 12 . 1 1 51 51 LYS C C 51 178.530 178.530 178.135 0.395 18703 4300 1 12 . 1 1 51 51 LYS CA C 51 59.348 59.348 59.094 0.253 18703 4301 1 12 . 1 1 51 51 LYS CB C 51 32.265 32.265 32.305 -0.040 18703 4302 1 12 . 1 1 51 51 LYS H H 51 8.268 8.268 7.508 0.760 18703 4303 1 12 . 1 1 52 52 LYS N N 52 117.547 117.547 120.028 -2.481 18703 4304 1 12 . 1 1 52 52 LYS HA H 52 4.162 4.162 4.088 0.074 18703 4305 1 12 . 1 1 52 52 LYS C C 52 179.132 179.132 179.106 0.026 18703 4306 1 12 . 1 1 52 52 LYS CA C 52 58.811 58.811 59.213 -0.402 18703 4307 1 12 . 1 1 52 52 LYS CB C 52 32.054 32.054 32.410 -0.356 18703 4308 1 12 . 1 1 52 52 LYS H H 52 7.595 7.595 7.584 0.011 18703 4309 1 12 . 1 1 53 53 VAL N N 53 119.190 119.190 119.630 -0.440 18703 4310 1 12 . 1 1 53 53 VAL HA H 53 3.767 3.767 3.665 0.102 18703 4311 1 12 . 1 1 53 53 VAL C C 53 177.933 177.933 177.734 0.199 18703 4312 1 12 . 1 1 53 53 VAL CA C 53 66.065 66.065 66.150 -0.085 18703 4313 1 12 . 1 1 53 53 VAL CB C 53 31.248 31.248 30.857 0.391 18703 4314 1 12 . 1 1 53 53 VAL H H 53 7.597 7.597 7.683 -0.086 18703 4315 1 12 . 1 1 54 54 GLU N N 54 120.226 120.226 119.508 0.718 18703 4316 1 12 . 1 1 54 54 GLU HA H 54 3.833 3.833 4.035 -0.202 18703 4317 1 12 . 1 1 54 54 GLU C C 54 179.352 179.352 178.646 0.706 18703 4318 1 12 . 1 1 54 54 GLU CA C 54 59.153 59.153 59.670 -0.517 18703 4319 1 12 . 1 1 54 54 GLU CB C 54 29.224 29.224 29.363 -0.139 18703 4320 1 12 . 1 1 54 54 GLU H H 54 8.609 8.609 7.752 0.857 18703 4321 1 12 . 1 1 55 55 GLU N N 55 119.148 119.148 119.224 -0.076 18703 4322 1 12 . 1 1 55 55 GLU HA H 55 4.084 4.084 4.125 -0.041 18703 4323 1 12 . 1 1 55 55 GLU C C 55 179.084 179.084 178.792 0.292 18703 4324 1 12 . 1 1 55 55 GLU CA C 55 59.295 59.295 58.976 0.319 18703 4325 1 12 . 1 1 55 55 GLU CB C 55 29.361 29.361 29.715 -0.354 18703 4326 1 12 . 1 1 55 55 GLU H H 55 7.713 7.713 7.996 -0.283 18703 4327 1 12 . 1 1 56 56 GLU N N 56 120.301 120.301 118.923 1.378 18703 4328 1 12 . 1 1 56 56 GLU HA H 56 4.079 4.079 4.143 -0.064 18703 4329 1 12 . 1 1 56 56 GLU C C 56 179.773 179.773 179.165 0.608 18703 4330 1 12 . 1 1 56 56 GLU CA C 56 59.528 59.528 59.237 0.291 18703 4331 1 12 . 1 1 56 56 GLU CB C 56 30.162 30.162 29.756 0.406 18703 4332 1 12 . 1 1 56 56 GLU H H 56 7.899 7.899 7.556 0.343 18703 4333 1 12 . 1 1 57 57 VAL N N 57 121.536 121.536 118.757 2.779 18703 4334 1 12 . 1 1 57 57 VAL HA H 57 3.540 3.540 3.894 -0.354 18703 4335 1 12 . 1 1 57 57 VAL C C 57 176.984 176.984 177.775 -0.791 18703 4336 1 12 . 1 1 57 57 VAL CA C 57 66.734 66.734 65.506 1.228 18703 4337 1 12 . 1 1 57 57 VAL CB C 57 31.425 31.425 31.173 0.252 18703 4338 1 12 . 1 1 57 57 VAL H H 57 8.652 8.652 7.481 1.171 18703 4339 1 12 . 1 1 58 58 LYS N N 58 120.219 120.219 120.150 0.069 18703 4340 1 12 . 1 1 58 58 LYS HA H 58 4.199 4.199 4.091 0.108 18703 4341 1 12 . 1 1 58 58 LYS C C 58 178.972 178.972 178.641 0.331 18703 4342 1 12 . 1 1 58 58 LYS CA C 58 59.357 59.357 59.596 -0.239 18703 4343 1 12 . 1 1 58 58 LYS CB C 58 32.186 32.186 32.138 0.048 18703 4344 1 12 . 1 1 58 58 LYS H H 58 7.791 7.791 7.427 0.364 18703 4345 1 12 . 1 1 59 59 LYS N N 59 118.252 118.252 119.615 -1.363 18703 4346 1 12 . 1 1 59 59 LYS HA H 59 4.069 4.069 4.161 -0.092 18703 4347 1 12 . 1 1 59 59 LYS C C 59 179.180 179.180 178.489 0.691 18703 4348 1 12 . 1 1 59 59 LYS CA C 59 59.285 59.285 58.993 0.292 18703 4349 1 12 . 1 1 59 59 LYS CB C 59 32.345 32.345 32.336 0.010 18703 4350 1 12 . 1 1 59 59 LYS H H 59 7.849 7.849 7.529 0.320 18703 4351 1 12 . 1 1 60 60 LEU N N 60 121.243 121.243 119.706 1.537 18703 4352 1 12 . 1 1 60 60 LEU HA H 60 4.242 4.242 4.151 0.091 18703 4353 1 12 . 1 1 60 60 LEU C C 60 178.413 178.413 178.110 0.303 18703 4354 1 12 . 1 1 60 60 LEU CA C 60 57.798 57.798 57.191 0.606 18703 4355 1 12 . 1 1 60 60 LEU CB C 60 41.150 41.150 42.193 -1.043 18703 4356 1 12 . 1 1 60 60 LEU H H 60 7.825 7.825 7.558 0.267 18703 4357 1 12 . 1 1 61 61 GLU N N 61 118.844 118.844 120.143 -1.299 18703 4358 1 12 . 1 1 61 61 GLU HA H 61 3.800 3.800 3.933 -0.133 18703 4359 1 12 . 1 1 61 61 GLU C C 61 179.078 179.078 178.586 0.492 18703 4360 1 12 . 1 1 61 61 GLU CA C 61 60.104 60.104 60.017 0.087 18703 4361 1 12 . 1 1 61 61 GLU CB C 61 29.864 29.864 29.641 0.223 18703 4362 1 12 . 1 1 61 61 GLU H H 61 8.582 8.582 7.719 0.863 18703 4363 1 12 . 1 1 62 62 GLU N N 62 117.659 117.659 118.745 -1.086 18703 4364 1 12 . 1 1 62 62 GLU HA H 62 3.990 3.990 4.057 -0.067 18703 4365 1 12 . 1 1 62 62 GLU C C 62 178.847 178.847 178.916 -0.069 18703 4366 1 12 . 1 1 62 62 GLU CA C 62 59.067 59.067 58.922 0.145 18703 4367 1 12 . 1 1 62 62 GLU CB C 62 29.440 29.440 29.642 -0.202 18703 4368 1 12 . 1 1 62 62 GLU H H 62 8.032 8.032 7.644 0.388 18703 4369 1 12 . 1 1 63 63 GLU N N 63 119.290 119.290 119.153 0.137 18703 4370 1 12 . 1 1 63 63 GLU HA H 63 4.012 4.012 4.070 -0.058 18703 4371 1 12 . 1 1 63 63 GLU C C 63 179.784 179.784 179.459 0.325 18703 4372 1 12 . 1 1 63 63 GLU CA C 63 59.300 59.300 59.463 -0.163 18703 4373 1 12 . 1 1 63 63 GLU CB C 63 29.728 29.728 29.539 0.189 18703 4374 1 12 . 1 1 63 63 GLU H H 63 7.958 7.958 7.486 0.472 18703 4375 1 12 . 1 1 64 64 ILE N N 64 118.453 118.453 118.920 -0.467 18703 4376 1 12 . 1 1 64 64 ILE HA H 64 3.711 3.711 3.816 -0.105 18703 4377 1 12 . 1 1 64 64 ILE C C 64 177.655 177.655 177.278 0.377 18703 4378 1 12 . 1 1 64 64 ILE CA C 64 64.256 64.256 63.888 0.368 18703 4379 1 12 . 1 1 64 64 ILE CB C 64 38.002 38.002 37.574 0.428 18703 4380 1 12 . 1 1 64 64 ILE H H 64 8.160 8.160 7.550 0.610 18703 4381 1 12 . 1 1 65 65 LYS N N 65 118.871 118.871 118.305 0.566 18703 4382 1 12 . 1 1 65 65 LYS HA H 65 4.111 4.111 4.154 -0.043 18703 4383 1 12 . 1 1 65 65 LYS C C 65 177.076 177.076 177.513 -0.437 18703 4384 1 12 . 1 1 65 65 LYS CA C 65 58.421 58.421 58.311 0.110 18703 4385 1 12 . 1 1 65 65 LYS CB C 65 32.639 32.639 32.303 0.336 18703 4386 1 12 . 1 1 65 65 LYS H H 65 7.664 7.664 7.610 0.054 18703 4387 1 12 . 1 1 66 66 LYS N N 66 116.944 116.944 118.052 -1.108 18703 4388 1 12 . 1 1 66 66 LYS HA H 66 4.320 4.320 4.095 0.225 18703 4389 1 12 . 1 1 66 66 LYS C C 66 175.897 175.897 177.437 -1.540 18703 4390 1 12 . 1 1 66 66 LYS CA C 66 56.352 56.352 58.328 -1.976 18703 4391 1 12 . 1 1 66 66 LYS CB C 66 33.024 33.024 32.835 0.189 18703 4392 1 12 . 1 1 66 66 LYS H H 66 7.246 7.246 7.667 -0.421 18703 4393 1 13 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.321 -0.075 18703 4394 1 13 . 1 1 3 3 ARG C C 3 178.379 178.379 177.171 1.208 18703 4395 1 13 . 1 1 3 3 ARG CA C 3 58.367 58.367 57.369 0.998 18703 4396 1 13 . 1 1 3 3 ARG CB C 3 30.691 30.691 30.654 0.037 18703 4397 1 13 . 1 1 3 3 ARG H H 3 7.905 7.905 8.067 -0.162 18703 4398 1 13 . 1 1 4 4 VAL N N 4 118.966 118.966 121.321 -2.355 18703 4399 1 13 . 1 1 4 4 VAL HA H 4 3.803 3.803 3.846 -0.043 18703 4400 1 13 . 1 1 4 4 VAL C C 4 176.968 176.968 176.808 0.160 18703 4401 1 13 . 1 1 4 4 VAL CA C 4 65.441 65.441 64.384 1.057 18703 4402 1 13 . 1 1 4 4 VAL CB C 4 31.710 31.710 31.542 0.168 18703 4403 1 13 . 1 1 4 4 VAL H H 4 8.070 8.070 8.247 -0.177 18703 4404 1 13 . 1 1 5 5 LYS N N 5 122.058 122.058 118.116 3.942 18703 4405 1 13 . 1 1 5 5 LYS HA H 5 4.154 4.154 4.046 0.108 18703 4406 1 13 . 1 1 5 5 LYS C C 5 178.553 178.553 178.813 -0.260 18703 4407 1 13 . 1 1 5 5 LYS CA C 5 58.712 58.712 59.419 -0.707 18703 4408 1 13 . 1 1 5 5 LYS CB C 5 31.788 31.788 32.128 -0.340 18703 4409 1 13 . 1 1 5 5 LYS H H 5 7.798 7.798 8.439 -0.641 18703 4410 1 13 . 1 1 6 6 ALA N N 6 119.955 119.955 121.306 -1.351 18703 4411 1 13 . 1 1 6 6 ALA HA H 6 4.198 4.198 4.213 -0.015 18703 4412 1 13 . 1 1 6 6 ALA C C 6 180.974 180.974 179.266 1.708 18703 4413 1 13 . 1 1 6 6 ALA CA C 6 54.850 54.850 54.356 0.494 18703 4414 1 13 . 1 1 6 6 ALA CB C 6 17.995 17.995 18.422 -0.427 18703 4415 1 13 . 1 1 6 6 ALA H H 6 7.928 7.928 7.448 0.480 18703 4416 1 13 . 1 1 7 7 LEU N N 7 119.211 119.211 118.532 0.679 18703 4417 1 13 . 1 1 7 7 LEU HA H 7 4.124 4.124 4.009 0.115 18703 4418 1 13 . 1 1 7 7 LEU C C 7 178.353 178.353 178.309 0.044 18703 4419 1 13 . 1 1 7 7 LEU CA C 7 57.658 57.658 57.400 0.258 18703 4420 1 13 . 1 1 7 7 LEU CB C 7 41.971 41.971 41.957 0.014 18703 4421 1 13 . 1 1 7 7 LEU H H 7 7.594 7.594 7.381 0.213 18703 4422 1 13 . 1 1 8 8 GLU N N 8 120.258 120.258 117.525 2.733 18703 4423 1 13 . 1 1 8 8 GLU HA H 8 3.846 3.846 4.028 -0.182 18703 4424 1 13 . 1 1 8 8 GLU C C 8 179.546 179.546 178.408 1.138 18703 4425 1 13 . 1 1 8 8 GLU CA C 8 60.006 60.006 59.469 0.537 18703 4426 1 13 . 1 1 8 8 GLU CB C 8 29.683 29.683 29.450 0.233 18703 4427 1 13 . 1 1 8 8 GLU H H 8 8.382 8.382 7.916 0.466 18703 4428 1 13 . 1 1 9 9 GLU N N 9 118.584 118.584 118.752 -0.168 18703 4429 1 13 . 1 1 9 9 GLU HA H 9 4.039 4.039 4.140 -0.101 18703 4430 1 13 . 1 1 9 9 GLU C C 9 179.635 179.635 178.583 1.052 18703 4431 1 13 . 1 1 9 9 GLU CA C 9 59.235 59.235 58.548 0.687 18703 4432 1 13 . 1 1 9 9 GLU CB C 9 29.358 29.358 29.120 0.238 18703 4433 1 13 . 1 1 9 9 GLU H H 9 7.908 7.908 7.640 0.268 18703 4434 1 13 . 1 1 10 10 LYS N N 10 120.956 120.956 120.346 0.610 18703 4435 1 13 . 1 1 10 10 LYS HA H 10 4.190 4.190 4.113 0.077 18703 4436 1 13 . 1 1 10 10 LYS C C 10 179.395 179.395 178.991 0.404 18703 4437 1 13 . 1 1 10 10 LYS CA C 10 59.231 59.231 59.369 -0.138 18703 4438 1 13 . 1 1 10 10 LYS CB C 10 32.211 32.211 32.641 -0.430 18703 4439 1 13 . 1 1 10 10 LYS H H 10 8.009 8.009 7.403 0.606 18703 4440 1 13 . 1 1 11 11 VAL N N 11 119.577 119.577 117.493 2.084 18703 4441 1 13 . 1 1 11 11 VAL HA H 11 3.844 3.844 3.760 0.084 18703 4442 1 13 . 1 1 11 11 VAL C C 11 177.078 177.078 177.544 -0.466 18703 4443 1 13 . 1 1 11 11 VAL CA C 11 66.407 66.407 65.976 0.431 18703 4444 1 13 . 1 1 11 11 VAL CB C 11 31.252 31.252 31.312 -0.060 18703 4445 1 13 . 1 1 11 11 VAL H H 11 8.488 8.488 7.471 1.017 18703 4446 1 13 . 1 1 12 12 LYS N N 12 122.864 122.864 120.189 2.675 18703 4447 1 13 . 1 1 12 12 LYS HA H 12 4.189 4.189 3.944 0.245 18703 4448 1 13 . 1 1 12 12 LYS C C 12 178.755 178.755 178.539 0.216 18703 4449 1 13 . 1 1 12 12 LYS CA C 12 59.375 59.375 59.812 -0.437 18703 4450 1 13 . 1 1 12 12 LYS CB C 12 31.991 31.991 32.205 -0.214 18703 4451 1 13 . 1 1 12 12 LYS H H 12 7.944 7.944 7.595 0.349 18703 4452 1 13 . 1 1 13 13 ALA N N 13 121.202 121.202 120.614 0.588 18703 4453 1 13 . 1 1 13 13 ALA HA H 13 4.209 4.209 4.282 -0.073 18703 4454 1 13 . 1 1 13 13 ALA C C 13 181.060 181.060 179.391 1.669 18703 4455 1 13 . 1 1 13 13 ALA CA C 13 54.710 54.710 54.243 0.466 18703 4456 1 13 . 1 1 13 13 ALA CB C 13 17.861 17.861 18.434 -0.573 18703 4457 1 13 . 1 1 13 13 ALA H H 13 7.563 7.563 7.469 0.094 18703 4458 1 13 . 1 1 14 14 LEU N N 14 120.014 120.014 119.582 0.432 18703 4459 1 13 . 1 1 14 14 LEU HA H 14 4.072 4.072 4.014 0.058 18703 4460 1 13 . 1 1 14 14 LEU C C 14 177.862 177.862 178.240 -0.378 18703 4461 1 13 . 1 1 14 14 LEU CA C 14 57.864 57.864 57.340 0.524 18703 4462 1 13 . 1 1 14 14 LEU CB C 14 41.539 41.539 42.071 -0.532 18703 4463 1 13 . 1 1 14 14 LEU H H 14 8.087 8.087 7.504 0.583 18703 4464 1 13 . 1 1 15 15 GLU N N 15 121.644 121.644 119.968 1.676 18703 4465 1 13 . 1 1 15 15 GLU HA H 15 3.692 3.692 4.012 -0.320 18703 4466 1 13 . 1 1 15 15 GLU C C 15 177.819 177.819 178.343 -0.524 18703 4467 1 13 . 1 1 15 15 GLU CA C 15 59.239 59.239 59.151 0.088 18703 4468 1 13 . 1 1 15 15 GLU CB C 15 28.865 28.865 29.640 -0.775 18703 4469 1 13 . 1 1 15 15 GLU H H 15 8.542 8.542 7.636 0.906 18703 4470 1 13 . 1 1 16 16 GLU N N 16 116.016 116.016 118.519 -2.503 18703 4471 1 13 . 1 1 16 16 GLU HA H 16 3.955 3.955 3.980 -0.025 18703 4472 1 13 . 1 1 16 16 GLU C C 16 179.159 179.159 178.974 0.185 18703 4473 1 13 . 1 1 16 16 GLU CA C 16 59.324 59.324 59.198 0.126 18703 4474 1 13 . 1 1 16 16 GLU CB C 16 29.060 29.060 29.197 -0.137 18703 4475 1 13 . 1 1 16 16 GLU H H 16 7.492 7.492 7.844 -0.352 18703 4476 1 13 . 1 1 17 17 LYS N N 17 118.546 118.546 117.934 0.612 18703 4477 1 13 . 1 1 17 17 LYS HA H 17 4.117 4.117 4.178 -0.061 18703 4478 1 13 . 1 1 17 17 LYS C C 17 178.976 178.976 178.365 0.611 18703 4479 1 13 . 1 1 17 17 LYS CA C 17 58.837 58.837 58.357 0.480 18703 4480 1 13 . 1 1 17 17 LYS CB C 17 32.538 32.538 32.330 0.208 18703 4481 1 13 . 1 1 17 17 LYS H H 17 7.720 7.720 7.546 0.174 18703 4482 1 13 . 1 1 18 18 VAL N N 18 118.376 118.376 119.292 -0.916 18703 4483 1 13 . 1 1 18 18 VAL HA H 18 3.711 3.711 3.830 -0.119 18703 4484 1 13 . 1 1 18 18 VAL C C 18 178.765 178.765 178.369 0.396 18703 4485 1 13 . 1 1 18 18 VAL CA C 18 66.237 66.237 65.414 0.823 18703 4486 1 13 . 1 1 18 18 VAL CB C 18 31.682 31.682 31.429 0.253 18703 4487 1 13 . 1 1 18 18 VAL H H 18 8.754 8.754 7.658 1.096 18703 4488 1 13 . 1 1 19 19 LYS N N 19 118.817 118.817 119.866 -1.049 18703 4489 1 13 . 1 1 19 19 LYS HA H 19 4.078 4.078 3.999 0.079 18703 4490 1 13 . 1 1 19 19 LYS C C 19 178.049 178.049 178.114 -0.065 18703 4491 1 13 . 1 1 19 19 LYS CA C 19 59.731 59.731 59.208 0.523 18703 4492 1 13 . 1 1 19 19 LYS CB C 19 32.523 32.523 31.870 0.653 18703 4493 1 13 . 1 1 19 19 LYS H H 19 8.299 8.299 8.457 -0.158 18703 4494 1 13 . 1 1 20 20 ALA N N 20 119.656 119.656 119.063 0.593 18703 4495 1 13 . 1 1 20 20 ALA HA H 20 4.347 4.347 4.344 0.003 18703 4496 1 13 . 1 1 20 20 ALA C C 20 178.532 178.532 177.972 0.560 18703 4497 1 13 . 1 1 20 20 ALA CA C 20 52.853 52.853 52.465 0.389 18703 4498 1 13 . 1 1 20 20 ALA CB C 20 18.832 18.832 19.541 -0.709 18703 4499 1 13 . 1 1 20 20 ALA H H 20 7.425 7.425 7.809 -0.384 18703 4500 1 13 . 1 1 21 21 LEU N N 21 118.594 118.594 118.093 0.501 18703 4501 1 13 . 1 1 21 21 LEU HA H 21 4.297 4.297 4.696 -0.399 18703 4502 1 13 . 1 1 21 21 LEU C C 21 177.784 177.784 176.421 1.363 18703 4503 1 13 . 1 1 21 21 LEU CA C 21 55.750 55.750 54.382 1.368 18703 4504 1 13 . 1 1 21 21 LEU CB C 21 42.898 42.898 43.334 -0.436 18703 4505 1 13 . 1 1 21 21 LEU H H 21 7.508 7.508 7.610 -0.102 18703 4506 1 13 . 1 1 22 22 GLY N N 22 106.650 106.650 105.391 1.259 18703 4507 1 13 . 1 1 22 22 GLY C C 22 173.605 173.605 173.167 0.438 18703 4508 1 13 . 1 1 22 22 GLY CA C 22 45.330 45.330 44.947 0.383 18703 4509 1 13 . 1 1 22 22 GLY H H 22 7.814 7.814 8.304 -0.490 18703 4510 1 13 . 1 1 23 23 GLY N N 23 108.011 108.011 107.617 0.394 18703 4511 1 13 . 1 1 23 23 GLY C C 23 174.061 174.061 173.094 0.967 18703 4512 1 13 . 1 1 23 23 GLY CA C 23 44.772 44.772 45.208 -0.436 18703 4513 1 13 . 1 1 23 23 GLY H H 23 8.139 8.139 8.409 -0.270 18703 4514 1 13 . 1 1 24 24 GLY N N 24 107.826 107.826 106.255 1.571 18703 4515 1 13 . 1 1 24 24 GLY C C 24 175.046 175.046 173.999 1.047 18703 4516 1 13 . 1 1 24 24 GLY CA C 24 44.422 44.422 44.998 -0.576 18703 4517 1 13 . 1 1 24 24 GLY H H 24 8.497 8.497 8.217 0.280 18703 4518 1 13 . 1 1 25 25 GLY N N 25 108.830 108.830 109.937 -1.107 18703 4519 1 13 . 1 1 25 25 GLY C C 25 176.272 176.272 176.025 0.247 18703 4520 1 13 . 1 1 25 25 GLY CA C 25 47.101 47.101 45.477 1.624 18703 4521 1 13 . 1 1 25 25 GLY H H 25 8.616 8.616 8.134 0.482 18703 4522 1 13 . 1 1 26 26 ARG N N 26 123.109 123.109 124.264 -1.155 18703 4523 1 13 . 1 1 26 26 ARG HA H 26 4.283 4.283 4.093 0.190 18703 4524 1 13 . 1 1 26 26 ARG C C 26 177.848 177.848 178.581 -0.733 18703 4525 1 13 . 1 1 26 26 ARG CA C 26 57.663 57.663 58.097 -0.434 18703 4526 1 13 . 1 1 26 26 ARG CB C 26 29.811 29.811 30.017 -0.206 18703 4527 1 13 . 1 1 26 26 ARG H H 26 8.770 8.770 8.147 0.623 18703 4528 1 13 . 1 1 27 27 ILE N N 27 118.104 118.104 119.059 -0.955 18703 4529 1 13 . 1 1 27 27 ILE HA H 27 3.787 3.787 3.665 0.122 18703 4530 1 13 . 1 1 27 27 ILE C C 27 177.473 177.473 177.634 -0.161 18703 4531 1 13 . 1 1 27 27 ILE CA C 27 63.036 63.036 64.975 -1.939 18703 4532 1 13 . 1 1 27 27 ILE CB C 27 36.664 36.664 37.462 -0.798 18703 4533 1 13 . 1 1 27 27 ILE H H 27 7.708 7.708 8.470 -0.762 18703 4534 1 13 . 1 1 28 28 GLU N N 28 119.934 119.934 119.329 0.605 18703 4535 1 13 . 1 1 28 28 GLU HA H 28 3.954 3.954 3.873 0.081 18703 4536 1 13 . 1 1 28 28 GLU C C 28 179.514 179.514 178.851 0.663 18703 4537 1 13 . 1 1 28 28 GLU CA C 28 59.450 59.450 60.034 -0.584 18703 4538 1 13 . 1 1 28 28 GLU CB C 28 29.600 29.600 29.106 0.494 18703 4539 1 13 . 1 1 28 28 GLU H H 28 7.872 7.872 8.229 -0.357 18703 4540 1 13 . 1 1 29 29 GLU N N 29 118.134 118.134 119.618 -1.484 18703 4541 1 13 . 1 1 29 29 GLU HA H 29 4.028 4.028 4.074 -0.046 18703 4542 1 13 . 1 1 29 29 GLU C C 29 179.182 179.182 179.094 0.088 18703 4543 1 13 . 1 1 29 29 GLU CA C 29 59.173 59.173 59.245 -0.071 18703 4544 1 13 . 1 1 29 29 GLU CB C 29 29.503 29.503 29.423 0.080 18703 4545 1 13 . 1 1 29 29 GLU H H 29 8.166 8.166 7.539 0.627 18703 4546 1 13 . 1 1 30 30 LEU N N 30 120.242 120.242 117.644 2.598 18703 4547 1 13 . 1 1 30 30 LEU HA H 30 4.028 4.028 4.014 0.014 18703 4548 1 13 . 1 1 30 30 LEU C C 30 178.796 178.796 178.691 0.105 18703 4549 1 13 . 1 1 30 30 LEU CA C 30 57.654 57.654 57.375 0.279 18703 4550 1 13 . 1 1 30 30 LEU CB C 30 41.629 41.629 41.759 -0.130 18703 4551 1 13 . 1 1 30 30 LEU H H 30 7.695 7.695 7.584 0.111 18703 4552 1 13 . 1 1 31 31 LYS N N 31 120.506 120.506 119.535 0.971 18703 4553 1 13 . 1 1 31 31 LYS HA H 31 3.532 3.532 4.062 -0.530 18703 4554 1 13 . 1 1 31 31 LYS C C 31 178.919 178.919 178.303 0.616 18703 4555 1 13 . 1 1 31 31 LYS CA C 31 60.240 60.240 59.186 1.054 18703 4556 1 13 . 1 1 31 31 LYS CB C 31 32.015 32.015 32.474 -0.459 18703 4557 1 13 . 1 1 31 31 LYS H H 31 8.561 8.561 7.662 0.899 18703 4558 1 13 . 1 1 32 32 LYS N N 32 118.566 118.566 119.066 -0.500 18703 4559 1 13 . 1 1 32 32 LYS C C 32 179.392 179.392 179.046 0.346 18703 4560 1 13 . 1 1 32 32 LYS CA C 32 59.356 59.356 59.782 -0.426 18703 4561 1 13 . 1 1 32 32 LYS CB C 32 32.117 32.117 32.203 -0.085 18703 4562 1 13 . 1 1 32 32 LYS H H 32 7.699 7.699 7.502 0.197 18703 4563 1 13 . 1 1 33 33 LYS N N 33 118.964 118.964 118.885 0.079 18703 4564 1 13 . 1 1 33 33 LYS HA H 33 4.117 4.117 4.206 -0.089 18703 4565 1 13 . 1 1 33 33 LYS C C 33 178.355 178.355 178.846 -0.491 18703 4566 1 13 . 1 1 33 33 LYS CA C 33 58.633 58.633 59.082 -0.449 18703 4567 1 13 . 1 1 33 33 LYS CB C 33 31.904 31.904 32.435 -0.531 18703 4568 1 13 . 1 1 33 33 LYS H H 33 7.752 7.752 7.557 0.195 18703 4569 1 13 . 1 1 34 34 CYS N N 34 119.956 119.956 118.200 1.756 18703 4570 1 13 . 1 1 34 34 CYS HA H 34 3.967 3.967 4.085 -0.118 18703 4571 1 13 . 1 1 34 34 CYS C C 34 175.521 175.521 176.920 -1.399 18703 4572 1 13 . 1 1 34 34 CYS CA C 34 60.987 60.987 63.029 -2.042 18703 4573 1 13 . 1 1 34 34 CYS CB C 34 36.600 36.600 26.509 10.091 18703 4574 1 13 . 1 1 34 34 CYS H H 34 8.393 8.393 7.775 0.618 18703 4575 1 13 . 1 1 35 35 GLU N N 35 120.327 120.327 119.696 0.631 18703 4576 1 13 . 1 1 35 35 GLU HA H 35 3.891 3.891 3.909 -0.018 18703 4577 1 13 . 1 1 35 35 GLU C C 35 179.684 179.684 178.553 1.131 18703 4578 1 13 . 1 1 35 35 GLU CA C 35 60.059 60.059 59.455 0.604 18703 4579 1 13 . 1 1 35 35 GLU CB C 35 29.718 29.718 28.950 0.769 18703 4580 1 13 . 1 1 35 35 GLU H H 35 8.558 8.558 7.803 0.755 18703 4581 1 13 . 1 1 36 36 GLU N N 36 120.190 120.190 119.515 0.675 18703 4582 1 13 . 1 1 36 36 GLU HA H 36 4.051 4.051 3.935 0.116 18703 4583 1 13 . 1 1 36 36 GLU C C 36 179.408 179.408 179.008 0.400 18703 4584 1 13 . 1 1 36 36 GLU CA C 36 59.148 59.148 58.788 0.360 18703 4585 1 13 . 1 1 36 36 GLU CB C 36 29.766 29.766 28.964 0.802 18703 4586 1 13 . 1 1 36 36 GLU H H 36 8.038 8.038 7.840 0.198 18703 4587 1 13 . 1 1 37 37 LEU N N 37 121.102 121.102 120.500 0.602 18703 4588 1 13 . 1 1 37 37 LEU HA H 37 4.079 4.079 4.150 -0.071 18703 4589 1 13 . 1 1 37 37 LEU C C 37 178.279 178.279 178.192 0.087 18703 4590 1 13 . 1 1 37 37 LEU CA C 37 57.803 57.803 57.348 0.455 18703 4591 1 13 . 1 1 37 37 LEU CB C 37 41.502 41.502 41.837 -0.335 18703 4592 1 13 . 1 1 37 37 LEU H H 37 8.065 8.065 7.509 0.556 18703 4593 1 13 . 1 1 38 38 LYS N N 38 119.980 119.980 119.096 0.884 18703 4594 1 13 . 1 1 38 38 LYS HA H 38 3.851 3.851 3.911 -0.060 18703 4595 1 13 . 1 1 38 38 LYS C C 38 178.919 178.919 179.152 -0.233 18703 4596 1 13 . 1 1 38 38 LYS CA C 38 60.794 60.794 59.737 1.057 18703 4597 1 13 . 1 1 38 38 LYS CB C 38 32.863 32.863 32.242 0.621 18703 4598 1 13 . 1 1 38 38 LYS H H 38 8.741 8.741 7.936 0.805 18703 4599 1 13 . 1 1 39 39 LYS N N 39 118.307 118.307 117.291 1.016 18703 4600 1 13 . 1 1 39 39 LYS HA H 39 4.125 4.125 3.929 0.196 18703 4601 1 13 . 1 1 39 39 LYS C C 39 178.622 178.622 178.433 0.189 18703 4602 1 13 . 1 1 39 39 LYS CA C 39 58.993 58.993 59.448 -0.455 18703 4603 1 13 . 1 1 39 39 LYS CB C 39 32.097 32.097 31.583 0.514 18703 4604 1 13 . 1 1 39 39 LYS H H 39 7.584 7.584 7.719 -0.135 18703 4605 1 13 . 1 1 40 40 LYS N N 40 118.826 118.826 119.696 -0.870 18703 4606 1 13 . 1 1 40 40 LYS HA H 40 4.069 4.069 4.119 -0.050 18703 4607 1 13 . 1 1 40 40 LYS C C 40 179.802 179.802 178.998 0.804 18703 4608 1 13 . 1 1 40 40 LYS CA C 40 59.322 59.322 58.849 0.473 18703 4609 1 13 . 1 1 40 40 LYS CB C 40 32.505 32.505 32.364 0.141 18703 4610 1 13 . 1 1 40 40 LYS H H 40 7.945 7.945 7.368 0.577 18703 4611 1 13 . 1 1 41 41 ILE N N 41 118.958 118.958 118.001 0.957 18703 4612 1 13 . 1 1 41 41 ILE HA H 41 3.659 3.659 3.826 -0.167 18703 4613 1 13 . 1 1 41 41 ILE C C 41 178.146 178.146 176.974 1.172 18703 4614 1 13 . 1 1 41 41 ILE CA C 41 65.037 65.037 64.010 1.027 18703 4615 1 13 . 1 1 41 41 ILE CB C 41 37.950 37.950 37.897 0.053 18703 4616 1 13 . 1 1 41 41 ILE H H 41 8.369 8.369 7.977 0.392 18703 4617 1 13 . 1 1 42 42 GLU N N 42 120.331 120.331 117.130 3.201 18703 4618 1 13 . 1 1 42 42 GLU HA H 42 4.094 4.094 4.125 -0.031 18703 4619 1 13 . 1 1 42 42 GLU C C 42 178.697 178.697 177.438 1.259 18703 4620 1 13 . 1 1 42 42 GLU CA C 42 58.927 58.927 58.647 0.280 18703 4621 1 13 . 1 1 42 42 GLU CB C 42 29.399 29.399 30.237 -0.838 18703 4622 1 13 . 1 1 42 42 GLU H H 42 7.805 7.805 7.611 0.194 18703 4623 1 13 . 1 1 43 43 GLU N N 43 117.120 117.120 116.471 0.649 18703 4624 1 13 . 1 1 43 43 GLU HA H 43 4.291 4.291 4.220 0.071 18703 4625 1 13 . 1 1 43 43 GLU C C 43 177.551 177.551 177.597 -0.046 18703 4626 1 13 . 1 1 43 43 GLU CA C 43 56.800 56.800 57.124 -0.324 18703 4627 1 13 . 1 1 43 43 GLU CB C 43 29.931 29.931 29.759 0.171 18703 4628 1 13 . 1 1 43 43 GLU H H 43 7.701 7.701 7.556 0.145 18703 4629 1 13 . 1 1 44 44 LEU N N 44 120.940 120.940 121.229 -0.289 18703 4630 1 13 . 1 1 44 44 LEU HA H 44 4.251 4.251 4.191 0.060 18703 4631 1 13 . 1 1 44 44 LEU C C 44 178.596 178.596 176.783 1.813 18703 4632 1 13 . 1 1 44 44 LEU CA C 44 56.448 56.448 55.181 1.267 18703 4633 1 13 . 1 1 44 44 LEU CB C 44 42.519 42.519 42.761 -0.242 18703 4634 1 13 . 1 1 44 44 LEU H H 44 7.581 7.581 7.288 0.293 18703 4635 1 13 . 1 1 45 45 GLY N N 45 108.689 108.689 108.724 -0.035 18703 4636 1 13 . 1 1 45 45 GLY C C 45 174.853 174.853 174.339 0.514 18703 4637 1 13 . 1 1 45 45 GLY CA C 45 46.233 46.233 44.334 1.899 18703 4638 1 13 . 1 1 45 45 GLY H H 45 8.232 8.232 8.278 -0.046 18703 4639 1 13 . 1 1 46 46 GLY N N 46 108.029 108.029 108.752 -0.723 18703 4640 1 13 . 1 1 46 46 GLY C C 46 174.351 174.351 174.307 0.044 18703 4641 1 13 . 1 1 46 46 GLY CA C 46 45.105 45.105 44.527 0.578 18703 4642 1 13 . 1 1 46 46 GLY H H 46 8.176 8.176 8.132 0.044 18703 4643 1 13 . 1 1 47 47 GLY N N 47 108.183 108.183 108.508 -0.325 18703 4644 1 13 . 1 1 47 47 GLY C C 47 174.671 174.671 174.469 0.202 18703 4645 1 13 . 1 1 47 47 GLY CA C 47 45.254 45.254 44.843 0.411 18703 4646 1 13 . 1 1 47 47 GLY H H 47 8.290 8.290 7.991 0.299 18703 4647 1 13 . 1 1 48 48 GLY N N 48 108.616 108.616 109.222 -0.606 18703 4648 1 13 . 1 1 48 48 GLY C C 48 174.321 174.321 176.150 -1.829 18703 4649 1 13 . 1 1 48 48 GLY CA C 48 45.192 45.192 45.597 -0.405 18703 4650 1 13 . 1 1 48 48 GLY H H 48 8.027 8.027 8.700 -0.673 18703 4651 1 13 . 1 1 49 49 GLU N N 49 121.057 121.057 122.041 -0.984 18703 4652 1 13 . 1 1 49 49 GLU HA H 49 4.425 4.425 4.133 0.292 18703 4653 1 13 . 1 1 49 49 GLU C C 49 177.072 177.072 178.486 -1.414 18703 4654 1 13 . 1 1 49 49 GLU CA C 49 56.330 56.330 58.522 -2.192 18703 4655 1 13 . 1 1 49 49 GLU CB C 49 29.602 29.602 29.258 0.344 18703 4656 1 13 . 1 1 49 49 GLU H H 49 8.486 8.486 8.540 -0.054 18703 4657 1 13 . 1 1 50 50 VAL N N 50 122.122 122.122 118.316 3.806 18703 4658 1 13 . 1 1 50 50 VAL HA H 50 3.792 3.792 3.646 0.146 18703 4659 1 13 . 1 1 50 50 VAL C C 50 176.774 176.774 177.246 -0.472 18703 4660 1 13 . 1 1 50 50 VAL CA C 50 64.864 64.864 65.489 -0.625 18703 4661 1 13 . 1 1 50 50 VAL CB C 50 32.179 32.179 30.854 1.325 18703 4662 1 13 . 1 1 50 50 VAL H H 50 8.095 8.095 8.147 -0.052 18703 4663 1 13 . 1 1 51 51 LYS N N 51 120.602 120.602 118.318 2.284 18703 4664 1 13 . 1 1 51 51 LYS HA H 51 4.195 4.195 4.077 0.118 18703 4665 1 13 . 1 1 51 51 LYS C C 51 178.530 178.530 178.719 -0.189 18703 4666 1 13 . 1 1 51 51 LYS CA C 51 59.348 59.348 58.359 0.989 18703 4667 1 13 . 1 1 51 51 LYS CB C 51 32.265 32.265 31.733 0.531 18703 4668 1 13 . 1 1 51 51 LYS H H 51 8.268 8.268 7.811 0.457 18703 4669 1 13 . 1 1 52 52 LYS N N 52 117.547 117.547 120.414 -2.867 18703 4670 1 13 . 1 1 52 52 LYS HA H 52 4.162 4.162 4.078 0.084 18703 4671 1 13 . 1 1 52 52 LYS C C 52 179.132 179.132 179.290 -0.158 18703 4672 1 13 . 1 1 52 52 LYS CA C 52 58.811 58.811 59.305 -0.494 18703 4673 1 13 . 1 1 52 52 LYS CB C 52 32.054 32.054 32.241 -0.187 18703 4674 1 13 . 1 1 52 52 LYS H H 52 7.595 7.595 7.738 -0.143 18703 4675 1 13 . 1 1 53 53 VAL N N 53 119.190 119.190 118.709 0.481 18703 4676 1 13 . 1 1 53 53 VAL HA H 53 3.767 3.767 3.913 -0.146 18703 4677 1 13 . 1 1 53 53 VAL C C 53 177.933 177.933 177.813 0.120 18703 4678 1 13 . 1 1 53 53 VAL CA C 53 66.065 66.065 65.842 0.223 18703 4679 1 13 . 1 1 53 53 VAL CB C 53 31.248 31.248 31.572 -0.324 18703 4680 1 13 . 1 1 53 53 VAL H H 53 7.597 7.597 7.774 -0.177 18703 4681 1 13 . 1 1 54 54 GLU N N 54 120.226 120.226 119.047 1.179 18703 4682 1 13 . 1 1 54 54 GLU HA H 54 3.833 3.833 3.985 -0.152 18703 4683 1 13 . 1 1 54 54 GLU C C 54 179.352 179.352 178.440 0.912 18703 4684 1 13 . 1 1 54 54 GLU CA C 54 59.153 59.153 59.438 -0.285 18703 4685 1 13 . 1 1 54 54 GLU CB C 54 29.224 29.224 29.484 -0.260 18703 4686 1 13 . 1 1 54 54 GLU H H 54 8.609 8.609 7.621 0.988 18703 4687 1 13 . 1 1 55 55 GLU N N 55 119.148 119.148 119.025 0.123 18703 4688 1 13 . 1 1 55 55 GLU HA H 55 4.084 4.084 4.141 -0.057 18703 4689 1 13 . 1 1 55 55 GLU C C 55 179.084 179.084 178.813 0.271 18703 4690 1 13 . 1 1 55 55 GLU CA C 55 59.295 59.295 58.939 0.356 18703 4691 1 13 . 1 1 55 55 GLU CB C 55 29.361 29.361 29.722 -0.361 18703 4692 1 13 . 1 1 55 55 GLU H H 55 7.713 7.713 7.843 -0.130 18703 4693 1 13 . 1 1 56 56 GLU N N 56 120.301 120.301 119.320 0.981 18703 4694 1 13 . 1 1 56 56 GLU HA H 56 4.079 4.079 4.127 -0.048 18703 4695 1 13 . 1 1 56 56 GLU C C 56 179.773 179.773 179.213 0.560 18703 4696 1 13 . 1 1 56 56 GLU CA C 56 59.528 59.528 59.282 0.246 18703 4697 1 13 . 1 1 56 56 GLU CB C 56 30.162 30.162 29.635 0.527 18703 4698 1 13 . 1 1 56 56 GLU H H 56 7.899 7.899 7.581 0.318 18703 4699 1 13 . 1 1 57 57 VAL N N 57 121.536 121.536 118.401 3.135 18703 4700 1 13 . 1 1 57 57 VAL HA H 57 3.540 3.540 3.769 -0.229 18703 4701 1 13 . 1 1 57 57 VAL C C 57 176.984 176.984 177.382 -0.398 18703 4702 1 13 . 1 1 57 57 VAL CA C 57 66.734 66.734 66.011 0.723 18703 4703 1 13 . 1 1 57 57 VAL CB C 57 31.425 31.425 31.593 -0.168 18703 4704 1 13 . 1 1 57 57 VAL H H 57 8.652 8.652 7.596 1.056 18703 4705 1 13 . 1 1 58 58 LYS N N 58 120.219 120.219 120.079 0.140 18703 4706 1 13 . 1 1 58 58 LYS HA H 58 4.199 4.199 4.073 0.126 18703 4707 1 13 . 1 1 58 58 LYS C C 58 178.972 178.972 178.315 0.657 18703 4708 1 13 . 1 1 58 58 LYS CA C 58 59.357 59.357 59.569 -0.212 18703 4709 1 13 . 1 1 58 58 LYS CB C 58 32.186 32.186 32.151 0.035 18703 4710 1 13 . 1 1 58 58 LYS H H 58 7.791 7.791 7.468 0.323 18703 4711 1 13 . 1 1 59 59 LYS N N 59 118.252 118.252 119.565 -1.313 18703 4712 1 13 . 1 1 59 59 LYS HA H 59 4.069 4.069 4.156 -0.087 18703 4713 1 13 . 1 1 59 59 LYS C C 59 179.180 179.180 178.481 0.699 18703 4714 1 13 . 1 1 59 59 LYS CA C 59 59.285 59.285 59.085 0.200 18703 4715 1 13 . 1 1 59 59 LYS CB C 59 32.345 32.345 32.359 -0.014 18703 4716 1 13 . 1 1 59 59 LYS H H 59 7.849 7.849 7.521 0.328 18703 4717 1 13 . 1 1 60 60 LEU N N 60 121.243 121.243 119.744 1.499 18703 4718 1 13 . 1 1 60 60 LEU HA H 60 4.242 4.242 4.152 0.090 18703 4719 1 13 . 1 1 60 60 LEU C C 60 178.413 178.413 178.108 0.305 18703 4720 1 13 . 1 1 60 60 LEU CA C 60 57.798 57.798 57.180 0.618 18703 4721 1 13 . 1 1 60 60 LEU CB C 60 41.150 41.150 42.159 -1.009 18703 4722 1 13 . 1 1 60 60 LEU H H 60 7.825 7.825 7.558 0.267 18703 4723 1 13 . 1 1 61 61 GLU N N 61 118.844 118.844 120.169 -1.325 18703 4724 1 13 . 1 1 61 61 GLU HA H 61 3.800 3.800 3.927 -0.127 18703 4725 1 13 . 1 1 61 61 GLU C C 61 179.078 179.078 178.603 0.475 18703 4726 1 13 . 1 1 61 61 GLU CA C 61 60.104 60.104 60.020 0.084 18703 4727 1 13 . 1 1 61 61 GLU CB C 61 29.864 29.864 29.643 0.221 18703 4728 1 13 . 1 1 61 61 GLU H H 61 8.582 8.582 7.716 0.866 18703 4729 1 13 . 1 1 62 62 GLU N N 62 117.659 117.659 118.683 -1.024 18703 4730 1 13 . 1 1 62 62 GLU HA H 62 3.990 3.990 4.046 -0.056 18703 4731 1 13 . 1 1 62 62 GLU C C 62 178.847 178.847 179.022 -0.175 18703 4732 1 13 . 1 1 62 62 GLU CA C 62 59.067 59.067 59.001 0.067 18703 4733 1 13 . 1 1 62 62 GLU CB C 62 29.440 29.440 29.618 -0.178 18703 4734 1 13 . 1 1 62 62 GLU H H 62 8.032 8.032 7.623 0.409 18703 4735 1 13 . 1 1 63 63 GLU N N 63 119.290 119.290 119.006 0.284 18703 4736 1 13 . 1 1 63 63 GLU HA H 63 4.012 4.012 4.086 -0.074 18703 4737 1 13 . 1 1 63 63 GLU C C 63 179.784 179.784 179.483 0.301 18703 4738 1 13 . 1 1 63 63 GLU CA C 63 59.300 59.300 59.076 0.224 18703 4739 1 13 . 1 1 63 63 GLU CB C 63 29.728 29.728 29.339 0.389 18703 4740 1 13 . 1 1 63 63 GLU H H 63 7.958 7.958 7.510 0.448 18703 4741 1 13 . 1 1 64 64 ILE N N 64 118.453 118.453 119.488 -1.035 18703 4742 1 13 . 1 1 64 64 ILE HA H 64 3.711 3.711 3.807 -0.096 18703 4743 1 13 . 1 1 64 64 ILE C C 64 177.655 177.655 177.755 -0.100 18703 4744 1 13 . 1 1 64 64 ILE CA C 64 64.256 64.256 64.043 0.213 18703 4745 1 13 . 1 1 64 64 ILE CB C 64 38.002 38.002 37.599 0.403 18703 4746 1 13 . 1 1 64 64 ILE H H 64 8.160 8.160 7.588 0.572 18703 4747 1 13 . 1 1 65 65 LYS N N 65 118.871 118.871 119.326 -0.455 18703 4748 1 13 . 1 1 65 65 LYS HA H 65 4.111 4.111 4.125 -0.014 18703 4749 1 13 . 1 1 65 65 LYS C C 65 177.076 177.076 177.641 -0.565 18703 4750 1 13 . 1 1 65 65 LYS CA C 65 58.421 58.421 58.558 -0.137 18703 4751 1 13 . 1 1 65 65 LYS CB C 65 32.639 32.639 32.191 0.447 18703 4752 1 13 . 1 1 65 65 LYS H H 65 7.664 7.664 7.819 -0.155 18703 4753 1 13 . 1 1 66 66 LYS N N 66 116.944 116.944 118.668 -1.724 18703 4754 1 13 . 1 1 66 66 LYS HA H 66 4.320 4.320 4.091 0.229 18703 4755 1 13 . 1 1 66 66 LYS C C 66 175.897 175.897 177.681 -1.784 18703 4756 1 13 . 1 1 66 66 LYS CA C 66 56.352 56.352 58.189 -1.837 18703 4757 1 13 . 1 1 66 66 LYS CB C 66 33.024 33.024 32.782 0.242 18703 4758 1 13 . 1 1 66 66 LYS H H 66 7.246 7.246 7.496 -0.250 18703 4759 1 14 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.462 -0.216 18703 4760 1 14 . 1 1 3 3 ARG C C 3 178.379 178.379 177.474 0.905 18703 4761 1 14 . 1 1 3 3 ARG CA C 3 58.367 58.367 56.937 1.430 18703 4762 1 14 . 1 1 3 3 ARG CB C 3 30.691 30.691 30.841 -0.150 18703 4763 1 14 . 1 1 3 3 ARG H H 3 7.905 7.905 8.649 -0.744 18703 4764 1 14 . 1 1 4 4 VAL N N 4 118.966 118.966 119.707 -0.741 18703 4765 1 14 . 1 1 4 4 VAL HA H 4 3.803 3.803 3.702 0.101 18703 4766 1 14 . 1 1 4 4 VAL C C 4 176.968 176.968 177.413 -0.445 18703 4767 1 14 . 1 1 4 4 VAL CA C 4 65.441 65.441 65.965 -0.524 18703 4768 1 14 . 1 1 4 4 VAL CB C 4 31.710 31.710 31.831 -0.121 18703 4769 1 14 . 1 1 4 4 VAL H H 4 8.070 8.070 8.395 -0.325 18703 4770 1 14 . 1 1 5 5 LYS N N 5 122.058 122.058 120.076 1.982 18703 4771 1 14 . 1 1 5 5 LYS HA H 5 4.154 4.154 4.171 -0.017 18703 4772 1 14 . 1 1 5 5 LYS C C 5 178.553 178.553 178.905 -0.352 18703 4773 1 14 . 1 1 5 5 LYS CA C 5 58.712 58.712 59.575 -0.863 18703 4774 1 14 . 1 1 5 5 LYS CB C 5 31.788 31.788 32.291 -0.503 18703 4775 1 14 . 1 1 5 5 LYS H H 5 7.798 7.798 7.707 0.091 18703 4776 1 14 . 1 1 6 6 ALA N N 6 119.955 119.955 119.496 0.459 18703 4777 1 14 . 1 1 6 6 ALA HA H 6 4.198 4.198 4.250 -0.052 18703 4778 1 14 . 1 1 6 6 ALA C C 6 180.974 180.974 179.169 1.805 18703 4779 1 14 . 1 1 6 6 ALA CA C 6 54.850 54.850 54.136 0.714 18703 4780 1 14 . 1 1 6 6 ALA CB C 6 17.995 17.995 18.420 -0.425 18703 4781 1 14 . 1 1 6 6 ALA H H 6 7.928 7.928 8.038 -0.110 18703 4782 1 14 . 1 1 7 7 LEU N N 7 119.211 119.211 119.631 -0.420 18703 4783 1 14 . 1 1 7 7 LEU HA H 7 4.124 4.124 3.989 0.135 18703 4784 1 14 . 1 1 7 7 LEU C C 7 178.353 178.353 178.616 -0.263 18703 4785 1 14 . 1 1 7 7 LEU CA C 7 57.658 57.658 57.365 0.293 18703 4786 1 14 . 1 1 7 7 LEU CB C 7 41.971 41.971 42.061 -0.090 18703 4787 1 14 . 1 1 7 7 LEU H H 7 7.594 7.594 7.451 0.143 18703 4788 1 14 . 1 1 8 8 GLU N N 8 120.258 120.258 117.950 2.308 18703 4789 1 14 . 1 1 8 8 GLU HA H 8 3.846 3.846 4.022 -0.176 18703 4790 1 14 . 1 1 8 8 GLU C C 8 179.546 179.546 178.744 0.802 18703 4791 1 14 . 1 1 8 8 GLU CA C 8 60.006 60.006 59.489 0.517 18703 4792 1 14 . 1 1 8 8 GLU CB C 8 29.683 29.683 29.520 0.163 18703 4793 1 14 . 1 1 8 8 GLU H H 8 8.382 8.382 7.828 0.554 18703 4794 1 14 . 1 1 9 9 GLU N N 9 118.584 118.584 118.789 -0.205 18703 4795 1 14 . 1 1 9 9 GLU HA H 9 4.039 4.039 4.138 -0.099 18703 4796 1 14 . 1 1 9 9 GLU C C 9 179.635 179.635 178.636 0.999 18703 4797 1 14 . 1 1 9 9 GLU CA C 9 59.235 59.235 58.511 0.724 18703 4798 1 14 . 1 1 9 9 GLU CB C 9 29.358 29.358 29.261 0.097 18703 4799 1 14 . 1 1 9 9 GLU H H 9 7.908 7.908 7.870 0.038 18703 4800 1 14 . 1 1 10 10 LYS N N 10 120.956 120.956 120.461 0.495 18703 4801 1 14 . 1 1 10 10 LYS HA H 10 4.190 4.190 4.133 0.057 18703 4802 1 14 . 1 1 10 10 LYS C C 10 179.395 179.395 179.033 0.362 18703 4803 1 14 . 1 1 10 10 LYS CA C 10 59.231 59.231 59.261 -0.030 18703 4804 1 14 . 1 1 10 10 LYS CB C 10 32.211 32.211 32.656 -0.445 18703 4805 1 14 . 1 1 10 10 LYS H H 10 8.009 8.009 7.367 0.642 18703 4806 1 14 . 1 1 11 11 VAL N N 11 119.577 119.577 118.034 1.543 18703 4807 1 14 . 1 1 11 11 VAL HA H 11 3.844 3.844 3.667 0.177 18703 4808 1 14 . 1 1 11 11 VAL C C 11 177.078 177.078 177.441 -0.363 18703 4809 1 14 . 1 1 11 11 VAL CA C 11 66.407 66.407 66.250 0.157 18703 4810 1 14 . 1 1 11 11 VAL CB C 11 31.252 31.252 31.304 -0.052 18703 4811 1 14 . 1 1 11 11 VAL H H 11 8.488 8.488 7.448 1.040 18703 4812 1 14 . 1 1 12 12 LYS N N 12 122.864 122.864 119.565 3.299 18703 4813 1 14 . 1 1 12 12 LYS HA H 12 4.189 4.189 3.959 0.230 18703 4814 1 14 . 1 1 12 12 LYS C C 12 178.755 178.755 178.397 0.358 18703 4815 1 14 . 1 1 12 12 LYS CA C 12 59.375 59.375 59.743 -0.368 18703 4816 1 14 . 1 1 12 12 LYS CB C 12 31.991 31.991 32.218 -0.227 18703 4817 1 14 . 1 1 12 12 LYS H H 12 7.944 7.944 7.620 0.324 18703 4818 1 14 . 1 1 13 13 ALA N N 13 121.202 121.202 120.639 0.563 18703 4819 1 14 . 1 1 13 13 ALA HA H 13 4.209 4.209 4.261 -0.052 18703 4820 1 14 . 1 1 13 13 ALA C C 13 181.060 181.060 179.436 1.624 18703 4821 1 14 . 1 1 13 13 ALA CA C 13 54.710 54.710 54.187 0.523 18703 4822 1 14 . 1 1 13 13 ALA CB C 13 17.861 17.861 18.428 -0.567 18703 4823 1 14 . 1 1 13 13 ALA H H 13 7.563 7.563 7.484 0.079 18703 4824 1 14 . 1 1 14 14 LEU N N 14 120.014 120.014 119.705 0.309 18703 4825 1 14 . 1 1 14 14 LEU HA H 14 4.072 4.072 4.003 0.069 18703 4826 1 14 . 1 1 14 14 LEU C C 14 177.862 177.862 178.235 -0.373 18703 4827 1 14 . 1 1 14 14 LEU CA C 14 57.864 57.864 57.636 0.228 18703 4828 1 14 . 1 1 14 14 LEU CB C 14 41.539 41.539 42.163 -0.624 18703 4829 1 14 . 1 1 14 14 LEU H H 14 8.087 8.087 7.514 0.573 18703 4830 1 14 . 1 1 15 15 GLU N N 15 121.644 121.644 119.817 1.827 18703 4831 1 14 . 1 1 15 15 GLU HA H 15 3.692 3.692 4.019 -0.327 18703 4832 1 14 . 1 1 15 15 GLU C C 15 177.819 177.819 178.253 -0.434 18703 4833 1 14 . 1 1 15 15 GLU CA C 15 59.239 59.239 59.264 -0.025 18703 4834 1 14 . 1 1 15 15 GLU CB C 15 28.865 28.865 29.555 -0.690 18703 4835 1 14 . 1 1 15 15 GLU H H 15 8.542 8.542 7.696 0.846 18703 4836 1 14 . 1 1 16 16 GLU N N 16 116.016 116.016 118.730 -2.714 18703 4837 1 14 . 1 1 16 16 GLU HA H 16 3.955 3.955 4.000 -0.045 18703 4838 1 14 . 1 1 16 16 GLU C C 16 179.159 179.159 179.135 0.024 18703 4839 1 14 . 1 1 16 16 GLU CA C 16 59.324 59.324 59.338 -0.014 18703 4840 1 14 . 1 1 16 16 GLU CB C 16 29.060 29.060 29.188 -0.128 18703 4841 1 14 . 1 1 16 16 GLU H H 16 7.492 7.492 7.881 -0.389 18703 4842 1 14 . 1 1 17 17 LYS N N 17 118.546 118.546 119.002 -0.456 18703 4843 1 14 . 1 1 17 17 LYS HA H 17 4.117 4.117 4.124 -0.007 18703 4844 1 14 . 1 1 17 17 LYS C C 17 178.976 178.976 178.529 0.447 18703 4845 1 14 . 1 1 17 17 LYS CA C 17 58.837 58.837 58.962 -0.125 18703 4846 1 14 . 1 1 17 17 LYS CB C 17 32.538 32.538 32.584 -0.046 18703 4847 1 14 . 1 1 17 17 LYS H H 17 7.720 7.720 7.390 0.330 18703 4848 1 14 . 1 1 18 18 VAL N N 18 118.376 118.376 118.923 -0.547 18703 4849 1 14 . 1 1 18 18 VAL HA H 18 3.711 3.711 3.769 -0.058 18703 4850 1 14 . 1 1 18 18 VAL C C 18 178.765 178.765 178.721 0.044 18703 4851 1 14 . 1 1 18 18 VAL CA C 18 66.237 66.237 65.672 0.565 18703 4852 1 14 . 1 1 18 18 VAL CB C 18 31.682 31.682 31.741 -0.059 18703 4853 1 14 . 1 1 18 18 VAL H H 18 8.754 8.754 7.390 1.364 18703 4854 1 14 . 1 1 19 19 LYS N N 19 118.817 118.817 118.906 -0.089 18703 4855 1 14 . 1 1 19 19 LYS HA H 19 4.078 4.078 3.958 0.120 18703 4856 1 14 . 1 1 19 19 LYS C C 19 178.049 178.049 177.730 0.319 18703 4857 1 14 . 1 1 19 19 LYS CA C 19 59.731 59.731 59.410 0.321 18703 4858 1 14 . 1 1 19 19 LYS CB C 19 32.523 32.523 32.149 0.374 18703 4859 1 14 . 1 1 19 19 LYS H H 19 8.299 8.299 8.511 -0.212 18703 4860 1 14 . 1 1 20 20 ALA N N 20 119.656 119.656 119.361 0.295 18703 4861 1 14 . 1 1 20 20 ALA HA H 20 4.347 4.347 4.347 0.000 18703 4862 1 14 . 1 1 20 20 ALA C C 20 178.532 178.532 178.325 0.207 18703 4863 1 14 . 1 1 20 20 ALA CA C 20 52.853 52.853 52.919 -0.066 18703 4864 1 14 . 1 1 20 20 ALA CB C 20 18.832 18.832 18.890 -0.058 18703 4865 1 14 . 1 1 20 20 ALA H H 20 7.425 7.425 7.586 -0.161 18703 4866 1 14 . 1 1 21 21 LEU N N 21 118.594 118.594 119.450 -0.856 18703 4867 1 14 . 1 1 21 21 LEU HA H 21 4.297 4.297 4.187 0.110 18703 4868 1 14 . 1 1 21 21 LEU C C 21 177.784 177.784 177.647 0.137 18703 4869 1 14 . 1 1 21 21 LEU CA C 21 55.750 55.750 56.574 -0.824 18703 4870 1 14 . 1 1 21 21 LEU CB C 21 42.898 42.898 42.664 0.234 18703 4871 1 14 . 1 1 21 21 LEU H H 21 7.508 7.508 8.084 -0.576 18703 4872 1 14 . 1 1 22 22 GLY N N 22 106.650 106.650 104.078 2.572 18703 4873 1 14 . 1 1 22 22 GLY C C 22 173.605 173.605 172.503 1.102 18703 4874 1 14 . 1 1 22 22 GLY CA C 22 45.330 45.330 44.972 0.358 18703 4875 1 14 . 1 1 22 22 GLY H H 22 7.814 7.814 7.866 -0.052 18703 4876 1 14 . 1 1 23 23 GLY N N 23 108.011 108.011 106.497 1.514 18703 4877 1 14 . 1 1 23 23 GLY C C 23 174.061 174.061 172.496 1.565 18703 4878 1 14 . 1 1 23 23 GLY CA C 23 44.772 44.772 45.050 -0.278 18703 4879 1 14 . 1 1 23 23 GLY H H 23 8.139 8.139 7.989 0.150 18703 4880 1 14 . 1 1 24 24 GLY N N 24 107.826 107.826 109.533 -1.707 18703 4881 1 14 . 1 1 24 24 GLY C C 24 175.046 175.046 174.720 0.326 18703 4882 1 14 . 1 1 24 24 GLY CA C 24 44.422 44.422 44.952 -0.530 18703 4883 1 14 . 1 1 24 24 GLY H H 24 8.497 8.497 8.421 0.076 18703 4884 1 14 . 1 1 25 25 GLY N N 25 108.830 108.830 112.721 -3.891 18703 4885 1 14 . 1 1 25 25 GLY C C 25 176.272 176.272 175.048 1.224 18703 4886 1 14 . 1 1 25 25 GLY CA C 25 47.101 47.101 44.938 2.163 18703 4887 1 14 . 1 1 25 25 GLY H H 25 8.616 8.616 7.902 0.714 18703 4888 1 14 . 1 1 26 26 ARG N N 26 123.109 123.109 123.749 -0.640 18703 4889 1 14 . 1 1 26 26 ARG HA H 26 4.283 4.283 4.164 0.119 18703 4890 1 14 . 1 1 26 26 ARG C C 26 177.848 177.848 178.185 -0.337 18703 4891 1 14 . 1 1 26 26 ARG CA C 26 57.663 57.663 57.976 -0.313 18703 4892 1 14 . 1 1 26 26 ARG CB C 26 29.811 29.811 30.195 -0.384 18703 4893 1 14 . 1 1 26 26 ARG H H 26 8.770 8.770 8.612 0.158 18703 4894 1 14 . 1 1 27 27 ILE N N 27 118.104 118.104 118.449 -0.345 18703 4895 1 14 . 1 1 27 27 ILE HA H 27 3.787 3.787 3.822 -0.035 18703 4896 1 14 . 1 1 27 27 ILE C C 27 177.473 177.473 177.715 -0.242 18703 4897 1 14 . 1 1 27 27 ILE CA C 27 63.036 63.036 64.372 -1.336 18703 4898 1 14 . 1 1 27 27 ILE CB C 27 36.664 36.664 37.592 -0.928 18703 4899 1 14 . 1 1 27 27 ILE H H 27 7.708 7.708 8.114 -0.406 18703 4900 1 14 . 1 1 28 28 GLU N N 28 119.934 119.934 120.516 -0.582 18703 4901 1 14 . 1 1 28 28 GLU HA H 28 3.954 3.954 3.823 0.131 18703 4902 1 14 . 1 1 28 28 GLU C C 28 179.514 179.514 178.424 1.090 18703 4903 1 14 . 1 1 28 28 GLU CA C 28 59.450 59.450 60.023 -0.573 18703 4904 1 14 . 1 1 28 28 GLU CB C 28 29.600 29.600 29.372 0.229 18703 4905 1 14 . 1 1 28 28 GLU H H 28 7.872 7.872 7.567 0.305 18703 4906 1 14 . 1 1 29 29 GLU N N 29 118.134 118.134 119.857 -1.723 18703 4907 1 14 . 1 1 29 29 GLU HA H 29 4.028 4.028 4.074 -0.046 18703 4908 1 14 . 1 1 29 29 GLU C C 29 179.182 179.182 179.161 0.021 18703 4909 1 14 . 1 1 29 29 GLU CA C 29 59.173 59.173 59.245 -0.071 18703 4910 1 14 . 1 1 29 29 GLU CB C 29 29.503 29.503 29.426 0.077 18703 4911 1 14 . 1 1 29 29 GLU H H 29 8.166 8.166 7.517 0.649 18703 4912 1 14 . 1 1 30 30 LEU N N 30 120.242 120.242 117.780 2.462 18703 4913 1 14 . 1 1 30 30 LEU HA H 30 4.028 4.028 4.001 0.027 18703 4914 1 14 . 1 1 30 30 LEU C C 30 178.796 178.796 179.036 -0.240 18703 4915 1 14 . 1 1 30 30 LEU CA C 30 57.654 57.654 56.962 0.692 18703 4916 1 14 . 1 1 30 30 LEU CB C 30 41.629 41.629 41.584 0.045 18703 4917 1 14 . 1 1 30 30 LEU H H 30 7.695 7.695 7.648 0.047 18703 4918 1 14 . 1 1 31 31 LYS N N 31 120.506 120.506 120.016 0.490 18703 4919 1 14 . 1 1 31 31 LYS HA H 31 3.532 3.532 4.032 -0.500 18703 4920 1 14 . 1 1 31 31 LYS C C 31 178.919 178.919 178.262 0.657 18703 4921 1 14 . 1 1 31 31 LYS CA C 31 60.240 60.240 59.250 0.990 18703 4922 1 14 . 1 1 31 31 LYS CB C 31 32.015 32.015 32.261 -0.247 18703 4923 1 14 . 1 1 31 31 LYS H H 31 8.561 8.561 7.590 0.971 18703 4924 1 14 . 1 1 32 32 LYS N N 32 118.566 118.566 118.633 -0.067 18703 4925 1 14 . 1 1 32 32 LYS C C 32 179.392 179.392 179.301 0.091 18703 4926 1 14 . 1 1 32 32 LYS CA C 32 59.356 59.356 59.752 -0.396 18703 4927 1 14 . 1 1 32 32 LYS CB C 32 32.117 32.117 32.336 -0.218 18703 4928 1 14 . 1 1 32 32 LYS H H 32 7.699 7.699 7.517 0.182 18703 4929 1 14 . 1 1 33 33 LYS N N 33 118.964 118.964 117.544 1.420 18703 4930 1 14 . 1 1 33 33 LYS HA H 33 4.117 4.117 4.209 -0.092 18703 4931 1 14 . 1 1 33 33 LYS C C 33 178.355 178.355 178.758 -0.403 18703 4932 1 14 . 1 1 33 33 LYS CA C 33 58.633 58.633 58.582 0.051 18703 4933 1 14 . 1 1 33 33 LYS CB C 33 31.904 31.904 32.258 -0.354 18703 4934 1 14 . 1 1 33 33 LYS H H 33 7.752 7.752 7.604 0.148 18703 4935 1 14 . 1 1 34 34 CYS N N 34 119.956 119.956 118.960 0.996 18703 4936 1 14 . 1 1 34 34 CYS HA H 34 3.967 3.967 4.125 -0.158 18703 4937 1 14 . 1 1 34 34 CYS C C 34 175.521 175.521 176.727 -1.206 18703 4938 1 14 . 1 1 34 34 CYS CA C 34 60.987 60.987 63.015 -2.028 18703 4939 1 14 . 1 1 34 34 CYS CB C 34 36.600 36.600 26.704 9.896 18703 4940 1 14 . 1 1 34 34 CYS H H 34 8.393 8.393 7.612 0.781 18703 4941 1 14 . 1 1 35 35 GLU N N 35 120.327 120.327 119.652 0.675 18703 4942 1 14 . 1 1 35 35 GLU HA H 35 3.891 3.891 3.952 -0.061 18703 4943 1 14 . 1 1 35 35 GLU C C 35 179.684 179.684 178.675 1.009 18703 4944 1 14 . 1 1 35 35 GLU CA C 35 60.059 60.059 59.390 0.669 18703 4945 1 14 . 1 1 35 35 GLU CB C 35 29.718 29.718 28.834 0.884 18703 4946 1 14 . 1 1 35 35 GLU H H 35 8.558 8.558 7.799 0.759 18703 4947 1 14 . 1 1 36 36 GLU N N 36 120.190 120.190 119.802 0.388 18703 4948 1 14 . 1 1 36 36 GLU HA H 36 4.051 4.051 4.021 0.030 18703 4949 1 14 . 1 1 36 36 GLU C C 36 179.408 179.408 178.954 0.454 18703 4950 1 14 . 1 1 36 36 GLU CA C 36 59.148 59.148 58.962 0.186 18703 4951 1 14 . 1 1 36 36 GLU CB C 36 29.766 29.766 29.632 0.134 18703 4952 1 14 . 1 1 36 36 GLU H H 36 8.038 8.038 7.661 0.377 18703 4953 1 14 . 1 1 37 37 LEU N N 37 121.102 121.102 119.919 1.183 18703 4954 1 14 . 1 1 37 37 LEU HA H 37 4.079 4.079 4.190 -0.111 18703 4955 1 14 . 1 1 37 37 LEU C C 37 178.279 178.279 178.455 -0.176 18703 4956 1 14 . 1 1 37 37 LEU CA C 37 57.803 57.803 57.349 0.454 18703 4957 1 14 . 1 1 37 37 LEU CB C 37 41.502 41.502 41.723 -0.221 18703 4958 1 14 . 1 1 37 37 LEU H H 37 8.065 8.065 7.448 0.617 18703 4959 1 14 . 1 1 38 38 LYS N N 38 119.980 119.980 119.082 0.898 18703 4960 1 14 . 1 1 38 38 LYS HA H 38 3.851 3.851 3.873 -0.022 18703 4961 1 14 . 1 1 38 38 LYS C C 38 178.919 178.919 179.151 -0.232 18703 4962 1 14 . 1 1 38 38 LYS CA C 38 60.794 60.794 59.843 0.951 18703 4963 1 14 . 1 1 38 38 LYS CB C 38 32.863 32.863 32.201 0.662 18703 4964 1 14 . 1 1 38 38 LYS H H 38 8.741 8.741 7.806 0.935 18703 4965 1 14 . 1 1 39 39 LYS N N 39 118.307 118.307 117.235 1.072 18703 4966 1 14 . 1 1 39 39 LYS HA H 39 4.125 4.125 4.334 -0.209 18703 4967 1 14 . 1 1 39 39 LYS C C 39 178.622 178.622 178.719 -0.097 18703 4968 1 14 . 1 1 39 39 LYS CA C 39 58.993 58.993 59.041 -0.049 18703 4969 1 14 . 1 1 39 39 LYS CB C 39 32.097 32.097 31.783 0.314 18703 4970 1 14 . 1 1 39 39 LYS H H 39 7.584 7.584 7.707 -0.123 18703 4971 1 14 . 1 1 40 40 LYS N N 40 118.826 118.826 119.638 -0.812 18703 4972 1 14 . 1 1 40 40 LYS HA H 40 4.069 4.069 4.342 -0.273 18703 4973 1 14 . 1 1 40 40 LYS C C 40 179.802 179.802 178.792 1.010 18703 4974 1 14 . 1 1 40 40 LYS CA C 40 59.322 59.322 58.561 0.761 18703 4975 1 14 . 1 1 40 40 LYS CB C 40 32.505 32.505 32.263 0.242 18703 4976 1 14 . 1 1 40 40 LYS H H 40 7.945 7.945 7.384 0.561 18703 4977 1 14 . 1 1 41 41 ILE N N 41 118.958 118.958 118.347 0.611 18703 4978 1 14 . 1 1 41 41 ILE HA H 41 3.659 3.659 3.782 -0.123 18703 4979 1 14 . 1 1 41 41 ILE C C 41 178.146 178.146 176.915 1.231 18703 4980 1 14 . 1 1 41 41 ILE CA C 41 65.037 65.037 64.105 0.932 18703 4981 1 14 . 1 1 41 41 ILE CB C 41 37.950 37.950 37.909 0.041 18703 4982 1 14 . 1 1 41 41 ILE H H 41 8.369 8.369 7.999 0.370 18703 4983 1 14 . 1 1 42 42 GLU N N 42 120.331 120.331 117.070 3.261 18703 4984 1 14 . 1 1 42 42 GLU HA H 42 4.094 4.094 4.039 0.055 18703 4985 1 14 . 1 1 42 42 GLU C C 42 178.697 178.697 177.838 0.859 18703 4986 1 14 . 1 1 42 42 GLU CA C 42 58.927 58.927 58.782 0.145 18703 4987 1 14 . 1 1 42 42 GLU CB C 42 29.399 29.399 30.087 -0.688 18703 4988 1 14 . 1 1 42 42 GLU H H 42 7.805 7.805 7.672 0.133 18703 4989 1 14 . 1 1 43 43 GLU N N 43 117.120 117.120 117.064 0.056 18703 4990 1 14 . 1 1 43 43 GLU HA H 43 4.291 4.291 4.126 0.165 18703 4991 1 14 . 1 1 43 43 GLU C C 43 177.551 177.551 177.583 -0.032 18703 4992 1 14 . 1 1 43 43 GLU CA C 43 56.800 56.800 57.079 -0.279 18703 4993 1 14 . 1 1 43 43 GLU CB C 43 29.931 29.931 29.847 0.084 18703 4994 1 14 . 1 1 43 43 GLU H H 43 7.701 7.701 7.639 0.062 18703 4995 1 14 . 1 1 44 44 LEU N N 44 120.940 120.940 120.865 0.075 18703 4996 1 14 . 1 1 44 44 LEU HA H 44 4.251 4.251 4.071 0.180 18703 4997 1 14 . 1 1 44 44 LEU C C 44 178.596 178.596 176.771 1.825 18703 4998 1 14 . 1 1 44 44 LEU CA C 44 56.448 56.448 55.769 0.679 18703 4999 1 14 . 1 1 44 44 LEU CB C 44 42.519 42.519 42.569 -0.050 18703 5000 1 14 . 1 1 44 44 LEU H H 44 7.581 7.581 7.416 0.165 18703 5001 1 14 . 1 1 45 45 GLY N N 45 108.689 108.689 107.728 0.961 18703 5002 1 14 . 1 1 45 45 GLY C C 45 174.853 174.853 173.447 1.406 18703 5003 1 14 . 1 1 45 45 GLY CA C 45 46.233 46.233 45.079 1.154 18703 5004 1 14 . 1 1 45 45 GLY H H 45 8.232 8.232 8.552 -0.320 18703 5005 1 14 . 1 1 46 46 GLY N N 46 108.029 108.029 108.042 -0.013 18703 5006 1 14 . 1 1 46 46 GLY C C 46 174.351 174.351 173.530 0.821 18703 5007 1 14 . 1 1 46 46 GLY CA C 46 45.105 45.105 45.345 -0.240 18703 5008 1 14 . 1 1 46 46 GLY H H 46 8.176 8.176 7.987 0.189 18703 5009 1 14 . 1 1 47 47 GLY N N 47 108.183 108.183 110.098 -1.915 18703 5010 1 14 . 1 1 47 47 GLY C C 47 174.671 174.671 174.865 -0.194 18703 5011 1 14 . 1 1 47 47 GLY CA C 47 45.254 45.254 44.319 0.935 18703 5012 1 14 . 1 1 47 47 GLY H H 47 8.290 8.290 8.183 0.107 18703 5013 1 14 . 1 1 48 48 GLY N N 48 108.616 108.616 111.339 -2.723 18703 5014 1 14 . 1 1 48 48 GLY C C 48 174.321 174.321 174.901 -0.580 18703 5015 1 14 . 1 1 48 48 GLY CA C 48 45.192 45.192 45.419 -0.227 18703 5016 1 14 . 1 1 48 48 GLY H H 48 8.027 8.027 8.473 -0.446 18703 5017 1 14 . 1 1 49 49 GLU N N 49 121.057 121.057 122.216 -1.159 18703 5018 1 14 . 1 1 49 49 GLU HA H 49 4.425 4.425 4.516 -0.091 18703 5019 1 14 . 1 1 49 49 GLU C C 49 177.072 177.072 178.561 -1.489 18703 5020 1 14 . 1 1 49 49 GLU CA C 49 56.330 56.330 56.470 -0.140 18703 5021 1 14 . 1 1 49 49 GLU CB C 49 29.602 29.602 30.272 -0.670 18703 5022 1 14 . 1 1 49 49 GLU H H 49 8.486 8.486 8.580 -0.094 18703 5023 1 14 . 1 1 50 50 VAL N N 50 122.122 122.122 119.661 2.461 18703 5024 1 14 . 1 1 50 50 VAL HA H 50 3.792 3.792 3.624 0.168 18703 5025 1 14 . 1 1 50 50 VAL C C 50 176.774 176.774 176.844 -0.070 18703 5026 1 14 . 1 1 50 50 VAL CA C 50 64.864 64.864 65.292 -0.428 18703 5027 1 14 . 1 1 50 50 VAL CB C 50 32.179 32.179 31.716 0.463 18703 5028 1 14 . 1 1 50 50 VAL H H 50 8.095 8.095 8.272 -0.177 18703 5029 1 14 . 1 1 51 51 LYS N N 51 120.602 120.602 115.667 4.935 18703 5030 1 14 . 1 1 51 51 LYS HA H 51 4.195 4.195 4.093 0.102 18703 5031 1 14 . 1 1 51 51 LYS C C 51 178.530 178.530 177.972 0.558 18703 5032 1 14 . 1 1 51 51 LYS CA C 51 59.348 59.348 58.452 0.896 18703 5033 1 14 . 1 1 51 51 LYS CB C 51 32.265 32.265 31.983 0.282 18703 5034 1 14 . 1 1 51 51 LYS H H 51 8.268 8.268 8.106 0.162 18703 5035 1 14 . 1 1 52 52 LYS N N 52 117.547 117.547 121.044 -3.497 18703 5036 1 14 . 1 1 52 52 LYS HA H 52 4.162 4.162 4.095 0.067 18703 5037 1 14 . 1 1 52 52 LYS C C 52 179.132 179.132 178.921 0.211 18703 5038 1 14 . 1 1 52 52 LYS CA C 52 58.811 58.811 59.190 -0.379 18703 5039 1 14 . 1 1 52 52 LYS CB C 52 32.054 32.054 32.590 -0.536 18703 5040 1 14 . 1 1 52 52 LYS H H 52 7.595 7.595 7.904 -0.309 18703 5041 1 14 . 1 1 53 53 VAL N N 53 119.190 119.190 118.117 1.073 18703 5042 1 14 . 1 1 53 53 VAL HA H 53 3.767 3.767 3.937 -0.170 18703 5043 1 14 . 1 1 53 53 VAL C C 53 177.933 177.933 178.194 -0.261 18703 5044 1 14 . 1 1 53 53 VAL CA C 53 66.065 66.065 65.620 0.445 18703 5045 1 14 . 1 1 53 53 VAL CB C 53 31.248 31.248 30.781 0.467 18703 5046 1 14 . 1 1 53 53 VAL H H 53 7.597 7.597 7.588 0.009 18703 5047 1 14 . 1 1 54 54 GLU N N 54 120.226 120.226 119.749 0.477 18703 5048 1 14 . 1 1 54 54 GLU HA H 54 3.833 3.833 3.975 -0.142 18703 5049 1 14 . 1 1 54 54 GLU C C 54 179.352 179.352 178.652 0.700 18703 5050 1 14 . 1 1 54 54 GLU CA C 54 59.153 59.153 59.689 -0.536 18703 5051 1 14 . 1 1 54 54 GLU CB C 54 29.224 29.224 29.435 -0.211 18703 5052 1 14 . 1 1 54 54 GLU H H 54 8.609 8.609 7.744 0.865 18703 5053 1 14 . 1 1 55 55 GLU N N 55 119.148 119.148 119.249 -0.101 18703 5054 1 14 . 1 1 55 55 GLU HA H 55 4.084 4.084 4.101 -0.017 18703 5055 1 14 . 1 1 55 55 GLU C C 55 179.084 179.084 178.867 0.217 18703 5056 1 14 . 1 1 55 55 GLU CA C 55 59.295 59.295 58.973 0.322 18703 5057 1 14 . 1 1 55 55 GLU CB C 55 29.361 29.361 29.526 -0.165 18703 5058 1 14 . 1 1 55 55 GLU H H 55 7.713 7.713 7.736 -0.023 18703 5059 1 14 . 1 1 56 56 GLU N N 56 120.301 120.301 118.510 1.791 18703 5060 1 14 . 1 1 56 56 GLU HA H 56 4.079 4.079 4.115 -0.036 18703 5061 1 14 . 1 1 56 56 GLU C C 56 179.773 179.773 179.067 0.706 18703 5062 1 14 . 1 1 56 56 GLU CA C 56 59.528 59.528 59.182 0.346 18703 5063 1 14 . 1 1 56 56 GLU CB C 56 30.162 30.162 29.635 0.527 18703 5064 1 14 . 1 1 56 56 GLU H H 56 7.899 7.899 7.655 0.244 18703 5065 1 14 . 1 1 57 57 VAL N N 57 121.536 121.536 118.735 2.801 18703 5066 1 14 . 1 1 57 57 VAL HA H 57 3.540 3.540 3.834 -0.294 18703 5067 1 14 . 1 1 57 57 VAL C C 57 176.984 176.984 177.454 -0.470 18703 5068 1 14 . 1 1 57 57 VAL CA C 57 66.734 66.734 65.152 1.582 18703 5069 1 14 . 1 1 57 57 VAL CB C 57 31.425 31.425 31.490 -0.065 18703 5070 1 14 . 1 1 57 57 VAL H H 57 8.652 8.652 7.354 1.298 18703 5071 1 14 . 1 1 58 58 LYS N N 58 120.219 120.219 120.103 0.116 18703 5072 1 14 . 1 1 58 58 LYS HA H 58 4.199 4.199 4.045 0.154 18703 5073 1 14 . 1 1 58 58 LYS C C 58 178.972 178.972 178.390 0.582 18703 5074 1 14 . 1 1 58 58 LYS CA C 58 59.357 59.357 59.923 -0.567 18703 5075 1 14 . 1 1 58 58 LYS CB C 58 32.186 32.186 32.107 0.079 18703 5076 1 14 . 1 1 58 58 LYS H H 58 7.791 7.791 7.474 0.317 18703 5077 1 14 . 1 1 59 59 LYS N N 59 118.252 118.252 119.737 -1.485 18703 5078 1 14 . 1 1 59 59 LYS HA H 59 4.069 4.069 4.145 -0.076 18703 5079 1 14 . 1 1 59 59 LYS C C 59 179.180 179.180 178.316 0.864 18703 5080 1 14 . 1 1 59 59 LYS CA C 59 59.285 59.285 59.141 0.144 18703 5081 1 14 . 1 1 59 59 LYS CB C 59 32.345 32.345 32.386 -0.041 18703 5082 1 14 . 1 1 59 59 LYS H H 59 7.849 7.849 7.532 0.317 18703 5083 1 14 . 1 1 60 60 LEU N N 60 121.243 121.243 119.812 1.431 18703 5084 1 14 . 1 1 60 60 LEU HA H 60 4.242 4.242 4.146 0.096 18703 5085 1 14 . 1 1 60 60 LEU C C 60 178.413 178.413 178.198 0.215 18703 5086 1 14 . 1 1 60 60 LEU CA C 60 57.798 57.798 57.245 0.553 18703 5087 1 14 . 1 1 60 60 LEU CB C 60 41.150 41.150 42.220 -1.070 18703 5088 1 14 . 1 1 60 60 LEU H H 60 7.825 7.825 7.573 0.252 18703 5089 1 14 . 1 1 61 61 GLU N N 61 118.844 118.844 120.127 -1.283 18703 5090 1 14 . 1 1 61 61 GLU HA H 61 3.800 3.800 3.937 -0.137 18703 5091 1 14 . 1 1 61 61 GLU C C 61 179.078 179.078 178.512 0.566 18703 5092 1 14 . 1 1 61 61 GLU CA C 61 60.104 60.104 60.134 -0.030 18703 5093 1 14 . 1 1 61 61 GLU CB C 61 29.864 29.864 29.676 0.188 18703 5094 1 14 . 1 1 61 61 GLU H H 61 8.582 8.582 7.750 0.832 18703 5095 1 14 . 1 1 62 62 GLU N N 62 117.659 117.659 118.499 -0.840 18703 5096 1 14 . 1 1 62 62 GLU HA H 62 3.990 3.990 4.063 -0.073 18703 5097 1 14 . 1 1 62 62 GLU C C 62 178.847 178.847 178.869 -0.022 18703 5098 1 14 . 1 1 62 62 GLU CA C 62 59.067 59.067 58.919 0.148 18703 5099 1 14 . 1 1 62 62 GLU CB C 62 29.440 29.440 29.674 -0.234 18703 5100 1 14 . 1 1 62 62 GLU H H 62 8.032 8.032 7.630 0.402 18703 5101 1 14 . 1 1 63 63 GLU N N 63 119.290 119.290 119.313 -0.023 18703 5102 1 14 . 1 1 63 63 GLU HA H 63 4.012 4.012 4.098 -0.086 18703 5103 1 14 . 1 1 63 63 GLU C C 63 179.784 179.784 179.310 0.474 18703 5104 1 14 . 1 1 63 63 GLU CA C 63 59.300 59.300 58.959 0.341 18703 5105 1 14 . 1 1 63 63 GLU CB C 63 29.728 29.728 29.488 0.240 18703 5106 1 14 . 1 1 63 63 GLU H H 63 7.958 7.958 7.437 0.521 18703 5107 1 14 . 1 1 64 64 ILE N N 64 118.453 118.453 119.181 -0.728 18703 5108 1 14 . 1 1 64 64 ILE HA H 64 3.711 3.711 3.728 -0.017 18703 5109 1 14 . 1 1 64 64 ILE C C 64 177.655 177.655 177.523 0.132 18703 5110 1 14 . 1 1 64 64 ILE CA C 64 64.256 64.256 64.277 -0.021 18703 5111 1 14 . 1 1 64 64 ILE CB C 64 38.002 38.002 37.573 0.429 18703 5112 1 14 . 1 1 64 64 ILE H H 64 8.160 8.160 7.554 0.606 18703 5113 1 14 . 1 1 65 65 LYS N N 65 118.871 118.871 117.741 1.130 18703 5114 1 14 . 1 1 65 65 LYS HA H 65 4.111 4.111 4.066 0.045 18703 5115 1 14 . 1 1 65 65 LYS C C 65 177.076 177.076 178.002 -0.926 18703 5116 1 14 . 1 1 65 65 LYS CA C 65 58.421 58.421 58.521 -0.100 18703 5117 1 14 . 1 1 65 65 LYS CB C 65 32.639 32.639 32.153 0.486 18703 5118 1 14 . 1 1 65 65 LYS H H 65 7.664 7.664 7.643 0.021 18703 5119 1 14 . 1 1 66 66 LYS N N 66 116.944 116.944 118.358 -1.414 18703 5120 1 14 . 1 1 66 66 LYS HA H 66 4.320 4.320 4.159 0.161 18703 5121 1 14 . 1 1 66 66 LYS C C 66 175.897 175.897 177.438 -1.541 18703 5122 1 14 . 1 1 66 66 LYS CA C 66 56.352 56.352 58.129 -1.777 18703 5123 1 14 . 1 1 66 66 LYS CB C 66 33.024 33.024 33.214 -0.190 18703 5124 1 14 . 1 1 66 66 LYS H H 66 7.246 7.246 7.852 -0.606 18703 5125 1 15 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.419 -0.173 18703 5126 1 15 . 1 1 3 3 ARG C C 3 178.379 178.379 176.237 2.142 18703 5127 1 15 . 1 1 3 3 ARG CA C 3 58.367 58.367 56.842 1.525 18703 5128 1 15 . 1 1 3 3 ARG CB C 3 30.691 30.691 31.212 -0.521 18703 5129 1 15 . 1 1 3 3 ARG H H 3 7.905 7.905 8.703 -0.798 18703 5130 1 15 . 1 1 4 4 VAL N N 4 118.966 118.966 121.033 -2.067 18703 5131 1 15 . 1 1 4 4 VAL HA H 4 3.803 3.803 4.006 -0.203 18703 5132 1 15 . 1 1 4 4 VAL C C 4 176.968 176.968 177.461 -0.493 18703 5133 1 15 . 1 1 4 4 VAL CA C 4 65.441 65.441 64.604 0.837 18703 5134 1 15 . 1 1 4 4 VAL CB C 4 31.710 31.710 31.563 0.147 18703 5135 1 15 . 1 1 4 4 VAL H H 4 8.070 8.070 8.298 -0.228 18703 5136 1 15 . 1 1 5 5 LYS N N 5 122.058 122.058 120.650 1.408 18703 5137 1 15 . 1 1 5 5 LYS HA H 5 4.154 4.154 4.112 0.042 18703 5138 1 15 . 1 1 5 5 LYS C C 5 178.553 178.553 179.175 -0.622 18703 5139 1 15 . 1 1 5 5 LYS CA C 5 58.712 58.712 59.414 -0.702 18703 5140 1 15 . 1 1 5 5 LYS CB C 5 31.788 31.788 31.893 -0.105 18703 5141 1 15 . 1 1 5 5 LYS H H 5 7.798 7.798 8.436 -0.638 18703 5142 1 15 . 1 1 6 6 ALA N N 6 119.955 119.955 119.971 -0.016 18703 5143 1 15 . 1 1 6 6 ALA HA H 6 4.198 4.198 4.394 -0.196 18703 5144 1 15 . 1 1 6 6 ALA C C 6 180.974 180.974 179.032 1.942 18703 5145 1 15 . 1 1 6 6 ALA CA C 6 54.850 54.850 54.079 0.771 18703 5146 1 15 . 1 1 6 6 ALA CB C 6 17.995 17.995 18.356 -0.361 18703 5147 1 15 . 1 1 6 6 ALA H H 6 7.928 7.928 8.169 -0.241 18703 5148 1 15 . 1 1 7 7 LEU N N 7 119.211 119.211 120.298 -1.087 18703 5149 1 15 . 1 1 7 7 LEU HA H 7 4.124 4.124 3.962 0.162 18703 5150 1 15 . 1 1 7 7 LEU C C 7 178.353 178.353 178.583 -0.230 18703 5151 1 15 . 1 1 7 7 LEU CA C 7 57.658 57.658 57.419 0.239 18703 5152 1 15 . 1 1 7 7 LEU CB C 7 41.971 41.971 42.037 -0.066 18703 5153 1 15 . 1 1 7 7 LEU H H 7 7.594 7.594 7.735 -0.141 18703 5154 1 15 . 1 1 8 8 GLU N N 8 120.258 120.258 117.770 2.488 18703 5155 1 15 . 1 1 8 8 GLU HA H 8 3.846 3.846 3.953 -0.107 18703 5156 1 15 . 1 1 8 8 GLU C C 8 179.546 179.546 178.895 0.651 18703 5157 1 15 . 1 1 8 8 GLU CA C 8 60.006 60.006 59.650 0.356 18703 5158 1 15 . 1 1 8 8 GLU CB C 8 29.683 29.683 29.451 0.232 18703 5159 1 15 . 1 1 8 8 GLU H H 8 8.382 8.382 7.808 0.574 18703 5160 1 15 . 1 1 9 9 GLU N N 9 118.584 118.584 117.989 0.595 18703 5161 1 15 . 1 1 9 9 GLU HA H 9 4.039 4.039 4.149 -0.110 18703 5162 1 15 . 1 1 9 9 GLU C C 9 179.635 179.635 178.636 0.999 18703 5163 1 15 . 1 1 9 9 GLU CA C 9 59.235 59.235 58.874 0.361 18703 5164 1 15 . 1 1 9 9 GLU CB C 9 29.358 29.358 29.265 0.093 18703 5165 1 15 . 1 1 9 9 GLU H H 9 7.908 7.908 7.738 0.170 18703 5166 1 15 . 1 1 10 10 LYS N N 10 120.956 120.956 119.433 1.523 18703 5167 1 15 . 1 1 10 10 LYS HA H 10 4.190 4.190 4.160 0.030 18703 5168 1 15 . 1 1 10 10 LYS C C 10 179.395 179.395 178.799 0.596 18703 5169 1 15 . 1 1 10 10 LYS CA C 10 59.231 59.231 58.855 0.376 18703 5170 1 15 . 1 1 10 10 LYS CB C 10 32.211 32.211 32.328 -0.117 18703 5171 1 15 . 1 1 10 10 LYS H H 10 8.009 8.009 7.340 0.669 18703 5172 1 15 . 1 1 11 11 VAL N N 11 119.577 119.577 118.325 1.252 18703 5173 1 15 . 1 1 11 11 VAL HA H 11 3.844 3.844 3.709 0.135 18703 5174 1 15 . 1 1 11 11 VAL C C 11 177.078 177.078 177.560 -0.482 18703 5175 1 15 . 1 1 11 11 VAL CA C 11 66.407 66.407 66.180 0.227 18703 5176 1 15 . 1 1 11 11 VAL CB C 11 31.252 31.252 31.644 -0.392 18703 5177 1 15 . 1 1 11 11 VAL H H 11 8.488 8.488 7.566 0.922 18703 5178 1 15 . 1 1 12 12 LYS N N 12 122.864 122.864 120.035 2.829 18703 5179 1 15 . 1 1 12 12 LYS HA H 12 4.189 4.189 3.976 0.213 18703 5180 1 15 . 1 1 12 12 LYS C C 12 178.755 178.755 178.177 0.578 18703 5181 1 15 . 1 1 12 12 LYS CA C 12 59.375 59.375 59.663 -0.287 18703 5182 1 15 . 1 1 12 12 LYS CB C 12 31.991 31.991 32.331 -0.341 18703 5183 1 15 . 1 1 12 12 LYS H H 12 7.944 7.944 7.558 0.386 18703 5184 1 15 . 1 1 13 13 ALA N N 13 121.202 121.202 120.580 0.622 18703 5185 1 15 . 1 1 13 13 ALA HA H 13 4.209 4.209 4.288 -0.079 18703 5186 1 15 . 1 1 13 13 ALA C C 13 181.060 181.060 179.374 1.686 18703 5187 1 15 . 1 1 13 13 ALA CA C 13 54.710 54.710 54.205 0.505 18703 5188 1 15 . 1 1 13 13 ALA CB C 13 17.861 17.861 18.466 -0.605 18703 5189 1 15 . 1 1 13 13 ALA H H 13 7.563 7.563 7.464 0.099 18703 5190 1 15 . 1 1 14 14 LEU N N 14 120.014 120.014 119.705 0.309 18703 5191 1 15 . 1 1 14 14 LEU HA H 14 4.072 4.072 4.012 0.060 18703 5192 1 15 . 1 1 14 14 LEU C C 14 177.862 177.862 178.165 -0.303 18703 5193 1 15 . 1 1 14 14 LEU CA C 14 57.864 57.864 57.503 0.361 18703 5194 1 15 . 1 1 14 14 LEU CB C 14 41.539 41.539 42.136 -0.597 18703 5195 1 15 . 1 1 14 14 LEU H H 14 8.087 8.087 7.535 0.552 18703 5196 1 15 . 1 1 15 15 GLU N N 15 121.644 121.644 120.252 1.392 18703 5197 1 15 . 1 1 15 15 GLU HA H 15 3.692 3.692 3.984 -0.292 18703 5198 1 15 . 1 1 15 15 GLU C C 15 177.819 177.819 178.179 -0.360 18703 5199 1 15 . 1 1 15 15 GLU CA C 15 59.239 59.239 59.503 -0.264 18703 5200 1 15 . 1 1 15 15 GLU CB C 15 28.865 28.865 29.630 -0.765 18703 5201 1 15 . 1 1 15 15 GLU H H 15 8.542 8.542 7.713 0.829 18703 5202 1 15 . 1 1 16 16 GLU N N 16 116.016 116.016 118.581 -2.565 18703 5203 1 15 . 1 1 16 16 GLU HA H 16 3.955 3.955 3.996 -0.041 18703 5204 1 15 . 1 1 16 16 GLU C C 16 179.159 179.159 178.965 0.194 18703 5205 1 15 . 1 1 16 16 GLU CA C 16 59.324 59.324 58.971 0.353 18703 5206 1 15 . 1 1 16 16 GLU CB C 16 29.060 29.060 28.984 0.076 18703 5207 1 15 . 1 1 16 16 GLU H H 16 7.492 7.492 8.000 -0.508 18703 5208 1 15 . 1 1 17 17 LYS N N 17 118.546 118.546 118.428 0.118 18703 5209 1 15 . 1 1 17 17 LYS HA H 17 4.117 4.117 4.136 -0.019 18703 5210 1 15 . 1 1 17 17 LYS C C 17 178.976 178.976 178.258 0.718 18703 5211 1 15 . 1 1 17 17 LYS CA C 17 58.837 58.837 58.684 0.153 18703 5212 1 15 . 1 1 17 17 LYS CB C 17 32.538 32.538 32.728 -0.190 18703 5213 1 15 . 1 1 17 17 LYS H H 17 7.720 7.720 7.521 0.199 18703 5214 1 15 . 1 1 18 18 VAL N N 18 118.376 118.376 119.281 -0.905 18703 5215 1 15 . 1 1 18 18 VAL HA H 18 3.711 3.711 3.764 -0.053 18703 5216 1 15 . 1 1 18 18 VAL C C 18 178.765 178.765 178.375 0.390 18703 5217 1 15 . 1 1 18 18 VAL CA C 18 66.237 66.237 65.770 0.467 18703 5218 1 15 . 1 1 18 18 VAL CB C 18 31.682 31.682 31.893 -0.211 18703 5219 1 15 . 1 1 18 18 VAL H H 18 8.754 8.754 7.586 1.168 18703 5220 1 15 . 1 1 19 19 LYS N N 19 118.817 118.817 119.516 -0.699 18703 5221 1 15 . 1 1 19 19 LYS HA H 19 4.078 4.078 4.024 0.054 18703 5222 1 15 . 1 1 19 19 LYS C C 19 178.049 178.049 177.800 0.249 18703 5223 1 15 . 1 1 19 19 LYS CA C 19 59.731 59.731 59.139 0.592 18703 5224 1 15 . 1 1 19 19 LYS CB C 19 32.523 32.523 32.000 0.523 18703 5225 1 15 . 1 1 19 19 LYS H H 19 8.299 8.299 8.623 -0.324 18703 5226 1 15 . 1 1 20 20 ALA N N 20 119.656 119.656 119.251 0.405 18703 5227 1 15 . 1 1 20 20 ALA HA H 20 4.347 4.347 4.373 -0.026 18703 5228 1 15 . 1 1 20 20 ALA C C 20 178.532 178.532 177.753 0.779 18703 5229 1 15 . 1 1 20 20 ALA CA C 20 52.853 52.853 52.306 0.547 18703 5230 1 15 . 1 1 20 20 ALA CB C 20 18.832 18.832 19.507 -0.675 18703 5231 1 15 . 1 1 20 20 ALA H H 20 7.425 7.425 7.859 -0.434 18703 5232 1 15 . 1 1 21 21 LEU N N 21 118.594 118.594 118.125 0.469 18703 5233 1 15 . 1 1 21 21 LEU HA H 21 4.297 4.297 4.682 -0.385 18703 5234 1 15 . 1 1 21 21 LEU C C 21 177.784 177.784 175.902 1.882 18703 5235 1 15 . 1 1 21 21 LEU CA C 21 55.750 55.750 54.765 0.985 18703 5236 1 15 . 1 1 21 21 LEU CB C 21 42.898 42.898 43.704 -0.806 18703 5237 1 15 . 1 1 21 21 LEU H H 21 7.508 7.508 7.472 0.036 18703 5238 1 15 . 1 1 22 22 GLY N N 22 106.650 106.650 106.173 0.477 18703 5239 1 15 . 1 1 22 22 GLY C C 22 173.605 173.605 173.573 0.032 18703 5240 1 15 . 1 1 22 22 GLY CA C 22 45.330 45.330 44.333 0.997 18703 5241 1 15 . 1 1 22 22 GLY H H 22 7.814 7.814 8.091 -0.277 18703 5242 1 15 . 1 1 23 23 GLY N N 23 108.011 108.011 107.113 0.898 18703 5243 1 15 . 1 1 23 23 GLY C C 23 174.061 174.061 173.175 0.886 18703 5244 1 15 . 1 1 23 23 GLY CA C 23 44.772 44.772 45.079 -0.307 18703 5245 1 15 . 1 1 23 23 GLY H H 23 8.139 8.139 8.221 -0.082 18703 5246 1 15 . 1 1 24 24 GLY N N 24 107.826 107.826 106.759 1.067 18703 5247 1 15 . 1 1 24 24 GLY C C 24 175.046 175.046 173.837 1.209 18703 5248 1 15 . 1 1 24 24 GLY CA C 24 44.422 44.422 45.182 -0.760 18703 5249 1 15 . 1 1 24 24 GLY H H 24 8.497 8.497 8.228 0.269 18703 5250 1 15 . 1 1 25 25 GLY N N 25 108.830 108.830 111.707 -2.877 18703 5251 1 15 . 1 1 25 25 GLY C C 25 176.272 176.272 175.924 0.348 18703 5252 1 15 . 1 1 25 25 GLY CA C 25 47.101 47.101 45.147 1.954 18703 5253 1 15 . 1 1 25 25 GLY H H 25 8.616 8.616 8.172 0.444 18703 5254 1 15 . 1 1 26 26 ARG N N 26 123.109 123.109 124.122 -1.013 18703 5255 1 15 . 1 1 26 26 ARG HA H 26 4.283 4.283 4.181 0.102 18703 5256 1 15 . 1 1 26 26 ARG C C 26 177.848 177.848 177.993 -0.145 18703 5257 1 15 . 1 1 26 26 ARG CA C 26 57.663 57.663 58.043 -0.380 18703 5258 1 15 . 1 1 26 26 ARG CB C 26 29.811 29.811 29.500 0.311 18703 5259 1 15 . 1 1 26 26 ARG H H 26 8.770 8.770 8.687 0.083 18703 5260 1 15 . 1 1 27 27 ILE N N 27 118.104 118.104 118.658 -0.554 18703 5261 1 15 . 1 1 27 27 ILE HA H 27 3.787 3.787 3.771 0.016 18703 5262 1 15 . 1 1 27 27 ILE C C 27 177.473 177.473 177.691 -0.218 18703 5263 1 15 . 1 1 27 27 ILE CA C 27 63.036 63.036 64.342 -1.306 18703 5264 1 15 . 1 1 27 27 ILE CB C 27 36.664 36.664 37.508 -0.844 18703 5265 1 15 . 1 1 27 27 ILE H H 27 7.708 7.708 8.052 -0.344 18703 5266 1 15 . 1 1 28 28 GLU N N 28 119.934 119.934 119.490 0.444 18703 5267 1 15 . 1 1 28 28 GLU HA H 28 3.954 3.954 3.931 0.023 18703 5268 1 15 . 1 1 28 28 GLU C C 28 179.514 179.514 178.806 0.708 18703 5269 1 15 . 1 1 28 28 GLU CA C 28 59.450 59.450 59.415 0.035 18703 5270 1 15 . 1 1 28 28 GLU CB C 28 29.600 29.600 29.360 0.240 18703 5271 1 15 . 1 1 28 28 GLU H H 28 7.872 7.872 7.898 -0.026 18703 5272 1 15 . 1 1 29 29 GLU N N 29 118.134 118.134 119.583 -1.449 18703 5273 1 15 . 1 1 29 29 GLU HA H 29 4.028 4.028 4.126 -0.098 18703 5274 1 15 . 1 1 29 29 GLU C C 29 179.182 179.182 179.275 -0.093 18703 5275 1 15 . 1 1 29 29 GLU CA C 29 59.173 59.173 58.571 0.602 18703 5276 1 15 . 1 1 29 29 GLU CB C 29 29.503 29.503 29.229 0.274 18703 5277 1 15 . 1 1 29 29 GLU H H 29 8.166 8.166 7.691 0.475 18703 5278 1 15 . 1 1 30 30 LEU N N 30 120.242 120.242 117.879 2.363 18703 5279 1 15 . 1 1 30 30 LEU HA H 30 4.028 4.028 4.184 -0.156 18703 5280 1 15 . 1 1 30 30 LEU C C 30 178.796 178.796 178.677 0.119 18703 5281 1 15 . 1 1 30 30 LEU CA C 30 57.654 57.654 56.350 1.304 18703 5282 1 15 . 1 1 30 30 LEU CB C 30 41.629 41.629 41.857 -0.228 18703 5283 1 15 . 1 1 30 30 LEU H H 30 7.695 7.695 7.501 0.194 18703 5284 1 15 . 1 1 31 31 LYS N N 31 120.506 120.506 120.612 -0.106 18703 5285 1 15 . 1 1 31 31 LYS HA H 31 3.532 3.532 4.044 -0.512 18703 5286 1 15 . 1 1 31 31 LYS C C 31 178.919 178.919 178.237 0.682 18703 5287 1 15 . 1 1 31 31 LYS CA C 31 60.240 60.240 59.333 0.907 18703 5288 1 15 . 1 1 31 31 LYS CB C 31 32.015 32.015 32.343 -0.327 18703 5289 1 15 . 1 1 31 31 LYS H H 31 8.561 8.561 7.749 0.812 18703 5290 1 15 . 1 1 32 32 LYS N N 32 118.566 118.566 118.930 -0.364 18703 5291 1 15 . 1 1 32 32 LYS C C 32 179.392 179.392 179.029 0.363 18703 5292 1 15 . 1 1 32 32 LYS CA C 32 59.356 59.356 59.847 -0.491 18703 5293 1 15 . 1 1 32 32 LYS CB C 32 32.117 32.117 32.406 -0.288 18703 5294 1 15 . 1 1 32 32 LYS H H 32 7.699 7.699 7.569 0.130 18703 5295 1 15 . 1 1 33 33 LYS N N 33 118.964 118.964 118.034 0.930 18703 5296 1 15 . 1 1 33 33 LYS HA H 33 4.117 4.117 4.055 0.062 18703 5297 1 15 . 1 1 33 33 LYS C C 33 178.355 178.355 178.527 -0.172 18703 5298 1 15 . 1 1 33 33 LYS CA C 33 58.633 58.633 59.142 -0.509 18703 5299 1 15 . 1 1 33 33 LYS CB C 33 31.904 31.904 32.379 -0.475 18703 5300 1 15 . 1 1 33 33 LYS H H 33 7.752 7.752 7.670 0.082 18703 5301 1 15 . 1 1 34 34 CYS N N 34 119.956 119.956 118.085 1.871 18703 5302 1 15 . 1 1 34 34 CYS HA H 34 3.967 3.967 4.122 -0.155 18703 5303 1 15 . 1 1 34 34 CYS C C 34 175.521 175.521 176.856 -1.335 18703 5304 1 15 . 1 1 34 34 CYS CA C 34 60.987 60.987 62.424 -1.437 18703 5305 1 15 . 1 1 34 34 CYS CB C 34 36.600 36.600 26.426 10.174 18703 5306 1 15 . 1 1 34 34 CYS H H 34 8.393 8.393 7.507 0.886 18703 5307 1 15 . 1 1 35 35 GLU N N 35 120.327 120.327 120.061 0.266 18703 5308 1 15 . 1 1 35 35 GLU HA H 35 3.891 3.891 3.936 -0.045 18703 5309 1 15 . 1 1 35 35 GLU C C 35 179.684 179.684 178.798 0.886 18703 5310 1 15 . 1 1 35 35 GLU CA C 35 60.059 60.059 59.340 0.719 18703 5311 1 15 . 1 1 35 35 GLU CB C 35 29.718 29.718 28.753 0.965 18703 5312 1 15 . 1 1 35 35 GLU H H 35 8.558 8.558 7.823 0.735 18703 5313 1 15 . 1 1 36 36 GLU N N 36 120.190 120.190 119.483 0.707 18703 5314 1 15 . 1 1 36 36 GLU HA H 36 4.051 4.051 3.936 0.115 18703 5315 1 15 . 1 1 36 36 GLU C C 36 179.408 179.408 179.000 0.408 18703 5316 1 15 . 1 1 36 36 GLU CA C 36 59.148 59.148 58.768 0.380 18703 5317 1 15 . 1 1 36 36 GLU CB C 36 29.766 29.766 28.939 0.827 18703 5318 1 15 . 1 1 36 36 GLU H H 36 8.038 8.038 7.839 0.199 18703 5319 1 15 . 1 1 37 37 LEU N N 37 121.102 121.102 120.853 0.249 18703 5320 1 15 . 1 1 37 37 LEU HA H 37 4.079 4.079 4.185 -0.106 18703 5321 1 15 . 1 1 37 37 LEU C C 37 178.279 178.279 178.319 -0.040 18703 5322 1 15 . 1 1 37 37 LEU CA C 37 57.803 57.803 57.158 0.645 18703 5323 1 15 . 1 1 37 37 LEU CB C 37 41.502 41.502 41.826 -0.324 18703 5324 1 15 . 1 1 37 37 LEU H H 37 8.065 8.065 7.479 0.586 18703 5325 1 15 . 1 1 38 38 LYS N N 38 119.980 119.980 118.925 1.055 18703 5326 1 15 . 1 1 38 38 LYS HA H 38 3.851 3.851 3.958 -0.107 18703 5327 1 15 . 1 1 38 38 LYS C C 38 178.919 178.919 179.174 -0.255 18703 5328 1 15 . 1 1 38 38 LYS CA C 38 60.794 60.794 60.011 0.783 18703 5329 1 15 . 1 1 38 38 LYS CB C 38 32.863 32.863 32.237 0.625 18703 5330 1 15 . 1 1 38 38 LYS H H 38 8.741 8.741 7.905 0.836 18703 5331 1 15 . 1 1 39 39 LYS N N 39 118.307 118.307 117.569 0.738 18703 5332 1 15 . 1 1 39 39 LYS HA H 39 4.125 4.125 3.986 0.139 18703 5333 1 15 . 1 1 39 39 LYS C C 39 178.622 178.622 178.439 0.183 18703 5334 1 15 . 1 1 39 39 LYS CA C 39 58.993 58.993 59.152 -0.159 18703 5335 1 15 . 1 1 39 39 LYS CB C 39 32.097 32.097 31.758 0.339 18703 5336 1 15 . 1 1 39 39 LYS H H 39 7.584 7.584 7.674 -0.090 18703 5337 1 15 . 1 1 40 40 LYS N N 40 118.826 118.826 119.544 -0.718 18703 5338 1 15 . 1 1 40 40 LYS HA H 40 4.069 4.069 4.137 -0.068 18703 5339 1 15 . 1 1 40 40 LYS C C 40 179.802 179.802 178.997 0.805 18703 5340 1 15 . 1 1 40 40 LYS CA C 40 59.322 59.322 58.696 0.626 18703 5341 1 15 . 1 1 40 40 LYS CB C 40 32.505 32.505 32.461 0.044 18703 5342 1 15 . 1 1 40 40 LYS H H 40 7.945 7.945 7.351 0.594 18703 5343 1 15 . 1 1 41 41 ILE N N 41 118.958 118.958 118.006 0.952 18703 5344 1 15 . 1 1 41 41 ILE HA H 41 3.659 3.659 3.719 -0.060 18703 5345 1 15 . 1 1 41 41 ILE C C 41 178.146 178.146 176.570 1.576 18703 5346 1 15 . 1 1 41 41 ILE CA C 41 65.037 65.037 64.280 0.757 18703 5347 1 15 . 1 1 41 41 ILE CB C 41 37.950 37.950 38.140 -0.190 18703 5348 1 15 . 1 1 41 41 ILE H H 41 8.369 8.369 8.029 0.340 18703 5349 1 15 . 1 1 42 42 GLU N N 42 120.331 120.331 116.785 3.546 18703 5350 1 15 . 1 1 42 42 GLU HA H 42 4.094 4.094 4.034 0.060 18703 5351 1 15 . 1 1 42 42 GLU C C 42 178.697 178.697 177.654 1.043 18703 5352 1 15 . 1 1 42 42 GLU CA C 42 58.927 58.927 58.202 0.725 18703 5353 1 15 . 1 1 42 42 GLU CB C 42 29.399 29.399 29.955 -0.556 18703 5354 1 15 . 1 1 42 42 GLU H H 42 7.805 7.805 7.630 0.175 18703 5355 1 15 . 1 1 43 43 GLU N N 43 117.120 117.120 118.014 -0.894 18703 5356 1 15 . 1 1 43 43 GLU HA H 43 4.291 4.291 4.182 0.109 18703 5357 1 15 . 1 1 43 43 GLU C C 43 177.551 177.551 177.529 0.022 18703 5358 1 15 . 1 1 43 43 GLU CA C 43 56.800 56.800 56.844 -0.044 18703 5359 1 15 . 1 1 43 43 GLU CB C 43 29.931 29.931 29.617 0.314 18703 5360 1 15 . 1 1 43 43 GLU H H 43 7.701 7.701 7.648 0.053 18703 5361 1 15 . 1 1 44 44 LEU N N 44 120.940 120.940 119.981 0.959 18703 5362 1 15 . 1 1 44 44 LEU HA H 44 4.251 4.251 4.018 0.233 18703 5363 1 15 . 1 1 44 44 LEU C C 44 178.596 178.596 177.766 0.830 18703 5364 1 15 . 1 1 44 44 LEU CA C 44 56.448 56.448 55.652 0.796 18703 5365 1 15 . 1 1 44 44 LEU CB C 44 42.519 42.519 42.345 0.174 18703 5366 1 15 . 1 1 44 44 LEU H H 44 7.581 7.581 7.370 0.211 18703 5367 1 15 . 1 1 45 45 GLY N N 45 108.689 108.689 107.445 1.244 18703 5368 1 15 . 1 1 45 45 GLY C C 45 174.853 174.853 173.709 1.144 18703 5369 1 15 . 1 1 45 45 GLY CA C 45 46.233 46.233 45.380 0.853 18703 5370 1 15 . 1 1 45 45 GLY H H 45 8.232 8.232 8.478 -0.246 18703 5371 1 15 . 1 1 46 46 GLY N N 46 108.029 108.029 108.152 -0.123 18703 5372 1 15 . 1 1 46 46 GLY C C 46 174.351 174.351 173.452 0.899 18703 5373 1 15 . 1 1 46 46 GLY CA C 46 45.105 45.105 45.841 -0.736 18703 5374 1 15 . 1 1 46 46 GLY H H 46 8.176 8.176 8.047 0.129 18703 5375 1 15 . 1 1 47 47 GLY N N 47 108.183 108.183 109.788 -1.605 18703 5376 1 15 . 1 1 47 47 GLY C C 47 174.671 174.671 174.579 0.092 18703 5377 1 15 . 1 1 47 47 GLY CA C 47 45.254 45.254 45.891 -0.637 18703 5378 1 15 . 1 1 47 47 GLY H H 47 8.290 8.290 8.114 0.176 18703 5379 1 15 . 1 1 48 48 GLY N N 48 108.616 108.616 107.792 0.824 18703 5380 1 15 . 1 1 48 48 GLY C C 48 174.321 174.321 174.760 -0.439 18703 5381 1 15 . 1 1 48 48 GLY CA C 48 45.192 45.192 45.308 -0.116 18703 5382 1 15 . 1 1 48 48 GLY H H 48 8.027 8.027 8.308 -0.281 18703 5383 1 15 . 1 1 49 49 GLU N N 49 121.057 121.057 120.181 0.876 18703 5384 1 15 . 1 1 49 49 GLU HA H 49 4.425 4.425 4.466 -0.041 18703 5385 1 15 . 1 1 49 49 GLU C C 49 177.072 177.072 177.994 -0.922 18703 5386 1 15 . 1 1 49 49 GLU CA C 49 56.330 56.330 56.795 -0.465 18703 5387 1 15 . 1 1 49 49 GLU CB C 49 29.602 29.602 29.926 -0.324 18703 5388 1 15 . 1 1 49 49 GLU H H 49 8.486 8.486 8.269 0.217 18703 5389 1 15 . 1 1 50 50 VAL N N 50 122.122 122.122 119.401 2.721 18703 5390 1 15 . 1 1 50 50 VAL HA H 50 3.792 3.792 3.673 0.119 18703 5391 1 15 . 1 1 50 50 VAL C C 50 176.774 176.774 178.116 -1.342 18703 5392 1 15 . 1 1 50 50 VAL CA C 50 64.864 64.864 65.631 -0.767 18703 5393 1 15 . 1 1 50 50 VAL CB C 50 32.179 32.179 31.567 0.612 18703 5394 1 15 . 1 1 50 50 VAL H H 50 8.095 8.095 7.865 0.230 18703 5395 1 15 . 1 1 51 51 LYS N N 51 120.602 120.602 118.160 2.442 18703 5396 1 15 . 1 1 51 51 LYS HA H 51 4.195 4.195 4.073 0.122 18703 5397 1 15 . 1 1 51 51 LYS C C 51 178.530 178.530 177.863 0.667 18703 5398 1 15 . 1 1 51 51 LYS CA C 51 59.348 59.348 59.068 0.280 18703 5399 1 15 . 1 1 51 51 LYS CB C 51 32.265 32.265 31.997 0.268 18703 5400 1 15 . 1 1 51 51 LYS H H 51 8.268 8.268 8.108 0.160 18703 5401 1 15 . 1 1 52 52 LYS N N 52 117.547 117.547 120.796 -3.249 18703 5402 1 15 . 1 1 52 52 LYS HA H 52 4.162 4.162 4.070 0.092 18703 5403 1 15 . 1 1 52 52 LYS C C 52 179.132 179.132 178.708 0.424 18703 5404 1 15 . 1 1 52 52 LYS CA C 52 58.811 58.811 59.409 -0.598 18703 5405 1 15 . 1 1 52 52 LYS CB C 52 32.054 32.054 32.441 -0.388 18703 5406 1 15 . 1 1 52 52 LYS H H 52 7.595 7.595 7.716 -0.121 18703 5407 1 15 . 1 1 53 53 VAL N N 53 119.190 119.190 118.385 0.805 18703 5408 1 15 . 1 1 53 53 VAL HA H 53 3.767 3.767 3.680 0.087 18703 5409 1 15 . 1 1 53 53 VAL C C 53 177.933 177.933 178.053 -0.120 18703 5410 1 15 . 1 1 53 53 VAL CA C 53 66.065 66.065 66.158 -0.093 18703 5411 1 15 . 1 1 53 53 VAL CB C 53 31.248 31.248 31.224 0.024 18703 5412 1 15 . 1 1 53 53 VAL H H 53 7.597 7.597 7.569 0.028 18703 5413 1 15 . 1 1 54 54 GLU N N 54 120.226 120.226 119.572 0.654 18703 5414 1 15 . 1 1 54 54 GLU HA H 54 3.833 3.833 4.020 -0.187 18703 5415 1 15 . 1 1 54 54 GLU C C 54 179.352 179.352 178.493 0.859 18703 5416 1 15 . 1 1 54 54 GLU CA C 54 59.153 59.153 59.382 -0.229 18703 5417 1 15 . 1 1 54 54 GLU CB C 54 29.224 29.224 29.406 -0.182 18703 5418 1 15 . 1 1 54 54 GLU H H 54 8.609 8.609 7.842 0.767 18703 5419 1 15 . 1 1 55 55 GLU N N 55 119.148 119.148 118.936 0.212 18703 5420 1 15 . 1 1 55 55 GLU HA H 55 4.084 4.084 4.132 -0.048 18703 5421 1 15 . 1 1 55 55 GLU C C 55 179.084 179.084 178.762 0.322 18703 5422 1 15 . 1 1 55 55 GLU CA C 55 59.295 59.295 58.972 0.323 18703 5423 1 15 . 1 1 55 55 GLU CB C 55 29.361 29.361 29.620 -0.259 18703 5424 1 15 . 1 1 55 55 GLU H H 55 7.713 7.713 7.711 0.002 18703 5425 1 15 . 1 1 56 56 GLU N N 56 120.301 120.301 119.032 1.269 18703 5426 1 15 . 1 1 56 56 GLU HA H 56 4.079 4.079 4.111 -0.032 18703 5427 1 15 . 1 1 56 56 GLU C C 56 179.773 179.773 179.147 0.626 18703 5428 1 15 . 1 1 56 56 GLU CA C 56 59.528 59.528 59.247 0.281 18703 5429 1 15 . 1 1 56 56 GLU CB C 56 30.162 30.162 29.797 0.365 18703 5430 1 15 . 1 1 56 56 GLU H H 56 7.899 7.899 7.567 0.332 18703 5431 1 15 . 1 1 57 57 VAL N N 57 121.536 121.536 118.240 3.296 18703 5432 1 15 . 1 1 57 57 VAL HA H 57 3.540 3.540 3.765 -0.225 18703 5433 1 15 . 1 1 57 57 VAL C C 57 176.984 176.984 177.485 -0.501 18703 5434 1 15 . 1 1 57 57 VAL CA C 57 66.734 66.734 65.440 1.294 18703 5435 1 15 . 1 1 57 57 VAL CB C 57 31.425 31.425 31.657 -0.232 18703 5436 1 15 . 1 1 57 57 VAL H H 57 8.652 8.652 7.565 1.087 18703 5437 1 15 . 1 1 58 58 LYS N N 58 120.219 120.219 119.994 0.225 18703 5438 1 15 . 1 1 58 58 LYS HA H 58 4.199 4.199 4.058 0.141 18703 5439 1 15 . 1 1 58 58 LYS C C 58 178.972 178.972 178.414 0.558 18703 5440 1 15 . 1 1 58 58 LYS CA C 58 59.357 59.357 59.536 -0.179 18703 5441 1 15 . 1 1 58 58 LYS CB C 58 32.186 32.186 32.093 0.093 18703 5442 1 15 . 1 1 58 58 LYS H H 58 7.791 7.791 7.463 0.328 18703 5443 1 15 . 1 1 59 59 LYS N N 59 118.252 118.252 119.870 -1.618 18703 5444 1 15 . 1 1 59 59 LYS HA H 59 4.069 4.069 4.136 -0.067 18703 5445 1 15 . 1 1 59 59 LYS C C 59 179.180 179.180 178.352 0.828 18703 5446 1 15 . 1 1 59 59 LYS CA C 59 59.285 59.285 59.274 0.011 18703 5447 1 15 . 1 1 59 59 LYS CB C 59 32.345 32.345 32.381 -0.036 18703 5448 1 15 . 1 1 59 59 LYS H H 59 7.849 7.849 7.524 0.325 18703 5449 1 15 . 1 1 60 60 LEU N N 60 121.243 121.243 119.805 1.438 18703 5450 1 15 . 1 1 60 60 LEU HA H 60 4.242 4.242 4.118 0.124 18703 5451 1 15 . 1 1 60 60 LEU C C 60 178.413 178.413 178.208 0.205 18703 5452 1 15 . 1 1 60 60 LEU CA C 60 57.798 57.798 57.234 0.564 18703 5453 1 15 . 1 1 60 60 LEU CB C 60 41.150 41.150 42.142 -0.991 18703 5454 1 15 . 1 1 60 60 LEU H H 60 7.825 7.825 7.579 0.246 18703 5455 1 15 . 1 1 61 61 GLU N N 61 118.844 118.844 120.072 -1.228 18703 5456 1 15 . 1 1 61 61 GLU HA H 61 3.800 3.800 3.926 -0.126 18703 5457 1 15 . 1 1 61 61 GLU C C 61 179.078 179.078 178.555 0.523 18703 5458 1 15 . 1 1 61 61 GLU CA C 61 60.104 60.104 59.981 0.123 18703 5459 1 15 . 1 1 61 61 GLU CB C 61 29.864 29.864 29.643 0.221 18703 5460 1 15 . 1 1 61 61 GLU H H 61 8.582 8.582 7.707 0.875 18703 5461 1 15 . 1 1 62 62 GLU N N 62 117.659 117.659 118.764 -1.105 18703 5462 1 15 . 1 1 62 62 GLU HA H 62 3.990 3.990 4.035 -0.045 18703 5463 1 15 . 1 1 62 62 GLU C C 62 178.847 178.847 178.937 -0.090 18703 5464 1 15 . 1 1 62 62 GLU CA C 62 59.067 59.067 58.960 0.107 18703 5465 1 15 . 1 1 62 62 GLU CB C 62 29.440 29.440 29.653 -0.213 18703 5466 1 15 . 1 1 62 62 GLU H H 62 8.032 8.032 7.617 0.415 18703 5467 1 15 . 1 1 63 63 GLU N N 63 119.290 119.290 119.404 -0.114 18703 5468 1 15 . 1 1 63 63 GLU HA H 63 4.012 4.012 4.090 -0.078 18703 5469 1 15 . 1 1 63 63 GLU C C 63 179.784 179.784 179.387 0.397 18703 5470 1 15 . 1 1 63 63 GLU CA C 63 59.300 59.300 59.211 0.089 18703 5471 1 15 . 1 1 63 63 GLU CB C 63 29.728 29.728 29.485 0.243 18703 5472 1 15 . 1 1 63 63 GLU H H 63 7.958 7.958 7.421 0.537 18703 5473 1 15 . 1 1 64 64 ILE N N 64 118.453 118.453 119.103 -0.650 18703 5474 1 15 . 1 1 64 64 ILE HA H 64 3.711 3.711 3.758 -0.047 18703 5475 1 15 . 1 1 64 64 ILE C C 64 177.655 177.655 177.143 0.512 18703 5476 1 15 . 1 1 64 64 ILE CA C 64 64.256 64.256 64.087 0.169 18703 5477 1 15 . 1 1 64 64 ILE CB C 64 38.002 38.002 37.531 0.471 18703 5478 1 15 . 1 1 64 64 ILE H H 64 8.160 8.160 7.543 0.617 18703 5479 1 15 . 1 1 65 65 LYS N N 65 118.871 118.871 117.987 0.884 18703 5480 1 15 . 1 1 65 65 LYS HA H 65 4.111 4.111 4.137 -0.026 18703 5481 1 15 . 1 1 65 65 LYS C C 65 177.076 177.076 177.764 -0.688 18703 5482 1 15 . 1 1 65 65 LYS CA C 65 58.421 58.421 58.426 -0.005 18703 5483 1 15 . 1 1 65 65 LYS CB C 65 32.639 32.639 32.352 0.287 18703 5484 1 15 . 1 1 65 65 LYS H H 65 7.664 7.664 7.537 0.127 18703 5485 1 15 . 1 1 66 66 LYS N N 66 116.944 116.944 118.244 -1.300 18703 5486 1 15 . 1 1 66 66 LYS HA H 66 4.320 4.320 4.118 0.202 18703 5487 1 15 . 1 1 66 66 LYS C C 66 175.897 175.897 177.289 -1.392 18703 5488 1 15 . 1 1 66 66 LYS CA C 66 56.352 56.352 58.405 -2.053 18703 5489 1 15 . 1 1 66 66 LYS CB C 66 33.024 33.024 33.135 -0.111 18703 5490 1 15 . 1 1 66 66 LYS H H 66 7.246 7.246 7.823 -0.577 18703 5491 1 16 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.443 -0.197 18703 5492 1 16 . 1 1 3 3 ARG C C 3 178.379 178.379 177.241 1.138 18703 5493 1 16 . 1 1 3 3 ARG CA C 3 58.367 58.367 56.720 1.647 18703 5494 1 16 . 1 1 3 3 ARG CB C 3 30.691 30.691 30.752 -0.061 18703 5495 1 16 . 1 1 3 3 ARG H H 3 7.905 7.905 8.680 -0.775 18703 5496 1 16 . 1 1 4 4 VAL N N 4 118.966 118.966 121.155 -2.189 18703 5497 1 16 . 1 1 4 4 VAL HA H 4 3.803 3.803 4.005 -0.202 18703 5498 1 16 . 1 1 4 4 VAL C C 4 176.968 176.968 177.332 -0.364 18703 5499 1 16 . 1 1 4 4 VAL CA C 4 65.441 65.441 64.808 0.633 18703 5500 1 16 . 1 1 4 4 VAL CB C 4 31.710 31.710 31.325 0.385 18703 5501 1 16 . 1 1 4 4 VAL H H 4 8.070 8.070 8.201 -0.131 18703 5502 1 16 . 1 1 5 5 LYS N N 5 122.058 122.058 120.060 1.998 18703 5503 1 16 . 1 1 5 5 LYS HA H 5 4.154 4.154 4.098 0.056 18703 5504 1 16 . 1 1 5 5 LYS C C 5 178.553 178.553 178.573 -0.020 18703 5505 1 16 . 1 1 5 5 LYS CA C 5 58.712 58.712 59.106 -0.394 18703 5506 1 16 . 1 1 5 5 LYS CB C 5 31.788 31.788 31.449 0.339 18703 5507 1 16 . 1 1 5 5 LYS H H 5 7.798 7.798 8.432 -0.634 18703 5508 1 16 . 1 1 6 6 ALA N N 6 119.955 119.955 121.000 -1.045 18703 5509 1 16 . 1 1 6 6 ALA HA H 6 4.198 4.198 4.267 -0.069 18703 5510 1 16 . 1 1 6 6 ALA C C 6 180.974 180.974 179.282 1.692 18703 5511 1 16 . 1 1 6 6 ALA CA C 6 54.850 54.850 54.060 0.790 18703 5512 1 16 . 1 1 6 6 ALA CB C 6 17.995 17.995 17.985 0.010 18703 5513 1 16 . 1 1 6 6 ALA H H 6 7.928 7.928 8.259 -0.331 18703 5514 1 16 . 1 1 7 7 LEU N N 7 119.211 119.211 120.016 -0.805 18703 5515 1 16 . 1 1 7 7 LEU HA H 7 4.124 4.124 3.939 0.185 18703 5516 1 16 . 1 1 7 7 LEU C C 7 178.353 178.353 178.504 -0.151 18703 5517 1 16 . 1 1 7 7 LEU CA C 7 57.658 57.658 57.362 0.296 18703 5518 1 16 . 1 1 7 7 LEU CB C 7 41.971 41.971 42.040 -0.069 18703 5519 1 16 . 1 1 7 7 LEU H H 7 7.594 7.594 7.854 -0.260 18703 5520 1 16 . 1 1 8 8 GLU N N 8 120.258 120.258 118.250 2.008 18703 5521 1 16 . 1 1 8 8 GLU HA H 8 3.846 3.846 4.000 -0.154 18703 5522 1 16 . 1 1 8 8 GLU C C 8 179.546 179.546 178.821 0.725 18703 5523 1 16 . 1 1 8 8 GLU CA C 8 60.006 60.006 59.634 0.372 18703 5524 1 16 . 1 1 8 8 GLU CB C 8 29.683 29.683 29.657 0.026 18703 5525 1 16 . 1 1 8 8 GLU H H 8 8.382 8.382 7.765 0.617 18703 5526 1 16 . 1 1 9 9 GLU N N 9 118.584 118.584 118.629 -0.045 18703 5527 1 16 . 1 1 9 9 GLU HA H 9 4.039 4.039 4.130 -0.091 18703 5528 1 16 . 1 1 9 9 GLU C C 9 179.635 179.635 178.667 0.968 18703 5529 1 16 . 1 1 9 9 GLU CA C 9 59.235 59.235 58.692 0.543 18703 5530 1 16 . 1 1 9 9 GLU CB C 9 29.358 29.358 29.136 0.222 18703 5531 1 16 . 1 1 9 9 GLU H H 9 7.908 7.908 7.826 0.082 18703 5532 1 16 . 1 1 10 10 LYS N N 10 120.956 120.956 120.193 0.763 18703 5533 1 16 . 1 1 10 10 LYS HA H 10 4.190 4.190 4.129 0.061 18703 5534 1 16 . 1 1 10 10 LYS C C 10 179.395 179.395 178.971 0.424 18703 5535 1 16 . 1 1 10 10 LYS CA C 10 59.231 59.231 59.222 0.009 18703 5536 1 16 . 1 1 10 10 LYS CB C 10 32.211 32.211 32.671 -0.460 18703 5537 1 16 . 1 1 10 10 LYS H H 10 8.009 8.009 7.411 0.598 18703 5538 1 16 . 1 1 11 11 VAL N N 11 119.577 119.577 118.355 1.222 18703 5539 1 16 . 1 1 11 11 VAL HA H 11 3.844 3.844 3.659 0.185 18703 5540 1 16 . 1 1 11 11 VAL C C 11 177.078 177.078 177.534 -0.456 18703 5541 1 16 . 1 1 11 11 VAL CA C 11 66.407 66.407 66.132 0.274 18703 5542 1 16 . 1 1 11 11 VAL CB C 11 31.252 31.252 31.409 -0.157 18703 5543 1 16 . 1 1 11 11 VAL H H 11 8.488 8.488 7.439 1.049 18703 5544 1 16 . 1 1 12 12 LYS N N 12 122.864 122.864 118.849 4.015 18703 5545 1 16 . 1 1 12 12 LYS HA H 12 4.189 4.189 3.987 0.202 18703 5546 1 16 . 1 1 12 12 LYS C C 12 178.755 178.755 178.486 0.269 18703 5547 1 16 . 1 1 12 12 LYS CA C 12 59.375 59.375 59.539 -0.164 18703 5548 1 16 . 1 1 12 12 LYS CB C 12 31.991 31.991 32.177 -0.186 18703 5549 1 16 . 1 1 12 12 LYS H H 12 7.944 7.944 7.645 0.299 18703 5550 1 16 . 1 1 13 13 ALA N N 13 121.202 121.202 120.470 0.732 18703 5551 1 16 . 1 1 13 13 ALA HA H 13 4.209 4.209 4.271 -0.062 18703 5552 1 16 . 1 1 13 13 ALA C C 13 181.060 181.060 179.590 1.470 18703 5553 1 16 . 1 1 13 13 ALA CA C 13 54.710 54.710 54.137 0.573 18703 5554 1 16 . 1 1 13 13 ALA CB C 13 17.861 17.861 18.349 -0.488 18703 5555 1 16 . 1 1 13 13 ALA H H 13 7.563 7.563 7.402 0.161 18703 5556 1 16 . 1 1 14 14 LEU N N 14 120.014 120.014 119.834 0.180 18703 5557 1 16 . 1 1 14 14 LEU HA H 14 4.072 4.072 4.003 0.069 18703 5558 1 16 . 1 1 14 14 LEU C C 14 177.862 177.862 178.065 -0.203 18703 5559 1 16 . 1 1 14 14 LEU CA C 14 57.864 57.864 57.533 0.331 18703 5560 1 16 . 1 1 14 14 LEU CB C 14 41.539 41.539 42.145 -0.606 18703 5561 1 16 . 1 1 14 14 LEU H H 14 8.087 8.087 7.498 0.589 18703 5562 1 16 . 1 1 15 15 GLU N N 15 121.644 121.644 120.124 1.520 18703 5563 1 16 . 1 1 15 15 GLU HA H 15 3.692 3.692 3.988 -0.296 18703 5564 1 16 . 1 1 15 15 GLU C C 15 177.819 177.819 178.303 -0.484 18703 5565 1 16 . 1 1 15 15 GLU CA C 15 59.239 59.239 59.369 -0.130 18703 5566 1 16 . 1 1 15 15 GLU CB C 15 28.865 28.865 29.478 -0.613 18703 5567 1 16 . 1 1 15 15 GLU H H 15 8.542 8.542 7.687 0.855 18703 5568 1 16 . 1 1 16 16 GLU N N 16 116.016 116.016 118.481 -2.465 18703 5569 1 16 . 1 1 16 16 GLU HA H 16 3.955 3.955 4.008 -0.053 18703 5570 1 16 . 1 1 16 16 GLU C C 16 179.159 179.159 178.885 0.274 18703 5571 1 16 . 1 1 16 16 GLU CA C 16 59.324 59.324 59.148 0.176 18703 5572 1 16 . 1 1 16 16 GLU CB C 16 29.060 29.060 29.226 -0.166 18703 5573 1 16 . 1 1 16 16 GLU H H 16 7.492 7.492 7.983 -0.491 18703 5574 1 16 . 1 1 17 17 LYS N N 17 118.546 118.546 119.112 -0.566 18703 5575 1 16 . 1 1 17 17 LYS HA H 17 4.117 4.117 4.144 -0.027 18703 5576 1 16 . 1 1 17 17 LYS C C 17 178.976 178.976 178.990 -0.014 18703 5577 1 16 . 1 1 17 17 LYS CA C 17 58.837 58.837 58.923 -0.086 18703 5578 1 16 . 1 1 17 17 LYS CB C 17 32.538 32.538 32.818 -0.280 18703 5579 1 16 . 1 1 17 17 LYS H H 17 7.720 7.720 7.477 0.243 18703 5580 1 16 . 1 1 18 18 VAL N N 18 118.376 118.376 119.411 -1.035 18703 5581 1 16 . 1 1 18 18 VAL HA H 18 3.711 3.711 3.642 0.069 18703 5582 1 16 . 1 1 18 18 VAL C C 18 178.765 178.765 178.746 0.019 18703 5583 1 16 . 1 1 18 18 VAL CA C 18 66.237 66.237 66.370 -0.133 18703 5584 1 16 . 1 1 18 18 VAL CB C 18 31.682 31.682 31.639 0.043 18703 5585 1 16 . 1 1 18 18 VAL H H 18 8.754 8.754 7.474 1.280 18703 5586 1 16 . 1 1 19 19 LYS N N 19 118.817 118.817 120.310 -1.493 18703 5587 1 16 . 1 1 19 19 LYS HA H 19 4.078 4.078 4.008 0.070 18703 5588 1 16 . 1 1 19 19 LYS C C 19 178.049 178.049 177.681 0.368 18703 5589 1 16 . 1 1 19 19 LYS CA C 19 59.731 59.731 59.270 0.461 18703 5590 1 16 . 1 1 19 19 LYS CB C 19 32.523 32.523 32.069 0.454 18703 5591 1 16 . 1 1 19 19 LYS H H 19 8.299 8.299 8.597 -0.298 18703 5592 1 16 . 1 1 20 20 ALA N N 20 119.656 119.656 118.965 0.691 18703 5593 1 16 . 1 1 20 20 ALA HA H 20 4.347 4.347 4.366 -0.019 18703 5594 1 16 . 1 1 20 20 ALA C C 20 178.532 178.532 177.920 0.612 18703 5595 1 16 . 1 1 20 20 ALA CA C 20 52.853 52.853 52.191 0.662 18703 5596 1 16 . 1 1 20 20 ALA CB C 20 18.832 18.832 19.328 -0.496 18703 5597 1 16 . 1 1 20 20 ALA H H 20 7.425 7.425 7.682 -0.257 18703 5598 1 16 . 1 1 21 21 LEU N N 21 118.594 118.594 119.476 -0.882 18703 5599 1 16 . 1 1 21 21 LEU HA H 21 4.297 4.297 4.323 -0.026 18703 5600 1 16 . 1 1 21 21 LEU C C 21 177.784 177.784 176.617 1.167 18703 5601 1 16 . 1 1 21 21 LEU CA C 21 55.750 55.750 54.987 0.763 18703 5602 1 16 . 1 1 21 21 LEU CB C 21 42.898 42.898 43.227 -0.329 18703 5603 1 16 . 1 1 21 21 LEU H H 21 7.508 7.508 7.691 -0.183 18703 5604 1 16 . 1 1 22 22 GLY N N 22 106.650 106.650 106.577 0.073 18703 5605 1 16 . 1 1 22 22 GLY C C 22 173.605 173.605 173.258 0.347 18703 5606 1 16 . 1 1 22 22 GLY CA C 22 45.330 45.330 44.649 0.681 18703 5607 1 16 . 1 1 22 22 GLY H H 22 7.814 7.814 8.344 -0.530 18703 5608 1 16 . 1 1 23 23 GLY N N 23 108.011 108.011 109.886 -1.875 18703 5609 1 16 . 1 1 23 23 GLY C C 23 174.061 174.061 172.977 1.084 18703 5610 1 16 . 1 1 23 23 GLY CA C 23 44.772 44.772 45.193 -0.421 18703 5611 1 16 . 1 1 23 23 GLY H H 23 8.139 8.139 8.013 0.126 18703 5612 1 16 . 1 1 24 24 GLY N N 24 107.826 107.826 108.872 -1.046 18703 5613 1 16 . 1 1 24 24 GLY C C 24 175.046 175.046 173.819 1.227 18703 5614 1 16 . 1 1 24 24 GLY CA C 24 44.422 44.422 45.072 -0.649 18703 5615 1 16 . 1 1 24 24 GLY H H 24 8.497 8.497 8.323 0.174 18703 5616 1 16 . 1 1 25 25 GLY N N 25 108.830 108.830 112.578 -3.748 18703 5617 1 16 . 1 1 25 25 GLY C C 25 176.272 176.272 175.014 1.258 18703 5618 1 16 . 1 1 25 25 GLY CA C 25 47.101 47.101 45.855 1.246 18703 5619 1 16 . 1 1 25 25 GLY H H 25 8.616 8.616 7.820 0.796 18703 5620 1 16 . 1 1 26 26 ARG N N 26 123.109 123.109 123.890 -0.781 18703 5621 1 16 . 1 1 26 26 ARG HA H 26 4.283 4.283 4.115 0.168 18703 5622 1 16 . 1 1 26 26 ARG C C 26 177.848 177.848 177.954 -0.106 18703 5623 1 16 . 1 1 26 26 ARG CA C 26 57.663 57.663 58.041 -0.378 18703 5624 1 16 . 1 1 26 26 ARG CB C 26 29.811 29.811 29.346 0.465 18703 5625 1 16 . 1 1 26 26 ARG H H 26 8.770 8.770 8.596 0.174 18703 5626 1 16 . 1 1 27 27 ILE N N 27 118.104 118.104 118.302 -0.198 18703 5627 1 16 . 1 1 27 27 ILE HA H 27 3.787 3.787 3.872 -0.085 18703 5628 1 16 . 1 1 27 27 ILE C C 27 177.473 177.473 177.874 -0.401 18703 5629 1 16 . 1 1 27 27 ILE CA C 27 63.036 63.036 64.026 -0.990 18703 5630 1 16 . 1 1 27 27 ILE CB C 27 36.664 36.664 37.309 -0.645 18703 5631 1 16 . 1 1 27 27 ILE H H 27 7.708 7.708 7.931 -0.223 18703 5632 1 16 . 1 1 28 28 GLU N N 28 119.934 119.934 120.381 -0.447 18703 5633 1 16 . 1 1 28 28 GLU HA H 28 3.954 3.954 3.976 -0.022 18703 5634 1 16 . 1 1 28 28 GLU C C 28 179.514 179.514 178.531 0.983 18703 5635 1 16 . 1 1 28 28 GLU CA C 28 59.450 59.450 59.333 0.117 18703 5636 1 16 . 1 1 28 28 GLU CB C 28 29.600 29.600 29.153 0.447 18703 5637 1 16 . 1 1 28 28 GLU H H 28 7.872 7.872 7.773 0.099 18703 5638 1 16 . 1 1 29 29 GLU N N 29 118.134 118.134 119.623 -1.489 18703 5639 1 16 . 1 1 29 29 GLU HA H 29 4.028 4.028 4.125 -0.097 18703 5640 1 16 . 1 1 29 29 GLU C C 29 179.182 179.182 179.254 -0.072 18703 5641 1 16 . 1 1 29 29 GLU CA C 29 59.173 59.173 58.827 0.346 18703 5642 1 16 . 1 1 29 29 GLU CB C 29 29.503 29.503 29.299 0.204 18703 5643 1 16 . 1 1 29 29 GLU H H 29 8.166 8.166 7.618 0.548 18703 5644 1 16 . 1 1 30 30 LEU N N 30 120.242 120.242 118.111 2.131 18703 5645 1 16 . 1 1 30 30 LEU HA H 30 4.028 4.028 4.098 -0.070 18703 5646 1 16 . 1 1 30 30 LEU C C 30 178.796 178.796 178.808 -0.012 18703 5647 1 16 . 1 1 30 30 LEU CA C 30 57.654 57.654 56.643 1.011 18703 5648 1 16 . 1 1 30 30 LEU CB C 30 41.629 41.629 41.771 -0.142 18703 5649 1 16 . 1 1 30 30 LEU H H 30 7.695 7.695 7.617 0.078 18703 5650 1 16 . 1 1 31 31 LYS N N 31 120.506 120.506 120.258 0.248 18703 5651 1 16 . 1 1 31 31 LYS HA H 31 3.532 3.532 4.036 -0.504 18703 5652 1 16 . 1 1 31 31 LYS C C 31 178.919 178.919 178.205 0.714 18703 5653 1 16 . 1 1 31 31 LYS CA C 31 60.240 60.240 59.307 0.933 18703 5654 1 16 . 1 1 31 31 LYS CB C 31 32.015 32.015 32.233 -0.218 18703 5655 1 16 . 1 1 31 31 LYS H H 31 8.561 8.561 7.567 0.994 18703 5656 1 16 . 1 1 32 32 LYS N N 32 118.566 118.566 118.757 -0.191 18703 5657 1 16 . 1 1 32 32 LYS C C 32 179.392 179.392 179.145 0.247 18703 5658 1 16 . 1 1 32 32 LYS CA C 32 59.356 59.356 59.730 -0.374 18703 5659 1 16 . 1 1 32 32 LYS CB C 32 32.117 32.117 32.333 -0.216 18703 5660 1 16 . 1 1 32 32 LYS H H 32 7.699 7.699 7.522 0.177 18703 5661 1 16 . 1 1 33 33 LYS N N 33 118.964 118.964 117.676 1.288 18703 5662 1 16 . 1 1 33 33 LYS HA H 33 4.117 4.117 4.256 -0.139 18703 5663 1 16 . 1 1 33 33 LYS C C 33 178.355 178.355 178.314 0.041 18703 5664 1 16 . 1 1 33 33 LYS CA C 33 58.633 58.633 57.396 1.237 18703 5665 1 16 . 1 1 33 33 LYS CB C 33 31.904 31.904 31.915 -0.011 18703 5666 1 16 . 1 1 33 33 LYS H H 33 7.752 7.752 7.585 0.167 18703 5667 1 16 . 1 1 34 34 CYS N N 34 119.956 119.956 119.631 0.325 18703 5668 1 16 . 1 1 34 34 CYS HA H 34 3.967 3.967 4.120 -0.153 18703 5669 1 16 . 1 1 34 34 CYS C C 34 175.521 175.521 176.381 -0.860 18703 5670 1 16 . 1 1 34 34 CYS CA C 34 60.987 60.987 63.253 -2.266 18703 5671 1 16 . 1 1 34 34 CYS CB C 34 36.600 36.600 26.650 9.950 18703 5672 1 16 . 1 1 34 34 CYS H H 34 8.393 8.393 7.859 0.534 18703 5673 1 16 . 1 1 35 35 GLU N N 35 120.327 120.327 119.314 1.013 18703 5674 1 16 . 1 1 35 35 GLU HA H 35 3.891 3.891 3.951 -0.060 18703 5675 1 16 . 1 1 35 35 GLU C C 35 179.684 179.684 178.679 1.005 18703 5676 1 16 . 1 1 35 35 GLU CA C 35 60.059 60.059 59.390 0.669 18703 5677 1 16 . 1 1 35 35 GLU CB C 35 29.718 29.718 28.615 1.103 18703 5678 1 16 . 1 1 35 35 GLU H H 35 8.558 8.558 7.991 0.567 18703 5679 1 16 . 1 1 36 36 GLU N N 36 120.190 120.190 119.756 0.434 18703 5680 1 16 . 1 1 36 36 GLU HA H 36 4.051 4.051 4.072 -0.021 18703 5681 1 16 . 1 1 36 36 GLU C C 36 179.408 179.408 178.877 0.531 18703 5682 1 16 . 1 1 36 36 GLU CA C 36 59.148 59.148 58.925 0.223 18703 5683 1 16 . 1 1 36 36 GLU CB C 36 29.766 29.766 29.501 0.265 18703 5684 1 16 . 1 1 36 36 GLU H H 36 8.038 8.038 7.634 0.404 18703 5685 1 16 . 1 1 37 37 LEU N N 37 121.102 121.102 121.081 0.021 18703 5686 1 16 . 1 1 37 37 LEU HA H 37 4.079 4.079 4.079 0.000 18703 5687 1 16 . 1 1 37 37 LEU C C 37 178.279 178.279 178.633 -0.354 18703 5688 1 16 . 1 1 37 37 LEU CA C 37 57.803 57.803 57.694 0.109 18703 5689 1 16 . 1 1 37 37 LEU CB C 37 41.502 41.502 41.730 -0.228 18703 5690 1 16 . 1 1 37 37 LEU H H 37 8.065 8.065 7.457 0.608 18703 5691 1 16 . 1 1 38 38 LYS N N 38 119.980 119.980 118.852 1.128 18703 5692 1 16 . 1 1 38 38 LYS HA H 38 3.851 3.851 3.854 -0.003 18703 5693 1 16 . 1 1 38 38 LYS C C 38 178.919 178.919 179.285 -0.366 18703 5694 1 16 . 1 1 38 38 LYS CA C 38 60.794 60.794 59.903 0.891 18703 5695 1 16 . 1 1 38 38 LYS CB C 38 32.863 32.863 32.413 0.450 18703 5696 1 16 . 1 1 38 38 LYS H H 38 8.741 8.741 7.576 1.165 18703 5697 1 16 . 1 1 39 39 LYS N N 39 118.307 118.307 116.144 2.163 18703 5698 1 16 . 1 1 39 39 LYS HA H 39 4.125 4.125 4.010 0.115 18703 5699 1 16 . 1 1 39 39 LYS C C 39 178.622 178.622 178.314 0.308 18703 5700 1 16 . 1 1 39 39 LYS CA C 39 58.993 58.993 59.097 -0.104 18703 5701 1 16 . 1 1 39 39 LYS CB C 39 32.097 32.097 31.779 0.318 18703 5702 1 16 . 1 1 39 39 LYS H H 39 7.584 7.584 7.744 -0.160 18703 5703 1 16 . 1 1 40 40 LYS N N 40 118.826 118.826 119.657 -0.831 18703 5704 1 16 . 1 1 40 40 LYS HA H 40 4.069 4.069 4.156 -0.087 18703 5705 1 16 . 1 1 40 40 LYS C C 40 179.802 179.802 178.740 1.062 18703 5706 1 16 . 1 1 40 40 LYS CA C 40 59.322 59.322 58.686 0.636 18703 5707 1 16 . 1 1 40 40 LYS CB C 40 32.505 32.505 32.435 0.070 18703 5708 1 16 . 1 1 40 40 LYS H H 40 7.945 7.945 7.527 0.418 18703 5709 1 16 . 1 1 41 41 ILE N N 41 118.958 118.958 118.454 0.504 18703 5710 1 16 . 1 1 41 41 ILE HA H 41 3.659 3.659 3.768 -0.109 18703 5711 1 16 . 1 1 41 41 ILE C C 41 178.146 178.146 176.898 1.248 18703 5712 1 16 . 1 1 41 41 ILE CA C 41 65.037 65.037 64.159 0.878 18703 5713 1 16 . 1 1 41 41 ILE CB C 41 37.950 37.950 37.859 0.091 18703 5714 1 16 . 1 1 41 41 ILE H H 41 8.369 8.369 8.027 0.342 18703 5715 1 16 . 1 1 42 42 GLU N N 42 120.331 120.331 116.513 3.818 18703 5716 1 16 . 1 1 42 42 GLU HA H 42 4.094 4.094 4.182 -0.088 18703 5717 1 16 . 1 1 42 42 GLU C C 42 178.697 178.697 177.545 1.152 18703 5718 1 16 . 1 1 42 42 GLU CA C 42 58.927 58.927 58.412 0.515 18703 5719 1 16 . 1 1 42 42 GLU CB C 42 29.399 29.399 30.258 -0.859 18703 5720 1 16 . 1 1 42 42 GLU H H 42 7.805 7.805 7.513 0.292 18703 5721 1 16 . 1 1 43 43 GLU N N 43 117.120 117.120 116.780 0.340 18703 5722 1 16 . 1 1 43 43 GLU HA H 43 4.291 4.291 4.156 0.135 18703 5723 1 16 . 1 1 43 43 GLU C C 43 177.551 177.551 177.620 -0.069 18703 5724 1 16 . 1 1 43 43 GLU CA C 43 56.800 56.800 57.083 -0.283 18703 5725 1 16 . 1 1 43 43 GLU CB C 43 29.931 29.931 29.671 0.261 18703 5726 1 16 . 1 1 43 43 GLU H H 43 7.701 7.701 7.652 0.049 18703 5727 1 16 . 1 1 44 44 LEU N N 44 120.940 120.940 120.290 0.650 18703 5728 1 16 . 1 1 44 44 LEU HA H 44 4.251 4.251 4.131 0.120 18703 5729 1 16 . 1 1 44 44 LEU C C 44 178.596 178.596 177.741 0.855 18703 5730 1 16 . 1 1 44 44 LEU CA C 44 56.448 56.448 55.842 0.606 18703 5731 1 16 . 1 1 44 44 LEU CB C 44 42.519 42.519 42.446 0.073 18703 5732 1 16 . 1 1 44 44 LEU H H 44 7.581 7.581 7.367 0.214 18703 5733 1 16 . 1 1 45 45 GLY N N 45 108.689 108.689 105.884 2.805 18703 5734 1 16 . 1 1 45 45 GLY C C 45 174.853 174.853 174.388 0.465 18703 5735 1 16 . 1 1 45 45 GLY CA C 45 46.233 46.233 45.987 0.246 18703 5736 1 16 . 1 1 45 45 GLY H H 45 8.232 8.232 8.885 -0.653 18703 5737 1 16 . 1 1 46 46 GLY N N 46 108.029 108.029 108.250 -0.221 18703 5738 1 16 . 1 1 46 46 GLY C C 46 174.351 174.351 174.837 -0.486 18703 5739 1 16 . 1 1 46 46 GLY CA C 46 45.105 45.105 45.822 -0.717 18703 5740 1 16 . 1 1 46 46 GLY H H 46 8.176 8.176 8.751 -0.575 18703 5741 1 16 . 1 1 47 47 GLY N N 47 108.183 108.183 108.553 -0.370 18703 5742 1 16 . 1 1 47 47 GLY C C 47 174.671 174.671 175.413 -0.742 18703 5743 1 16 . 1 1 47 47 GLY CA C 47 45.254 45.254 44.513 0.741 18703 5744 1 16 . 1 1 47 47 GLY H H 47 8.290 8.290 7.962 0.328 18703 5745 1 16 . 1 1 48 48 GLY N N 48 108.616 108.616 106.517 2.099 18703 5746 1 16 . 1 1 48 48 GLY C C 48 174.321 174.321 174.553 -0.232 18703 5747 1 16 . 1 1 48 48 GLY CA C 48 45.192 45.192 45.582 -0.390 18703 5748 1 16 . 1 1 48 48 GLY H H 48 8.027 8.027 8.256 -0.229 18703 5749 1 16 . 1 1 49 49 GLU N N 49 121.057 121.057 120.839 0.218 18703 5750 1 16 . 1 1 49 49 GLU HA H 49 4.425 4.425 4.455 -0.030 18703 5751 1 16 . 1 1 49 49 GLU C C 49 177.072 177.072 178.113 -1.041 18703 5752 1 16 . 1 1 49 49 GLU CA C 49 56.330 56.330 56.780 -0.450 18703 5753 1 16 . 1 1 49 49 GLU CB C 49 29.602 29.602 29.684 -0.082 18703 5754 1 16 . 1 1 49 49 GLU H H 49 8.486 8.486 8.200 0.286 18703 5755 1 16 . 1 1 50 50 VAL N N 50 122.122 122.122 121.377 0.745 18703 5756 1 16 . 1 1 50 50 VAL HA H 50 3.792 3.792 3.651 0.141 18703 5757 1 16 . 1 1 50 50 VAL C C 50 176.774 176.774 176.649 0.125 18703 5758 1 16 . 1 1 50 50 VAL CA C 50 64.864 64.864 65.384 -0.520 18703 5759 1 16 . 1 1 50 50 VAL CB C 50 32.179 32.179 31.633 0.546 18703 5760 1 16 . 1 1 50 50 VAL H H 50 8.095 8.095 7.714 0.381 18703 5761 1 16 . 1 1 51 51 LYS N N 51 120.602 120.602 116.550 4.052 18703 5762 1 16 . 1 1 51 51 LYS HA H 51 4.195 4.195 3.964 0.231 18703 5763 1 16 . 1 1 51 51 LYS C C 51 178.530 178.530 178.322 0.208 18703 5764 1 16 . 1 1 51 51 LYS CA C 51 59.348 59.348 58.972 0.376 18703 5765 1 16 . 1 1 51 51 LYS CB C 51 32.265 32.265 31.695 0.570 18703 5766 1 16 . 1 1 51 51 LYS H H 51 8.268 8.268 8.230 0.038 18703 5767 1 16 . 1 1 52 52 LYS N N 52 117.547 117.547 120.853 -3.306 18703 5768 1 16 . 1 1 52 52 LYS HA H 52 4.162 4.162 4.073 0.089 18703 5769 1 16 . 1 1 52 52 LYS C C 52 179.132 179.132 178.983 0.149 18703 5770 1 16 . 1 1 52 52 LYS CA C 52 58.811 58.811 59.303 -0.492 18703 5771 1 16 . 1 1 52 52 LYS CB C 52 32.054 32.054 32.485 -0.431 18703 5772 1 16 . 1 1 52 52 LYS H H 52 7.595 7.595 7.848 -0.253 18703 5773 1 16 . 1 1 53 53 VAL N N 53 119.190 119.190 119.794 -0.604 18703 5774 1 16 . 1 1 53 53 VAL HA H 53 3.767 3.767 3.598 0.169 18703 5775 1 16 . 1 1 53 53 VAL C C 53 177.933 177.933 177.903 0.030 18703 5776 1 16 . 1 1 53 53 VAL CA C 53 66.065 66.065 65.967 0.098 18703 5777 1 16 . 1 1 53 53 VAL CB C 53 31.248 31.248 31.402 -0.154 18703 5778 1 16 . 1 1 53 53 VAL H H 53 7.597 7.597 7.692 -0.095 18703 5779 1 16 . 1 1 54 54 GLU N N 54 120.226 120.226 118.314 1.912 18703 5780 1 16 . 1 1 54 54 GLU HA H 54 3.833 3.833 3.999 -0.166 18703 5781 1 16 . 1 1 54 54 GLU C C 54 179.352 179.352 178.759 0.593 18703 5782 1 16 . 1 1 54 54 GLU CA C 54 59.153 59.153 59.417 -0.264 18703 5783 1 16 . 1 1 54 54 GLU CB C 54 29.224 29.224 29.137 0.087 18703 5784 1 16 . 1 1 54 54 GLU H H 54 8.609 8.609 7.634 0.975 18703 5785 1 16 . 1 1 55 55 GLU N N 55 119.148 119.148 119.636 -0.488 18703 5786 1 16 . 1 1 55 55 GLU HA H 55 4.084 4.084 4.143 -0.059 18703 5787 1 16 . 1 1 55 55 GLU C C 55 179.084 179.084 178.623 0.461 18703 5788 1 16 . 1 1 55 55 GLU CA C 55 59.295 59.295 58.878 0.417 18703 5789 1 16 . 1 1 55 55 GLU CB C 55 29.361 29.361 29.722 -0.361 18703 5790 1 16 . 1 1 55 55 GLU H H 55 7.713 7.713 8.171 -0.458 18703 5791 1 16 . 1 1 56 56 GLU N N 56 120.301 120.301 119.146 1.155 18703 5792 1 16 . 1 1 56 56 GLU HA H 56 4.079 4.079 4.136 -0.057 18703 5793 1 16 . 1 1 56 56 GLU C C 56 179.773 179.773 179.201 0.572 18703 5794 1 16 . 1 1 56 56 GLU CA C 56 59.528 59.528 59.286 0.242 18703 5795 1 16 . 1 1 56 56 GLU CB C 56 30.162 30.162 29.787 0.375 18703 5796 1 16 . 1 1 56 56 GLU H H 56 7.899 7.899 7.550 0.349 18703 5797 1 16 . 1 1 57 57 VAL N N 57 121.536 121.536 118.684 2.852 18703 5798 1 16 . 1 1 57 57 VAL HA H 57 3.540 3.540 3.820 -0.280 18703 5799 1 16 . 1 1 57 57 VAL C C 57 176.984 176.984 177.812 -0.828 18703 5800 1 16 . 1 1 57 57 VAL CA C 57 66.734 66.734 65.463 1.271 18703 5801 1 16 . 1 1 57 57 VAL CB C 57 31.425 31.425 31.481 -0.056 18703 5802 1 16 . 1 1 57 57 VAL H H 57 8.652 8.652 7.584 1.068 18703 5803 1 16 . 1 1 58 58 LYS N N 58 120.219 120.219 119.988 0.231 18703 5804 1 16 . 1 1 58 58 LYS HA H 58 4.199 4.199 4.088 0.111 18703 5805 1 16 . 1 1 58 58 LYS C C 58 178.972 178.972 178.503 0.469 18703 5806 1 16 . 1 1 58 58 LYS CA C 58 59.357 59.357 59.277 0.080 18703 5807 1 16 . 1 1 58 58 LYS CB C 58 32.186 32.186 32.087 0.099 18703 5808 1 16 . 1 1 58 58 LYS H H 58 7.791 7.791 7.447 0.344 18703 5809 1 16 . 1 1 59 59 LYS N N 59 118.252 118.252 119.801 -1.549 18703 5810 1 16 . 1 1 59 59 LYS HA H 59 4.069 4.069 4.148 -0.079 18703 5811 1 16 . 1 1 59 59 LYS C C 59 179.180 179.180 178.597 0.583 18703 5812 1 16 . 1 1 59 59 LYS CA C 59 59.285 59.285 59.310 -0.025 18703 5813 1 16 . 1 1 59 59 LYS CB C 59 32.345 32.345 32.260 0.085 18703 5814 1 16 . 1 1 59 59 LYS H H 59 7.849 7.849 7.511 0.338 18703 5815 1 16 . 1 1 60 60 LEU N N 60 121.243 121.243 119.758 1.485 18703 5816 1 16 . 1 1 60 60 LEU HA H 60 4.242 4.242 4.082 0.160 18703 5817 1 16 . 1 1 60 60 LEU C C 60 178.413 178.413 178.232 0.181 18703 5818 1 16 . 1 1 60 60 LEU CA C 60 57.798 57.798 57.482 0.316 18703 5819 1 16 . 1 1 60 60 LEU CB C 60 41.150 41.150 42.170 -1.020 18703 5820 1 16 . 1 1 60 60 LEU H H 60 7.825 7.825 7.645 0.180 18703 5821 1 16 . 1 1 61 61 GLU N N 61 118.844 118.844 120.015 -1.171 18703 5822 1 16 . 1 1 61 61 GLU HA H 61 3.800 3.800 3.929 -0.129 18703 5823 1 16 . 1 1 61 61 GLU C C 61 179.078 179.078 178.505 0.573 18703 5824 1 16 . 1 1 61 61 GLU CA C 61 60.104 60.104 59.922 0.182 18703 5825 1 16 . 1 1 61 61 GLU CB C 61 29.864 29.864 29.660 0.204 18703 5826 1 16 . 1 1 61 61 GLU H H 61 8.582 8.582 7.724 0.858 18703 5827 1 16 . 1 1 62 62 GLU N N 62 117.659 117.659 118.798 -1.139 18703 5828 1 16 . 1 1 62 62 GLU HA H 62 3.990 3.990 4.041 -0.051 18703 5829 1 16 . 1 1 62 62 GLU C C 62 178.847 178.847 178.895 -0.048 18703 5830 1 16 . 1 1 62 62 GLU CA C 62 59.067 59.067 59.011 0.056 18703 5831 1 16 . 1 1 62 62 GLU CB C 62 29.440 29.440 29.661 -0.221 18703 5832 1 16 . 1 1 62 62 GLU H H 62 8.032 8.032 7.624 0.408 18703 5833 1 16 . 1 1 63 63 GLU N N 63 119.290 119.290 119.393 -0.103 18703 5834 1 16 . 1 1 63 63 GLU HA H 63 4.012 4.012 4.094 -0.082 18703 5835 1 16 . 1 1 63 63 GLU C C 63 179.784 179.784 179.432 0.352 18703 5836 1 16 . 1 1 63 63 GLU CA C 63 59.300 59.300 59.338 -0.038 18703 5837 1 16 . 1 1 63 63 GLU CB C 63 29.728 29.728 29.562 0.166 18703 5838 1 16 . 1 1 63 63 GLU H H 63 7.958 7.958 7.432 0.526 18703 5839 1 16 . 1 1 64 64 ILE N N 64 118.453 118.453 119.179 -0.726 18703 5840 1 16 . 1 1 64 64 ILE HA H 64 3.711 3.711 3.742 -0.031 18703 5841 1 16 . 1 1 64 64 ILE C C 64 177.655 177.655 178.493 -0.838 18703 5842 1 16 . 1 1 64 64 ILE CA C 64 64.256 64.256 64.164 0.092 18703 5843 1 16 . 1 1 64 64 ILE CB C 64 38.002 38.002 37.586 0.416 18703 5844 1 16 . 1 1 64 64 ILE H H 64 8.160 8.160 7.587 0.573 18703 5845 1 16 . 1 1 65 65 LYS N N 65 118.871 118.871 118.940 -0.069 18703 5846 1 16 . 1 1 65 65 LYS HA H 65 4.111 4.111 4.088 0.023 18703 5847 1 16 . 1 1 65 65 LYS C C 65 177.076 177.076 177.802 -0.726 18703 5848 1 16 . 1 1 65 65 LYS CA C 65 58.421 58.421 58.839 -0.418 18703 5849 1 16 . 1 1 65 65 LYS CB C 65 32.639 32.639 32.212 0.427 18703 5850 1 16 . 1 1 65 65 LYS H H 65 7.664 7.664 7.479 0.185 18703 5851 1 16 . 1 1 66 66 LYS N N 66 116.944 116.944 118.372 -1.428 18703 5852 1 16 . 1 1 66 66 LYS HA H 66 4.320 4.320 4.098 0.222 18703 5853 1 16 . 1 1 66 66 LYS C C 66 175.897 175.897 177.679 -1.782 18703 5854 1 16 . 1 1 66 66 LYS CA C 66 56.352 56.352 58.375 -2.023 18703 5855 1 16 . 1 1 66 66 LYS CB C 66 33.024 33.024 32.825 0.199 18703 5856 1 16 . 1 1 66 66 LYS H H 66 7.246 7.246 7.707 -0.461 18703 5857 1 17 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.442 -0.196 18703 5858 1 17 . 1 1 3 3 ARG C C 3 178.379 178.379 177.063 1.316 18703 5859 1 17 . 1 1 3 3 ARG CA C 3 58.367 58.367 56.885 1.482 18703 5860 1 17 . 1 1 3 3 ARG CB C 3 30.691 30.691 31.059 -0.368 18703 5861 1 17 . 1 1 3 3 ARG H H 3 7.905 7.905 8.362 -0.457 18703 5862 1 17 . 1 1 4 4 VAL N N 4 118.966 118.966 121.316 -2.350 18703 5863 1 17 . 1 1 4 4 VAL HA H 4 3.803 3.803 3.820 -0.017 18703 5864 1 17 . 1 1 4 4 VAL C C 4 176.968 176.968 177.107 -0.139 18703 5865 1 17 . 1 1 4 4 VAL CA C 4 65.441 65.441 65.811 -0.370 18703 5866 1 17 . 1 1 4 4 VAL CB C 4 31.710 31.710 31.416 0.294 18703 5867 1 17 . 1 1 4 4 VAL H H 4 8.070 8.070 8.277 -0.207 18703 5868 1 17 . 1 1 5 5 LYS N N 5 122.058 122.058 120.026 2.032 18703 5869 1 17 . 1 1 5 5 LYS HA H 5 4.154 4.154 4.341 -0.187 18703 5870 1 17 . 1 1 5 5 LYS C C 5 178.553 178.553 179.205 -0.652 18703 5871 1 17 . 1 1 5 5 LYS CA C 5 58.712 58.712 59.377 -0.665 18703 5872 1 17 . 1 1 5 5 LYS CB C 5 31.788 31.788 32.023 -0.235 18703 5873 1 17 . 1 1 5 5 LYS H H 5 7.798 7.798 8.441 -0.643 18703 5874 1 17 . 1 1 6 6 ALA N N 6 119.955 119.955 120.373 -0.418 18703 5875 1 17 . 1 1 6 6 ALA HA H 6 4.198 4.198 4.301 -0.103 18703 5876 1 17 . 1 1 6 6 ALA C C 6 180.974 180.974 179.037 1.937 18703 5877 1 17 . 1 1 6 6 ALA CA C 6 54.850 54.850 54.189 0.661 18703 5878 1 17 . 1 1 6 6 ALA CB C 6 17.995 17.995 18.118 -0.123 18703 5879 1 17 . 1 1 6 6 ALA H H 6 7.928 7.928 8.225 -0.297 18703 5880 1 17 . 1 1 7 7 LEU N N 7 119.211 119.211 119.526 -0.315 18703 5881 1 17 . 1 1 7 7 LEU HA H 7 4.124 4.124 3.988 0.136 18703 5882 1 17 . 1 1 7 7 LEU C C 7 178.353 178.353 178.660 -0.307 18703 5883 1 17 . 1 1 7 7 LEU CA C 7 57.658 57.658 57.367 0.291 18703 5884 1 17 . 1 1 7 7 LEU CB C 7 41.971 41.971 42.099 -0.128 18703 5885 1 17 . 1 1 7 7 LEU H H 7 7.594 7.594 7.732 -0.138 18703 5886 1 17 . 1 1 8 8 GLU N N 8 120.258 120.258 118.202 2.056 18703 5887 1 17 . 1 1 8 8 GLU HA H 8 3.846 3.846 4.021 -0.175 18703 5888 1 17 . 1 1 8 8 GLU C C 8 179.546 179.546 178.736 0.810 18703 5889 1 17 . 1 1 8 8 GLU CA C 8 60.006 60.006 59.615 0.391 18703 5890 1 17 . 1 1 8 8 GLU CB C 8 29.683 29.683 29.565 0.118 18703 5891 1 17 . 1 1 8 8 GLU H H 8 8.382 8.382 7.783 0.599 18703 5892 1 17 . 1 1 9 9 GLU N N 9 118.584 118.584 118.896 -0.312 18703 5893 1 17 . 1 1 9 9 GLU HA H 9 4.039 4.039 4.095 -0.056 18703 5894 1 17 . 1 1 9 9 GLU C C 9 179.635 179.635 178.715 0.920 18703 5895 1 17 . 1 1 9 9 GLU CA C 9 59.235 59.235 58.784 0.451 18703 5896 1 17 . 1 1 9 9 GLU CB C 9 29.358 29.358 29.099 0.259 18703 5897 1 17 . 1 1 9 9 GLU H H 9 7.908 7.908 7.770 0.138 18703 5898 1 17 . 1 1 10 10 LYS N N 10 120.956 120.956 119.901 1.055 18703 5899 1 17 . 1 1 10 10 LYS HA H 10 4.190 4.190 4.079 0.111 18703 5900 1 17 . 1 1 10 10 LYS C C 10 179.395 179.395 178.682 0.713 18703 5901 1 17 . 1 1 10 10 LYS CA C 10 59.231 59.231 58.825 0.406 18703 5902 1 17 . 1 1 10 10 LYS CB C 10 32.211 32.211 32.551 -0.340 18703 5903 1 17 . 1 1 10 10 LYS H H 10 8.009 8.009 7.474 0.535 18703 5904 1 17 . 1 1 11 11 VAL N N 11 119.577 119.577 118.033 1.544 18703 5905 1 17 . 1 1 11 11 VAL HA H 11 3.844 3.844 3.644 0.200 18703 5906 1 17 . 1 1 11 11 VAL C C 11 177.078 177.078 177.533 -0.455 18703 5907 1 17 . 1 1 11 11 VAL CA C 11 66.407 66.407 66.541 -0.134 18703 5908 1 17 . 1 1 11 11 VAL CB C 11 31.252 31.252 31.711 -0.459 18703 5909 1 17 . 1 1 11 11 VAL H H 11 8.488 8.488 7.505 0.983 18703 5910 1 17 . 1 1 12 12 LYS N N 12 122.864 122.864 119.753 3.111 18703 5911 1 17 . 1 1 12 12 LYS HA H 12 4.189 4.189 3.938 0.251 18703 5912 1 17 . 1 1 12 12 LYS C C 12 178.755 178.755 177.815 0.940 18703 5913 1 17 . 1 1 12 12 LYS CA C 12 59.375 59.375 59.712 -0.337 18703 5914 1 17 . 1 1 12 12 LYS CB C 12 31.991 31.991 32.321 -0.330 18703 5915 1 17 . 1 1 12 12 LYS H H 12 7.944 7.944 7.602 0.342 18703 5916 1 17 . 1 1 13 13 ALA N N 13 121.202 121.202 120.550 0.652 18703 5917 1 17 . 1 1 13 13 ALA HA H 13 4.209 4.209 4.340 -0.131 18703 5918 1 17 . 1 1 13 13 ALA C C 13 181.060 181.060 179.322 1.738 18703 5919 1 17 . 1 1 13 13 ALA CA C 13 54.710 54.710 54.118 0.592 18703 5920 1 17 . 1 1 13 13 ALA CB C 13 17.861 17.861 18.543 -0.682 18703 5921 1 17 . 1 1 13 13 ALA H H 13 7.563 7.563 7.453 0.110 18703 5922 1 17 . 1 1 14 14 LEU N N 14 120.014 120.014 119.660 0.354 18703 5923 1 17 . 1 1 14 14 LEU HA H 14 4.072 4.072 3.999 0.073 18703 5924 1 17 . 1 1 14 14 LEU C C 14 177.862 177.862 178.227 -0.365 18703 5925 1 17 . 1 1 14 14 LEU CA C 14 57.864 57.864 57.649 0.215 18703 5926 1 17 . 1 1 14 14 LEU CB C 14 41.539 41.539 42.157 -0.618 18703 5927 1 17 . 1 1 14 14 LEU H H 14 8.087 8.087 7.525 0.562 18703 5928 1 17 . 1 1 15 15 GLU N N 15 121.644 121.644 120.235 1.409 18703 5929 1 17 . 1 1 15 15 GLU HA H 15 3.692 3.692 4.002 -0.310 18703 5930 1 17 . 1 1 15 15 GLU C C 15 177.819 177.819 178.179 -0.360 18703 5931 1 17 . 1 1 15 15 GLU CA C 15 59.239 59.239 59.464 -0.225 18703 5932 1 17 . 1 1 15 15 GLU CB C 15 28.865 28.865 29.657 -0.791 18703 5933 1 17 . 1 1 15 15 GLU H H 15 8.542 8.542 7.707 0.835 18703 5934 1 17 . 1 1 16 16 GLU N N 16 116.016 116.016 118.693 -2.677 18703 5935 1 17 . 1 1 16 16 GLU HA H 16 3.955 3.955 3.962 -0.007 18703 5936 1 17 . 1 1 16 16 GLU C C 16 179.159 179.159 179.184 -0.025 18703 5937 1 17 . 1 1 16 16 GLU CA C 16 59.324 59.324 59.010 0.314 18703 5938 1 17 . 1 1 16 16 GLU CB C 16 29.060 29.060 28.988 0.072 18703 5939 1 17 . 1 1 16 16 GLU H H 16 7.492 7.492 7.984 -0.492 18703 5940 1 17 . 1 1 17 17 LYS N N 17 118.546 118.546 119.108 -0.562 18703 5941 1 17 . 1 1 17 17 LYS HA H 17 4.117 4.117 4.132 -0.015 18703 5942 1 17 . 1 1 17 17 LYS C C 17 178.976 178.976 178.072 0.904 18703 5943 1 17 . 1 1 17 17 LYS CA C 17 58.837 58.837 58.847 -0.010 18703 5944 1 17 . 1 1 17 17 LYS CB C 17 32.538 32.538 32.561 -0.023 18703 5945 1 17 . 1 1 17 17 LYS H H 17 7.720 7.720 7.478 0.242 18703 5946 1 17 . 1 1 18 18 VAL N N 18 118.376 118.376 118.694 -0.318 18703 5947 1 17 . 1 1 18 18 VAL HA H 18 3.711 3.711 3.775 -0.064 18703 5948 1 17 . 1 1 18 18 VAL C C 18 178.765 178.765 178.523 0.242 18703 5949 1 17 . 1 1 18 18 VAL CA C 18 66.237 66.237 65.585 0.652 18703 5950 1 17 . 1 1 18 18 VAL CB C 18 31.682 31.682 31.822 -0.140 18703 5951 1 17 . 1 1 18 18 VAL H H 18 8.754 8.754 7.408 1.346 18703 5952 1 17 . 1 1 19 19 LYS N N 19 118.817 118.817 120.011 -1.194 18703 5953 1 17 . 1 1 19 19 LYS HA H 19 4.078 4.078 3.995 0.083 18703 5954 1 17 . 1 1 19 19 LYS C C 19 178.049 178.049 177.711 0.338 18703 5955 1 17 . 1 1 19 19 LYS CA C 19 59.731 59.731 59.098 0.633 18703 5956 1 17 . 1 1 19 19 LYS CB C 19 32.523 32.523 32.002 0.521 18703 5957 1 17 . 1 1 19 19 LYS H H 19 8.299 8.299 8.699 -0.400 18703 5958 1 17 . 1 1 20 20 ALA N N 20 119.656 119.656 119.036 0.620 18703 5959 1 17 . 1 1 20 20 ALA HA H 20 4.347 4.347 4.366 -0.019 18703 5960 1 17 . 1 1 20 20 ALA C C 20 178.532 178.532 177.787 0.745 18703 5961 1 17 . 1 1 20 20 ALA CA C 20 52.853 52.853 51.772 1.081 18703 5962 1 17 . 1 1 20 20 ALA CB C 20 18.832 18.832 19.495 -0.663 18703 5963 1 17 . 1 1 20 20 ALA H H 20 7.425 7.425 7.690 -0.265 18703 5964 1 17 . 1 1 21 21 LEU N N 21 118.594 118.594 119.735 -1.141 18703 5965 1 17 . 1 1 21 21 LEU HA H 21 4.297 4.297 4.200 0.097 18703 5966 1 17 . 1 1 21 21 LEU C C 21 177.784 177.784 178.157 -0.373 18703 5967 1 17 . 1 1 21 21 LEU CA C 21 55.750 55.750 55.029 0.721 18703 5968 1 17 . 1 1 21 21 LEU CB C 21 42.898 42.898 42.984 -0.086 18703 5969 1 17 . 1 1 21 21 LEU H H 21 7.508 7.508 7.609 -0.101 18703 5970 1 17 . 1 1 22 22 GLY N N 22 106.650 106.650 109.399 -2.749 18703 5971 1 17 . 1 1 22 22 GLY C C 22 173.605 173.605 173.722 -0.117 18703 5972 1 17 . 1 1 22 22 GLY CA C 22 45.330 45.330 45.551 -0.221 18703 5973 1 17 . 1 1 22 22 GLY H H 22 7.814 7.814 8.967 -1.153 18703 5974 1 17 . 1 1 23 23 GLY N N 23 108.011 108.011 105.650 2.361 18703 5975 1 17 . 1 1 23 23 GLY C C 23 174.061 174.061 173.992 0.069 18703 5976 1 17 . 1 1 23 23 GLY CA C 23 44.772 44.772 45.676 -0.904 18703 5977 1 17 . 1 1 23 23 GLY H H 23 8.139 8.139 8.823 -0.684 18703 5978 1 17 . 1 1 24 24 GLY N N 24 107.826 107.826 109.201 -1.375 18703 5979 1 17 . 1 1 24 24 GLY C C 24 175.046 175.046 174.686 0.360 18703 5980 1 17 . 1 1 24 24 GLY CA C 24 44.422 44.422 45.944 -1.522 18703 5981 1 17 . 1 1 24 24 GLY H H 24 8.497 8.497 8.750 -0.253 18703 5982 1 17 . 1 1 25 25 GLY N N 25 108.830 108.830 109.177 -0.347 18703 5983 1 17 . 1 1 25 25 GLY C C 25 176.272 176.272 176.162 0.110 18703 5984 1 17 . 1 1 25 25 GLY CA C 25 47.101 47.101 45.123 1.978 18703 5985 1 17 . 1 1 25 25 GLY H H 25 8.616 8.616 8.092 0.524 18703 5986 1 17 . 1 1 26 26 ARG N N 26 123.109 123.109 122.225 0.884 18703 5987 1 17 . 1 1 26 26 ARG HA H 26 4.283 4.283 4.095 0.188 18703 5988 1 17 . 1 1 26 26 ARG C C 26 177.848 177.848 178.013 -0.165 18703 5989 1 17 . 1 1 26 26 ARG CA C 26 57.663 57.663 58.077 -0.414 18703 5990 1 17 . 1 1 26 26 ARG CB C 26 29.811 29.811 28.841 0.970 18703 5991 1 17 . 1 1 26 26 ARG H H 26 8.770 8.770 8.768 0.002 18703 5992 1 17 . 1 1 27 27 ILE N N 27 118.104 118.104 118.834 -0.730 18703 5993 1 17 . 1 1 27 27 ILE HA H 27 3.787 3.787 3.776 0.011 18703 5994 1 17 . 1 1 27 27 ILE C C 27 177.473 177.473 177.867 -0.394 18703 5995 1 17 . 1 1 27 27 ILE CA C 27 63.036 63.036 64.016 -0.980 18703 5996 1 17 . 1 1 27 27 ILE CB C 27 36.664 36.664 37.340 -0.676 18703 5997 1 17 . 1 1 27 27 ILE H H 27 7.708 7.708 8.057 -0.349 18703 5998 1 17 . 1 1 28 28 GLU N N 28 119.934 119.934 119.784 0.150 18703 5999 1 17 . 1 1 28 28 GLU HA H 28 3.954 3.954 3.947 0.007 18703 6000 1 17 . 1 1 28 28 GLU C C 28 179.514 179.514 178.765 0.749 18703 6001 1 17 . 1 1 28 28 GLU CA C 28 59.450 59.450 59.630 -0.180 18703 6002 1 17 . 1 1 28 28 GLU CB C 28 29.600 29.600 29.317 0.283 18703 6003 1 17 . 1 1 28 28 GLU H H 28 7.872 7.872 7.898 -0.026 18703 6004 1 17 . 1 1 29 29 GLU N N 29 118.134 118.134 119.470 -1.336 18703 6005 1 17 . 1 1 29 29 GLU HA H 29 4.028 4.028 4.112 -0.084 18703 6006 1 17 . 1 1 29 29 GLU C C 29 179.182 179.182 179.126 0.056 18703 6007 1 17 . 1 1 29 29 GLU CA C 29 59.173 59.173 58.617 0.556 18703 6008 1 17 . 1 1 29 29 GLU CB C 29 29.503 29.503 29.282 0.221 18703 6009 1 17 . 1 1 29 29 GLU H H 29 8.166 8.166 7.659 0.507 18703 6010 1 17 . 1 1 30 30 LEU N N 30 120.242 120.242 117.991 2.251 18703 6011 1 17 . 1 1 30 30 LEU HA H 30 4.028 4.028 4.173 -0.145 18703 6012 1 17 . 1 1 30 30 LEU C C 30 178.796 178.796 178.684 0.112 18703 6013 1 17 . 1 1 30 30 LEU CA C 30 57.654 57.654 56.366 1.288 18703 6014 1 17 . 1 1 30 30 LEU CB C 30 41.629 41.629 41.846 -0.217 18703 6015 1 17 . 1 1 30 30 LEU H H 30 7.695 7.695 7.513 0.182 18703 6016 1 17 . 1 1 31 31 LYS N N 31 120.506 120.506 120.644 -0.138 18703 6017 1 17 . 1 1 31 31 LYS HA H 31 3.532 3.532 4.032 -0.500 18703 6018 1 17 . 1 1 31 31 LYS C C 31 178.919 178.919 178.254 0.665 18703 6019 1 17 . 1 1 31 31 LYS CA C 31 60.240 60.240 59.381 0.859 18703 6020 1 17 . 1 1 31 31 LYS CB C 31 32.015 32.015 32.266 -0.251 18703 6021 1 17 . 1 1 31 31 LYS H H 31 8.561 8.561 7.732 0.829 18703 6022 1 17 . 1 1 32 32 LYS N N 32 118.566 118.566 118.676 -0.110 18703 6023 1 17 . 1 1 32 32 LYS C C 32 179.392 179.392 179.280 0.112 18703 6024 1 17 . 1 1 32 32 LYS CA C 32 59.356 59.356 59.697 -0.341 18703 6025 1 17 . 1 1 32 32 LYS CB C 32 32.117 32.117 32.422 -0.305 18703 6026 1 17 . 1 1 32 32 LYS H H 32 7.699 7.699 7.575 0.124 18703 6027 1 17 . 1 1 33 33 LYS N N 33 118.964 118.964 117.921 1.043 18703 6028 1 17 . 1 1 33 33 LYS HA H 33 4.117 4.117 4.136 -0.019 18703 6029 1 17 . 1 1 33 33 LYS C C 33 178.355 178.355 178.414 -0.059 18703 6030 1 17 . 1 1 33 33 LYS CA C 33 58.633 58.633 58.919 -0.286 18703 6031 1 17 . 1 1 33 33 LYS CB C 33 31.904 31.904 32.422 -0.518 18703 6032 1 17 . 1 1 33 33 LYS H H 33 7.752 7.752 7.645 0.107 18703 6033 1 17 . 1 1 34 34 CYS N N 34 119.956 119.956 119.261 0.695 18703 6034 1 17 . 1 1 34 34 CYS HA H 34 3.967 3.967 4.114 -0.147 18703 6035 1 17 . 1 1 34 34 CYS C C 34 175.521 175.521 176.729 -1.208 18703 6036 1 17 . 1 1 34 34 CYS CA C 34 60.987 60.987 63.063 -2.076 18703 6037 1 17 . 1 1 34 34 CYS CB C 34 36.600 36.600 26.644 9.956 18703 6038 1 17 . 1 1 34 34 CYS H H 34 8.393 8.393 7.661 0.732 18703 6039 1 17 . 1 1 35 35 GLU N N 35 120.327 120.327 119.606 0.721 18703 6040 1 17 . 1 1 35 35 GLU HA H 35 3.891 3.891 3.938 -0.047 18703 6041 1 17 . 1 1 35 35 GLU C C 35 179.684 179.684 178.580 1.104 18703 6042 1 17 . 1 1 35 35 GLU CA C 35 60.059 60.059 59.372 0.687 18703 6043 1 17 . 1 1 35 35 GLU CB C 35 29.718 29.718 28.836 0.882 18703 6044 1 17 . 1 1 35 35 GLU H H 35 8.558 8.558 7.869 0.689 18703 6045 1 17 . 1 1 36 36 GLU N N 36 120.190 120.190 119.747 0.443 18703 6046 1 17 . 1 1 36 36 GLU HA H 36 4.051 4.051 4.016 0.035 18703 6047 1 17 . 1 1 36 36 GLU C C 36 179.408 179.408 178.962 0.446 18703 6048 1 17 . 1 1 36 36 GLU CA C 36 59.148 59.148 58.942 0.206 18703 6049 1 17 . 1 1 36 36 GLU CB C 36 29.766 29.766 29.804 -0.038 18703 6050 1 17 . 1 1 36 36 GLU H H 36 8.038 8.038 7.605 0.433 18703 6051 1 17 . 1 1 37 37 LEU N N 37 121.102 121.102 119.677 1.425 18703 6052 1 17 . 1 1 37 37 LEU HA H 37 4.079 4.079 4.183 -0.104 18703 6053 1 17 . 1 1 37 37 LEU C C 37 178.279 178.279 178.375 -0.096 18703 6054 1 17 . 1 1 37 37 LEU CA C 37 57.803 57.803 57.578 0.225 18703 6055 1 17 . 1 1 37 37 LEU CB C 37 41.502 41.502 41.733 -0.231 18703 6056 1 17 . 1 1 37 37 LEU H H 37 8.065 8.065 7.478 0.587 18703 6057 1 17 . 1 1 38 38 LYS N N 38 119.980 119.980 119.069 0.911 18703 6058 1 17 . 1 1 38 38 LYS HA H 38 3.851 3.851 3.902 -0.051 18703 6059 1 17 . 1 1 38 38 LYS C C 38 178.919 178.919 179.162 -0.243 18703 6060 1 17 . 1 1 38 38 LYS CA C 38 60.794 60.794 59.556 1.238 18703 6061 1 17 . 1 1 38 38 LYS CB C 38 32.863 32.863 32.094 0.769 18703 6062 1 17 . 1 1 38 38 LYS H H 38 8.741 8.741 7.672 1.069 18703 6063 1 17 . 1 1 39 39 LYS N N 39 118.307 118.307 116.867 1.440 18703 6064 1 17 . 1 1 39 39 LYS HA H 39 4.125 4.125 3.998 0.127 18703 6065 1 17 . 1 1 39 39 LYS C C 39 178.622 178.622 178.590 0.032 18703 6066 1 17 . 1 1 39 39 LYS CA C 39 58.993 58.993 59.319 -0.326 18703 6067 1 17 . 1 1 39 39 LYS CB C 39 32.097 32.097 31.588 0.509 18703 6068 1 17 . 1 1 39 39 LYS H H 39 7.584 7.584 7.711 -0.127 18703 6069 1 17 . 1 1 40 40 LYS N N 40 118.826 118.826 118.966 -0.140 18703 6070 1 17 . 1 1 40 40 LYS HA H 40 4.069 4.069 4.143 -0.074 18703 6071 1 17 . 1 1 40 40 LYS C C 40 179.802 179.802 178.385 1.417 18703 6072 1 17 . 1 1 40 40 LYS CA C 40 59.322 59.322 58.517 0.805 18703 6073 1 17 . 1 1 40 40 LYS CB C 40 32.505 32.505 32.387 0.118 18703 6074 1 17 . 1 1 40 40 LYS H H 40 7.945 7.945 7.360 0.585 18703 6075 1 17 . 1 1 41 41 ILE N N 41 118.958 118.958 119.236 -0.278 18703 6076 1 17 . 1 1 41 41 ILE HA H 41 3.659 3.659 3.738 -0.079 18703 6077 1 17 . 1 1 41 41 ILE C C 41 178.146 178.146 178.393 -0.247 18703 6078 1 17 . 1 1 41 41 ILE CA C 41 65.037 65.037 64.817 0.220 18703 6079 1 17 . 1 1 41 41 ILE CB C 41 37.950 37.950 37.971 -0.021 18703 6080 1 17 . 1 1 41 41 ILE H H 41 8.369 8.369 8.077 0.292 18703 6081 1 17 . 1 1 42 42 GLU N N 42 120.331 120.331 118.805 1.526 18703 6082 1 17 . 1 1 42 42 GLU HA H 42 4.094 4.094 4.057 0.037 18703 6083 1 17 . 1 1 42 42 GLU C C 42 178.697 178.697 177.691 1.006 18703 6084 1 17 . 1 1 42 42 GLU CA C 42 58.927 58.927 59.021 -0.094 18703 6085 1 17 . 1 1 42 42 GLU CB C 42 29.399 29.399 29.536 -0.137 18703 6086 1 17 . 1 1 42 42 GLU H H 42 7.805 7.805 7.710 0.095 18703 6087 1 17 . 1 1 43 43 GLU N N 43 117.120 117.120 116.295 0.825 18703 6088 1 17 . 1 1 43 43 GLU HA H 43 4.291 4.291 4.287 0.004 18703 6089 1 17 . 1 1 43 43 GLU C C 43 177.551 177.551 177.008 0.543 18703 6090 1 17 . 1 1 43 43 GLU CA C 43 56.800 56.800 56.260 0.540 18703 6091 1 17 . 1 1 43 43 GLU CB C 43 29.931 29.931 30.205 -0.274 18703 6092 1 17 . 1 1 43 43 GLU H H 43 7.701 7.701 7.691 0.010 18703 6093 1 17 . 1 1 44 44 LEU N N 44 120.940 120.940 120.624 0.316 18703 6094 1 17 . 1 1 44 44 LEU HA H 44 4.251 4.251 4.204 0.047 18703 6095 1 17 . 1 1 44 44 LEU C C 44 178.596 178.596 177.421 1.175 18703 6096 1 17 . 1 1 44 44 LEU CA C 44 56.448 56.448 55.220 1.228 18703 6097 1 17 . 1 1 44 44 LEU CB C 44 42.519 42.519 42.696 -0.177 18703 6098 1 17 . 1 1 44 44 LEU H H 44 7.581 7.581 7.556 0.025 18703 6099 1 17 . 1 1 45 45 GLY N N 45 108.689 108.689 108.821 -0.132 18703 6100 1 17 . 1 1 45 45 GLY C C 45 174.853 174.853 173.870 0.983 18703 6101 1 17 . 1 1 45 45 GLY CA C 45 46.233 46.233 45.095 1.138 18703 6102 1 17 . 1 1 45 45 GLY H H 45 8.232 8.232 8.443 -0.211 18703 6103 1 17 . 1 1 46 46 GLY N N 46 108.029 108.029 107.922 0.107 18703 6104 1 17 . 1 1 46 46 GLY C C 46 174.351 174.351 174.188 0.163 18703 6105 1 17 . 1 1 46 46 GLY CA C 46 45.105 45.105 44.930 0.175 18703 6106 1 17 . 1 1 46 46 GLY H H 46 8.176 8.176 8.120 0.056 18703 6107 1 17 . 1 1 47 47 GLY N N 47 108.183 108.183 110.759 -2.576 18703 6108 1 17 . 1 1 47 47 GLY C C 47 174.671 174.671 175.259 -0.588 18703 6109 1 17 . 1 1 47 47 GLY CA C 47 45.254 45.254 44.339 0.915 18703 6110 1 17 . 1 1 47 47 GLY H H 47 8.290 8.290 8.377 -0.087 18703 6111 1 17 . 1 1 48 48 GLY N N 48 108.616 108.616 111.683 -3.067 18703 6112 1 17 . 1 1 48 48 GLY C C 48 174.321 174.321 175.794 -1.473 18703 6113 1 17 . 1 1 48 48 GLY CA C 48 45.192 45.192 45.712 -0.520 18703 6114 1 17 . 1 1 48 48 GLY H H 48 8.027 8.027 8.405 -0.378 18703 6115 1 17 . 1 1 49 49 GLU N N 49 121.057 121.057 122.369 -1.312 18703 6116 1 17 . 1 1 49 49 GLU HA H 49 4.425 4.425 4.116 0.309 18703 6117 1 17 . 1 1 49 49 GLU C C 49 177.072 177.072 178.406 -1.334 18703 6118 1 17 . 1 1 49 49 GLU CA C 49 56.330 56.330 58.509 -2.179 18703 6119 1 17 . 1 1 49 49 GLU CB C 49 29.602 29.602 29.686 -0.084 18703 6120 1 17 . 1 1 49 49 GLU H H 49 8.486 8.486 8.153 0.333 18703 6121 1 17 . 1 1 50 50 VAL N N 50 122.122 122.122 118.776 3.346 18703 6122 1 17 . 1 1 50 50 VAL HA H 50 3.792 3.792 3.644 0.148 18703 6123 1 17 . 1 1 50 50 VAL C C 50 176.774 176.774 177.736 -0.962 18703 6124 1 17 . 1 1 50 50 VAL CA C 50 64.864 64.864 65.126 -0.262 18703 6125 1 17 . 1 1 50 50 VAL CB C 50 32.179 32.179 31.306 0.873 18703 6126 1 17 . 1 1 50 50 VAL H H 50 8.095 8.095 7.931 0.164 18703 6127 1 17 . 1 1 51 51 LYS N N 51 120.602 120.602 118.669 1.933 18703 6128 1 17 . 1 1 51 51 LYS HA H 51 4.195 4.195 4.098 0.097 18703 6129 1 17 . 1 1 51 51 LYS C C 51 178.530 178.530 178.328 0.202 18703 6130 1 17 . 1 1 51 51 LYS CA C 51 59.348 59.348 58.789 0.559 18703 6131 1 17 . 1 1 51 51 LYS CB C 51 32.265 32.265 32.388 -0.123 18703 6132 1 17 . 1 1 51 51 LYS H H 51 8.268 8.268 7.987 0.281 18703 6133 1 17 . 1 1 52 52 LYS N N 52 117.547 117.547 120.767 -3.220 18703 6134 1 17 . 1 1 52 52 LYS HA H 52 4.162 4.162 4.108 0.054 18703 6135 1 17 . 1 1 52 52 LYS C C 52 179.132 179.132 178.923 0.209 18703 6136 1 17 . 1 1 52 52 LYS CA C 52 58.811 58.811 58.819 -0.008 18703 6137 1 17 . 1 1 52 52 LYS CB C 52 32.054 32.054 32.009 0.045 18703 6138 1 17 . 1 1 52 52 LYS H H 52 7.595 7.595 7.747 -0.152 18703 6139 1 17 . 1 1 53 53 VAL N N 53 119.190 119.190 118.358 0.832 18703 6140 1 17 . 1 1 53 53 VAL HA H 53 3.767 3.767 3.704 0.063 18703 6141 1 17 . 1 1 53 53 VAL C C 53 177.933 177.933 178.011 -0.078 18703 6142 1 17 . 1 1 53 53 VAL CA C 53 66.065 66.065 66.395 -0.330 18703 6143 1 17 . 1 1 53 53 VAL CB C 53 31.248 31.248 31.167 0.081 18703 6144 1 17 . 1 1 53 53 VAL H H 53 7.597 7.597 7.548 0.049 18703 6145 1 17 . 1 1 54 54 GLU N N 54 120.226 120.226 119.497 0.729 18703 6146 1 17 . 1 1 54 54 GLU HA H 54 3.833 3.833 4.024 -0.191 18703 6147 1 17 . 1 1 54 54 GLU C C 54 179.352 179.352 178.382 0.970 18703 6148 1 17 . 1 1 54 54 GLU CA C 54 59.153 59.153 59.507 -0.354 18703 6149 1 17 . 1 1 54 54 GLU CB C 54 29.224 29.224 29.440 -0.216 18703 6150 1 17 . 1 1 54 54 GLU H H 54 8.609 8.609 7.740 0.869 18703 6151 1 17 . 1 1 55 55 GLU N N 55 119.148 119.148 119.032 0.116 18703 6152 1 17 . 1 1 55 55 GLU HA H 55 4.084 4.084 4.113 -0.029 18703 6153 1 17 . 1 1 55 55 GLU C C 55 179.084 179.084 178.738 0.346 18703 6154 1 17 . 1 1 55 55 GLU CA C 55 59.295 59.295 58.948 0.347 18703 6155 1 17 . 1 1 55 55 GLU CB C 55 29.361 29.361 29.649 -0.288 18703 6156 1 17 . 1 1 55 55 GLU H H 55 7.713 7.713 7.651 0.062 18703 6157 1 17 . 1 1 56 56 GLU N N 56 120.301 120.301 118.656 1.645 18703 6158 1 17 . 1 1 56 56 GLU HA H 56 4.079 4.079 4.134 -0.055 18703 6159 1 17 . 1 1 56 56 GLU C C 56 179.773 179.773 179.179 0.594 18703 6160 1 17 . 1 1 56 56 GLU CA C 56 59.528 59.528 59.256 0.272 18703 6161 1 17 . 1 1 56 56 GLU CB C 56 30.162 30.162 29.767 0.395 18703 6162 1 17 . 1 1 56 56 GLU H H 56 7.899 7.899 7.587 0.312 18703 6163 1 17 . 1 1 57 57 VAL N N 57 121.536 121.536 118.414 3.122 18703 6164 1 17 . 1 1 57 57 VAL HA H 57 3.540 3.540 3.804 -0.264 18703 6165 1 17 . 1 1 57 57 VAL C C 57 176.984 176.984 177.451 -0.467 18703 6166 1 17 . 1 1 57 57 VAL CA C 57 66.734 66.734 65.695 1.039 18703 6167 1 17 . 1 1 57 57 VAL CB C 57 31.425 31.425 31.477 -0.052 18703 6168 1 17 . 1 1 57 57 VAL H H 57 8.652 8.652 7.502 1.150 18703 6169 1 17 . 1 1 58 58 LYS N N 58 120.219 120.219 120.045 0.174 18703 6170 1 17 . 1 1 58 58 LYS HA H 58 4.199 4.199 4.109 0.090 18703 6171 1 17 . 1 1 58 58 LYS C C 58 178.972 178.972 178.453 0.519 18703 6172 1 17 . 1 1 58 58 LYS CA C 58 59.357 59.357 59.188 0.169 18703 6173 1 17 . 1 1 58 58 LYS CB C 58 32.186 32.186 32.137 0.049 18703 6174 1 17 . 1 1 58 58 LYS H H 58 7.791 7.791 7.439 0.352 18703 6175 1 17 . 1 1 59 59 LYS N N 59 118.252 118.252 119.891 -1.639 18703 6176 1 17 . 1 1 59 59 LYS HA H 59 4.069 4.069 4.162 -0.093 18703 6177 1 17 . 1 1 59 59 LYS C C 59 179.180 179.180 178.595 0.585 18703 6178 1 17 . 1 1 59 59 LYS CA C 59 59.285 59.285 59.060 0.225 18703 6179 1 17 . 1 1 59 59 LYS CB C 59 32.345 32.345 32.225 0.120 18703 6180 1 17 . 1 1 59 59 LYS H H 59 7.849 7.849 7.496 0.353 18703 6181 1 17 . 1 1 60 60 LEU N N 60 121.243 121.243 119.841 1.402 18703 6182 1 17 . 1 1 60 60 LEU HA H 60 4.242 4.242 4.133 0.109 18703 6183 1 17 . 1 1 60 60 LEU C C 60 178.413 178.413 178.200 0.213 18703 6184 1 17 . 1 1 60 60 LEU CA C 60 57.798 57.798 57.231 0.567 18703 6185 1 17 . 1 1 60 60 LEU CB C 60 41.150 41.150 42.186 -1.036 18703 6186 1 17 . 1 1 60 60 LEU H H 60 7.825 7.825 7.551 0.274 18703 6187 1 17 . 1 1 61 61 GLU N N 61 118.844 118.844 120.069 -1.225 18703 6188 1 17 . 1 1 61 61 GLU HA H 61 3.800 3.800 3.929 -0.129 18703 6189 1 17 . 1 1 61 61 GLU C C 61 179.078 179.078 178.549 0.529 18703 6190 1 17 . 1 1 61 61 GLU CA C 61 60.104 60.104 60.008 0.096 18703 6191 1 17 . 1 1 61 61 GLU CB C 61 29.864 29.864 29.648 0.217 18703 6192 1 17 . 1 1 61 61 GLU H H 61 8.582 8.582 7.725 0.857 18703 6193 1 17 . 1 1 62 62 GLU N N 62 117.659 117.659 118.791 -1.132 18703 6194 1 17 . 1 1 62 62 GLU HA H 62 3.990 3.990 4.040 -0.050 18703 6195 1 17 . 1 1 62 62 GLU C C 62 178.847 178.847 178.920 -0.073 18703 6196 1 17 . 1 1 62 62 GLU CA C 62 59.067 59.067 58.963 0.104 18703 6197 1 17 . 1 1 62 62 GLU CB C 62 29.440 29.440 29.654 -0.214 18703 6198 1 17 . 1 1 62 62 GLU H H 62 8.032 8.032 7.628 0.404 18703 6199 1 17 . 1 1 63 63 GLU N N 63 119.290 119.290 119.413 -0.123 18703 6200 1 17 . 1 1 63 63 GLU HA H 63 4.012 4.012 4.090 -0.078 18703 6201 1 17 . 1 1 63 63 GLU C C 63 179.784 179.784 179.405 0.379 18703 6202 1 17 . 1 1 63 63 GLU CA C 63 59.300 59.300 59.283 0.017 18703 6203 1 17 . 1 1 63 63 GLU CB C 63 29.728 29.728 29.530 0.198 18703 6204 1 17 . 1 1 63 63 GLU H H 63 7.958 7.958 7.434 0.524 18703 6205 1 17 . 1 1 64 64 ILE N N 64 118.453 118.453 118.945 -0.492 18703 6206 1 17 . 1 1 64 64 ILE HA H 64 3.711 3.711 3.785 -0.074 18703 6207 1 17 . 1 1 64 64 ILE C C 64 177.655 177.655 178.064 -0.409 18703 6208 1 17 . 1 1 64 64 ILE CA C 64 64.256 64.256 64.035 0.221 18703 6209 1 17 . 1 1 64 64 ILE CB C 64 38.002 38.002 37.654 0.348 18703 6210 1 17 . 1 1 64 64 ILE H H 64 8.160 8.160 7.605 0.555 18703 6211 1 17 . 1 1 65 65 LYS N N 65 118.871 118.871 118.456 0.415 18703 6212 1 17 . 1 1 65 65 LYS HA H 65 4.111 4.111 4.101 0.010 18703 6213 1 17 . 1 1 65 65 LYS C C 65 177.076 177.076 177.816 -0.740 18703 6214 1 17 . 1 1 65 65 LYS CA C 65 58.421 58.421 58.416 0.005 18703 6215 1 17 . 1 1 65 65 LYS CB C 65 32.639 32.639 32.299 0.340 18703 6216 1 17 . 1 1 65 65 LYS H H 65 7.664 7.664 7.491 0.173 18703 6217 1 17 . 1 1 66 66 LYS N N 66 116.944 116.944 117.848 -0.904 18703 6218 1 17 . 1 1 66 66 LYS HA H 66 4.320 4.320 4.118 0.202 18703 6219 1 17 . 1 1 66 66 LYS C C 66 175.897 175.897 178.028 -2.131 18703 6220 1 17 . 1 1 66 66 LYS CA C 66 56.352 56.352 57.506 -1.154 18703 6221 1 17 . 1 1 66 66 LYS CB C 66 33.024 33.024 32.503 0.521 18703 6222 1 17 . 1 1 66 66 LYS H H 66 7.246 7.246 7.794 -0.548 18703 6223 1 18 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.353 -0.107 18703 6224 1 18 . 1 1 3 3 ARG C C 3 178.379 178.379 176.969 1.410 18703 6225 1 18 . 1 1 3 3 ARG CA C 3 58.367 58.367 56.620 1.747 18703 6226 1 18 . 1 1 3 3 ARG CB C 3 30.691 30.691 30.865 -0.174 18703 6227 1 18 . 1 1 3 3 ARG H H 3 7.905 7.905 8.361 -0.456 18703 6228 1 18 . 1 1 4 4 VAL N N 4 118.966 118.966 120.811 -1.845 18703 6229 1 18 . 1 1 4 4 VAL HA H 4 3.803 3.803 3.887 -0.084 18703 6230 1 18 . 1 1 4 4 VAL C C 4 176.968 176.968 177.612 -0.644 18703 6231 1 18 . 1 1 4 4 VAL CA C 4 65.441 65.441 64.985 0.456 18703 6232 1 18 . 1 1 4 4 VAL CB C 4 31.710 31.710 31.528 0.182 18703 6233 1 18 . 1 1 4 4 VAL H H 4 8.070 8.070 8.359 -0.289 18703 6234 1 18 . 1 1 5 5 LYS N N 5 122.058 122.058 119.504 2.554 18703 6235 1 18 . 1 1 5 5 LYS HA H 5 4.154 4.154 3.996 0.158 18703 6236 1 18 . 1 1 5 5 LYS C C 5 178.553 178.553 178.540 0.013 18703 6237 1 18 . 1 1 5 5 LYS CA C 5 58.712 58.712 59.528 -0.816 18703 6238 1 18 . 1 1 5 5 LYS CB C 5 31.788 31.788 32.255 -0.467 18703 6239 1 18 . 1 1 5 5 LYS H H 5 7.798 7.798 8.142 -0.344 18703 6240 1 18 . 1 1 6 6 ALA N N 6 119.955 119.955 120.384 -0.429 18703 6241 1 18 . 1 1 6 6 ALA HA H 6 4.198 4.198 4.275 -0.077 18703 6242 1 18 . 1 1 6 6 ALA C C 6 180.974 180.974 179.331 1.643 18703 6243 1 18 . 1 1 6 6 ALA CA C 6 54.850 54.850 54.182 0.668 18703 6244 1 18 . 1 1 6 6 ALA CB C 6 17.995 17.995 18.289 -0.294 18703 6245 1 18 . 1 1 6 6 ALA H H 6 7.928 7.928 7.513 0.415 18703 6246 1 18 . 1 1 7 7 LEU N N 7 119.211 119.211 119.390 -0.179 18703 6247 1 18 . 1 1 7 7 LEU HA H 7 4.124 4.124 4.010 0.114 18703 6248 1 18 . 1 1 7 7 LEU C C 7 178.353 178.353 178.657 -0.304 18703 6249 1 18 . 1 1 7 7 LEU CA C 7 57.658 57.658 57.270 0.388 18703 6250 1 18 . 1 1 7 7 LEU CB C 7 41.971 41.971 42.140 -0.169 18703 6251 1 18 . 1 1 7 7 LEU H H 7 7.594 7.594 7.681 -0.087 18703 6252 1 18 . 1 1 8 8 GLU N N 8 120.258 120.258 118.066 2.192 18703 6253 1 18 . 1 1 8 8 GLU HA H 8 3.846 3.846 4.065 -0.219 18703 6254 1 18 . 1 1 8 8 GLU C C 8 179.546 179.546 178.755 0.791 18703 6255 1 18 . 1 1 8 8 GLU CA C 8 60.006 60.006 59.449 0.557 18703 6256 1 18 . 1 1 8 8 GLU CB C 8 29.683 29.683 29.647 0.036 18703 6257 1 18 . 1 1 8 8 GLU H H 8 8.382 8.382 7.779 0.603 18703 6258 1 18 . 1 1 9 9 GLU N N 9 118.584 118.584 119.154 -0.570 18703 6259 1 18 . 1 1 9 9 GLU HA H 9 4.039 4.039 4.119 -0.080 18703 6260 1 18 . 1 1 9 9 GLU C C 9 179.635 179.635 178.543 1.092 18703 6261 1 18 . 1 1 9 9 GLU CA C 9 59.235 59.235 58.447 0.788 18703 6262 1 18 . 1 1 9 9 GLU CB C 9 29.358 29.358 28.870 0.488 18703 6263 1 18 . 1 1 9 9 GLU H H 9 7.908 7.908 7.901 0.007 18703 6264 1 18 . 1 1 10 10 LYS N N 10 120.956 120.956 120.093 0.863 18703 6265 1 18 . 1 1 10 10 LYS HA H 10 4.190 4.190 4.104 0.086 18703 6266 1 18 . 1 1 10 10 LYS C C 10 179.395 179.395 178.926 0.469 18703 6267 1 18 . 1 1 10 10 LYS CA C 10 59.231 59.231 59.287 -0.056 18703 6268 1 18 . 1 1 10 10 LYS CB C 10 32.211 32.211 32.554 -0.344 18703 6269 1 18 . 1 1 10 10 LYS H H 10 8.009 8.009 7.557 0.452 18703 6270 1 18 . 1 1 11 11 VAL N N 11 119.577 119.577 118.559 1.018 18703 6271 1 18 . 1 1 11 11 VAL HA H 11 3.844 3.844 3.598 0.246 18703 6272 1 18 . 1 1 11 11 VAL C C 11 177.078 177.078 177.477 -0.399 18703 6273 1 18 . 1 1 11 11 VAL CA C 11 66.407 66.407 66.672 -0.265 18703 6274 1 18 . 1 1 11 11 VAL CB C 11 31.252 31.252 31.637 -0.385 18703 6275 1 18 . 1 1 11 11 VAL H H 11 8.488 8.488 7.537 0.951 18703 6276 1 18 . 1 1 12 12 LYS N N 12 122.864 122.864 119.276 3.588 18703 6277 1 18 . 1 1 12 12 LYS HA H 12 4.189 4.189 3.958 0.231 18703 6278 1 18 . 1 1 12 12 LYS C C 12 178.755 178.755 178.085 0.670 18703 6279 1 18 . 1 1 12 12 LYS CA C 12 59.375 59.375 59.129 0.246 18703 6280 1 18 . 1 1 12 12 LYS CB C 12 31.991 31.991 32.115 -0.124 18703 6281 1 18 . 1 1 12 12 LYS H H 12 7.944 7.944 7.622 0.322 18703 6282 1 18 . 1 1 13 13 ALA N N 13 121.202 121.202 120.393 0.809 18703 6283 1 18 . 1 1 13 13 ALA HA H 13 4.209 4.209 4.245 -0.036 18703 6284 1 18 . 1 1 13 13 ALA C C 13 181.060 181.060 179.426 1.634 18703 6285 1 18 . 1 1 13 13 ALA CA C 13 54.710 54.710 54.220 0.490 18703 6286 1 18 . 1 1 13 13 ALA CB C 13 17.861 17.861 18.399 -0.538 18703 6287 1 18 . 1 1 13 13 ALA H H 13 7.563 7.563 7.368 0.195 18703 6288 1 18 . 1 1 14 14 LEU N N 14 120.014 120.014 119.651 0.363 18703 6289 1 18 . 1 1 14 14 LEU HA H 14 4.072 4.072 4.006 0.066 18703 6290 1 18 . 1 1 14 14 LEU C C 14 177.862 177.862 178.181 -0.319 18703 6291 1 18 . 1 1 14 14 LEU CA C 14 57.864 57.864 57.390 0.474 18703 6292 1 18 . 1 1 14 14 LEU CB C 14 41.539 41.539 42.083 -0.543 18703 6293 1 18 . 1 1 14 14 LEU H H 14 8.087 8.087 7.492 0.595 18703 6294 1 18 . 1 1 15 15 GLU N N 15 121.644 121.644 120.085 1.559 18703 6295 1 18 . 1 1 15 15 GLU HA H 15 3.692 3.692 4.021 -0.329 18703 6296 1 18 . 1 1 15 15 GLU C C 15 177.819 177.819 178.253 -0.434 18703 6297 1 18 . 1 1 15 15 GLU CA C 15 59.239 59.239 59.179 0.060 18703 6298 1 18 . 1 1 15 15 GLU CB C 15 28.865 28.865 29.523 -0.658 18703 6299 1 18 . 1 1 15 15 GLU H H 15 8.542 8.542 7.686 0.856 18703 6300 1 18 . 1 1 16 16 GLU N N 16 116.016 116.016 118.613 -2.597 18703 6301 1 18 . 1 1 16 16 GLU HA H 16 3.955 3.955 3.987 -0.032 18703 6302 1 18 . 1 1 16 16 GLU C C 16 179.159 179.159 179.090 0.069 18703 6303 1 18 . 1 1 16 16 GLU CA C 16 59.324 59.324 59.178 0.146 18703 6304 1 18 . 1 1 16 16 GLU CB C 16 29.060 29.060 29.310 -0.250 18703 6305 1 18 . 1 1 16 16 GLU H H 16 7.492 7.492 7.984 -0.492 18703 6306 1 18 . 1 1 17 17 LYS N N 17 118.546 118.546 119.239 -0.693 18703 6307 1 18 . 1 1 17 17 LYS HA H 17 4.117 4.117 4.115 0.002 18703 6308 1 18 . 1 1 17 17 LYS C C 17 178.976 178.976 178.112 0.864 18703 6309 1 18 . 1 1 17 17 LYS CA C 17 58.837 58.837 58.889 -0.052 18703 6310 1 18 . 1 1 17 17 LYS CB C 17 32.538 32.538 32.497 0.041 18703 6311 1 18 . 1 1 17 17 LYS H H 17 7.720 7.720 7.471 0.249 18703 6312 1 18 . 1 1 18 18 VAL N N 18 118.376 118.376 118.518 -0.142 18703 6313 1 18 . 1 1 18 18 VAL HA H 18 3.711 3.711 3.750 -0.039 18703 6314 1 18 . 1 1 18 18 VAL C C 18 178.765 178.765 178.291 0.474 18703 6315 1 18 . 1 1 18 18 VAL CA C 18 66.237 66.237 66.313 -0.076 18703 6316 1 18 . 1 1 18 18 VAL CB C 18 31.682 31.682 31.924 -0.242 18703 6317 1 18 . 1 1 18 18 VAL H H 18 8.754 8.754 7.439 1.315 18703 6318 1 18 . 1 1 19 19 LYS N N 19 118.817 118.817 119.263 -0.446 18703 6319 1 18 . 1 1 19 19 LYS HA H 19 4.078 4.078 3.934 0.144 18703 6320 1 18 . 1 1 19 19 LYS C C 19 178.049 178.049 177.456 0.593 18703 6321 1 18 . 1 1 19 19 LYS CA C 19 59.731 59.731 59.343 0.388 18703 6322 1 18 . 1 1 19 19 LYS CB C 19 32.523 32.523 32.036 0.487 18703 6323 1 18 . 1 1 19 19 LYS H H 19 8.299 8.299 8.587 -0.288 18703 6324 1 18 . 1 1 20 20 ALA N N 20 119.656 119.656 119.077 0.579 18703 6325 1 18 . 1 1 20 20 ALA HA H 20 4.347 4.347 4.275 0.072 18703 6326 1 18 . 1 1 20 20 ALA C C 20 178.532 178.532 178.472 0.060 18703 6327 1 18 . 1 1 20 20 ALA CA C 20 52.853 52.853 52.592 0.261 18703 6328 1 18 . 1 1 20 20 ALA CB C 20 18.832 18.832 19.234 -0.402 18703 6329 1 18 . 1 1 20 20 ALA H H 20 7.425 7.425 7.548 -0.123 18703 6330 1 18 . 1 1 21 21 LEU N N 21 118.594 118.594 117.039 1.555 18703 6331 1 18 . 1 1 21 21 LEU HA H 21 4.297 4.297 4.361 -0.064 18703 6332 1 18 . 1 1 21 21 LEU C C 21 177.784 177.784 177.083 0.701 18703 6333 1 18 . 1 1 21 21 LEU CA C 21 55.750 55.750 55.032 0.718 18703 6334 1 18 . 1 1 21 21 LEU CB C 21 42.898 42.898 41.782 1.116 18703 6335 1 18 . 1 1 21 21 LEU H H 21 7.508 7.508 7.745 -0.237 18703 6336 1 18 . 1 1 22 22 GLY N N 22 106.650 106.650 107.803 -1.153 18703 6337 1 18 . 1 1 22 22 GLY C C 22 173.605 173.605 173.356 0.249 18703 6338 1 18 . 1 1 22 22 GLY CA C 22 45.330 45.330 45.172 0.158 18703 6339 1 18 . 1 1 22 22 GLY H H 22 7.814 7.814 8.703 -0.889 18703 6340 1 18 . 1 1 23 23 GLY N N 23 108.011 108.011 109.380 -1.369 18703 6341 1 18 . 1 1 23 23 GLY C C 23 174.061 174.061 173.403 0.658 18703 6342 1 18 . 1 1 23 23 GLY CA C 23 44.772 44.772 44.981 -0.209 18703 6343 1 18 . 1 1 23 23 GLY H H 23 8.139 8.139 8.182 -0.043 18703 6344 1 18 . 1 1 24 24 GLY N N 24 107.826 107.826 106.652 1.174 18703 6345 1 18 . 1 1 24 24 GLY C C 24 175.046 175.046 173.330 1.716 18703 6346 1 18 . 1 1 24 24 GLY CA C 24 44.422 44.422 44.982 -0.560 18703 6347 1 18 . 1 1 24 24 GLY H H 24 8.497 8.497 7.999 0.498 18703 6348 1 18 . 1 1 25 25 GLY N N 25 108.830 108.830 109.323 -0.493 18703 6349 1 18 . 1 1 25 25 GLY C C 25 176.272 176.272 175.021 1.251 18703 6350 1 18 . 1 1 25 25 GLY CA C 25 47.101 47.101 45.119 1.982 18703 6351 1 18 . 1 1 25 25 GLY H H 25 8.616 8.616 8.542 0.074 18703 6352 1 18 . 1 1 26 26 ARG N N 26 123.109 123.109 123.819 -0.710 18703 6353 1 18 . 1 1 26 26 ARG HA H 26 4.283 4.283 4.122 0.161 18703 6354 1 18 . 1 1 26 26 ARG C C 26 177.848 177.848 178.447 -0.599 18703 6355 1 18 . 1 1 26 26 ARG CA C 26 57.663 57.663 58.228 -0.565 18703 6356 1 18 . 1 1 26 26 ARG CB C 26 29.811 29.811 30.069 -0.258 18703 6357 1 18 . 1 1 26 26 ARG H H 26 8.770 8.770 8.593 0.177 18703 6358 1 18 . 1 1 27 27 ILE N N 27 118.104 118.104 117.685 0.419 18703 6359 1 18 . 1 1 27 27 ILE HA H 27 3.787 3.787 3.769 0.018 18703 6360 1 18 . 1 1 27 27 ILE C C 27 177.473 177.473 177.837 -0.364 18703 6361 1 18 . 1 1 27 27 ILE CA C 27 63.036 63.036 64.300 -1.264 18703 6362 1 18 . 1 1 27 27 ILE CB C 27 36.664 36.664 37.721 -1.057 18703 6363 1 18 . 1 1 27 27 ILE H H 27 7.708 7.708 8.070 -0.362 18703 6364 1 18 . 1 1 28 28 GLU N N 28 119.934 119.934 119.664 0.270 18703 6365 1 18 . 1 1 28 28 GLU HA H 28 3.954 3.954 3.911 0.043 18703 6366 1 18 . 1 1 28 28 GLU C C 28 179.514 179.514 178.599 0.915 18703 6367 1 18 . 1 1 28 28 GLU CA C 28 59.450 59.450 59.812 -0.362 18703 6368 1 18 . 1 1 28 28 GLU CB C 28 29.600 29.600 29.250 0.350 18703 6369 1 18 . 1 1 28 28 GLU H H 28 7.872 7.872 7.793 0.079 18703 6370 1 18 . 1 1 29 29 GLU N N 29 118.134 118.134 119.668 -1.534 18703 6371 1 18 . 1 1 29 29 GLU HA H 29 4.028 4.028 4.090 -0.062 18703 6372 1 18 . 1 1 29 29 GLU C C 29 179.182 179.182 179.063 0.119 18703 6373 1 18 . 1 1 29 29 GLU CA C 29 59.173 59.173 58.908 0.265 18703 6374 1 18 . 1 1 29 29 GLU CB C 29 29.503 29.503 29.262 0.241 18703 6375 1 18 . 1 1 29 29 GLU H H 29 8.166 8.166 7.602 0.564 18703 6376 1 18 . 1 1 30 30 LEU N N 30 120.242 120.242 117.786 2.456 18703 6377 1 18 . 1 1 30 30 LEU HA H 30 4.028 4.028 4.060 -0.032 18703 6378 1 18 . 1 1 30 30 LEU C C 30 178.796 178.796 179.031 -0.235 18703 6379 1 18 . 1 1 30 30 LEU CA C 30 57.654 57.654 56.851 0.803 18703 6380 1 18 . 1 1 30 30 LEU CB C 30 41.629 41.629 41.579 0.050 18703 6381 1 18 . 1 1 30 30 LEU H H 30 7.695 7.695 7.623 0.072 18703 6382 1 18 . 1 1 31 31 LYS N N 31 120.506 120.506 120.317 0.189 18703 6383 1 18 . 1 1 31 31 LYS HA H 31 3.532 3.532 4.034 -0.502 18703 6384 1 18 . 1 1 31 31 LYS C C 31 178.919 178.919 178.311 0.608 18703 6385 1 18 . 1 1 31 31 LYS CA C 31 60.240 60.240 59.296 0.944 18703 6386 1 18 . 1 1 31 31 LYS CB C 31 32.015 32.015 32.293 -0.278 18703 6387 1 18 . 1 1 31 31 LYS H H 31 8.561 8.561 7.740 0.821 18703 6388 1 18 . 1 1 32 32 LYS N N 32 118.566 118.566 119.294 -0.728 18703 6389 1 18 . 1 1 32 32 LYS C C 32 179.392 179.392 179.323 0.069 18703 6390 1 18 . 1 1 32 32 LYS CA C 32 59.356 59.356 59.915 -0.559 18703 6391 1 18 . 1 1 32 32 LYS CB C 32 32.117 32.117 32.380 -0.263 18703 6392 1 18 . 1 1 32 32 LYS H H 32 7.699 7.699 7.533 0.166 18703 6393 1 18 . 1 1 33 33 LYS N N 33 118.964 118.964 118.554 0.410 18703 6394 1 18 . 1 1 33 33 LYS HA H 33 4.117 4.117 4.194 -0.077 18703 6395 1 18 . 1 1 33 33 LYS C C 33 178.355 178.355 178.704 -0.349 18703 6396 1 18 . 1 1 33 33 LYS CA C 33 58.633 58.633 58.534 0.099 18703 6397 1 18 . 1 1 33 33 LYS CB C 33 31.904 31.904 31.950 -0.046 18703 6398 1 18 . 1 1 33 33 LYS H H 33 7.752 7.752 7.535 0.217 18703 6399 1 18 . 1 1 34 34 CYS N N 34 119.956 119.956 118.882 1.074 18703 6400 1 18 . 1 1 34 34 CYS HA H 34 3.967 3.967 4.101 -0.134 18703 6401 1 18 . 1 1 34 34 CYS C C 34 175.521 175.521 176.736 -1.215 18703 6402 1 18 . 1 1 34 34 CYS CA C 34 60.987 60.987 63.114 -2.127 18703 6403 1 18 . 1 1 34 34 CYS CB C 34 36.600 36.600 26.494 10.107 18703 6404 1 18 . 1 1 34 34 CYS H H 34 8.393 8.393 7.761 0.632 18703 6405 1 18 . 1 1 35 35 GLU N N 35 120.327 120.327 119.904 0.423 18703 6406 1 18 . 1 1 35 35 GLU HA H 35 3.891 3.891 3.924 -0.033 18703 6407 1 18 . 1 1 35 35 GLU C C 35 179.684 179.684 178.712 0.972 18703 6408 1 18 . 1 1 35 35 GLU CA C 35 60.059 60.059 59.148 0.910 18703 6409 1 18 . 1 1 35 35 GLU CB C 35 29.718 29.718 28.649 1.069 18703 6410 1 18 . 1 1 35 35 GLU H H 35 8.558 8.558 7.750 0.808 18703 6411 1 18 . 1 1 36 36 GLU N N 36 120.190 120.190 120.049 0.141 18703 6412 1 18 . 1 1 36 36 GLU HA H 36 4.051 4.051 3.985 0.066 18703 6413 1 18 . 1 1 36 36 GLU C C 36 179.408 179.408 178.936 0.472 18703 6414 1 18 . 1 1 36 36 GLU CA C 36 59.148 59.148 59.004 0.144 18703 6415 1 18 . 1 1 36 36 GLU CB C 36 29.766 29.766 29.790 -0.023 18703 6416 1 18 . 1 1 36 36 GLU H H 36 8.038 8.038 7.610 0.428 18703 6417 1 18 . 1 1 37 37 LEU N N 37 121.102 121.102 119.849 1.253 18703 6418 1 18 . 1 1 37 37 LEU HA H 37 4.079 4.079 4.198 -0.119 18703 6419 1 18 . 1 1 37 37 LEU C C 37 178.279 178.279 178.406 -0.127 18703 6420 1 18 . 1 1 37 37 LEU CA C 37 57.803 57.803 57.274 0.529 18703 6421 1 18 . 1 1 37 37 LEU CB C 37 41.502 41.502 41.648 -0.146 18703 6422 1 18 . 1 1 37 37 LEU H H 37 8.065 8.065 7.566 0.499 18703 6423 1 18 . 1 1 38 38 LYS N N 38 119.980 119.980 119.073 0.907 18703 6424 1 18 . 1 1 38 38 LYS HA H 38 3.851 3.851 3.864 -0.013 18703 6425 1 18 . 1 1 38 38 LYS C C 38 178.919 178.919 179.162 -0.243 18703 6426 1 18 . 1 1 38 38 LYS CA C 38 60.794 60.794 60.111 0.683 18703 6427 1 18 . 1 1 38 38 LYS CB C 38 32.863 32.863 32.260 0.603 18703 6428 1 18 . 1 1 38 38 LYS H H 38 8.741 8.741 7.981 0.760 18703 6429 1 18 . 1 1 39 39 LYS N N 39 118.307 118.307 118.163 0.144 18703 6430 1 18 . 1 1 39 39 LYS HA H 39 4.125 4.125 3.985 0.140 18703 6431 1 18 . 1 1 39 39 LYS C C 39 178.622 178.622 178.574 0.048 18703 6432 1 18 . 1 1 39 39 LYS CA C 39 58.993 58.993 59.111 -0.118 18703 6433 1 18 . 1 1 39 39 LYS CB C 39 32.097 32.097 31.811 0.285 18703 6434 1 18 . 1 1 39 39 LYS H H 39 7.584 7.584 7.759 -0.175 18703 6435 1 18 . 1 1 40 40 LYS N N 40 118.826 118.826 119.566 -0.740 18703 6436 1 18 . 1 1 40 40 LYS HA H 40 4.069 4.069 4.152 -0.083 18703 6437 1 18 . 1 1 40 40 LYS C C 40 179.802 179.802 178.852 0.950 18703 6438 1 18 . 1 1 40 40 LYS CA C 40 59.322 59.322 58.722 0.600 18703 6439 1 18 . 1 1 40 40 LYS CB C 40 32.505 32.505 32.398 0.107 18703 6440 1 18 . 1 1 40 40 LYS H H 40 7.945 7.945 7.344 0.601 18703 6441 1 18 . 1 1 41 41 ILE N N 41 118.958 118.958 119.422 -0.464 18703 6442 1 18 . 1 1 41 41 ILE HA H 41 3.659 3.659 3.801 -0.142 18703 6443 1 18 . 1 1 41 41 ILE C C 41 178.146 178.146 177.766 0.380 18703 6444 1 18 . 1 1 41 41 ILE CA C 41 65.037 65.037 64.143 0.894 18703 6445 1 18 . 1 1 41 41 ILE CB C 41 37.950 37.950 37.760 0.190 18703 6446 1 18 . 1 1 41 41 ILE H H 41 8.369 8.369 8.107 0.262 18703 6447 1 18 . 1 1 42 42 GLU N N 42 120.331 120.331 119.000 1.331 18703 6448 1 18 . 1 1 42 42 GLU HA H 42 4.094 4.094 4.071 0.023 18703 6449 1 18 . 1 1 42 42 GLU C C 42 178.697 178.697 177.953 0.744 18703 6450 1 18 . 1 1 42 42 GLU CA C 42 58.927 58.927 58.722 0.205 18703 6451 1 18 . 1 1 42 42 GLU CB C 42 29.399 29.399 29.645 -0.246 18703 6452 1 18 . 1 1 42 42 GLU H H 42 7.805 7.805 7.741 0.064 18703 6453 1 18 . 1 1 43 43 GLU N N 43 117.120 117.120 116.808 0.312 18703 6454 1 18 . 1 1 43 43 GLU HA H 43 4.291 4.291 4.192 0.099 18703 6455 1 18 . 1 1 43 43 GLU C C 43 177.551 177.551 177.680 -0.129 18703 6456 1 18 . 1 1 43 43 GLU CA C 43 56.800 56.800 57.097 -0.298 18703 6457 1 18 . 1 1 43 43 GLU CB C 43 29.931 29.931 29.681 0.250 18703 6458 1 18 . 1 1 43 43 GLU H H 43 7.701 7.701 7.638 0.063 18703 6459 1 18 . 1 1 44 44 LEU N N 44 120.940 120.940 121.335 -0.395 18703 6460 1 18 . 1 1 44 44 LEU HA H 44 4.251 4.251 4.033 0.218 18703 6461 1 18 . 1 1 44 44 LEU C C 44 178.596 178.596 177.077 1.519 18703 6462 1 18 . 1 1 44 44 LEU CA C 44 56.448 56.448 55.372 1.076 18703 6463 1 18 . 1 1 44 44 LEU CB C 44 42.519 42.519 42.572 -0.053 18703 6464 1 18 . 1 1 44 44 LEU H H 44 7.581 7.581 7.406 0.175 18703 6465 1 18 . 1 1 45 45 GLY N N 45 108.689 108.689 108.610 0.079 18703 6466 1 18 . 1 1 45 45 GLY C C 45 174.853 174.853 173.980 0.873 18703 6467 1 18 . 1 1 45 45 GLY CA C 45 46.233 46.233 44.692 1.541 18703 6468 1 18 . 1 1 45 45 GLY H H 45 8.232 8.232 8.149 0.083 18703 6469 1 18 . 1 1 46 46 GLY N N 46 108.029 108.029 109.106 -1.077 18703 6470 1 18 . 1 1 46 46 GLY C C 46 174.351 174.351 174.747 -0.396 18703 6471 1 18 . 1 1 46 46 GLY CA C 46 45.105 45.105 44.720 0.385 18703 6472 1 18 . 1 1 46 46 GLY H H 46 8.176 8.176 8.205 -0.029 18703 6473 1 18 . 1 1 47 47 GLY N N 47 108.183 108.183 106.413 1.770 18703 6474 1 18 . 1 1 47 47 GLY C C 47 174.671 174.671 174.927 -0.256 18703 6475 1 18 . 1 1 47 47 GLY CA C 47 45.254 45.254 44.434 0.820 18703 6476 1 18 . 1 1 47 47 GLY H H 47 8.290 8.290 8.197 0.093 18703 6477 1 18 . 1 1 48 48 GLY N N 48 108.616 108.616 109.766 -1.150 18703 6478 1 18 . 1 1 48 48 GLY C C 48 174.321 174.321 176.123 -1.802 18703 6479 1 18 . 1 1 48 48 GLY CA C 48 45.192 45.192 45.724 -0.532 18703 6480 1 18 . 1 1 48 48 GLY H H 48 8.027 8.027 8.285 -0.258 18703 6481 1 18 . 1 1 49 49 GLU N N 49 121.057 121.057 124.003 -2.946 18703 6482 1 18 . 1 1 49 49 GLU HA H 49 4.425 4.425 4.182 0.243 18703 6483 1 18 . 1 1 49 49 GLU C C 49 177.072 177.072 178.162 -1.090 18703 6484 1 18 . 1 1 49 49 GLU CA C 49 56.330 56.330 58.230 -1.900 18703 6485 1 18 . 1 1 49 49 GLU CB C 49 29.602 29.602 29.746 -0.144 18703 6486 1 18 . 1 1 49 49 GLU H H 49 8.486 8.486 8.149 0.337 18703 6487 1 18 . 1 1 50 50 VAL N N 50 122.122 122.122 118.354 3.768 18703 6488 1 18 . 1 1 50 50 VAL HA H 50 3.792 3.792 3.778 0.014 18703 6489 1 18 . 1 1 50 50 VAL C C 50 176.774 176.774 177.884 -1.110 18703 6490 1 18 . 1 1 50 50 VAL CA C 50 64.864 64.864 65.180 -0.316 18703 6491 1 18 . 1 1 50 50 VAL CB C 50 32.179 32.179 30.861 1.318 18703 6492 1 18 . 1 1 50 50 VAL H H 50 8.095 8.095 8.057 0.038 18703 6493 1 18 . 1 1 51 51 LYS N N 51 120.602 120.602 120.041 0.561 18703 6494 1 18 . 1 1 51 51 LYS HA H 51 4.195 4.195 4.068 0.127 18703 6495 1 18 . 1 1 51 51 LYS C C 51 178.530 178.530 178.379 0.151 18703 6496 1 18 . 1 1 51 51 LYS CA C 51 59.348 59.348 59.111 0.237 18703 6497 1 18 . 1 1 51 51 LYS CB C 51 32.265 32.265 32.369 -0.104 18703 6498 1 18 . 1 1 51 51 LYS H H 51 8.268 8.268 7.750 0.518 18703 6499 1 18 . 1 1 52 52 LYS N N 52 117.547 117.547 120.216 -2.669 18703 6500 1 18 . 1 1 52 52 LYS HA H 52 4.162 4.162 4.097 0.065 18703 6501 1 18 . 1 1 52 52 LYS C C 52 179.132 179.132 178.896 0.236 18703 6502 1 18 . 1 1 52 52 LYS CA C 52 58.811 58.811 58.787 0.024 18703 6503 1 18 . 1 1 52 52 LYS CB C 52 32.054 32.054 31.943 0.111 18703 6504 1 18 . 1 1 52 52 LYS H H 52 7.595 7.595 7.541 0.054 18703 6505 1 18 . 1 1 53 53 VAL N N 53 119.190 119.190 118.166 1.024 18703 6506 1 18 . 1 1 53 53 VAL HA H 53 3.767 3.767 3.903 -0.136 18703 6507 1 18 . 1 1 53 53 VAL C C 53 177.933 177.933 177.809 0.124 18703 6508 1 18 . 1 1 53 53 VAL CA C 53 66.065 66.065 66.761 -0.696 18703 6509 1 18 . 1 1 53 53 VAL CB C 53 31.248 31.248 31.581 -0.333 18703 6510 1 18 . 1 1 53 53 VAL H H 53 7.597 7.597 7.518 0.079 18703 6511 1 18 . 1 1 54 54 GLU N N 54 120.226 120.226 118.646 1.580 18703 6512 1 18 . 1 1 54 54 GLU HA H 54 3.833 3.833 4.001 -0.168 18703 6513 1 18 . 1 1 54 54 GLU C C 54 179.352 179.352 178.573 0.779 18703 6514 1 18 . 1 1 54 54 GLU CA C 54 59.153 59.153 59.728 -0.575 18703 6515 1 18 . 1 1 54 54 GLU CB C 54 29.224 29.224 29.299 -0.075 18703 6516 1 18 . 1 1 54 54 GLU H H 54 8.609 8.609 7.687 0.922 18703 6517 1 18 . 1 1 55 55 GLU N N 55 119.148 119.148 119.467 -0.319 18703 6518 1 18 . 1 1 55 55 GLU HA H 55 4.084 4.084 4.113 -0.029 18703 6519 1 18 . 1 1 55 55 GLU C C 55 179.084 179.084 178.798 0.286 18703 6520 1 18 . 1 1 55 55 GLU CA C 55 59.295 59.295 59.017 0.278 18703 6521 1 18 . 1 1 55 55 GLU CB C 55 29.361 29.361 29.657 -0.296 18703 6522 1 18 . 1 1 55 55 GLU H H 55 7.713 7.713 7.747 -0.034 18703 6523 1 18 . 1 1 56 56 GLU N N 56 120.301 120.301 119.290 1.011 18703 6524 1 18 . 1 1 56 56 GLU HA H 56 4.079 4.079 4.143 -0.064 18703 6525 1 18 . 1 1 56 56 GLU C C 56 179.773 179.773 179.237 0.536 18703 6526 1 18 . 1 1 56 56 GLU CA C 56 59.528 59.528 59.201 0.327 18703 6527 1 18 . 1 1 56 56 GLU CB C 56 30.162 30.162 29.648 0.514 18703 6528 1 18 . 1 1 56 56 GLU H H 56 7.899 7.899 7.569 0.330 18703 6529 1 18 . 1 1 57 57 VAL N N 57 121.536 121.536 118.787 2.749 18703 6530 1 18 . 1 1 57 57 VAL HA H 57 3.540 3.540 3.861 -0.321 18703 6531 1 18 . 1 1 57 57 VAL C C 57 176.984 176.984 177.722 -0.738 18703 6532 1 18 . 1 1 57 57 VAL CA C 57 66.734 66.734 65.816 0.918 18703 6533 1 18 . 1 1 57 57 VAL CB C 57 31.425 31.425 31.345 0.080 18703 6534 1 18 . 1 1 57 57 VAL H H 57 8.652 8.652 7.462 1.190 18703 6535 1 18 . 1 1 58 58 LYS N N 58 120.219 120.219 119.977 0.242 18703 6536 1 18 . 1 1 58 58 LYS HA H 58 4.199 4.199 4.073 0.126 18703 6537 1 18 . 1 1 58 58 LYS C C 58 178.972 178.972 178.612 0.360 18703 6538 1 18 . 1 1 58 58 LYS CA C 58 59.357 59.357 59.803 -0.446 18703 6539 1 18 . 1 1 58 58 LYS CB C 58 32.186 32.186 32.119 0.067 18703 6540 1 18 . 1 1 58 58 LYS H H 58 7.791 7.791 7.519 0.272 18703 6541 1 18 . 1 1 59 59 LYS N N 59 118.252 118.252 120.080 -1.828 18703 6542 1 18 . 1 1 59 59 LYS HA H 59 4.069 4.069 4.138 -0.069 18703 6543 1 18 . 1 1 59 59 LYS C C 59 179.180 179.180 178.369 0.811 18703 6544 1 18 . 1 1 59 59 LYS CA C 59 59.285 59.285 59.200 0.085 18703 6545 1 18 . 1 1 59 59 LYS CB C 59 32.345 32.345 32.379 -0.034 18703 6546 1 18 . 1 1 59 59 LYS H H 59 7.849 7.849 7.523 0.326 18703 6547 1 18 . 1 1 60 60 LEU N N 60 121.243 121.243 119.675 1.568 18703 6548 1 18 . 1 1 60 60 LEU HA H 60 4.242 4.242 4.143 0.099 18703 6549 1 18 . 1 1 60 60 LEU C C 60 178.413 178.413 178.210 0.203 18703 6550 1 18 . 1 1 60 60 LEU CA C 60 57.798 57.798 57.275 0.523 18703 6551 1 18 . 1 1 60 60 LEU CB C 60 41.150 41.150 42.268 -1.118 18703 6552 1 18 . 1 1 60 60 LEU H H 60 7.825 7.825 7.572 0.253 18703 6553 1 18 . 1 1 61 61 GLU N N 61 118.844 118.844 119.879 -1.035 18703 6554 1 18 . 1 1 61 61 GLU HA H 61 3.800 3.800 3.937 -0.137 18703 6555 1 18 . 1 1 61 61 GLU C C 61 179.078 179.078 178.517 0.561 18703 6556 1 18 . 1 1 61 61 GLU CA C 61 60.104 60.104 59.880 0.224 18703 6557 1 18 . 1 1 61 61 GLU CB C 61 29.864 29.864 29.657 0.207 18703 6558 1 18 . 1 1 61 61 GLU H H 61 8.582 8.582 7.726 0.856 18703 6559 1 18 . 1 1 62 62 GLU N N 62 117.659 117.659 118.492 -0.833 18703 6560 1 18 . 1 1 62 62 GLU HA H 62 3.990 3.990 4.079 -0.089 18703 6561 1 18 . 1 1 62 62 GLU C C 62 178.847 178.847 178.939 -0.092 18703 6562 1 18 . 1 1 62 62 GLU CA C 62 59.067 59.067 58.915 0.152 18703 6563 1 18 . 1 1 62 62 GLU CB C 62 29.440 29.440 29.717 -0.277 18703 6564 1 18 . 1 1 62 62 GLU H H 62 8.032 8.032 7.596 0.436 18703 6565 1 18 . 1 1 63 63 GLU N N 63 119.290 119.290 119.567 -0.277 18703 6566 1 18 . 1 1 63 63 GLU HA H 63 4.012 4.012 4.098 -0.086 18703 6567 1 18 . 1 1 63 63 GLU C C 63 179.784 179.784 179.424 0.360 18703 6568 1 18 . 1 1 63 63 GLU CA C 63 59.300 59.300 59.021 0.279 18703 6569 1 18 . 1 1 63 63 GLU CB C 63 29.728 29.728 29.384 0.344 18703 6570 1 18 . 1 1 63 63 GLU H H 63 7.958 7.958 7.451 0.507 18703 6571 1 18 . 1 1 64 64 ILE N N 64 118.453 118.453 119.596 -1.143 18703 6572 1 18 . 1 1 64 64 ILE HA H 64 3.711 3.711 3.757 -0.046 18703 6573 1 18 . 1 1 64 64 ILE C C 64 177.655 177.655 177.888 -0.233 18703 6574 1 18 . 1 1 64 64 ILE CA C 64 64.256 64.256 64.365 -0.110 18703 6575 1 18 . 1 1 64 64 ILE CB C 64 38.002 38.002 37.595 0.407 18703 6576 1 18 . 1 1 64 64 ILE H H 64 8.160 8.160 7.596 0.564 18703 6577 1 18 . 1 1 65 65 LYS N N 65 118.871 118.871 118.648 0.223 18703 6578 1 18 . 1 1 65 65 LYS HA H 65 4.111 4.111 4.064 0.047 18703 6579 1 18 . 1 1 65 65 LYS C C 65 177.076 177.076 177.869 -0.793 18703 6580 1 18 . 1 1 65 65 LYS CA C 65 58.421 58.421 58.800 -0.379 18703 6581 1 18 . 1 1 65 65 LYS CB C 65 32.639 32.639 32.423 0.216 18703 6582 1 18 . 1 1 65 65 LYS H H 65 7.664 7.664 7.812 -0.148 18703 6583 1 18 . 1 1 66 66 LYS N N 66 116.944 116.944 118.566 -1.622 18703 6584 1 18 . 1 1 66 66 LYS HA H 66 4.320 4.320 4.153 0.167 18703 6585 1 18 . 1 1 66 66 LYS C C 66 175.897 175.897 177.764 -1.867 18703 6586 1 18 . 1 1 66 66 LYS CA C 66 56.352 56.352 58.001 -1.649 18703 6587 1 18 . 1 1 66 66 LYS CB C 66 33.024 33.024 32.808 0.216 18703 6588 1 18 . 1 1 66 66 LYS H H 66 7.246 7.246 7.872 -0.626 18703 6589 1 19 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.509 -0.263 18703 6590 1 19 . 1 1 3 3 ARG C C 3 178.379 178.379 177.813 0.566 18703 6591 1 19 . 1 1 3 3 ARG CA C 3 58.367 58.367 56.237 2.130 18703 6592 1 19 . 1 1 3 3 ARG CB C 3 30.691 30.691 31.264 -0.573 18703 6593 1 19 . 1 1 3 3 ARG H H 3 7.905 7.905 7.999 -0.094 18703 6594 1 19 . 1 1 4 4 VAL N N 4 118.966 118.966 122.122 -3.156 18703 6595 1 19 . 1 1 4 4 VAL HA H 4 3.803 3.803 3.784 0.019 18703 6596 1 19 . 1 1 4 4 VAL C C 4 176.968 176.968 177.312 -0.344 18703 6597 1 19 . 1 1 4 4 VAL CA C 4 65.441 65.441 65.019 0.422 18703 6598 1 19 . 1 1 4 4 VAL CB C 4 31.710 31.710 31.670 0.040 18703 6599 1 19 . 1 1 4 4 VAL H H 4 8.070 8.070 8.197 -0.127 18703 6600 1 19 . 1 1 5 5 LYS N N 5 122.058 122.058 120.151 1.907 18703 6601 1 19 . 1 1 5 5 LYS HA H 5 4.154 4.154 4.257 -0.103 18703 6602 1 19 . 1 1 5 5 LYS C C 5 178.553 178.553 178.442 0.111 18703 6603 1 19 . 1 1 5 5 LYS CA C 5 58.712 58.712 59.130 -0.418 18703 6604 1 19 . 1 1 5 5 LYS CB C 5 31.788 31.788 32.113 -0.325 18703 6605 1 19 . 1 1 5 5 LYS H H 5 7.798 7.798 8.449 -0.651 18703 6606 1 19 . 1 1 6 6 ALA N N 6 119.955 119.955 120.610 -0.655 18703 6607 1 19 . 1 1 6 6 ALA HA H 6 4.198 4.198 4.233 -0.035 18703 6608 1 19 . 1 1 6 6 ALA C C 6 180.974 180.974 179.633 1.341 18703 6609 1 19 . 1 1 6 6 ALA CA C 6 54.850 54.850 54.340 0.510 18703 6610 1 19 . 1 1 6 6 ALA CB C 6 17.995 17.995 18.392 -0.397 18703 6611 1 19 . 1 1 6 6 ALA H H 6 7.928 7.928 7.494 0.434 18703 6612 1 19 . 1 1 7 7 LEU N N 7 119.211 119.211 119.305 -0.094 18703 6613 1 19 . 1 1 7 7 LEU HA H 7 4.124 4.124 3.998 0.126 18703 6614 1 19 . 1 1 7 7 LEU C C 7 178.353 178.353 178.763 -0.410 18703 6615 1 19 . 1 1 7 7 LEU CA C 7 57.658 57.658 57.429 0.229 18703 6616 1 19 . 1 1 7 7 LEU CB C 7 41.971 41.971 42.199 -0.228 18703 6617 1 19 . 1 1 7 7 LEU H H 7 7.594 7.594 7.708 -0.114 18703 6618 1 19 . 1 1 8 8 GLU N N 8 120.258 120.258 118.276 1.982 18703 6619 1 19 . 1 1 8 8 GLU HA H 8 3.846 3.846 4.048 -0.202 18703 6620 1 19 . 1 1 8 8 GLU C C 8 179.546 179.546 178.786 0.760 18703 6621 1 19 . 1 1 8 8 GLU CA C 8 60.006 60.006 59.515 0.491 18703 6622 1 19 . 1 1 8 8 GLU CB C 8 29.683 29.683 29.619 0.065 18703 6623 1 19 . 1 1 8 8 GLU H H 8 8.382 8.382 7.784 0.598 18703 6624 1 19 . 1 1 9 9 GLU N N 9 118.584 118.584 118.919 -0.335 18703 6625 1 19 . 1 1 9 9 GLU HA H 9 4.039 4.039 4.101 -0.062 18703 6626 1 19 . 1 1 9 9 GLU C C 9 179.635 179.635 178.682 0.953 18703 6627 1 19 . 1 1 9 9 GLU CA C 9 59.235 59.235 58.755 0.480 18703 6628 1 19 . 1 1 9 9 GLU CB C 9 29.358 29.358 29.044 0.314 18703 6629 1 19 . 1 1 9 9 GLU H H 9 7.908 7.908 7.804 0.104 18703 6630 1 19 . 1 1 10 10 LYS N N 10 120.956 120.956 119.490 1.466 18703 6631 1 19 . 1 1 10 10 LYS HA H 10 4.190 4.190 4.188 0.002 18703 6632 1 19 . 1 1 10 10 LYS C C 10 179.395 179.395 178.896 0.499 18703 6633 1 19 . 1 1 10 10 LYS CA C 10 59.231 59.231 58.571 0.660 18703 6634 1 19 . 1 1 10 10 LYS CB C 10 32.211 32.211 32.379 -0.168 18703 6635 1 19 . 1 1 10 10 LYS H H 10 8.009 8.009 7.600 0.409 18703 6636 1 19 . 1 1 11 11 VAL N N 11 119.577 119.577 118.607 0.970 18703 6637 1 19 . 1 1 11 11 VAL HA H 11 3.844 3.844 3.656 0.188 18703 6638 1 19 . 1 1 11 11 VAL C C 11 177.078 177.078 177.707 -0.629 18703 6639 1 19 . 1 1 11 11 VAL CA C 11 66.407 66.407 66.173 0.234 18703 6640 1 19 . 1 1 11 11 VAL CB C 11 31.252 31.252 31.312 -0.060 18703 6641 1 19 . 1 1 11 11 VAL H H 11 8.488 8.488 7.526 0.962 18703 6642 1 19 . 1 1 12 12 LYS N N 12 122.864 122.864 119.490 3.374 18703 6643 1 19 . 1 1 12 12 LYS HA H 12 4.189 4.189 3.947 0.242 18703 6644 1 19 . 1 1 12 12 LYS C C 12 178.755 178.755 178.216 0.539 18703 6645 1 19 . 1 1 12 12 LYS CA C 12 59.375 59.375 59.565 -0.190 18703 6646 1 19 . 1 1 12 12 LYS CB C 12 31.991 31.991 32.184 -0.193 18703 6647 1 19 . 1 1 12 12 LYS H H 12 7.944 7.944 7.589 0.355 18703 6648 1 19 . 1 1 13 13 ALA N N 13 121.202 121.202 120.838 0.364 18703 6649 1 19 . 1 1 13 13 ALA HA H 13 4.209 4.209 4.250 -0.041 18703 6650 1 19 . 1 1 13 13 ALA C C 13 181.060 181.060 179.607 1.453 18703 6651 1 19 . 1 1 13 13 ALA CA C 13 54.710 54.710 54.229 0.481 18703 6652 1 19 . 1 1 13 13 ALA CB C 13 17.861 17.861 18.356 -0.495 18703 6653 1 19 . 1 1 13 13 ALA H H 13 7.563 7.563 7.437 0.126 18703 6654 1 19 . 1 1 14 14 LEU N N 14 120.014 120.014 119.591 0.423 18703 6655 1 19 . 1 1 14 14 LEU HA H 14 4.072 4.072 4.012 0.060 18703 6656 1 19 . 1 1 14 14 LEU C C 14 177.862 177.862 178.218 -0.356 18703 6657 1 19 . 1 1 14 14 LEU CA C 14 57.864 57.864 57.256 0.608 18703 6658 1 19 . 1 1 14 14 LEU CB C 14 41.539 41.539 41.969 -0.430 18703 6659 1 19 . 1 1 14 14 LEU H H 14 8.087 8.087 7.494 0.593 18703 6660 1 19 . 1 1 15 15 GLU N N 15 121.644 121.644 120.243 1.401 18703 6661 1 19 . 1 1 15 15 GLU HA H 15 3.692 3.692 4.037 -0.345 18703 6662 1 19 . 1 1 15 15 GLU C C 15 177.819 177.819 178.303 -0.484 18703 6663 1 19 . 1 1 15 15 GLU CA C 15 59.239 59.239 59.178 0.061 18703 6664 1 19 . 1 1 15 15 GLU CB C 15 28.865 28.865 29.602 -0.737 18703 6665 1 19 . 1 1 15 15 GLU H H 15 8.542 8.542 7.688 0.854 18703 6666 1 19 . 1 1 16 16 GLU N N 16 116.016 116.016 118.816 -2.800 18703 6667 1 19 . 1 1 16 16 GLU HA H 16 3.955 3.955 3.985 -0.030 18703 6668 1 19 . 1 1 16 16 GLU C C 16 179.159 179.159 179.140 0.019 18703 6669 1 19 . 1 1 16 16 GLU CA C 16 59.324 59.324 59.223 0.101 18703 6670 1 19 . 1 1 16 16 GLU CB C 16 29.060 29.060 29.372 -0.312 18703 6671 1 19 . 1 1 16 16 GLU H H 16 7.492 7.492 7.880 -0.388 18703 6672 1 19 . 1 1 17 17 LYS N N 17 118.546 118.546 119.282 -0.736 18703 6673 1 19 . 1 1 17 17 LYS HA H 17 4.117 4.117 4.147 -0.030 18703 6674 1 19 . 1 1 17 17 LYS C C 17 178.976 178.976 178.442 0.534 18703 6675 1 19 . 1 1 17 17 LYS CA C 17 58.837 58.837 58.562 0.275 18703 6676 1 19 . 1 1 17 17 LYS CB C 17 32.538 32.538 32.300 0.238 18703 6677 1 19 . 1 1 17 17 LYS H H 17 7.720 7.720 7.466 0.254 18703 6678 1 19 . 1 1 18 18 VAL N N 18 118.376 118.376 118.900 -0.524 18703 6679 1 19 . 1 1 18 18 VAL HA H 18 3.711 3.711 3.715 -0.004 18703 6680 1 19 . 1 1 18 18 VAL C C 18 178.765 178.765 178.627 0.138 18703 6681 1 19 . 1 1 18 18 VAL CA C 18 66.237 66.237 66.468 -0.231 18703 6682 1 19 . 1 1 18 18 VAL CB C 18 31.682 31.682 31.861 -0.179 18703 6683 1 19 . 1 1 18 18 VAL H H 18 8.754 8.754 7.437 1.317 18703 6684 1 19 . 1 1 19 19 LYS N N 19 118.817 118.817 118.834 -0.017 18703 6685 1 19 . 1 1 19 19 LYS HA H 19 4.078 4.078 3.977 0.101 18703 6686 1 19 . 1 1 19 19 LYS C C 19 178.049 178.049 177.495 0.554 18703 6687 1 19 . 1 1 19 19 LYS CA C 19 59.731 59.731 59.153 0.578 18703 6688 1 19 . 1 1 19 19 LYS CB C 19 32.523 32.523 32.126 0.397 18703 6689 1 19 . 1 1 19 19 LYS H H 19 8.299 8.299 8.552 -0.253 18703 6690 1 19 . 1 1 20 20 ALA N N 20 119.656 119.656 119.357 0.299 18703 6691 1 19 . 1 1 20 20 ALA HA H 20 4.347 4.347 4.337 0.010 18703 6692 1 19 . 1 1 20 20 ALA C C 20 178.532 178.532 178.094 0.438 18703 6693 1 19 . 1 1 20 20 ALA CA C 20 52.853 52.853 52.232 0.621 18703 6694 1 19 . 1 1 20 20 ALA CB C 20 18.832 18.832 19.461 -0.629 18703 6695 1 19 . 1 1 20 20 ALA H H 20 7.425 7.425 7.506 -0.081 18703 6696 1 19 . 1 1 21 21 LEU N N 21 118.594 118.594 119.982 -1.388 18703 6697 1 19 . 1 1 21 21 LEU HA H 21 4.297 4.297 4.283 0.014 18703 6698 1 19 . 1 1 21 21 LEU C C 21 177.784 177.784 178.006 -0.222 18703 6699 1 19 . 1 1 21 21 LEU CA C 21 55.750 55.750 54.385 1.365 18703 6700 1 19 . 1 1 21 21 LEU CB C 21 42.898 42.898 43.030 -0.132 18703 6701 1 19 . 1 1 21 21 LEU H H 21 7.508 7.508 7.749 -0.241 18703 6702 1 19 . 1 1 22 22 GLY N N 22 106.650 106.650 108.497 -1.847 18703 6703 1 19 . 1 1 22 22 GLY C C 22 173.605 173.605 174.155 -0.550 18703 6704 1 19 . 1 1 22 22 GLY CA C 22 45.330 45.330 45.637 -0.307 18703 6705 1 19 . 1 1 22 22 GLY H H 22 7.814 7.814 8.648 -0.834 18703 6706 1 19 . 1 1 23 23 GLY N N 23 108.011 108.011 105.604 2.407 18703 6707 1 19 . 1 1 23 23 GLY C C 23 174.061 174.061 172.652 1.409 18703 6708 1 19 . 1 1 23 23 GLY CA C 23 44.772 44.772 44.422 0.350 18703 6709 1 19 . 1 1 23 23 GLY H H 23 8.139 8.139 7.673 0.466 18703 6710 1 19 . 1 1 24 24 GLY N N 24 107.826 107.826 110.012 -2.186 18703 6711 1 19 . 1 1 24 24 GLY C C 24 175.046 175.046 174.146 0.900 18703 6712 1 19 . 1 1 24 24 GLY CA C 24 44.422 44.422 45.259 -0.837 18703 6713 1 19 . 1 1 24 24 GLY H H 24 8.497 8.497 8.397 0.100 18703 6714 1 19 . 1 1 25 25 GLY N N 25 108.830 108.830 112.042 -3.212 18703 6715 1 19 . 1 1 25 25 GLY C C 25 176.272 176.272 175.183 1.089 18703 6716 1 19 . 1 1 25 25 GLY CA C 25 47.101 47.101 45.027 2.074 18703 6717 1 19 . 1 1 25 25 GLY H H 25 8.616 8.616 8.004 0.612 18703 6718 1 19 . 1 1 26 26 ARG N N 26 123.109 123.109 123.670 -0.561 18703 6719 1 19 . 1 1 26 26 ARG HA H 26 4.283 4.283 4.104 0.179 18703 6720 1 19 . 1 1 26 26 ARG C C 26 177.848 177.848 178.009 -0.161 18703 6721 1 19 . 1 1 26 26 ARG CA C 26 57.663 57.663 58.210 -0.547 18703 6722 1 19 . 1 1 26 26 ARG CB C 26 29.811 29.811 29.524 0.287 18703 6723 1 19 . 1 1 26 26 ARG H H 26 8.770 8.770 8.546 0.224 18703 6724 1 19 . 1 1 27 27 ILE N N 27 118.104 118.104 119.026 -0.922 18703 6725 1 19 . 1 1 27 27 ILE HA H 27 3.787 3.787 3.853 -0.066 18703 6726 1 19 . 1 1 27 27 ILE C C 27 177.473 177.473 177.887 -0.414 18703 6727 1 19 . 1 1 27 27 ILE CA C 27 63.036 63.036 63.974 -0.938 18703 6728 1 19 . 1 1 27 27 ILE CB C 27 36.664 36.664 37.419 -0.755 18703 6729 1 19 . 1 1 27 27 ILE H H 27 7.708 7.708 7.968 -0.260 18703 6730 1 19 . 1 1 28 28 GLU N N 28 119.934 119.934 120.627 -0.693 18703 6731 1 19 . 1 1 28 28 GLU HA H 28 3.954 3.954 3.911 0.043 18703 6732 1 19 . 1 1 28 28 GLU C C 28 179.514 179.514 178.476 1.038 18703 6733 1 19 . 1 1 28 28 GLU CA C 28 59.450 59.450 59.963 -0.513 18703 6734 1 19 . 1 1 28 28 GLU CB C 28 29.600 29.600 29.431 0.169 18703 6735 1 19 . 1 1 28 28 GLU H H 28 7.872 7.872 7.782 0.090 18703 6736 1 19 . 1 1 29 29 GLU N N 29 118.134 118.134 119.730 -1.596 18703 6737 1 19 . 1 1 29 29 GLU HA H 29 4.028 4.028 4.084 -0.056 18703 6738 1 19 . 1 1 29 29 GLU C C 29 179.182 179.182 179.155 0.027 18703 6739 1 19 . 1 1 29 29 GLU CA C 29 59.173 59.173 59.270 -0.097 18703 6740 1 19 . 1 1 29 29 GLU CB C 29 29.503 29.503 29.460 0.043 18703 6741 1 19 . 1 1 29 29 GLU H H 29 8.166 8.166 7.566 0.600 18703 6742 1 19 . 1 1 30 30 LEU N N 30 120.242 120.242 117.588 2.654 18703 6743 1 19 . 1 1 30 30 LEU HA H 30 4.028 4.028 4.052 -0.024 18703 6744 1 19 . 1 1 30 30 LEU C C 30 178.796 178.796 178.850 -0.054 18703 6745 1 19 . 1 1 30 30 LEU CA C 30 57.654 57.654 56.853 0.801 18703 6746 1 19 . 1 1 30 30 LEU CB C 30 41.629 41.629 41.691 -0.062 18703 6747 1 19 . 1 1 30 30 LEU H H 30 7.695 7.695 7.618 0.077 18703 6748 1 19 . 1 1 31 31 LYS N N 31 120.506 120.506 119.726 0.780 18703 6749 1 19 . 1 1 31 31 LYS HA H 31 3.532 3.532 4.038 -0.506 18703 6750 1 19 . 1 1 31 31 LYS C C 31 178.919 178.919 178.068 0.851 18703 6751 1 19 . 1 1 31 31 LYS CA C 31 60.240 60.240 59.165 1.075 18703 6752 1 19 . 1 1 31 31 LYS CB C 31 32.015 32.015 32.286 -0.271 18703 6753 1 19 . 1 1 31 31 LYS H H 31 8.561 8.561 7.500 1.061 18703 6754 1 19 . 1 1 32 32 LYS N N 32 118.566 118.566 119.527 -0.961 18703 6755 1 19 . 1 1 32 32 LYS C C 32 179.392 179.392 178.799 0.593 18703 6756 1 19 . 1 1 32 32 LYS CA C 32 59.356 59.356 59.638 -0.282 18703 6757 1 19 . 1 1 32 32 LYS CB C 32 32.117 32.117 32.325 -0.208 18703 6758 1 19 . 1 1 32 32 LYS H H 32 7.699 7.699 7.499 0.200 18703 6759 1 19 . 1 1 33 33 LYS N N 33 118.964 118.964 118.281 0.683 18703 6760 1 19 . 1 1 33 33 LYS HA H 33 4.117 4.117 4.130 -0.013 18703 6761 1 19 . 1 1 33 33 LYS C C 33 178.355 178.355 179.146 -0.791 18703 6762 1 19 . 1 1 33 33 LYS CA C 33 58.633 58.633 58.834 -0.201 18703 6763 1 19 . 1 1 33 33 LYS CB C 33 31.904 31.904 32.135 -0.231 18703 6764 1 19 . 1 1 33 33 LYS H H 33 7.752 7.752 7.581 0.171 18703 6765 1 19 . 1 1 34 34 CYS N N 34 119.956 119.956 118.326 1.630 18703 6766 1 19 . 1 1 34 34 CYS HA H 34 3.967 3.967 4.112 -0.145 18703 6767 1 19 . 1 1 34 34 CYS C C 34 175.521 175.521 176.812 -1.291 18703 6768 1 19 . 1 1 34 34 CYS CA C 34 60.987 60.987 62.929 -1.942 18703 6769 1 19 . 1 1 34 34 CYS CB C 34 36.600 36.600 26.711 9.889 18703 6770 1 19 . 1 1 34 34 CYS H H 34 8.393 8.393 7.553 0.840 18703 6771 1 19 . 1 1 35 35 GLU N N 35 120.327 120.327 119.740 0.587 18703 6772 1 19 . 1 1 35 35 GLU HA H 35 3.891 3.891 3.907 -0.016 18703 6773 1 19 . 1 1 35 35 GLU C C 35 179.684 179.684 178.624 1.060 18703 6774 1 19 . 1 1 35 35 GLU CA C 35 60.059 60.059 59.300 0.759 18703 6775 1 19 . 1 1 35 35 GLU CB C 35 29.718 29.718 28.845 0.873 18703 6776 1 19 . 1 1 35 35 GLU H H 35 8.558 8.558 7.795 0.763 18703 6777 1 19 . 1 1 36 36 GLU N N 36 120.190 120.190 119.885 0.305 18703 6778 1 19 . 1 1 36 36 GLU HA H 36 4.051 4.051 3.983 0.068 18703 6779 1 19 . 1 1 36 36 GLU C C 36 179.408 179.408 179.006 0.402 18703 6780 1 19 . 1 1 36 36 GLU CA C 36 59.148 59.148 59.167 -0.019 18703 6781 1 19 . 1 1 36 36 GLU CB C 36 29.766 29.766 29.564 0.202 18703 6782 1 19 . 1 1 36 36 GLU H H 36 8.038 8.038 7.628 0.410 18703 6783 1 19 . 1 1 37 37 LEU N N 37 121.102 121.102 119.722 1.380 18703 6784 1 19 . 1 1 37 37 LEU HA H 37 4.079 4.079 4.165 -0.086 18703 6785 1 19 . 1 1 37 37 LEU C C 37 178.279 178.279 178.340 -0.061 18703 6786 1 19 . 1 1 37 37 LEU CA C 37 57.803 57.803 57.462 0.341 18703 6787 1 19 . 1 1 37 37 LEU CB C 37 41.502 41.502 41.742 -0.240 18703 6788 1 19 . 1 1 37 37 LEU H H 37 8.065 8.065 7.536 0.529 18703 6789 1 19 . 1 1 38 38 LYS N N 38 119.980 119.980 119.133 0.847 18703 6790 1 19 . 1 1 38 38 LYS HA H 38 3.851 3.851 3.911 -0.060 18703 6791 1 19 . 1 1 38 38 LYS C C 38 178.919 178.919 179.115 -0.196 18703 6792 1 19 . 1 1 38 38 LYS CA C 38 60.794 60.794 59.755 1.039 18703 6793 1 19 . 1 1 38 38 LYS CB C 38 32.863 32.863 32.396 0.467 18703 6794 1 19 . 1 1 38 38 LYS H H 38 8.741 8.741 8.061 0.680 18703 6795 1 19 . 1 1 39 39 LYS N N 39 118.307 118.307 117.291 1.016 18703 6796 1 19 . 1 1 39 39 LYS HA H 39 4.125 4.125 3.934 0.191 18703 6797 1 19 . 1 1 39 39 LYS C C 39 178.622 178.622 178.387 0.235 18703 6798 1 19 . 1 1 39 39 LYS CA C 39 58.993 58.993 59.382 -0.389 18703 6799 1 19 . 1 1 39 39 LYS CB C 39 32.097 32.097 31.631 0.466 18703 6800 1 19 . 1 1 39 39 LYS H H 39 7.584 7.584 7.709 -0.125 18703 6801 1 19 . 1 1 40 40 LYS N N 40 118.826 118.826 119.987 -1.161 18703 6802 1 19 . 1 1 40 40 LYS HA H 40 4.069 4.069 4.154 -0.085 18703 6803 1 19 . 1 1 40 40 LYS C C 40 179.802 179.802 178.774 1.028 18703 6804 1 19 . 1 1 40 40 LYS CA C 40 59.322 59.322 58.855 0.467 18703 6805 1 19 . 1 1 40 40 LYS CB C 40 32.505 32.505 32.309 0.196 18703 6806 1 19 . 1 1 40 40 LYS H H 40 7.945 7.945 7.364 0.581 18703 6807 1 19 . 1 1 41 41 ILE N N 41 118.958 118.958 118.626 0.332 18703 6808 1 19 . 1 1 41 41 ILE HA H 41 3.659 3.659 3.796 -0.137 18703 6809 1 19 . 1 1 41 41 ILE C C 41 178.146 178.146 176.904 1.242 18703 6810 1 19 . 1 1 41 41 ILE CA C 41 65.037 65.037 64.108 0.930 18703 6811 1 19 . 1 1 41 41 ILE CB C 41 37.950 37.950 37.727 0.223 18703 6812 1 19 . 1 1 41 41 ILE H H 41 8.369 8.369 7.985 0.384 18703 6813 1 19 . 1 1 42 42 GLU N N 42 120.331 120.331 116.654 3.677 18703 6814 1 19 . 1 1 42 42 GLU HA H 42 4.094 4.094 4.092 0.002 18703 6815 1 19 . 1 1 42 42 GLU C C 42 178.697 178.697 177.701 0.996 18703 6816 1 19 . 1 1 42 42 GLU CA C 42 58.927 58.927 58.650 0.277 18703 6817 1 19 . 1 1 42 42 GLU CB C 42 29.399 29.399 30.184 -0.785 18703 6818 1 19 . 1 1 42 42 GLU H H 42 7.805 7.805 7.632 0.173 18703 6819 1 19 . 1 1 43 43 GLU N N 43 117.120 117.120 116.589 0.531 18703 6820 1 19 . 1 1 43 43 GLU HA H 43 4.291 4.291 4.195 0.096 18703 6821 1 19 . 1 1 43 43 GLU C C 43 177.551 177.551 177.625 -0.074 18703 6822 1 19 . 1 1 43 43 GLU CA C 43 56.800 56.800 57.104 -0.304 18703 6823 1 19 . 1 1 43 43 GLU CB C 43 29.931 29.931 29.716 0.215 18703 6824 1 19 . 1 1 43 43 GLU H H 43 7.701 7.701 7.548 0.153 18703 6825 1 19 . 1 1 44 44 LEU N N 44 120.940 120.940 120.567 0.373 18703 6826 1 19 . 1 1 44 44 LEU HA H 44 4.251 4.251 3.981 0.270 18703 6827 1 19 . 1 1 44 44 LEU C C 44 178.596 178.596 177.030 1.566 18703 6828 1 19 . 1 1 44 44 LEU CA C 44 56.448 56.448 55.129 1.319 18703 6829 1 19 . 1 1 44 44 LEU CB C 44 42.519 42.519 42.505 0.014 18703 6830 1 19 . 1 1 44 44 LEU H H 44 7.581 7.581 7.371 0.210 18703 6831 1 19 . 1 1 45 45 GLY N N 45 108.689 108.689 107.225 1.464 18703 6832 1 19 . 1 1 45 45 GLY C C 45 174.853 174.853 174.031 0.822 18703 6833 1 19 . 1 1 45 45 GLY CA C 45 46.233 46.233 45.219 1.014 18703 6834 1 19 . 1 1 45 45 GLY H H 45 8.232 8.232 8.525 -0.293 18703 6835 1 19 . 1 1 46 46 GLY N N 46 108.029 108.029 106.846 1.183 18703 6836 1 19 . 1 1 46 46 GLY C C 46 174.351 174.351 174.717 -0.366 18703 6837 1 19 . 1 1 46 46 GLY CA C 46 45.105 45.105 45.245 -0.140 18703 6838 1 19 . 1 1 46 46 GLY H H 46 8.176 8.176 9.024 -0.848 18703 6839 1 19 . 1 1 47 47 GLY N N 47 108.183 108.183 108.424 -0.241 18703 6840 1 19 . 1 1 47 47 GLY C C 47 174.671 174.671 175.369 -0.698 18703 6841 1 19 . 1 1 47 47 GLY CA C 47 45.254 45.254 46.919 -1.665 18703 6842 1 19 . 1 1 47 47 GLY H H 47 8.290 8.290 10.100 -1.810 18703 6843 1 19 . 1 1 48 48 GLY N N 48 108.616 108.616 109.274 -0.658 18703 6844 1 19 . 1 1 48 48 GLY C C 48 174.321 174.321 175.038 -0.717 18703 6845 1 19 . 1 1 48 48 GLY CA C 48 45.192 45.192 45.100 0.092 18703 6846 1 19 . 1 1 48 48 GLY H H 48 8.027 8.027 8.017 0.010 18703 6847 1 19 . 1 1 49 49 GLU N N 49 121.057 121.057 122.140 -1.083 18703 6848 1 19 . 1 1 49 49 GLU HA H 49 4.425 4.425 4.197 0.228 18703 6849 1 19 . 1 1 49 49 GLU C C 49 177.072 177.072 177.730 -0.658 18703 6850 1 19 . 1 1 49 49 GLU CA C 49 56.330 56.330 58.057 -1.728 18703 6851 1 19 . 1 1 49 49 GLU CB C 49 29.602 29.602 29.374 0.228 18703 6852 1 19 . 1 1 49 49 GLU H H 49 8.486 8.486 8.750 -0.264 18703 6853 1 19 . 1 1 50 50 VAL N N 50 122.122 122.122 119.009 3.113 18703 6854 1 19 . 1 1 50 50 VAL HA H 50 3.792 3.792 3.650 0.142 18703 6855 1 19 . 1 1 50 50 VAL C C 50 176.774 176.774 177.838 -1.064 18703 6856 1 19 . 1 1 50 50 VAL CA C 50 64.864 64.864 65.169 -0.305 18703 6857 1 19 . 1 1 50 50 VAL CB C 50 32.179 32.179 31.150 1.029 18703 6858 1 19 . 1 1 50 50 VAL H H 50 8.095 8.095 7.969 0.126 18703 6859 1 19 . 1 1 51 51 LYS N N 51 120.602 120.602 118.843 1.759 18703 6860 1 19 . 1 1 51 51 LYS HA H 51 4.195 4.195 4.045 0.150 18703 6861 1 19 . 1 1 51 51 LYS C C 51 178.530 178.530 178.356 0.174 18703 6862 1 19 . 1 1 51 51 LYS CA C 51 59.348 59.348 59.243 0.105 18703 6863 1 19 . 1 1 51 51 LYS CB C 51 32.265 32.265 32.246 0.019 18703 6864 1 19 . 1 1 51 51 LYS H H 51 8.268 8.268 7.821 0.447 18703 6865 1 19 . 1 1 52 52 LYS N N 52 117.547 117.547 120.604 -3.057 18703 6866 1 19 . 1 1 52 52 LYS HA H 52 4.162 4.162 4.057 0.105 18703 6867 1 19 . 1 1 52 52 LYS C C 52 179.132 179.132 178.960 0.172 18703 6868 1 19 . 1 1 52 52 LYS CA C 52 58.811 58.811 59.460 -0.649 18703 6869 1 19 . 1 1 52 52 LYS CB C 52 32.054 32.054 32.270 -0.216 18703 6870 1 19 . 1 1 52 52 LYS H H 52 7.595 7.595 7.716 -0.121 18703 6871 1 19 . 1 1 53 53 VAL N N 53 119.190 119.190 118.140 1.050 18703 6872 1 19 . 1 1 53 53 VAL HA H 53 3.767 3.767 3.692 0.075 18703 6873 1 19 . 1 1 53 53 VAL C C 53 177.933 177.933 177.861 0.072 18703 6874 1 19 . 1 1 53 53 VAL CA C 53 66.065 66.065 65.858 0.207 18703 6875 1 19 . 1 1 53 53 VAL CB C 53 31.248 31.248 31.136 0.112 18703 6876 1 19 . 1 1 53 53 VAL H H 53 7.597 7.597 7.587 0.010 18703 6877 1 19 . 1 1 54 54 GLU N N 54 120.226 120.226 119.215 1.011 18703 6878 1 19 . 1 1 54 54 GLU HA H 54 3.833 3.833 3.977 -0.144 18703 6879 1 19 . 1 1 54 54 GLU C C 54 179.352 179.352 178.487 0.865 18703 6880 1 19 . 1 1 54 54 GLU CA C 54 59.153 59.153 59.580 -0.427 18703 6881 1 19 . 1 1 54 54 GLU CB C 54 29.224 29.224 29.419 -0.195 18703 6882 1 19 . 1 1 54 54 GLU H H 54 8.609 8.609 7.658 0.951 18703 6883 1 19 . 1 1 55 55 GLU N N 55 119.148 119.148 119.145 0.003 18703 6884 1 19 . 1 1 55 55 GLU HA H 55 4.084 4.084 4.124 -0.040 18703 6885 1 19 . 1 1 55 55 GLU C C 55 179.084 179.084 178.801 0.283 18703 6886 1 19 . 1 1 55 55 GLU CA C 55 59.295 59.295 59.033 0.262 18703 6887 1 19 . 1 1 55 55 GLU CB C 55 29.361 29.361 29.665 -0.304 18703 6888 1 19 . 1 1 55 55 GLU H H 55 7.713 7.713 7.725 -0.012 18703 6889 1 19 . 1 1 56 56 GLU N N 56 120.301 120.301 119.218 1.083 18703 6890 1 19 . 1 1 56 56 GLU HA H 56 4.079 4.079 4.139 -0.060 18703 6891 1 19 . 1 1 56 56 GLU C C 56 179.773 179.773 179.248 0.525 18703 6892 1 19 . 1 1 56 56 GLU CA C 56 59.528 59.528 59.287 0.241 18703 6893 1 19 . 1 1 56 56 GLU CB C 56 30.162 30.162 29.799 0.363 18703 6894 1 19 . 1 1 56 56 GLU H H 56 7.899 7.899 7.562 0.337 18703 6895 1 19 . 1 1 57 57 VAL N N 57 121.536 121.536 119.139 2.397 18703 6896 1 19 . 1 1 57 57 VAL HA H 57 3.540 3.540 3.832 -0.292 18703 6897 1 19 . 1 1 57 57 VAL C C 57 176.984 176.984 177.969 -0.985 18703 6898 1 19 . 1 1 57 57 VAL CA C 57 66.734 66.734 65.852 0.882 18703 6899 1 19 . 1 1 57 57 VAL CB C 57 31.425 31.425 31.498 -0.073 18703 6900 1 19 . 1 1 57 57 VAL H H 57 8.652 8.652 7.616 1.036 18703 6901 1 19 . 1 1 58 58 LYS N N 58 120.219 120.219 119.810 0.409 18703 6902 1 19 . 1 1 58 58 LYS HA H 58 4.199 4.199 4.118 0.081 18703 6903 1 19 . 1 1 58 58 LYS C C 58 178.972 178.972 178.408 0.564 18703 6904 1 19 . 1 1 58 58 LYS CA C 58 59.357 59.357 58.733 0.624 18703 6905 1 19 . 1 1 58 58 LYS CB C 58 32.186 32.186 31.884 0.302 18703 6906 1 19 . 1 1 58 58 LYS H H 58 7.791 7.791 7.494 0.297 18703 6907 1 19 . 1 1 59 59 LYS N N 59 118.252 118.252 119.951 -1.699 18703 6908 1 19 . 1 1 59 59 LYS HA H 59 4.069 4.069 4.165 -0.096 18703 6909 1 19 . 1 1 59 59 LYS C C 59 179.180 179.180 178.290 0.890 18703 6910 1 19 . 1 1 59 59 LYS CA C 59 59.285 59.285 59.187 0.098 18703 6911 1 19 . 1 1 59 59 LYS CB C 59 32.345 32.345 32.350 -0.005 18703 6912 1 19 . 1 1 59 59 LYS H H 59 7.849 7.849 7.514 0.335 18703 6913 1 19 . 1 1 60 60 LEU N N 60 121.243 121.243 119.719 1.524 18703 6914 1 19 . 1 1 60 60 LEU HA H 60 4.242 4.242 4.144 0.098 18703 6915 1 19 . 1 1 60 60 LEU C C 60 178.413 178.413 178.207 0.206 18703 6916 1 19 . 1 1 60 60 LEU CA C 60 57.798 57.798 57.240 0.557 18703 6917 1 19 . 1 1 60 60 LEU CB C 60 41.150 41.150 42.251 -1.101 18703 6918 1 19 . 1 1 60 60 LEU H H 60 7.825 7.825 7.554 0.271 18703 6919 1 19 . 1 1 61 61 GLU N N 61 118.844 118.844 119.962 -1.118 18703 6920 1 19 . 1 1 61 61 GLU HA H 61 3.800 3.800 3.943 -0.143 18703 6921 1 19 . 1 1 61 61 GLU C C 61 179.078 179.078 178.505 0.573 18703 6922 1 19 . 1 1 61 61 GLU CA C 61 60.104 60.104 59.916 0.188 18703 6923 1 19 . 1 1 61 61 GLU CB C 61 29.864 29.864 29.667 0.197 18703 6924 1 19 . 1 1 61 61 GLU H H 61 8.582 8.582 7.723 0.859 18703 6925 1 19 . 1 1 62 62 GLU N N 62 117.659 117.659 118.257 -0.598 18703 6926 1 19 . 1 1 62 62 GLU HA H 62 3.990 3.990 4.081 -0.091 18703 6927 1 19 . 1 1 62 62 GLU C C 62 178.847 178.847 178.596 0.251 18703 6928 1 19 . 1 1 62 62 GLU CA C 62 59.067 59.067 58.855 0.212 18703 6929 1 19 . 1 1 62 62 GLU CB C 62 29.440 29.440 29.692 -0.252 18703 6930 1 19 . 1 1 62 62 GLU H H 62 8.032 8.032 7.610 0.422 18703 6931 1 19 . 1 1 63 63 GLU N N 63 119.290 119.290 119.123 0.167 18703 6932 1 19 . 1 1 63 63 GLU HA H 63 4.012 4.012 4.108 -0.096 18703 6933 1 19 . 1 1 63 63 GLU C C 63 179.784 179.784 179.279 0.505 18703 6934 1 19 . 1 1 63 63 GLU CA C 63 59.300 59.300 59.132 0.168 18703 6935 1 19 . 1 1 63 63 GLU CB C 63 29.728 29.728 29.751 -0.023 18703 6936 1 19 . 1 1 63 63 GLU H H 63 7.958 7.958 7.440 0.518 18703 6937 1 19 . 1 1 64 64 ILE N N 64 118.453 118.453 119.581 -1.128 18703 6938 1 19 . 1 1 64 64 ILE HA H 64 3.711 3.711 3.773 -0.062 18703 6939 1 19 . 1 1 64 64 ILE C C 64 177.655 177.655 177.895 -0.240 18703 6940 1 19 . 1 1 64 64 ILE CA C 64 64.256 64.256 64.141 0.115 18703 6941 1 19 . 1 1 64 64 ILE CB C 64 38.002 38.002 37.605 0.397 18703 6942 1 19 . 1 1 64 64 ILE H H 64 8.160 8.160 7.593 0.567 18703 6943 1 19 . 1 1 65 65 LYS N N 65 118.871 118.871 119.667 -0.796 18703 6944 1 19 . 1 1 65 65 LYS HA H 65 4.111 4.111 4.089 0.022 18703 6945 1 19 . 1 1 65 65 LYS C C 65 177.076 177.076 177.276 -0.200 18703 6946 1 19 . 1 1 65 65 LYS CA C 65 58.421 58.421 59.007 -0.586 18703 6947 1 19 . 1 1 65 65 LYS CB C 65 32.639 32.639 32.582 0.057 18703 6948 1 19 . 1 1 65 65 LYS H H 65 7.664 7.664 7.734 -0.070 18703 6949 1 19 . 1 1 66 66 LYS N N 66 116.944 116.944 116.405 0.539 18703 6950 1 19 . 1 1 66 66 LYS HA H 66 4.320 4.320 4.396 -0.076 18703 6951 1 19 . 1 1 66 66 LYS C C 66 175.897 175.897 176.849 -0.952 18703 6952 1 19 . 1 1 66 66 LYS CA C 66 56.352 56.352 56.598 -0.246 18703 6953 1 19 . 1 1 66 66 LYS CB C 66 33.024 33.024 33.889 -0.865 18703 6954 1 19 . 1 1 66 66 LYS H H 66 7.246 7.246 7.665 -0.419 18703 6955 1 20 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.418 -0.172 18703 6956 1 20 . 1 1 3 3 ARG C C 3 178.379 178.379 176.494 1.885 18703 6957 1 20 . 1 1 3 3 ARG CA C 3 58.367 58.367 56.955 1.412 18703 6958 1 20 . 1 1 3 3 ARG CB C 3 30.691 30.691 31.051 -0.360 18703 6959 1 20 . 1 1 3 3 ARG H H 3 7.905 7.905 8.692 -0.787 18703 6960 1 20 . 1 1 4 4 VAL N N 4 118.966 118.966 120.971 -2.005 18703 6961 1 20 . 1 1 4 4 VAL HA H 4 3.803 3.803 3.894 -0.091 18703 6962 1 20 . 1 1 4 4 VAL C C 4 176.968 176.968 176.902 0.066 18703 6963 1 20 . 1 1 4 4 VAL CA C 4 65.441 65.441 64.457 0.984 18703 6964 1 20 . 1 1 4 4 VAL CB C 4 31.710 31.710 31.998 -0.288 18703 6965 1 20 . 1 1 4 4 VAL H H 4 8.070 8.070 8.249 -0.179 18703 6966 1 20 . 1 1 5 5 LYS N N 5 122.058 122.058 120.408 1.650 18703 6967 1 20 . 1 1 5 5 LYS HA H 5 4.154 4.154 4.253 -0.099 18703 6968 1 20 . 1 1 5 5 LYS C C 5 178.553 178.553 178.396 0.157 18703 6969 1 20 . 1 1 5 5 LYS CA C 5 58.712 58.712 59.239 -0.526 18703 6970 1 20 . 1 1 5 5 LYS CB C 5 31.788 31.788 32.109 -0.321 18703 6971 1 20 . 1 1 5 5 LYS H H 5 7.798 7.798 8.447 -0.649 18703 6972 1 20 . 1 1 6 6 ALA N N 6 119.955 119.955 119.631 0.324 18703 6973 1 20 . 1 1 6 6 ALA HA H 6 4.198 4.198 4.214 -0.016 18703 6974 1 20 . 1 1 6 6 ALA C C 6 180.974 180.974 179.122 1.852 18703 6975 1 20 . 1 1 6 6 ALA CA C 6 54.850 54.850 54.222 0.628 18703 6976 1 20 . 1 1 6 6 ALA CB C 6 17.995 17.995 18.265 -0.269 18703 6977 1 20 . 1 1 6 6 ALA H H 6 7.928 7.928 8.098 -0.170 18703 6978 1 20 . 1 1 7 7 LEU N N 7 119.211 119.211 119.540 -0.329 18703 6979 1 20 . 1 1 7 7 LEU HA H 7 4.124 4.124 3.970 0.153 18703 6980 1 20 . 1 1 7 7 LEU C C 7 178.353 178.353 178.604 -0.251 18703 6981 1 20 . 1 1 7 7 LEU CA C 7 57.658 57.658 57.386 0.272 18703 6982 1 20 . 1 1 7 7 LEU CB C 7 41.971 41.971 42.062 -0.091 18703 6983 1 20 . 1 1 7 7 LEU H H 7 7.594 7.594 7.651 -0.057 18703 6984 1 20 . 1 1 8 8 GLU N N 8 120.258 120.258 118.003 2.255 18703 6985 1 20 . 1 1 8 8 GLU HA H 8 3.846 3.846 3.995 -0.149 18703 6986 1 20 . 1 1 8 8 GLU C C 8 179.546 179.546 178.717 0.829 18703 6987 1 20 . 1 1 8 8 GLU CA C 8 60.006 60.006 59.649 0.357 18703 6988 1 20 . 1 1 8 8 GLU CB C 8 29.683 29.683 29.436 0.248 18703 6989 1 20 . 1 1 8 8 GLU H H 8 8.382 8.382 7.821 0.561 18703 6990 1 20 . 1 1 9 9 GLU N N 9 118.584 118.584 118.688 -0.104 18703 6991 1 20 . 1 1 9 9 GLU HA H 9 4.039 4.039 4.116 -0.077 18703 6992 1 20 . 1 1 9 9 GLU C C 9 179.635 179.635 178.704 0.931 18703 6993 1 20 . 1 1 9 9 GLU CA C 9 59.235 59.235 58.725 0.510 18703 6994 1 20 . 1 1 9 9 GLU CB C 9 29.358 29.358 29.135 0.223 18703 6995 1 20 . 1 1 9 9 GLU H H 9 7.908 7.908 7.784 0.124 18703 6996 1 20 . 1 1 10 10 LYS N N 10 120.956 120.956 119.930 1.026 18703 6997 1 20 . 1 1 10 10 LYS HA H 10 4.190 4.190 4.152 0.038 18703 6998 1 20 . 1 1 10 10 LYS C C 10 179.395 179.395 178.961 0.434 18703 6999 1 20 . 1 1 10 10 LYS CA C 10 59.231 59.231 58.979 0.252 18703 7000 1 20 . 1 1 10 10 LYS CB C 10 32.211 32.211 32.549 -0.338 18703 7001 1 20 . 1 1 10 10 LYS H H 10 8.009 8.009 7.434 0.575 18703 7002 1 20 . 1 1 11 11 VAL N N 11 119.577 119.577 118.267 1.310 18703 7003 1 20 . 1 1 11 11 VAL HA H 11 3.844 3.844 3.685 0.159 18703 7004 1 20 . 1 1 11 11 VAL C C 11 177.078 177.078 177.667 -0.589 18703 7005 1 20 . 1 1 11 11 VAL CA C 11 66.407 66.407 66.190 0.217 18703 7006 1 20 . 1 1 11 11 VAL CB C 11 31.252 31.252 31.422 -0.170 18703 7007 1 20 . 1 1 11 11 VAL H H 11 8.488 8.488 7.440 1.048 18703 7008 1 20 . 1 1 12 12 LYS N N 12 122.864 122.864 119.455 3.409 18703 7009 1 20 . 1 1 12 12 LYS HA H 12 4.189 4.189 3.943 0.246 18703 7010 1 20 . 1 1 12 12 LYS C C 12 178.755 178.755 178.289 0.466 18703 7011 1 20 . 1 1 12 12 LYS CA C 12 59.375 59.375 59.808 -0.433 18703 7012 1 20 . 1 1 12 12 LYS CB C 12 31.991 31.991 32.246 -0.255 18703 7013 1 20 . 1 1 12 12 LYS H H 12 7.944 7.944 7.649 0.295 18703 7014 1 20 . 1 1 13 13 ALA N N 13 121.202 121.202 120.161 1.041 18703 7015 1 20 . 1 1 13 13 ALA HA H 13 4.209 4.209 4.443 -0.234 18703 7016 1 20 . 1 1 13 13 ALA C C 13 181.060 181.060 179.210 1.850 18703 7017 1 20 . 1 1 13 13 ALA CA C 13 54.710 54.710 53.990 0.720 18703 7018 1 20 . 1 1 13 13 ALA CB C 13 17.861 17.861 18.533 -0.672 18703 7019 1 20 . 1 1 13 13 ALA H H 13 7.563 7.563 7.406 0.157 18703 7020 1 20 . 1 1 14 14 LEU N N 14 120.014 120.014 119.598 0.416 18703 7021 1 20 . 1 1 14 14 LEU HA H 14 4.072 4.072 4.002 0.070 18703 7022 1 20 . 1 1 14 14 LEU C C 14 177.862 177.862 178.240 -0.378 18703 7023 1 20 . 1 1 14 14 LEU CA C 14 57.864 57.864 57.567 0.297 18703 7024 1 20 . 1 1 14 14 LEU CB C 14 41.539 41.539 42.148 -0.609 18703 7025 1 20 . 1 1 14 14 LEU H H 14 8.087 8.087 7.529 0.558 18703 7026 1 20 . 1 1 15 15 GLU N N 15 121.644 121.644 120.271 1.373 18703 7027 1 20 . 1 1 15 15 GLU HA H 15 3.692 3.692 3.991 -0.299 18703 7028 1 20 . 1 1 15 15 GLU C C 15 177.819 177.819 178.248 -0.429 18703 7029 1 20 . 1 1 15 15 GLU CA C 15 59.239 59.239 59.474 -0.235 18703 7030 1 20 . 1 1 15 15 GLU CB C 15 28.865 28.865 29.622 -0.757 18703 7031 1 20 . 1 1 15 15 GLU H H 15 8.542 8.542 7.689 0.853 18703 7032 1 20 . 1 1 16 16 GLU N N 16 116.016 116.016 118.649 -2.633 18703 7033 1 20 . 1 1 16 16 GLU HA H 16 3.955 3.955 3.935 0.020 18703 7034 1 20 . 1 1 16 16 GLU C C 16 179.159 179.159 179.173 -0.014 18703 7035 1 20 . 1 1 16 16 GLU CA C 16 59.324 59.324 59.005 0.319 18703 7036 1 20 . 1 1 16 16 GLU CB C 16 29.060 29.060 29.003 0.057 18703 7037 1 20 . 1 1 16 16 GLU H H 16 7.492 7.492 8.001 -0.509 18703 7038 1 20 . 1 1 17 17 LYS N N 17 118.546 118.546 118.646 -0.100 18703 7039 1 20 . 1 1 17 17 LYS HA H 17 4.117 4.117 4.148 -0.031 18703 7040 1 20 . 1 1 17 17 LYS C C 17 178.976 178.976 177.863 1.113 18703 7041 1 20 . 1 1 17 17 LYS CA C 17 58.837 58.837 58.600 0.237 18703 7042 1 20 . 1 1 17 17 LYS CB C 17 32.538 32.538 32.483 0.055 18703 7043 1 20 . 1 1 17 17 LYS H H 17 7.720 7.720 7.467 0.253 18703 7044 1 20 . 1 1 18 18 VAL N N 18 118.376 118.376 118.812 -0.436 18703 7045 1 20 . 1 1 18 18 VAL HA H 18 3.711 3.711 3.827 -0.116 18703 7046 1 20 . 1 1 18 18 VAL C C 18 178.765 178.765 178.451 0.314 18703 7047 1 20 . 1 1 18 18 VAL CA C 18 66.237 66.237 65.719 0.518 18703 7048 1 20 . 1 1 18 18 VAL CB C 18 31.682 31.682 31.739 -0.057 18703 7049 1 20 . 1 1 18 18 VAL H H 18 8.754 8.754 7.747 1.007 18703 7050 1 20 . 1 1 19 19 LYS N N 19 118.817 118.817 119.163 -0.346 18703 7051 1 20 . 1 1 19 19 LYS HA H 19 4.078 4.078 3.970 0.108 18703 7052 1 20 . 1 1 19 19 LYS C C 19 178.049 178.049 177.850 0.199 18703 7053 1 20 . 1 1 19 19 LYS CA C 19 59.731 59.731 59.421 0.310 18703 7054 1 20 . 1 1 19 19 LYS CB C 19 32.523 32.523 32.138 0.385 18703 7055 1 20 . 1 1 19 19 LYS H H 19 8.299 8.299 8.638 -0.339 18703 7056 1 20 . 1 1 20 20 ALA N N 20 119.656 119.656 119.399 0.257 18703 7057 1 20 . 1 1 20 20 ALA HA H 20 4.347 4.347 4.344 0.003 18703 7058 1 20 . 1 1 20 20 ALA C C 20 178.532 178.532 178.419 0.113 18703 7059 1 20 . 1 1 20 20 ALA CA C 20 52.853 52.853 52.867 -0.014 18703 7060 1 20 . 1 1 20 20 ALA CB C 20 18.832 18.832 18.842 -0.010 18703 7061 1 20 . 1 1 20 20 ALA H H 20 7.425 7.425 7.559 -0.134 18703 7062 1 20 . 1 1 21 21 LEU N N 21 118.594 118.594 119.196 -0.602 18703 7063 1 20 . 1 1 21 21 LEU HA H 21 4.297 4.297 4.131 0.166 18703 7064 1 20 . 1 1 21 21 LEU C C 21 177.784 177.784 177.853 -0.069 18703 7065 1 20 . 1 1 21 21 LEU CA C 21 55.750 55.750 56.535 -0.785 18703 7066 1 20 . 1 1 21 21 LEU CB C 21 42.898 42.898 42.523 0.375 18703 7067 1 20 . 1 1 21 21 LEU H H 21 7.508 7.508 7.908 -0.400 18703 7068 1 20 . 1 1 22 22 GLY N N 22 106.650 106.650 103.729 2.921 18703 7069 1 20 . 1 1 22 22 GLY C C 22 173.605 173.605 172.530 1.075 18703 7070 1 20 . 1 1 22 22 GLY CA C 22 45.330 45.330 44.639 0.691 18703 7071 1 20 . 1 1 22 22 GLY H H 22 7.814 7.814 7.605 0.209 18703 7072 1 20 . 1 1 23 23 GLY N N 23 108.011 108.011 107.198 0.813 18703 7073 1 20 . 1 1 23 23 GLY C C 23 174.061 174.061 172.912 1.149 18703 7074 1 20 . 1 1 23 23 GLY CA C 23 44.772 44.772 45.315 -0.543 18703 7075 1 20 . 1 1 23 23 GLY H H 23 8.139 8.139 7.900 0.239 18703 7076 1 20 . 1 1 24 24 GLY N N 24 107.826 107.826 110.423 -2.597 18703 7077 1 20 . 1 1 24 24 GLY C C 24 175.046 175.046 173.899 1.147 18703 7078 1 20 . 1 1 24 24 GLY CA C 24 44.422 44.422 45.374 -0.952 18703 7079 1 20 . 1 1 24 24 GLY H H 24 8.497 8.497 8.230 0.267 18703 7080 1 20 . 1 1 25 25 GLY N N 25 108.830 108.830 112.485 -3.655 18703 7081 1 20 . 1 1 25 25 GLY C C 25 176.272 176.272 174.646 1.626 18703 7082 1 20 . 1 1 25 25 GLY CA C 25 47.101 47.101 45.171 1.930 18703 7083 1 20 . 1 1 25 25 GLY H H 25 8.616 8.616 8.852 -0.236 18703 7084 1 20 . 1 1 26 26 ARG N N 26 123.109 123.109 124.497 -1.388 18703 7085 1 20 . 1 1 26 26 ARG HA H 26 4.283 4.283 4.154 0.129 18703 7086 1 20 . 1 1 26 26 ARG C C 26 177.848 177.848 177.856 -0.008 18703 7087 1 20 . 1 1 26 26 ARG CA C 26 57.663 57.663 58.531 -0.868 18703 7088 1 20 . 1 1 26 26 ARG CB C 26 29.811 29.811 29.609 0.202 18703 7089 1 20 . 1 1 26 26 ARG H H 26 8.770 8.770 8.611 0.159 18703 7090 1 20 . 1 1 27 27 ILE N N 27 118.104 118.104 118.822 -0.718 18703 7091 1 20 . 1 1 27 27 ILE HA H 27 3.787 3.787 3.805 -0.018 18703 7092 1 20 . 1 1 27 27 ILE C C 27 177.473 177.473 177.491 -0.018 18703 7093 1 20 . 1 1 27 27 ILE CA C 27 63.036 63.036 63.928 -0.892 18703 7094 1 20 . 1 1 27 27 ILE CB C 27 36.664 36.664 37.457 -0.793 18703 7095 1 20 . 1 1 27 27 ILE H H 27 7.708 7.708 7.930 -0.222 18703 7096 1 20 . 1 1 28 28 GLU N N 28 119.934 119.934 119.730 0.204 18703 7097 1 20 . 1 1 28 28 GLU HA H 28 3.954 3.954 3.871 0.083 18703 7098 1 20 . 1 1 28 28 GLU C C 28 179.514 179.514 178.480 1.034 18703 7099 1 20 . 1 1 28 28 GLU CA C 28 59.450 59.450 59.798 -0.348 18703 7100 1 20 . 1 1 28 28 GLU CB C 28 29.600 29.600 29.327 0.273 18703 7101 1 20 . 1 1 28 28 GLU H H 28 7.872 7.872 7.638 0.234 18703 7102 1 20 . 1 1 29 29 GLU N N 29 118.134 118.134 119.669 -1.535 18703 7103 1 20 . 1 1 29 29 GLU HA H 29 4.028 4.028 4.089 -0.061 18703 7104 1 20 . 1 1 29 29 GLU C C 29 179.182 179.182 179.158 0.024 18703 7105 1 20 . 1 1 29 29 GLU CA C 29 59.173 59.173 58.965 0.208 18703 7106 1 20 . 1 1 29 29 GLU CB C 29 29.503 29.503 29.497 0.006 18703 7107 1 20 . 1 1 29 29 GLU H H 29 8.166 8.166 7.715 0.451 18703 7108 1 20 . 1 1 30 30 LEU N N 30 120.242 120.242 117.944 2.298 18703 7109 1 20 . 1 1 30 30 LEU HA H 30 4.028 4.028 4.144 -0.116 18703 7110 1 20 . 1 1 30 30 LEU C C 30 178.796 178.796 178.672 0.124 18703 7111 1 20 . 1 1 30 30 LEU CA C 30 57.654 57.654 56.500 1.154 18703 7112 1 20 . 1 1 30 30 LEU CB C 30 41.629 41.629 41.871 -0.242 18703 7113 1 20 . 1 1 30 30 LEU H H 30 7.695 7.695 7.532 0.163 18703 7114 1 20 . 1 1 31 31 LYS N N 31 120.506 120.506 120.548 -0.042 18703 7115 1 20 . 1 1 31 31 LYS HA H 31 3.532 3.532 4.049 -0.517 18703 7116 1 20 . 1 1 31 31 LYS C C 31 178.919 178.919 178.219 0.700 18703 7117 1 20 . 1 1 31 31 LYS CA C 31 60.240 60.240 59.336 0.904 18703 7118 1 20 . 1 1 31 31 LYS CB C 31 32.015 32.015 32.289 -0.274 18703 7119 1 20 . 1 1 31 31 LYS H H 31 8.561 8.561 7.746 0.815 18703 7120 1 20 . 1 1 32 32 LYS N N 32 118.566 118.566 118.457 0.109 18703 7121 1 20 . 1 1 32 32 LYS C C 32 179.392 179.392 179.030 0.362 18703 7122 1 20 . 1 1 32 32 LYS CA C 32 59.356 59.356 59.744 -0.388 18703 7123 1 20 . 1 1 32 32 LYS CB C 32 32.117 32.117 32.367 -0.251 18703 7124 1 20 . 1 1 32 32 LYS H H 32 7.699 7.699 7.553 0.146 18703 7125 1 20 . 1 1 33 33 LYS N N 33 118.964 118.964 117.864 1.100 18703 7126 1 20 . 1 1 33 33 LYS HA H 33 4.117 4.117 4.174 -0.057 18703 7127 1 20 . 1 1 33 33 LYS C C 33 178.355 178.355 178.274 0.081 18703 7128 1 20 . 1 1 33 33 LYS CA C 33 58.633 58.633 58.822 -0.189 18703 7129 1 20 . 1 1 33 33 LYS CB C 33 31.904 31.904 32.446 -0.542 18703 7130 1 20 . 1 1 33 33 LYS H H 33 7.752 7.752 7.605 0.147 18703 7131 1 20 . 1 1 34 34 CYS N N 34 119.956 119.956 119.302 0.654 18703 7132 1 20 . 1 1 34 34 CYS HA H 34 3.967 3.967 4.113 -0.146 18703 7133 1 20 . 1 1 34 34 CYS C C 34 175.521 175.521 176.706 -1.185 18703 7134 1 20 . 1 1 34 34 CYS CA C 34 60.987 60.987 63.094 -2.107 18703 7135 1 20 . 1 1 34 34 CYS CB C 34 36.600 36.600 26.685 9.915 18703 7136 1 20 . 1 1 34 34 CYS H H 34 8.393 8.393 7.673 0.721 18703 7137 1 20 . 1 1 35 35 GLU N N 35 120.327 120.327 119.505 0.822 18703 7138 1 20 . 1 1 35 35 GLU HA H 35 3.891 3.891 3.965 -0.074 18703 7139 1 20 . 1 1 35 35 GLU C C 35 179.684 179.684 178.687 0.997 18703 7140 1 20 . 1 1 35 35 GLU CA C 35 60.059 60.059 59.231 0.828 18703 7141 1 20 . 1 1 35 35 GLU CB C 35 29.718 29.718 28.655 1.063 18703 7142 1 20 . 1 1 35 35 GLU H H 35 8.558 8.558 7.961 0.597 18703 7143 1 20 . 1 1 36 36 GLU N N 36 120.190 120.190 119.606 0.584 18703 7144 1 20 . 1 1 36 36 GLU HA H 36 4.051 4.051 4.036 0.015 18703 7145 1 20 . 1 1 36 36 GLU C C 36 179.408 179.408 178.831 0.577 18703 7146 1 20 . 1 1 36 36 GLU CA C 36 59.148 59.148 59.138 0.010 18703 7147 1 20 . 1 1 36 36 GLU CB C 36 29.766 29.766 29.518 0.248 18703 7148 1 20 . 1 1 36 36 GLU H H 36 8.038 8.038 7.658 0.380 18703 7149 1 20 . 1 1 37 37 LEU N N 37 121.102 121.102 119.574 1.528 18703 7150 1 20 . 1 1 37 37 LEU HA H 37 4.079 4.079 4.203 -0.124 18703 7151 1 20 . 1 1 37 37 LEU C C 37 178.279 178.279 178.020 0.259 18703 7152 1 20 . 1 1 37 37 LEU CA C 37 57.803 57.803 57.741 0.062 18703 7153 1 20 . 1 1 37 37 LEU CB C 37 41.502 41.502 41.871 -0.369 18703 7154 1 20 . 1 1 37 37 LEU H H 37 8.065 8.065 7.460 0.605 18703 7155 1 20 . 1 1 38 38 LYS N N 38 119.980 119.980 117.929 2.051 18703 7156 1 20 . 1 1 38 38 LYS HA H 38 3.851 3.851 3.946 -0.095 18703 7157 1 20 . 1 1 38 38 LYS C C 38 178.919 178.919 178.735 0.184 18703 7158 1 20 . 1 1 38 38 LYS CA C 38 60.794 60.794 59.547 1.247 18703 7159 1 20 . 1 1 38 38 LYS CB C 38 32.863 32.863 32.059 0.804 18703 7160 1 20 . 1 1 38 38 LYS H H 38 8.741 8.741 7.601 1.140 18703 7161 1 20 . 1 1 39 39 LYS N N 39 118.307 118.307 117.313 0.994 18703 7162 1 20 . 1 1 39 39 LYS HA H 39 4.125 4.125 4.160 -0.035 18703 7163 1 20 . 1 1 39 39 LYS C C 39 178.622 178.622 178.499 0.123 18703 7164 1 20 . 1 1 39 39 LYS CA C 39 58.993 58.993 59.073 -0.080 18703 7165 1 20 . 1 1 39 39 LYS CB C 39 32.097 32.097 32.199 -0.102 18703 7166 1 20 . 1 1 39 39 LYS H H 39 7.584 7.584 7.662 -0.078 18703 7167 1 20 . 1 1 40 40 LYS N N 40 118.826 118.826 120.304 -1.478 18703 7168 1 20 . 1 1 40 40 LYS HA H 40 4.069 4.069 4.126 -0.057 18703 7169 1 20 . 1 1 40 40 LYS C C 40 179.802 179.802 178.484 1.318 18703 7170 1 20 . 1 1 40 40 LYS CA C 40 59.322 59.322 58.678 0.644 18703 7171 1 20 . 1 1 40 40 LYS CB C 40 32.505 32.505 32.341 0.164 18703 7172 1 20 . 1 1 40 40 LYS H H 40 7.945 7.945 7.258 0.687 18703 7173 1 20 . 1 1 41 41 ILE N N 41 118.958 118.958 118.890 0.068 18703 7174 1 20 . 1 1 41 41 ILE HA H 41 3.659 3.659 3.702 -0.043 18703 7175 1 20 . 1 1 41 41 ILE C C 41 178.146 178.146 178.502 -0.356 18703 7176 1 20 . 1 1 41 41 ILE CA C 41 65.037 65.037 65.081 -0.044 18703 7177 1 20 . 1 1 41 41 ILE CB C 41 37.950 37.950 37.869 0.081 18703 7178 1 20 . 1 1 41 41 ILE H H 41 8.369 8.369 7.537 0.832 18703 7179 1 20 . 1 1 42 42 GLU N N 42 120.331 120.331 118.368 1.963 18703 7180 1 20 . 1 1 42 42 GLU HA H 42 4.094 4.094 4.253 -0.159 18703 7181 1 20 . 1 1 42 42 GLU C C 42 178.697 178.697 177.696 1.001 18703 7182 1 20 . 1 1 42 42 GLU CA C 42 58.927 58.927 58.808 0.119 18703 7183 1 20 . 1 1 42 42 GLU CB C 42 29.399 29.399 29.370 0.029 18703 7184 1 20 . 1 1 42 42 GLU H H 42 7.805 7.805 7.681 0.124 18703 7185 1 20 . 1 1 43 43 GLU N N 43 117.120 117.120 116.159 0.961 18703 7186 1 20 . 1 1 43 43 GLU HA H 43 4.291 4.291 4.286 0.005 18703 7187 1 20 . 1 1 43 43 GLU C C 43 177.551 177.551 176.975 0.576 18703 7188 1 20 . 1 1 43 43 GLU CA C 43 56.800 56.800 56.234 0.566 18703 7189 1 20 . 1 1 43 43 GLU CB C 43 29.931 29.931 30.249 -0.318 18703 7190 1 20 . 1 1 43 43 GLU H H 43 7.701 7.701 7.679 0.022 18703 7191 1 20 . 1 1 44 44 LEU N N 44 120.940 120.940 120.623 0.317 18703 7192 1 20 . 1 1 44 44 LEU HA H 44 4.251 4.251 4.252 -0.001 18703 7193 1 20 . 1 1 44 44 LEU C C 44 178.596 178.596 177.150 1.446 18703 7194 1 20 . 1 1 44 44 LEU CA C 44 56.448 56.448 55.110 1.338 18703 7195 1 20 . 1 1 44 44 LEU CB C 44 42.519 42.519 42.673 -0.154 18703 7196 1 20 . 1 1 44 44 LEU H H 44 7.581 7.581 7.630 -0.049 18703 7197 1 20 . 1 1 45 45 GLY N N 45 108.689 108.689 108.419 0.270 18703 7198 1 20 . 1 1 45 45 GLY C C 45 174.853 174.853 174.057 0.796 18703 7199 1 20 . 1 1 45 45 GLY CA C 45 46.233 46.233 45.147 1.086 18703 7200 1 20 . 1 1 45 45 GLY H H 45 8.232 8.232 8.667 -0.435 18703 7201 1 20 . 1 1 46 46 GLY N N 46 108.029 108.029 107.959 0.070 18703 7202 1 20 . 1 1 46 46 GLY C C 46 174.351 174.351 173.578 0.773 18703 7203 1 20 . 1 1 46 46 GLY CA C 46 45.105 45.105 44.667 0.438 18703 7204 1 20 . 1 1 46 46 GLY H H 46 8.176 8.176 7.650 0.526 18703 7205 1 20 . 1 1 47 47 GLY N N 47 108.183 108.183 110.379 -2.196 18703 7206 1 20 . 1 1 47 47 GLY C C 47 174.671 174.671 173.746 0.925 18703 7207 1 20 . 1 1 47 47 GLY CA C 47 45.254 45.254 45.751 -0.497 18703 7208 1 20 . 1 1 47 47 GLY H H 47 8.290 8.290 8.268 0.022 18703 7209 1 20 . 1 1 48 48 GLY N N 48 108.616 108.616 108.594 0.022 18703 7210 1 20 . 1 1 48 48 GLY C C 48 174.321 174.321 175.829 -1.508 18703 7211 1 20 . 1 1 48 48 GLY CA C 48 45.192 45.192 45.124 0.068 18703 7212 1 20 . 1 1 48 48 GLY H H 48 8.027 8.027 8.513 -0.486 18703 7213 1 20 . 1 1 49 49 GLU N N 49 121.057 121.057 122.083 -1.026 18703 7214 1 20 . 1 1 49 49 GLU HA H 49 4.425 4.425 4.195 0.230 18703 7215 1 20 . 1 1 49 49 GLU C C 49 177.072 177.072 178.553 -1.481 18703 7216 1 20 . 1 1 49 49 GLU CA C 49 56.330 56.330 58.342 -2.012 18703 7217 1 20 . 1 1 49 49 GLU CB C 49 29.602 29.602 29.693 -0.091 18703 7218 1 20 . 1 1 49 49 GLU H H 49 8.486 8.486 8.776 -0.290 18703 7219 1 20 . 1 1 50 50 VAL N N 50 122.122 122.122 120.100 2.022 18703 7220 1 20 . 1 1 50 50 VAL HA H 50 3.792 3.792 3.713 0.079 18703 7221 1 20 . 1 1 50 50 VAL C C 50 176.774 176.774 177.652 -0.878 18703 7222 1 20 . 1 1 50 50 VAL CA C 50 64.864 64.864 64.693 0.171 18703 7223 1 20 . 1 1 50 50 VAL CB C 50 32.179 32.179 30.970 1.209 18703 7224 1 20 . 1 1 50 50 VAL H H 50 8.095 8.095 7.952 0.143 18703 7225 1 20 . 1 1 51 51 LYS N N 51 120.602 120.602 118.743 1.859 18703 7226 1 20 . 1 1 51 51 LYS HA H 51 4.195 4.195 4.092 0.103 18703 7227 1 20 . 1 1 51 51 LYS C C 51 178.530 178.530 178.482 0.048 18703 7228 1 20 . 1 1 51 51 LYS CA C 51 59.348 59.348 58.636 0.712 18703 7229 1 20 . 1 1 51 51 LYS CB C 51 32.265 32.265 32.191 0.074 18703 7230 1 20 . 1 1 51 51 LYS H H 51 8.268 8.268 7.968 0.300 18703 7231 1 20 . 1 1 52 52 LYS N N 52 117.547 117.547 120.948 -3.401 18703 7232 1 20 . 1 1 52 52 LYS HA H 52 4.162 4.162 4.058 0.104 18703 7233 1 20 . 1 1 52 52 LYS C C 52 179.132 179.132 178.827 0.305 18703 7234 1 20 . 1 1 52 52 LYS CA C 52 58.811 58.811 59.550 -0.739 18703 7235 1 20 . 1 1 52 52 LYS CB C 52 32.054 32.054 32.238 -0.184 18703 7236 1 20 . 1 1 52 52 LYS H H 52 7.595 7.595 7.762 -0.167 18703 7237 1 20 . 1 1 53 53 VAL N N 53 119.190 119.190 118.129 1.061 18703 7238 1 20 . 1 1 53 53 VAL HA H 53 3.767 3.767 3.669 0.098 18703 7239 1 20 . 1 1 53 53 VAL C C 53 177.933 177.933 177.719 0.214 18703 7240 1 20 . 1 1 53 53 VAL CA C 53 66.065 66.065 66.200 -0.135 18703 7241 1 20 . 1 1 53 53 VAL CB C 53 31.248 31.248 31.310 -0.062 18703 7242 1 20 . 1 1 53 53 VAL H H 53 7.597 7.597 7.520 0.077 18703 7243 1 20 . 1 1 54 54 GLU N N 54 120.226 120.226 119.631 0.595 18703 7244 1 20 . 1 1 54 54 GLU HA H 54 3.833 3.833 4.003 -0.170 18703 7245 1 20 . 1 1 54 54 GLU C C 54 179.352 179.352 178.480 0.872 18703 7246 1 20 . 1 1 54 54 GLU CA C 54 59.153 59.153 59.652 -0.499 18703 7247 1 20 . 1 1 54 54 GLU CB C 54 29.224 29.224 29.411 -0.187 18703 7248 1 20 . 1 1 54 54 GLU H H 54 8.609 8.609 7.715 0.894 18703 7249 1 20 . 1 1 55 55 GLU N N 55 119.148 119.148 119.303 -0.155 18703 7250 1 20 . 1 1 55 55 GLU HA H 55 4.084 4.084 4.102 -0.018 18703 7251 1 20 . 1 1 55 55 GLU C C 55 179.084 179.084 178.853 0.231 18703 7252 1 20 . 1 1 55 55 GLU CA C 55 59.295 59.295 59.014 0.281 18703 7253 1 20 . 1 1 55 55 GLU CB C 55 29.361 29.361 29.587 -0.226 18703 7254 1 20 . 1 1 55 55 GLU H H 55 7.713 7.713 7.744 -0.031 18703 7255 1 20 . 1 1 56 56 GLU N N 56 120.301 120.301 118.875 1.426 18703 7256 1 20 . 1 1 56 56 GLU HA H 56 4.079 4.079 4.128 -0.049 18703 7257 1 20 . 1 1 56 56 GLU C C 56 179.773 179.773 179.288 0.485 18703 7258 1 20 . 1 1 56 56 GLU CA C 56 59.528 59.528 59.227 0.301 18703 7259 1 20 . 1 1 56 56 GLU CB C 56 30.162 30.162 29.720 0.442 18703 7260 1 20 . 1 1 56 56 GLU H H 56 7.899 7.899 7.571 0.328 18703 7261 1 20 . 1 1 57 57 VAL N N 57 121.536 121.536 118.747 2.789 18703 7262 1 20 . 1 1 57 57 VAL HA H 57 3.540 3.540 3.878 -0.338 18703 7263 1 20 . 1 1 57 57 VAL C C 57 176.984 176.984 177.616 -0.632 18703 7264 1 20 . 1 1 57 57 VAL CA C 57 66.734 66.734 64.967 1.767 18703 7265 1 20 . 1 1 57 57 VAL CB C 57 31.425 31.425 31.059 0.366 18703 7266 1 20 . 1 1 57 57 VAL H H 57 8.652 8.652 7.564 1.088 18703 7267 1 20 . 1 1 58 58 LYS N N 58 120.219 120.219 120.208 0.011 18703 7268 1 20 . 1 1 58 58 LYS HA H 58 4.199 4.199 4.113 0.086 18703 7269 1 20 . 1 1 58 58 LYS C C 58 178.972 178.972 178.616 0.356 18703 7270 1 20 . 1 1 58 58 LYS CA C 58 59.357 59.357 59.263 0.094 18703 7271 1 20 . 1 1 58 58 LYS CB C 58 32.186 32.186 32.031 0.155 18703 7272 1 20 . 1 1 58 58 LYS H H 58 7.791 7.791 7.466 0.325 18703 7273 1 20 . 1 1 59 59 LYS N N 59 118.252 118.252 120.204 -1.952 18703 7274 1 20 . 1 1 59 59 LYS HA H 59 4.069 4.069 4.159 -0.090 18703 7275 1 20 . 1 1 59 59 LYS C C 59 179.180 179.180 178.234 0.946 18703 7276 1 20 . 1 1 59 59 LYS CA C 59 59.285 59.285 58.802 0.483 18703 7277 1 20 . 1 1 59 59 LYS CB C 59 32.345 32.345 32.267 0.078 18703 7278 1 20 . 1 1 59 59 LYS H H 59 7.849 7.849 7.500 0.349 18703 7279 1 20 . 1 1 60 60 LEU N N 60 121.243 121.243 119.829 1.414 18703 7280 1 20 . 1 1 60 60 LEU HA H 60 4.242 4.242 4.148 0.094 18703 7281 1 20 . 1 1 60 60 LEU C C 60 178.413 178.413 178.220 0.193 18703 7282 1 20 . 1 1 60 60 LEU CA C 60 57.798 57.798 57.184 0.614 18703 7283 1 20 . 1 1 60 60 LEU CB C 60 41.150 41.150 42.183 -1.033 18703 7284 1 20 . 1 1 60 60 LEU H H 60 7.825 7.825 7.568 0.257 18703 7285 1 20 . 1 1 61 61 GLU N N 61 118.844 118.844 120.090 -1.246 18703 7286 1 20 . 1 1 61 61 GLU HA H 61 3.800 3.800 3.936 -0.136 18703 7287 1 20 . 1 1 61 61 GLU C C 61 179.078 179.078 178.551 0.527 18703 7288 1 20 . 1 1 61 61 GLU CA C 61 60.104 60.104 59.991 0.113 18703 7289 1 20 . 1 1 61 61 GLU CB C 61 29.864 29.864 29.670 0.194 18703 7290 1 20 . 1 1 61 61 GLU H H 61 8.582 8.582 7.727 0.855 18703 7291 1 20 . 1 1 62 62 GLU N N 62 117.659 117.659 118.727 -1.068 18703 7292 1 20 . 1 1 62 62 GLU HA H 62 3.990 3.990 4.048 -0.058 18703 7293 1 20 . 1 1 62 62 GLU C C 62 178.847 178.847 178.883 -0.036 18703 7294 1 20 . 1 1 62 62 GLU CA C 62 59.067 59.067 58.954 0.113 18703 7295 1 20 . 1 1 62 62 GLU CB C 62 29.440 29.440 29.668 -0.228 18703 7296 1 20 . 1 1 62 62 GLU H H 62 8.032 8.032 7.625 0.407 18703 7297 1 20 . 1 1 63 63 GLU N N 63 119.290 119.290 119.479 -0.189 18703 7298 1 20 . 1 1 63 63 GLU HA H 63 4.012 4.012 4.090 -0.078 18703 7299 1 20 . 1 1 63 63 GLU C C 63 179.784 179.784 179.408 0.376 18703 7300 1 20 . 1 1 63 63 GLU CA C 63 59.300 59.300 59.214 0.086 18703 7301 1 20 . 1 1 63 63 GLU CB C 63 29.728 29.728 29.484 0.244 18703 7302 1 20 . 1 1 63 63 GLU H H 63 7.958 7.958 7.448 0.510 18703 7303 1 20 . 1 1 64 64 ILE N N 64 118.453 118.453 118.941 -0.488 18703 7304 1 20 . 1 1 64 64 ILE HA H 64 3.711 3.711 3.773 -0.062 18703 7305 1 20 . 1 1 64 64 ILE C C 64 177.655 177.655 177.171 0.484 18703 7306 1 20 . 1 1 64 64 ILE CA C 64 64.256 64.256 63.984 0.272 18703 7307 1 20 . 1 1 64 64 ILE CB C 64 38.002 38.002 37.573 0.429 18703 7308 1 20 . 1 1 64 64 ILE H H 64 8.160 8.160 7.535 0.625 18703 7309 1 20 . 1 1 65 65 LYS N N 65 118.871 118.871 118.322 0.549 18703 7310 1 20 . 1 1 65 65 LYS HA H 65 4.111 4.111 4.103 0.008 18703 7311 1 20 . 1 1 65 65 LYS C C 65 177.076 177.076 177.688 -0.612 18703 7312 1 20 . 1 1 65 65 LYS CA C 65 58.421 58.421 58.582 -0.161 18703 7313 1 20 . 1 1 65 65 LYS CB C 65 32.639 32.639 32.445 0.194 18703 7314 1 20 . 1 1 65 65 LYS H H 65 7.664 7.664 7.532 0.132 18703 7315 1 20 . 1 1 66 66 LYS N N 66 116.944 116.944 118.426 -1.482 18703 7316 1 20 . 1 1 66 66 LYS HA H 66 4.320 4.320 4.126 0.194 18703 7317 1 20 . 1 1 66 66 LYS C C 66 175.897 175.897 177.714 -1.817 18703 7318 1 20 . 1 1 66 66 LYS CA C 66 56.352 56.352 58.082 -1.730 18703 7319 1 20 . 1 1 66 66 LYS CB C 66 33.024 33.024 32.821 0.203 18703 7320 1 20 . 1 1 66 66 LYS H H 66 7.246 7.246 7.643 -0.397 18703 7321 1 21 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.384 -0.138 18703 7322 1 21 . 1 1 3 3 ARG C C 3 178.379 178.379 176.507 1.872 18703 7323 1 21 . 1 1 3 3 ARG CA C 3 58.367 58.367 56.726 1.641 18703 7324 1 21 . 1 1 3 3 ARG CB C 3 30.691 30.691 30.715 -0.024 18703 7325 1 21 . 1 1 3 3 ARG H H 3 7.905 7.905 8.538 -0.633 18703 7326 1 21 . 1 1 4 4 VAL N N 4 118.966 118.966 121.222 -2.256 18703 7327 1 21 . 1 1 4 4 VAL HA H 4 3.803 3.803 3.915 -0.112 18703 7328 1 21 . 1 1 4 4 VAL C C 4 176.968 176.968 177.321 -0.353 18703 7329 1 21 . 1 1 4 4 VAL CA C 4 65.441 65.441 65.278 0.163 18703 7330 1 21 . 1 1 4 4 VAL CB C 4 31.710 31.710 31.740 -0.030 18703 7331 1 21 . 1 1 4 4 VAL H H 4 8.070 8.070 8.357 -0.287 18703 7332 1 21 . 1 1 5 5 LYS N N 5 122.058 122.058 121.022 1.036 18703 7333 1 21 . 1 1 5 5 LYS HA H 5 4.154 4.154 4.334 -0.180 18703 7334 1 21 . 1 1 5 5 LYS C C 5 178.553 178.553 178.916 -0.363 18703 7335 1 21 . 1 1 5 5 LYS CA C 5 58.712 58.712 59.212 -0.500 18703 7336 1 21 . 1 1 5 5 LYS CB C 5 31.788 31.788 31.861 -0.073 18703 7337 1 21 . 1 1 5 5 LYS H H 5 7.798 7.798 8.447 -0.649 18703 7338 1 21 . 1 1 6 6 ALA N N 6 119.955 119.955 119.661 0.294 18703 7339 1 21 . 1 1 6 6 ALA HA H 6 4.198 4.198 4.292 -0.094 18703 7340 1 21 . 1 1 6 6 ALA C C 6 180.974 180.974 179.335 1.639 18703 7341 1 21 . 1 1 6 6 ALA CA C 6 54.850 54.850 54.274 0.576 18703 7342 1 21 . 1 1 6 6 ALA CB C 6 17.995 17.995 18.130 -0.135 18703 7343 1 21 . 1 1 6 6 ALA H H 6 7.928 7.928 8.305 -0.377 18703 7344 1 21 . 1 1 7 7 LEU N N 7 119.211 119.211 119.303 -0.092 18703 7345 1 21 . 1 1 7 7 LEU HA H 7 4.124 4.124 3.999 0.125 18703 7346 1 21 . 1 1 7 7 LEU C C 7 178.353 178.353 178.744 -0.391 18703 7347 1 21 . 1 1 7 7 LEU CA C 7 57.658 57.658 57.359 0.299 18703 7348 1 21 . 1 1 7 7 LEU CB C 7 41.971 41.971 42.148 -0.177 18703 7349 1 21 . 1 1 7 7 LEU H H 7 7.594 7.594 7.693 -0.099 18703 7350 1 21 . 1 1 8 8 GLU N N 8 120.258 120.258 118.291 1.967 18703 7351 1 21 . 1 1 8 8 GLU HA H 8 3.846 3.846 4.034 -0.188 18703 7352 1 21 . 1 1 8 8 GLU C C 8 179.546 179.546 178.773 0.773 18703 7353 1 21 . 1 1 8 8 GLU CA C 8 60.006 60.006 59.569 0.437 18703 7354 1 21 . 1 1 8 8 GLU CB C 8 29.683 29.683 29.595 0.088 18703 7355 1 21 . 1 1 8 8 GLU H H 8 8.382 8.382 7.788 0.594 18703 7356 1 21 . 1 1 9 9 GLU N N 9 118.584 118.584 118.910 -0.326 18703 7357 1 21 . 1 1 9 9 GLU HA H 9 4.039 4.039 4.112 -0.073 18703 7358 1 21 . 1 1 9 9 GLU C C 9 179.635 179.635 178.722 0.913 18703 7359 1 21 . 1 1 9 9 GLU CA C 9 59.235 59.235 58.802 0.433 18703 7360 1 21 . 1 1 9 9 GLU CB C 9 29.358 29.358 29.110 0.248 18703 7361 1 21 . 1 1 9 9 GLU H H 9 7.908 7.908 7.789 0.119 18703 7362 1 21 . 1 1 10 10 LYS N N 10 120.956 120.956 119.815 1.141 18703 7363 1 21 . 1 1 10 10 LYS HA H 10 4.190 4.190 4.126 0.064 18703 7364 1 21 . 1 1 10 10 LYS C C 10 179.395 179.395 178.590 0.805 18703 7365 1 21 . 1 1 10 10 LYS CA C 10 59.231 59.231 58.712 0.519 18703 7366 1 21 . 1 1 10 10 LYS CB C 10 32.211 32.211 32.647 -0.436 18703 7367 1 21 . 1 1 10 10 LYS H H 10 8.009 8.009 7.485 0.524 18703 7368 1 21 . 1 1 11 11 VAL N N 11 119.577 119.577 118.083 1.494 18703 7369 1 21 . 1 1 11 11 VAL HA H 11 3.844 3.844 3.716 0.128 18703 7370 1 21 . 1 1 11 11 VAL C C 11 177.078 177.078 177.609 -0.531 18703 7371 1 21 . 1 1 11 11 VAL CA C 11 66.407 66.407 66.131 0.276 18703 7372 1 21 . 1 1 11 11 VAL CB C 11 31.252 31.252 31.404 -0.152 18703 7373 1 21 . 1 1 11 11 VAL H H 11 8.488 8.488 7.477 1.011 18703 7374 1 21 . 1 1 12 12 LYS N N 12 122.864 122.864 119.951 2.913 18703 7375 1 21 . 1 1 12 12 LYS HA H 12 4.189 4.189 4.007 0.182 18703 7376 1 21 . 1 1 12 12 LYS C C 12 178.755 178.755 177.925 0.830 18703 7377 1 21 . 1 1 12 12 LYS CA C 12 59.375 59.375 59.242 0.133 18703 7378 1 21 . 1 1 12 12 LYS CB C 12 31.991 31.991 32.102 -0.111 18703 7379 1 21 . 1 1 12 12 LYS H H 12 7.944 7.944 7.607 0.337 18703 7380 1 21 . 1 1 13 13 ALA N N 13 121.202 121.202 120.303 0.899 18703 7381 1 21 . 1 1 13 13 ALA HA H 13 4.209 4.209 4.301 -0.092 18703 7382 1 21 . 1 1 13 13 ALA C C 13 181.060 181.060 179.514 1.546 18703 7383 1 21 . 1 1 13 13 ALA CA C 13 54.710 54.710 54.200 0.510 18703 7384 1 21 . 1 1 13 13 ALA CB C 13 17.861 17.861 18.339 -0.478 18703 7385 1 21 . 1 1 13 13 ALA H H 13 7.563 7.563 7.433 0.130 18703 7386 1 21 . 1 1 14 14 LEU N N 14 120.014 120.014 119.646 0.368 18703 7387 1 21 . 1 1 14 14 LEU HA H 14 4.072 4.072 4.023 0.049 18703 7388 1 21 . 1 1 14 14 LEU C C 14 177.862 177.862 178.149 -0.287 18703 7389 1 21 . 1 1 14 14 LEU CA C 14 57.864 57.864 57.179 0.685 18703 7390 1 21 . 1 1 14 14 LEU CB C 14 41.539 41.539 41.969 -0.430 18703 7391 1 21 . 1 1 14 14 LEU H H 14 8.087 8.087 7.502 0.585 18703 7392 1 21 . 1 1 15 15 GLU N N 15 121.644 121.644 120.340 1.304 18703 7393 1 21 . 1 1 15 15 GLU HA H 15 3.692 3.692 4.023 -0.331 18703 7394 1 21 . 1 1 15 15 GLU C C 15 177.819 177.819 178.334 -0.515 18703 7395 1 21 . 1 1 15 15 GLU CA C 15 59.239 59.239 59.215 0.024 18703 7396 1 21 . 1 1 15 15 GLU CB C 15 28.865 28.865 29.614 -0.749 18703 7397 1 21 . 1 1 15 15 GLU H H 15 8.542 8.542 7.662 0.880 18703 7398 1 21 . 1 1 16 16 GLU N N 16 116.016 116.016 118.525 -2.509 18703 7399 1 21 . 1 1 16 16 GLU HA H 16 3.955 3.955 3.973 -0.018 18703 7400 1 21 . 1 1 16 16 GLU C C 16 179.159 179.159 179.075 0.084 18703 7401 1 21 . 1 1 16 16 GLU CA C 16 59.324 59.324 59.261 0.063 18703 7402 1 21 . 1 1 16 16 GLU CB C 16 29.060 29.060 29.250 -0.190 18703 7403 1 21 . 1 1 16 16 GLU H H 16 7.492 7.492 7.920 -0.428 18703 7404 1 21 . 1 1 17 17 LYS N N 17 118.546 118.546 119.218 -0.672 18703 7405 1 21 . 1 1 17 17 LYS HA H 17 4.117 4.117 4.109 0.008 18703 7406 1 21 . 1 1 17 17 LYS C C 17 178.976 178.976 177.975 1.001 18703 7407 1 21 . 1 1 17 17 LYS CA C 17 58.837 58.837 59.135 -0.298 18703 7408 1 21 . 1 1 17 17 LYS CB C 17 32.538 32.538 32.298 0.240 18703 7409 1 21 . 1 1 17 17 LYS H H 17 7.720 7.720 7.387 0.333 18703 7410 1 21 . 1 1 18 18 VAL N N 18 118.376 118.376 118.167 0.209 18703 7411 1 21 . 1 1 18 18 VAL HA H 18 3.711 3.711 3.855 -0.144 18703 7412 1 21 . 1 1 18 18 VAL C C 18 178.765 178.765 178.689 0.076 18703 7413 1 21 . 1 1 18 18 VAL CA C 18 66.237 66.237 65.522 0.715 18703 7414 1 21 . 1 1 18 18 VAL CB C 18 31.682 31.682 31.209 0.473 18703 7415 1 21 . 1 1 18 18 VAL H H 18 8.754 8.754 7.770 0.984 18703 7416 1 21 . 1 1 19 19 LYS N N 19 118.817 118.817 120.137 -1.320 18703 7417 1 21 . 1 1 19 19 LYS HA H 19 4.078 4.078 3.992 0.086 18703 7418 1 21 . 1 1 19 19 LYS C C 19 178.049 178.049 177.990 0.059 18703 7419 1 21 . 1 1 19 19 LYS CA C 19 59.731 59.731 59.235 0.496 18703 7420 1 21 . 1 1 19 19 LYS CB C 19 32.523 32.523 31.921 0.602 18703 7421 1 21 . 1 1 19 19 LYS H H 19 8.299 8.299 8.610 -0.311 18703 7422 1 21 . 1 1 20 20 ALA N N 20 119.656 119.656 119.149 0.507 18703 7423 1 21 . 1 1 20 20 ALA HA H 20 4.347 4.347 4.344 0.003 18703 7424 1 21 . 1 1 20 20 ALA C C 20 178.532 178.532 177.820 0.712 18703 7425 1 21 . 1 1 20 20 ALA CA C 20 52.853 52.853 51.963 0.890 18703 7426 1 21 . 1 1 20 20 ALA CB C 20 18.832 18.832 19.494 -0.662 18703 7427 1 21 . 1 1 20 20 ALA H H 20 7.425 7.425 7.729 -0.304 18703 7428 1 21 . 1 1 21 21 LEU N N 21 118.594 118.594 119.657 -1.063 18703 7429 1 21 . 1 1 21 21 LEU HA H 21 4.297 4.297 4.244 0.053 18703 7430 1 21 . 1 1 21 21 LEU C C 21 177.784 177.784 176.872 0.912 18703 7431 1 21 . 1 1 21 21 LEU CA C 21 55.750 55.750 54.973 0.777 18703 7432 1 21 . 1 1 21 21 LEU CB C 21 42.898 42.898 42.957 -0.059 18703 7433 1 21 . 1 1 21 21 LEU H H 21 7.508 7.508 7.590 -0.082 18703 7434 1 21 . 1 1 22 22 GLY N N 22 106.650 106.650 109.991 -3.341 18703 7435 1 21 . 1 1 22 22 GLY C C 22 173.605 173.605 173.039 0.566 18703 7436 1 21 . 1 1 22 22 GLY CA C 22 45.330 45.330 45.468 -0.138 18703 7437 1 21 . 1 1 22 22 GLY H H 22 7.814 7.814 8.473 -0.659 18703 7438 1 21 . 1 1 23 23 GLY N N 23 108.011 108.011 109.765 -1.754 18703 7439 1 21 . 1 1 23 23 GLY C C 23 174.061 174.061 172.881 1.180 18703 7440 1 21 . 1 1 23 23 GLY CA C 23 44.772 44.772 45.113 -0.341 18703 7441 1 21 . 1 1 23 23 GLY H H 23 8.139 8.139 8.099 0.040 18703 7442 1 21 . 1 1 24 24 GLY N N 24 107.826 107.826 106.553 1.273 18703 7443 1 21 . 1 1 24 24 GLY C C 24 175.046 175.046 173.857 1.189 18703 7444 1 21 . 1 1 24 24 GLY CA C 24 44.422 44.422 44.752 -0.330 18703 7445 1 21 . 1 1 24 24 GLY H H 24 8.497 8.497 8.137 0.360 18703 7446 1 21 . 1 1 25 25 GLY N N 25 108.830 108.830 109.540 -0.710 18703 7447 1 21 . 1 1 25 25 GLY C C 25 176.272 176.272 175.998 0.274 18703 7448 1 21 . 1 1 25 25 GLY CA C 25 47.101 47.101 46.062 1.039 18703 7449 1 21 . 1 1 25 25 GLY H H 25 8.616 8.616 8.193 0.423 18703 7450 1 21 . 1 1 26 26 ARG N N 26 123.109 123.109 125.614 -2.505 18703 7451 1 21 . 1 1 26 26 ARG HA H 26 4.283 4.283 4.145 0.138 18703 7452 1 21 . 1 1 26 26 ARG C C 26 177.848 177.848 177.873 -0.025 18703 7453 1 21 . 1 1 26 26 ARG CA C 26 57.663 57.663 58.324 -0.661 18703 7454 1 21 . 1 1 26 26 ARG CB C 26 29.811 29.811 29.433 0.378 18703 7455 1 21 . 1 1 26 26 ARG H H 26 8.770 8.770 8.457 0.313 18703 7456 1 21 . 1 1 27 27 ILE N N 27 118.104 118.104 119.181 -1.077 18703 7457 1 21 . 1 1 27 27 ILE HA H 27 3.787 3.787 3.798 -0.011 18703 7458 1 21 . 1 1 27 27 ILE C C 27 177.473 177.473 177.884 -0.411 18703 7459 1 21 . 1 1 27 27 ILE CA C 27 63.036 63.036 64.216 -1.180 18703 7460 1 21 . 1 1 27 27 ILE CB C 27 36.664 36.664 37.497 -0.833 18703 7461 1 21 . 1 1 27 27 ILE H H 27 7.708 7.708 7.446 0.262 18703 7462 1 21 . 1 1 28 28 GLU N N 28 119.934 119.934 119.471 0.463 18703 7463 1 21 . 1 1 28 28 GLU HA H 28 3.954 3.954 4.025 -0.071 18703 7464 1 21 . 1 1 28 28 GLU C C 28 179.514 179.514 178.584 0.930 18703 7465 1 21 . 1 1 28 28 GLU CA C 28 59.450 59.450 59.533 -0.083 18703 7466 1 21 . 1 1 28 28 GLU CB C 28 29.600 29.600 29.082 0.518 18703 7467 1 21 . 1 1 28 28 GLU H H 28 7.872 7.872 7.874 -0.002 18703 7468 1 21 . 1 1 29 29 GLU N N 29 118.134 118.134 120.109 -1.975 18703 7469 1 21 . 1 1 29 29 GLU HA H 29 4.028 4.028 4.160 -0.132 18703 7470 1 21 . 1 1 29 29 GLU C C 29 179.182 179.182 179.094 0.088 18703 7471 1 21 . 1 1 29 29 GLU CA C 29 59.173 59.173 59.038 0.135 18703 7472 1 21 . 1 1 29 29 GLU CB C 29 29.503 29.503 29.558 -0.055 18703 7473 1 21 . 1 1 29 29 GLU H H 29 8.166 8.166 7.631 0.535 18703 7474 1 21 . 1 1 30 30 LEU N N 30 120.242 120.242 118.692 1.550 18703 7475 1 21 . 1 1 30 30 LEU HA H 30 4.028 4.028 4.170 -0.142 18703 7476 1 21 . 1 1 30 30 LEU C C 30 178.796 178.796 178.807 -0.011 18703 7477 1 21 . 1 1 30 30 LEU CA C 30 57.654 57.654 56.566 1.088 18703 7478 1 21 . 1 1 30 30 LEU CB C 30 41.629 41.629 41.867 -0.238 18703 7479 1 21 . 1 1 30 30 LEU H H 30 7.695 7.695 7.593 0.102 18703 7480 1 21 . 1 1 31 31 LYS N N 31 120.506 120.506 120.725 -0.219 18703 7481 1 21 . 1 1 31 31 LYS HA H 31 3.532 3.532 4.017 -0.485 18703 7482 1 21 . 1 1 31 31 LYS C C 31 178.919 178.919 178.157 0.762 18703 7483 1 21 . 1 1 31 31 LYS CA C 31 60.240 60.240 59.536 0.704 18703 7484 1 21 . 1 1 31 31 LYS CB C 31 32.015 32.015 32.276 -0.261 18703 7485 1 21 . 1 1 31 31 LYS H H 31 8.561 8.561 7.519 1.042 18703 7486 1 21 . 1 1 32 32 LYS N N 32 118.566 118.566 118.912 -0.346 18703 7487 1 21 . 1 1 32 32 LYS C C 32 179.392 179.392 178.718 0.674 18703 7488 1 21 . 1 1 32 32 LYS CA C 32 59.356 59.356 59.920 -0.564 18703 7489 1 21 . 1 1 32 32 LYS CB C 32 32.117 32.117 32.386 -0.269 18703 7490 1 21 . 1 1 32 32 LYS H H 32 7.699 7.699 7.569 0.130 18703 7491 1 21 . 1 1 33 33 LYS N N 33 118.964 118.964 117.862 1.102 18703 7492 1 21 . 1 1 33 33 LYS HA H 33 4.117 4.117 4.059 0.058 18703 7493 1 21 . 1 1 33 33 LYS C C 33 178.355 178.355 178.200 0.155 18703 7494 1 21 . 1 1 33 33 LYS CA C 33 58.633 58.633 59.049 -0.416 18703 7495 1 21 . 1 1 33 33 LYS CB C 33 31.904 31.904 32.299 -0.395 18703 7496 1 21 . 1 1 33 33 LYS H H 33 7.752 7.752 7.636 0.116 18703 7497 1 21 . 1 1 34 34 CYS N N 34 119.956 119.956 118.851 1.105 18703 7498 1 21 . 1 1 34 34 CYS HA H 34 3.967 3.967 4.103 -0.136 18703 7499 1 21 . 1 1 34 34 CYS C C 34 175.521 175.521 176.846 -1.325 18703 7500 1 21 . 1 1 34 34 CYS CA C 34 60.987 60.987 62.910 -1.923 18703 7501 1 21 . 1 1 34 34 CYS CB C 34 36.600 36.600 26.591 10.009 18703 7502 1 21 . 1 1 34 34 CYS H H 34 8.393 8.393 7.524 0.869 18703 7503 1 21 . 1 1 35 35 GLU N N 35 120.327 120.327 120.039 0.288 18703 7504 1 21 . 1 1 35 35 GLU HA H 35 3.891 3.891 3.915 -0.024 18703 7505 1 21 . 1 1 35 35 GLU C C 35 179.684 179.684 178.761 0.923 18703 7506 1 21 . 1 1 35 35 GLU CA C 35 60.059 60.059 59.195 0.864 18703 7507 1 21 . 1 1 35 35 GLU CB C 35 29.718 29.718 28.644 1.074 18703 7508 1 21 . 1 1 35 35 GLU H H 35 8.558 8.558 7.794 0.764 18703 7509 1 21 . 1 1 36 36 GLU N N 36 120.190 120.190 119.882 0.308 18703 7510 1 21 . 1 1 36 36 GLU HA H 36 4.051 4.051 3.984 0.067 18703 7511 1 21 . 1 1 36 36 GLU C C 36 179.408 179.408 179.003 0.405 18703 7512 1 21 . 1 1 36 36 GLU CA C 36 59.148 59.148 58.872 0.276 18703 7513 1 21 . 1 1 36 36 GLU CB C 36 29.766 29.766 29.753 0.013 18703 7514 1 21 . 1 1 36 36 GLU H H 36 8.038 8.038 7.597 0.441 18703 7515 1 21 . 1 1 37 37 LEU N N 37 121.102 121.102 119.634 1.468 18703 7516 1 21 . 1 1 37 37 LEU HA H 37 4.079 4.079 4.194 -0.115 18703 7517 1 21 . 1 1 37 37 LEU C C 37 178.279 178.279 178.420 -0.141 18703 7518 1 21 . 1 1 37 37 LEU CA C 37 57.803 57.803 57.259 0.544 18703 7519 1 21 . 1 1 37 37 LEU CB C 37 41.502 41.502 41.717 -0.215 18703 7520 1 21 . 1 1 37 37 LEU H H 37 8.065 8.065 7.468 0.597 18703 7521 1 21 . 1 1 38 38 LYS N N 38 119.980 119.980 119.035 0.945 18703 7522 1 21 . 1 1 38 38 LYS HA H 38 3.851 3.851 3.893 -0.042 18703 7523 1 21 . 1 1 38 38 LYS C C 38 178.919 178.919 179.124 -0.205 18703 7524 1 21 . 1 1 38 38 LYS CA C 38 60.794 60.794 60.258 0.536 18703 7525 1 21 . 1 1 38 38 LYS CB C 38 32.863 32.863 32.349 0.514 18703 7526 1 21 . 1 1 38 38 LYS H H 38 8.741 8.741 8.048 0.693 18703 7527 1 21 . 1 1 39 39 LYS N N 39 118.307 118.307 117.790 0.517 18703 7528 1 21 . 1 1 39 39 LYS HA H 39 4.125 4.125 4.168 -0.043 18703 7529 1 21 . 1 1 39 39 LYS C C 39 178.622 178.622 178.653 -0.031 18703 7530 1 21 . 1 1 39 39 LYS CA C 39 58.993 58.993 58.975 0.018 18703 7531 1 21 . 1 1 39 39 LYS CB C 39 32.097 32.097 31.787 0.310 18703 7532 1 21 . 1 1 39 39 LYS H H 39 7.584 7.584 7.718 -0.134 18703 7533 1 21 . 1 1 40 40 LYS N N 40 118.826 118.826 119.984 -1.158 18703 7534 1 21 . 1 1 40 40 LYS HA H 40 4.069 4.069 4.311 -0.242 18703 7535 1 21 . 1 1 40 40 LYS C C 40 179.802 179.802 178.797 1.005 18703 7536 1 21 . 1 1 40 40 LYS CA C 40 59.322 59.322 58.570 0.752 18703 7537 1 21 . 1 1 40 40 LYS CB C 40 32.505 32.505 32.222 0.283 18703 7538 1 21 . 1 1 40 40 LYS H H 40 7.945 7.945 7.347 0.598 18703 7539 1 21 . 1 1 41 41 ILE N N 41 118.958 118.958 117.984 0.974 18703 7540 1 21 . 1 1 41 41 ILE HA H 41 3.659 3.659 3.715 -0.056 18703 7541 1 21 . 1 1 41 41 ILE C C 41 178.146 178.146 176.569 1.577 18703 7542 1 21 . 1 1 41 41 ILE CA C 41 65.037 65.037 64.420 0.617 18703 7543 1 21 . 1 1 41 41 ILE CB C 41 37.950 37.950 38.066 -0.116 18703 7544 1 21 . 1 1 41 41 ILE H H 41 8.369 8.369 8.060 0.309 18703 7545 1 21 . 1 1 42 42 GLU N N 42 120.331 120.331 116.520 3.811 18703 7546 1 21 . 1 1 42 42 GLU HA H 42 4.094 4.094 4.009 0.085 18703 7547 1 21 . 1 1 42 42 GLU C C 42 178.697 178.697 177.716 0.981 18703 7548 1 21 . 1 1 42 42 GLU CA C 42 58.927 58.927 58.329 0.598 18703 7549 1 21 . 1 1 42 42 GLU CB C 42 29.399 29.399 29.780 -0.381 18703 7550 1 21 . 1 1 42 42 GLU H H 42 7.805 7.805 7.689 0.116 18703 7551 1 21 . 1 1 43 43 GLU N N 43 117.120 117.120 117.971 -0.851 18703 7552 1 21 . 1 1 43 43 GLU HA H 43 4.291 4.291 4.180 0.111 18703 7553 1 21 . 1 1 43 43 GLU C C 43 177.551 177.551 177.477 0.074 18703 7554 1 21 . 1 1 43 43 GLU CA C 43 56.800 56.800 56.819 -0.019 18703 7555 1 21 . 1 1 43 43 GLU CB C 43 29.931 29.931 29.584 0.347 18703 7556 1 21 . 1 1 43 43 GLU H H 43 7.701 7.701 7.617 0.084 18703 7557 1 21 . 1 1 44 44 LEU N N 44 120.940 120.940 121.015 -0.075 18703 7558 1 21 . 1 1 44 44 LEU HA H 44 4.251 4.251 4.056 0.195 18703 7559 1 21 . 1 1 44 44 LEU C C 44 178.596 178.596 176.838 1.758 18703 7560 1 21 . 1 1 44 44 LEU CA C 44 56.448 56.448 55.422 1.026 18703 7561 1 21 . 1 1 44 44 LEU CB C 44 42.519 42.519 42.498 0.021 18703 7562 1 21 . 1 1 44 44 LEU H H 44 7.581 7.581 7.357 0.224 18703 7563 1 21 . 1 1 45 45 GLY N N 45 108.689 108.689 108.398 0.291 18703 7564 1 21 . 1 1 45 45 GLY C C 45 174.853 174.853 173.624 1.229 18703 7565 1 21 . 1 1 45 45 GLY CA C 45 46.233 46.233 45.209 1.024 18703 7566 1 21 . 1 1 45 45 GLY H H 45 8.232 8.232 8.240 -0.008 18703 7567 1 21 . 1 1 46 46 GLY N N 46 108.029 108.029 108.253 -0.224 18703 7568 1 21 . 1 1 46 46 GLY C C 46 174.351 174.351 174.172 0.179 18703 7569 1 21 . 1 1 46 46 GLY CA C 46 45.105 45.105 45.593 -0.488 18703 7570 1 21 . 1 1 46 46 GLY H H 46 8.176 8.176 8.032 0.144 18703 7571 1 21 . 1 1 47 47 GLY N N 47 108.183 108.183 107.931 0.252 18703 7572 1 21 . 1 1 47 47 GLY C C 47 174.671 174.671 175.627 -0.956 18703 7573 1 21 . 1 1 47 47 GLY CA C 47 45.254 45.254 45.707 -0.453 18703 7574 1 21 . 1 1 47 47 GLY H H 47 8.290 8.290 8.880 -0.590 18703 7575 1 21 . 1 1 48 48 GLY N N 48 108.616 108.616 109.041 -0.425 18703 7576 1 21 . 1 1 48 48 GLY C C 48 174.321 174.321 175.359 -1.038 18703 7577 1 21 . 1 1 48 48 GLY CA C 48 45.192 45.192 44.744 0.448 18703 7578 1 21 . 1 1 48 48 GLY H H 48 8.027 8.027 7.994 0.033 18703 7579 1 21 . 1 1 49 49 GLU N N 49 121.057 121.057 121.686 -0.629 18703 7580 1 21 . 1 1 49 49 GLU HA H 49 4.425 4.425 4.235 0.190 18703 7581 1 21 . 1 1 49 49 GLU C C 49 177.072 177.072 178.028 -0.956 18703 7582 1 21 . 1 1 49 49 GLU CA C 49 56.330 56.330 57.721 -1.391 18703 7583 1 21 . 1 1 49 49 GLU CB C 49 29.602 29.602 29.557 0.045 18703 7584 1 21 . 1 1 49 49 GLU H H 49 8.486 8.486 8.835 -0.349 18703 7585 1 21 . 1 1 50 50 VAL N N 50 122.122 122.122 120.525 1.597 18703 7586 1 21 . 1 1 50 50 VAL HA H 50 3.792 3.792 3.644 0.148 18703 7587 1 21 . 1 1 50 50 VAL C C 50 176.774 176.774 177.527 -0.753 18703 7588 1 21 . 1 1 50 50 VAL CA C 50 64.864 64.864 65.277 -0.413 18703 7589 1 21 . 1 1 50 50 VAL CB C 50 32.179 32.179 31.201 0.978 18703 7590 1 21 . 1 1 50 50 VAL H H 50 8.095 8.095 7.950 0.145 18703 7591 1 21 . 1 1 51 51 LYS N N 51 120.602 120.602 118.599 2.003 18703 7592 1 21 . 1 1 51 51 LYS HA H 51 4.195 4.195 4.107 0.088 18703 7593 1 21 . 1 1 51 51 LYS C C 51 178.530 178.530 178.556 -0.026 18703 7594 1 21 . 1 1 51 51 LYS CA C 51 59.348 59.348 58.627 0.721 18703 7595 1 21 . 1 1 51 51 LYS CB C 51 32.265 32.265 32.292 -0.027 18703 7596 1 21 . 1 1 51 51 LYS H H 51 8.268 8.268 7.644 0.624 18703 7597 1 21 . 1 1 52 52 LYS N N 52 117.547 117.547 120.498 -2.951 18703 7598 1 21 . 1 1 52 52 LYS HA H 52 4.162 4.162 4.073 0.089 18703 7599 1 21 . 1 1 52 52 LYS C C 52 179.132 179.132 178.665 0.467 18703 7600 1 21 . 1 1 52 52 LYS CA C 52 58.811 58.811 59.448 -0.637 18703 7601 1 21 . 1 1 52 52 LYS CB C 52 32.054 32.054 32.425 -0.371 18703 7602 1 21 . 1 1 52 52 LYS H H 52 7.595 7.595 7.998 -0.403 18703 7603 1 21 . 1 1 53 53 VAL N N 53 119.190 119.190 118.305 0.885 18703 7604 1 21 . 1 1 53 53 VAL HA H 53 3.767 3.767 3.740 0.027 18703 7605 1 21 . 1 1 53 53 VAL C C 53 177.933 177.933 178.183 -0.250 18703 7606 1 21 . 1 1 53 53 VAL CA C 53 66.065 66.065 65.544 0.521 18703 7607 1 21 . 1 1 53 53 VAL CB C 53 31.248 31.248 30.754 0.494 18703 7608 1 21 . 1 1 53 53 VAL H H 53 7.597 7.597 7.579 0.018 18703 7609 1 21 . 1 1 54 54 GLU N N 54 120.226 120.226 119.464 0.762 18703 7610 1 21 . 1 1 54 54 GLU HA H 54 3.833 3.833 4.001 -0.168 18703 7611 1 21 . 1 1 54 54 GLU C C 54 179.352 179.352 178.590 0.762 18703 7612 1 21 . 1 1 54 54 GLU CA C 54 59.153 59.153 59.523 -0.370 18703 7613 1 21 . 1 1 54 54 GLU CB C 54 29.224 29.224 29.387 -0.162 18703 7614 1 21 . 1 1 54 54 GLU H H 54 8.609 8.609 7.747 0.862 18703 7615 1 21 . 1 1 55 55 GLU N N 55 119.148 119.148 119.149 -0.001 18703 7616 1 21 . 1 1 55 55 GLU HA H 55 4.084 4.084 4.104 -0.020 18703 7617 1 21 . 1 1 55 55 GLU C C 55 179.084 179.084 178.862 0.222 18703 7618 1 21 . 1 1 55 55 GLU CA C 55 59.295 59.295 59.051 0.244 18703 7619 1 21 . 1 1 55 55 GLU CB C 55 29.361 29.361 29.651 -0.289 18703 7620 1 21 . 1 1 55 55 GLU H H 55 7.713 7.713 7.811 -0.098 18703 7621 1 21 . 1 1 56 56 GLU N N 56 120.301 120.301 118.983 1.318 18703 7622 1 21 . 1 1 56 56 GLU HA H 56 4.079 4.079 4.140 -0.061 18703 7623 1 21 . 1 1 56 56 GLU C C 56 179.773 179.773 179.398 0.375 18703 7624 1 21 . 1 1 56 56 GLU CA C 56 59.528 59.528 59.024 0.504 18703 7625 1 21 . 1 1 56 56 GLU CB C 56 30.162 30.162 29.798 0.364 18703 7626 1 21 . 1 1 56 56 GLU H H 56 7.899 7.899 7.580 0.319 18703 7627 1 21 . 1 1 57 57 VAL N N 57 121.536 121.536 119.622 1.914 18703 7628 1 21 . 1 1 57 57 VAL HA H 57 3.540 3.540 3.795 -0.255 18703 7629 1 21 . 1 1 57 57 VAL C C 57 176.984 176.984 177.531 -0.547 18703 7630 1 21 . 1 1 57 57 VAL CA C 57 66.734 66.734 65.582 1.152 18703 7631 1 21 . 1 1 57 57 VAL CB C 57 31.425 31.425 31.590 -0.165 18703 7632 1 21 . 1 1 57 57 VAL H H 57 8.652 8.652 7.524 1.128 18703 7633 1 21 . 1 1 58 58 LYS N N 58 120.219 120.219 119.821 0.398 18703 7634 1 21 . 1 1 58 58 LYS HA H 58 4.199 4.199 4.116 0.083 18703 7635 1 21 . 1 1 58 58 LYS C C 58 178.972 178.972 178.500 0.472 18703 7636 1 21 . 1 1 58 58 LYS CA C 58 59.357 59.357 59.531 -0.174 18703 7637 1 21 . 1 1 58 58 LYS CB C 58 32.186 32.186 32.315 -0.129 18703 7638 1 21 . 1 1 58 58 LYS H H 58 7.791 7.791 7.510 0.281 18703 7639 1 21 . 1 1 59 59 LYS N N 59 118.252 118.252 119.863 -1.611 18703 7640 1 21 . 1 1 59 59 LYS HA H 59 4.069 4.069 4.143 -0.074 18703 7641 1 21 . 1 1 59 59 LYS C C 59 179.180 179.180 178.342 0.838 18703 7642 1 21 . 1 1 59 59 LYS CA C 59 59.285 59.285 59.198 0.087 18703 7643 1 21 . 1 1 59 59 LYS CB C 59 32.345 32.345 32.415 -0.070 18703 7644 1 21 . 1 1 59 59 LYS H H 59 7.849 7.849 7.534 0.315 18703 7645 1 21 . 1 1 60 60 LEU N N 60 121.243 121.243 119.712 1.531 18703 7646 1 21 . 1 1 60 60 LEU HA H 60 4.242 4.242 4.140 0.102 18703 7647 1 21 . 1 1 60 60 LEU C C 60 178.413 178.413 178.174 0.239 18703 7648 1 21 . 1 1 60 60 LEU CA C 60 57.798 57.798 57.286 0.512 18703 7649 1 21 . 1 1 60 60 LEU CB C 60 41.150 41.150 42.255 -1.105 18703 7650 1 21 . 1 1 60 60 LEU H H 60 7.825 7.825 7.552 0.273 18703 7651 1 21 . 1 1 61 61 GLU N N 61 118.844 118.844 119.869 -1.025 18703 7652 1 21 . 1 1 61 61 GLU HA H 61 3.800 3.800 3.945 -0.145 18703 7653 1 21 . 1 1 61 61 GLU C C 61 179.078 179.078 178.551 0.527 18703 7654 1 21 . 1 1 61 61 GLU CA C 61 60.104 60.104 59.837 0.267 18703 7655 1 21 . 1 1 61 61 GLU CB C 61 29.864 29.864 29.663 0.201 18703 7656 1 21 . 1 1 61 61 GLU H H 61 8.582 8.582 7.731 0.851 18703 7657 1 21 . 1 1 62 62 GLU N N 62 117.659 117.659 118.598 -0.939 18703 7658 1 21 . 1 1 62 62 GLU HA H 62 3.990 3.990 4.076 -0.086 18703 7659 1 21 . 1 1 62 62 GLU C C 62 178.847 178.847 178.881 -0.034 18703 7660 1 21 . 1 1 62 62 GLU CA C 62 59.067 59.067 58.835 0.232 18703 7661 1 21 . 1 1 62 62 GLU CB C 62 29.440 29.440 29.713 -0.273 18703 7662 1 21 . 1 1 62 62 GLU H H 62 8.032 8.032 7.607 0.425 18703 7663 1 21 . 1 1 63 63 GLU N N 63 119.290 119.290 119.603 -0.313 18703 7664 1 21 . 1 1 63 63 GLU HA H 63 4.012 4.012 4.092 -0.080 18703 7665 1 21 . 1 1 63 63 GLU C C 63 179.784 179.784 179.366 0.418 18703 7666 1 21 . 1 1 63 63 GLU CA C 63 59.300 59.300 59.172 0.127 18703 7667 1 21 . 1 1 63 63 GLU CB C 63 29.728 29.728 29.494 0.234 18703 7668 1 21 . 1 1 63 63 GLU H H 63 7.958 7.958 7.442 0.516 18703 7669 1 21 . 1 1 64 64 ILE N N 64 118.453 118.453 119.133 -0.680 18703 7670 1 21 . 1 1 64 64 ILE HA H 64 3.711 3.711 3.725 -0.014 18703 7671 1 21 . 1 1 64 64 ILE C C 64 177.655 177.655 177.688 -0.033 18703 7672 1 21 . 1 1 64 64 ILE CA C 64 64.256 64.256 64.141 0.115 18703 7673 1 21 . 1 1 64 64 ILE CB C 64 38.002 38.002 37.552 0.450 18703 7674 1 21 . 1 1 64 64 ILE H H 64 8.160 8.160 7.557 0.603 18703 7675 1 21 . 1 1 65 65 LYS N N 65 118.871 118.871 117.538 1.333 18703 7676 1 21 . 1 1 65 65 LYS HA H 65 4.111 4.111 4.064 0.047 18703 7677 1 21 . 1 1 65 65 LYS C C 65 177.076 177.076 178.111 -1.035 18703 7678 1 21 . 1 1 65 65 LYS CA C 65 58.421 58.421 58.428 -0.007 18703 7679 1 21 . 1 1 65 65 LYS CB C 65 32.639 32.639 32.086 0.553 18703 7680 1 21 . 1 1 65 65 LYS H H 65 7.664 7.664 7.554 0.110 18703 7681 1 21 . 1 1 66 66 LYS N N 66 116.944 116.944 117.953 -1.009 18703 7682 1 21 . 1 1 66 66 LYS HA H 66 4.320 4.320 4.127 0.193 18703 7683 1 21 . 1 1 66 66 LYS C C 66 175.897 175.897 177.120 -1.223 18703 7684 1 21 . 1 1 66 66 LYS CA C 66 56.352 56.352 57.880 -1.528 18703 7685 1 21 . 1 1 66 66 LYS CB C 66 33.024 33.024 33.170 -0.146 18703 7686 1 21 . 1 1 66 66 LYS H H 66 7.246 7.246 7.906 -0.660 18703 7687 1 22 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.331 -0.085 18703 7688 1 22 . 1 1 3 3 ARG C C 3 178.379 178.379 178.245 0.134 18703 7689 1 22 . 1 1 3 3 ARG CA C 3 58.367 58.367 57.892 0.475 18703 7690 1 22 . 1 1 3 3 ARG CB C 3 30.691 30.691 30.573 0.118 18703 7691 1 22 . 1 1 3 3 ARG H H 3 7.905 7.905 8.671 -0.766 18703 7692 1 22 . 1 1 4 4 VAL N N 4 118.966 118.966 120.413 -1.447 18703 7693 1 22 . 1 1 4 4 VAL HA H 4 3.803 3.803 3.736 0.067 18703 7694 1 22 . 1 1 4 4 VAL C C 4 176.968 176.968 177.406 -0.438 18703 7695 1 22 . 1 1 4 4 VAL CA C 4 65.441 65.441 65.475 -0.034 18703 7696 1 22 . 1 1 4 4 VAL CB C 4 31.710 31.710 31.560 0.150 18703 7697 1 22 . 1 1 4 4 VAL H H 4 8.070 8.070 8.274 -0.204 18703 7698 1 22 . 1 1 5 5 LYS N N 5 122.058 122.058 119.269 2.789 18703 7699 1 22 . 1 1 5 5 LYS HA H 5 4.154 4.154 3.969 0.185 18703 7700 1 22 . 1 1 5 5 LYS C C 5 178.553 178.553 178.452 0.101 18703 7701 1 22 . 1 1 5 5 LYS CA C 5 58.712 58.712 59.603 -0.891 18703 7702 1 22 . 1 1 5 5 LYS CB C 5 31.788 31.788 32.127 -0.339 18703 7703 1 22 . 1 1 5 5 LYS H H 5 7.798 7.798 8.422 -0.624 18703 7704 1 22 . 1 1 6 6 ALA N N 6 119.955 119.955 120.556 -0.601 18703 7705 1 22 . 1 1 6 6 ALA HA H 6 4.198 4.198 4.208 -0.010 18703 7706 1 22 . 1 1 6 6 ALA C C 6 180.974 180.974 179.448 1.526 18703 7707 1 22 . 1 1 6 6 ALA CA C 6 54.850 54.850 54.315 0.535 18703 7708 1 22 . 1 1 6 6 ALA CB C 6 17.995 17.995 18.368 -0.373 18703 7709 1 22 . 1 1 6 6 ALA H H 6 7.928 7.928 7.565 0.363 18703 7710 1 22 . 1 1 7 7 LEU N N 7 119.211 119.211 119.672 -0.461 18703 7711 1 22 . 1 1 7 7 LEU HA H 7 4.124 4.124 3.982 0.141 18703 7712 1 22 . 1 1 7 7 LEU C C 7 178.353 178.353 178.506 -0.153 18703 7713 1 22 . 1 1 7 7 LEU CA C 7 57.658 57.658 57.262 0.396 18703 7714 1 22 . 1 1 7 7 LEU CB C 7 41.971 41.971 42.057 -0.086 18703 7715 1 22 . 1 1 7 7 LEU H H 7 7.594 7.594 7.718 -0.124 18703 7716 1 22 . 1 1 8 8 GLU N N 8 120.258 120.258 118.044 2.214 18703 7717 1 22 . 1 1 8 8 GLU HA H 8 3.846 3.846 4.016 -0.170 18703 7718 1 22 . 1 1 8 8 GLU C C 8 179.546 179.546 178.811 0.735 18703 7719 1 22 . 1 1 8 8 GLU CA C 8 60.006 60.006 59.498 0.508 18703 7720 1 22 . 1 1 8 8 GLU CB C 8 29.683 29.683 29.534 0.149 18703 7721 1 22 . 1 1 8 8 GLU H H 8 8.382 8.382 7.807 0.575 18703 7722 1 22 . 1 1 9 9 GLU N N 9 118.584 118.584 118.672 -0.088 18703 7723 1 22 . 1 1 9 9 GLU HA H 9 4.039 4.039 4.141 -0.102 18703 7724 1 22 . 1 1 9 9 GLU C C 9 179.635 179.635 178.632 1.003 18703 7725 1 22 . 1 1 9 9 GLU CA C 9 59.235 59.235 58.600 0.635 18703 7726 1 22 . 1 1 9 9 GLU CB C 9 29.358 29.358 29.267 0.091 18703 7727 1 22 . 1 1 9 9 GLU H H 9 7.908 7.908 7.732 0.176 18703 7728 1 22 . 1 1 10 10 LYS N N 10 120.956 120.956 120.362 0.594 18703 7729 1 22 . 1 1 10 10 LYS HA H 10 4.190 4.190 4.135 0.055 18703 7730 1 22 . 1 1 10 10 LYS C C 10 179.395 179.395 178.991 0.404 18703 7731 1 22 . 1 1 10 10 LYS CA C 10 59.231 59.231 59.306 -0.075 18703 7732 1 22 . 1 1 10 10 LYS CB C 10 32.211 32.211 32.701 -0.490 18703 7733 1 22 . 1 1 10 10 LYS H H 10 8.009 8.009 7.381 0.628 18703 7734 1 22 . 1 1 11 11 VAL N N 11 119.577 119.577 118.013 1.564 18703 7735 1 22 . 1 1 11 11 VAL HA H 11 3.844 3.844 3.709 0.135 18703 7736 1 22 . 1 1 11 11 VAL C C 11 177.078 177.078 177.567 -0.489 18703 7737 1 22 . 1 1 11 11 VAL CA C 11 66.407 66.407 66.142 0.265 18703 7738 1 22 . 1 1 11 11 VAL CB C 11 31.252 31.252 31.222 0.030 18703 7739 1 22 . 1 1 11 11 VAL H H 11 8.488 8.488 7.468 1.020 18703 7740 1 22 . 1 1 12 12 LYS N N 12 122.864 122.864 119.473 3.391 18703 7741 1 22 . 1 1 12 12 LYS HA H 12 4.189 4.189 3.983 0.206 18703 7742 1 22 . 1 1 12 12 LYS C C 12 178.755 178.755 178.317 0.438 18703 7743 1 22 . 1 1 12 12 LYS CA C 12 59.375 59.375 59.457 -0.082 18703 7744 1 22 . 1 1 12 12 LYS CB C 12 31.991 31.991 32.020 -0.029 18703 7745 1 22 . 1 1 12 12 LYS H H 12 7.944 7.944 7.618 0.326 18703 7746 1 22 . 1 1 13 13 ALA N N 13 121.202 121.202 120.497 0.705 18703 7747 1 22 . 1 1 13 13 ALA HA H 13 4.209 4.209 4.245 -0.036 18703 7748 1 22 . 1 1 13 13 ALA C C 13 181.060 181.060 179.650 1.410 18703 7749 1 22 . 1 1 13 13 ALA CA C 13 54.710 54.710 54.200 0.510 18703 7750 1 22 . 1 1 13 13 ALA CB C 13 17.861 17.861 18.346 -0.485 18703 7751 1 22 . 1 1 13 13 ALA H H 13 7.563 7.563 7.470 0.093 18703 7752 1 22 . 1 1 14 14 LEU N N 14 120.014 120.014 119.759 0.255 18703 7753 1 22 . 1 1 14 14 LEU HA H 14 4.072 4.072 3.998 0.073 18703 7754 1 22 . 1 1 14 14 LEU C C 14 177.862 177.862 178.150 -0.288 18703 7755 1 22 . 1 1 14 14 LEU CA C 14 57.864 57.864 57.619 0.245 18703 7756 1 22 . 1 1 14 14 LEU CB C 14 41.539 41.539 42.149 -0.610 18703 7757 1 22 . 1 1 14 14 LEU H H 14 8.087 8.087 7.495 0.592 18703 7758 1 22 . 1 1 15 15 GLU N N 15 121.644 121.644 119.867 1.777 18703 7759 1 22 . 1 1 15 15 GLU HA H 15 3.692 3.692 4.006 -0.314 18703 7760 1 22 . 1 1 15 15 GLU C C 15 177.819 177.819 178.279 -0.460 18703 7761 1 22 . 1 1 15 15 GLU CA C 15 59.239 59.239 59.317 -0.078 18703 7762 1 22 . 1 1 15 15 GLU CB C 15 28.865 28.865 29.557 -0.692 18703 7763 1 22 . 1 1 15 15 GLU H H 15 8.542 8.542 7.681 0.861 18703 7764 1 22 . 1 1 16 16 GLU N N 16 116.016 116.016 118.715 -2.699 18703 7765 1 22 . 1 1 16 16 GLU HA H 16 3.955 3.955 4.003 -0.048 18703 7766 1 22 . 1 1 16 16 GLU C C 16 179.159 179.159 179.162 -0.003 18703 7767 1 22 . 1 1 16 16 GLU CA C 16 59.324 59.324 59.252 0.072 18703 7768 1 22 . 1 1 16 16 GLU CB C 16 29.060 29.060 29.123 -0.064 18703 7769 1 22 . 1 1 16 16 GLU H H 16 7.492 7.492 7.888 -0.396 18703 7770 1 22 . 1 1 17 17 LYS N N 17 118.546 118.546 119.235 -0.689 18703 7771 1 22 . 1 1 17 17 LYS HA H 17 4.117 4.117 4.136 -0.019 18703 7772 1 22 . 1 1 17 17 LYS C C 17 178.976 178.976 179.022 -0.046 18703 7773 1 22 . 1 1 17 17 LYS CA C 17 58.837 58.837 58.933 -0.096 18703 7774 1 22 . 1 1 17 17 LYS CB C 17 32.538 32.538 32.603 -0.065 18703 7775 1 22 . 1 1 17 17 LYS H H 17 7.720 7.720 7.413 0.307 18703 7776 1 22 . 1 1 18 18 VAL N N 18 118.376 118.376 119.148 -0.772 18703 7777 1 22 . 1 1 18 18 VAL HA H 18 3.711 3.711 3.621 0.090 18703 7778 1 22 . 1 1 18 18 VAL C C 18 178.765 178.765 178.520 0.245 18703 7779 1 22 . 1 1 18 18 VAL CA C 18 66.237 66.237 66.830 -0.593 18703 7780 1 22 . 1 1 18 18 VAL CB C 18 31.682 31.682 31.796 -0.114 18703 7781 1 22 . 1 1 18 18 VAL H H 18 8.754 8.754 7.461 1.293 18703 7782 1 22 . 1 1 19 19 LYS N N 19 118.817 118.817 119.359 -0.542 18703 7783 1 22 . 1 1 19 19 LYS HA H 19 4.078 4.078 3.950 0.128 18703 7784 1 22 . 1 1 19 19 LYS C C 19 178.049 178.049 177.263 0.786 18703 7785 1 22 . 1 1 19 19 LYS CA C 19 59.731 59.731 59.302 0.429 18703 7786 1 22 . 1 1 19 19 LYS CB C 19 32.523 32.523 32.061 0.462 18703 7787 1 22 . 1 1 19 19 LYS H H 19 8.299 8.299 8.597 -0.298 18703 7788 1 22 . 1 1 20 20 ALA N N 20 119.656 119.656 118.879 0.777 18703 7789 1 22 . 1 1 20 20 ALA HA H 20 4.347 4.347 4.369 -0.022 18703 7790 1 22 . 1 1 20 20 ALA C C 20 178.532 178.532 178.444 0.088 18703 7791 1 22 . 1 1 20 20 ALA CA C 20 52.853 52.853 52.748 0.105 18703 7792 1 22 . 1 1 20 20 ALA CB C 20 18.832 18.832 19.053 -0.221 18703 7793 1 22 . 1 1 20 20 ALA H H 20 7.425 7.425 7.468 -0.043 18703 7794 1 22 . 1 1 21 21 LEU N N 21 118.594 118.594 119.970 -1.376 18703 7795 1 22 . 1 1 21 21 LEU HA H 21 4.297 4.297 4.095 0.202 18703 7796 1 22 . 1 1 21 21 LEU C C 21 177.784 177.784 177.746 0.038 18703 7797 1 22 . 1 1 21 21 LEU CA C 21 55.750 55.750 56.150 -0.400 18703 7798 1 22 . 1 1 21 21 LEU CB C 21 42.898 42.898 42.727 0.171 18703 7799 1 22 . 1 1 21 21 LEU H H 21 7.508 7.508 7.839 -0.331 18703 7800 1 22 . 1 1 22 22 GLY N N 22 106.650 106.650 105.383 1.267 18703 7801 1 22 . 1 1 22 22 GLY C C 22 173.605 173.605 173.549 0.056 18703 7802 1 22 . 1 1 22 22 GLY CA C 22 45.330 45.330 44.247 1.083 18703 7803 1 22 . 1 1 22 22 GLY H H 22 7.814 7.814 7.920 -0.106 18703 7804 1 22 . 1 1 23 23 GLY N N 23 108.011 108.011 107.883 0.128 18703 7805 1 22 . 1 1 23 23 GLY C C 23 174.061 174.061 172.976 1.085 18703 7806 1 22 . 1 1 23 23 GLY CA C 23 44.772 44.772 44.637 0.135 18703 7807 1 22 . 1 1 23 23 GLY H H 23 8.139 8.139 8.245 -0.106 18703 7808 1 22 . 1 1 24 24 GLY N N 24 107.826 107.826 106.550 1.276 18703 7809 1 22 . 1 1 24 24 GLY C C 24 175.046 175.046 173.575 1.471 18703 7810 1 22 . 1 1 24 24 GLY CA C 24 44.422 44.422 44.330 0.093 18703 7811 1 22 . 1 1 24 24 GLY H H 24 8.497 8.497 8.016 0.481 18703 7812 1 22 . 1 1 25 25 GLY N N 25 108.830 108.830 108.992 -0.162 18703 7813 1 22 . 1 1 25 25 GLY C C 25 176.272 176.272 175.856 0.416 18703 7814 1 22 . 1 1 25 25 GLY CA C 25 47.101 47.101 45.905 1.196 18703 7815 1 22 . 1 1 25 25 GLY H H 25 8.616 8.616 8.065 0.551 18703 7816 1 22 . 1 1 26 26 ARG N N 26 123.109 123.109 124.235 -1.126 18703 7817 1 22 . 1 1 26 26 ARG HA H 26 4.283 4.283 4.143 0.140 18703 7818 1 22 . 1 1 26 26 ARG C C 26 177.848 177.848 178.513 -0.665 18703 7819 1 22 . 1 1 26 26 ARG CA C 26 57.663 57.663 58.276 -0.613 18703 7820 1 22 . 1 1 26 26 ARG CB C 26 29.811 29.811 30.023 -0.212 18703 7821 1 22 . 1 1 26 26 ARG H H 26 8.770 8.770 8.145 0.625 18703 7822 1 22 . 1 1 27 27 ILE N N 27 118.104 118.104 119.214 -1.110 18703 7823 1 22 . 1 1 27 27 ILE HA H 27 3.787 3.787 3.698 0.089 18703 7824 1 22 . 1 1 27 27 ILE C C 27 177.473 177.473 177.959 -0.486 18703 7825 1 22 . 1 1 27 27 ILE CA C 27 63.036 63.036 64.946 -1.910 18703 7826 1 22 . 1 1 27 27 ILE CB C 27 36.664 36.664 37.614 -0.950 18703 7827 1 22 . 1 1 27 27 ILE H H 27 7.708 7.708 8.439 -0.731 18703 7828 1 22 . 1 1 28 28 GLU N N 28 119.934 119.934 119.430 0.504 18703 7829 1 22 . 1 1 28 28 GLU HA H 28 3.954 3.954 3.868 0.086 18703 7830 1 22 . 1 1 28 28 GLU C C 28 179.514 179.514 178.747 0.767 18703 7831 1 22 . 1 1 28 28 GLU CA C 28 59.450 59.450 60.001 -0.551 18703 7832 1 22 . 1 1 28 28 GLU CB C 28 29.600 29.600 29.268 0.332 18703 7833 1 22 . 1 1 28 28 GLU H H 28 7.872 7.872 8.169 -0.297 18703 7834 1 22 . 1 1 29 29 GLU N N 29 118.134 118.134 119.551 -1.417 18703 7835 1 22 . 1 1 29 29 GLU HA H 29 4.028 4.028 4.083 -0.055 18703 7836 1 22 . 1 1 29 29 GLU C C 29 179.182 179.182 179.050 0.132 18703 7837 1 22 . 1 1 29 29 GLU CA C 29 59.173 59.173 58.958 0.215 18703 7838 1 22 . 1 1 29 29 GLU CB C 29 29.503 29.503 29.398 0.105 18703 7839 1 22 . 1 1 29 29 GLU H H 29 8.166 8.166 7.629 0.537 18703 7840 1 22 . 1 1 30 30 LEU N N 30 120.242 120.242 117.372 2.870 18703 7841 1 22 . 1 1 30 30 LEU HA H 30 4.028 4.028 4.147 -0.119 18703 7842 1 22 . 1 1 30 30 LEU C C 30 178.796 178.796 178.713 0.083 18703 7843 1 22 . 1 1 30 30 LEU CA C 30 57.654 57.654 57.200 0.454 18703 7844 1 22 . 1 1 30 30 LEU CB C 30 41.629 41.629 41.879 -0.250 18703 7845 1 22 . 1 1 30 30 LEU H H 30 7.695 7.695 7.473 0.222 18703 7846 1 22 . 1 1 31 31 LYS N N 31 120.506 120.506 119.725 0.781 18703 7847 1 22 . 1 1 31 31 LYS HA H 31 3.532 3.532 4.078 -0.546 18703 7848 1 22 . 1 1 31 31 LYS C C 31 178.919 178.919 178.281 0.638 18703 7849 1 22 . 1 1 31 31 LYS CA C 31 60.240 60.240 59.153 1.087 18703 7850 1 22 . 1 1 31 31 LYS CB C 31 32.015 32.015 32.398 -0.383 18703 7851 1 22 . 1 1 31 31 LYS H H 31 8.561 8.561 7.658 0.903 18703 7852 1 22 . 1 1 32 32 LYS N N 32 118.566 118.566 119.186 -0.620 18703 7853 1 22 . 1 1 32 32 LYS C C 32 179.392 179.392 179.036 0.356 18703 7854 1 22 . 1 1 32 32 LYS CA C 32 59.356 59.356 59.432 -0.076 18703 7855 1 22 . 1 1 32 32 LYS CB C 32 32.117 32.117 32.215 -0.098 18703 7856 1 22 . 1 1 32 32 LYS H H 32 7.699 7.699 7.501 0.198 18703 7857 1 22 . 1 1 33 33 LYS N N 33 118.964 118.964 118.190 0.774 18703 7858 1 22 . 1 1 33 33 LYS HA H 33 4.117 4.117 4.082 0.035 18703 7859 1 22 . 1 1 33 33 LYS C C 33 178.355 178.355 178.987 -0.632 18703 7860 1 22 . 1 1 33 33 LYS CA C 33 58.633 58.633 59.276 -0.643 18703 7861 1 22 . 1 1 33 33 LYS CB C 33 31.904 31.904 32.303 -0.399 18703 7862 1 22 . 1 1 33 33 LYS H H 33 7.752 7.752 7.643 0.109 18703 7863 1 22 . 1 1 34 34 CYS N N 34 119.956 119.956 118.357 1.599 18703 7864 1 22 . 1 1 34 34 CYS HA H 34 3.967 3.967 4.088 -0.121 18703 7865 1 22 . 1 1 34 34 CYS C C 34 175.521 175.521 176.883 -1.362 18703 7866 1 22 . 1 1 34 34 CYS CA C 34 60.987 60.987 63.029 -2.042 18703 7867 1 22 . 1 1 34 34 CYS CB C 34 36.600 36.600 26.553 10.047 18703 7868 1 22 . 1 1 34 34 CYS H H 34 8.393 8.393 7.802 0.591 18703 7869 1 22 . 1 1 35 35 GLU N N 35 120.327 120.327 119.765 0.562 18703 7870 1 22 . 1 1 35 35 GLU HA H 35 3.891 3.891 3.918 -0.027 18703 7871 1 22 . 1 1 35 35 GLU C C 35 179.684 179.684 178.654 1.030 18703 7872 1 22 . 1 1 35 35 GLU CA C 35 60.059 60.059 59.359 0.700 18703 7873 1 22 . 1 1 35 35 GLU CB C 35 29.718 29.718 28.799 0.919 18703 7874 1 22 . 1 1 35 35 GLU H H 35 8.558 8.558 7.756 0.802 18703 7875 1 22 . 1 1 36 36 GLU N N 36 120.190 120.190 119.933 0.257 18703 7876 1 22 . 1 1 36 36 GLU HA H 36 4.051 4.051 3.996 0.055 18703 7877 1 22 . 1 1 36 36 GLU C C 36 179.408 179.408 178.981 0.427 18703 7878 1 22 . 1 1 36 36 GLU CA C 36 59.148 59.148 59.060 0.088 18703 7879 1 22 . 1 1 36 36 GLU CB C 36 29.766 29.766 29.724 0.042 18703 7880 1 22 . 1 1 36 36 GLU H H 36 8.038 8.038 7.610 0.428 18703 7881 1 22 . 1 1 37 37 LEU N N 37 121.102 121.102 119.563 1.539 18703 7882 1 22 . 1 1 37 37 LEU HA H 37 4.079 4.079 4.199 -0.120 18703 7883 1 22 . 1 1 37 37 LEU C C 37 178.279 178.279 178.342 -0.063 18703 7884 1 22 . 1 1 37 37 LEU CA C 37 57.803 57.803 57.428 0.375 18703 7885 1 22 . 1 1 37 37 LEU CB C 37 41.502 41.502 41.722 -0.220 18703 7886 1 22 . 1 1 37 37 LEU H H 37 8.065 8.065 7.477 0.588 18703 7887 1 22 . 1 1 38 38 LYS N N 38 119.980 119.980 119.162 0.818 18703 7888 1 22 . 1 1 38 38 LYS HA H 38 3.851 3.851 3.867 -0.016 18703 7889 1 22 . 1 1 38 38 LYS C C 38 178.919 178.919 179.142 -0.223 18703 7890 1 22 . 1 1 38 38 LYS CA C 38 60.794 60.794 60.153 0.641 18703 7891 1 22 . 1 1 38 38 LYS CB C 38 32.863 32.863 32.194 0.669 18703 7892 1 22 . 1 1 38 38 LYS H H 38 8.741 8.741 7.972 0.769 18703 7893 1 22 . 1 1 39 39 LYS N N 39 118.307 118.307 117.428 0.879 18703 7894 1 22 . 1 1 39 39 LYS HA H 39 4.125 4.125 3.990 0.135 18703 7895 1 22 . 1 1 39 39 LYS C C 39 178.622 178.622 178.488 0.134 18703 7896 1 22 . 1 1 39 39 LYS CA C 39 58.993 58.993 58.995 -0.002 18703 7897 1 22 . 1 1 39 39 LYS CB C 39 32.097 32.097 31.826 0.272 18703 7898 1 22 . 1 1 39 39 LYS H H 39 7.584 7.584 7.737 -0.153 18703 7899 1 22 . 1 1 40 40 LYS N N 40 118.826 118.826 119.599 -0.773 18703 7900 1 22 . 1 1 40 40 LYS HA H 40 4.069 4.069 4.179 -0.110 18703 7901 1 22 . 1 1 40 40 LYS C C 40 179.802 179.802 178.772 1.030 18703 7902 1 22 . 1 1 40 40 LYS CA C 40 59.322 59.322 58.251 1.071 18703 7903 1 22 . 1 1 40 40 LYS CB C 40 32.505 32.505 32.092 0.413 18703 7904 1 22 . 1 1 40 40 LYS H H 40 7.945 7.945 7.375 0.570 18703 7905 1 22 . 1 1 41 41 ILE N N 41 118.958 118.958 119.210 -0.252 18703 7906 1 22 . 1 1 41 41 ILE HA H 41 3.659 3.659 3.814 -0.155 18703 7907 1 22 . 1 1 41 41 ILE C C 41 178.146 178.146 177.870 0.276 18703 7908 1 22 . 1 1 41 41 ILE CA C 41 65.037 65.037 64.233 0.804 18703 7909 1 22 . 1 1 41 41 ILE CB C 41 37.950 37.950 37.768 0.182 18703 7910 1 22 . 1 1 41 41 ILE H H 41 8.369 8.369 8.109 0.260 18703 7911 1 22 . 1 1 42 42 GLU N N 42 120.331 120.331 118.786 1.545 18703 7912 1 22 . 1 1 42 42 GLU HA H 42 4.094 4.094 4.061 0.033 18703 7913 1 22 . 1 1 42 42 GLU C C 42 178.697 178.697 177.750 0.947 18703 7914 1 22 . 1 1 42 42 GLU CA C 42 58.927 58.927 59.104 -0.177 18703 7915 1 22 . 1 1 42 42 GLU CB C 42 29.399 29.399 29.958 -0.559 18703 7916 1 22 . 1 1 42 42 GLU H H 42 7.805 7.805 7.696 0.109 18703 7917 1 22 . 1 1 43 43 GLU N N 43 117.120 117.120 116.522 0.598 18703 7918 1 22 . 1 1 43 43 GLU HA H 43 4.291 4.291 4.179 0.112 18703 7919 1 22 . 1 1 43 43 GLU C C 43 177.551 177.551 177.619 -0.068 18703 7920 1 22 . 1 1 43 43 GLU CA C 43 56.800 56.800 57.044 -0.244 18703 7921 1 22 . 1 1 43 43 GLU CB C 43 29.931 29.931 29.713 0.218 18703 7922 1 22 . 1 1 43 43 GLU H H 43 7.701 7.701 7.567 0.134 18703 7923 1 22 . 1 1 44 44 LEU N N 44 120.940 120.940 119.728 1.212 18703 7924 1 22 . 1 1 44 44 LEU HA H 44 4.251 4.251 3.994 0.257 18703 7925 1 22 . 1 1 44 44 LEU C C 44 178.596 178.596 177.795 0.801 18703 7926 1 22 . 1 1 44 44 LEU CA C 44 56.448 56.448 55.554 0.894 18703 7927 1 22 . 1 1 44 44 LEU CB C 44 42.519 42.519 42.394 0.126 18703 7928 1 22 . 1 1 44 44 LEU H H 44 7.581 7.581 7.334 0.247 18703 7929 1 22 . 1 1 45 45 GLY N N 45 108.689 108.689 106.870 1.819 18703 7930 1 22 . 1 1 45 45 GLY C C 45 174.853 174.853 174.505 0.348 18703 7931 1 22 . 1 1 45 45 GLY CA C 45 46.233 46.233 45.387 0.846 18703 7932 1 22 . 1 1 45 45 GLY H H 45 8.232 8.232 8.496 -0.264 18703 7933 1 22 . 1 1 46 46 GLY N N 46 108.029 108.029 108.381 -0.352 18703 7934 1 22 . 1 1 46 46 GLY C C 46 174.351 174.351 173.870 0.481 18703 7935 1 22 . 1 1 46 46 GLY CA C 46 45.105 45.105 44.712 0.393 18703 7936 1 22 . 1 1 46 46 GLY H H 46 8.176 8.176 7.845 0.331 18703 7937 1 22 . 1 1 47 47 GLY N N 47 108.183 108.183 106.839 1.344 18703 7938 1 22 . 1 1 47 47 GLY C C 47 174.671 174.671 175.312 -0.641 18703 7939 1 22 . 1 1 47 47 GLY CA C 47 45.254 45.254 44.743 0.511 18703 7940 1 22 . 1 1 47 47 GLY H H 47 8.290 8.290 8.238 0.052 18703 7941 1 22 . 1 1 48 48 GLY N N 48 108.616 108.616 109.721 -1.105 18703 7942 1 22 . 1 1 48 48 GLY C C 48 174.321 174.321 175.182 -0.861 18703 7943 1 22 . 1 1 48 48 GLY CA C 48 45.192 45.192 45.753 -0.561 18703 7944 1 22 . 1 1 48 48 GLY H H 48 8.027 8.027 8.347 -0.320 18703 7945 1 22 . 1 1 49 49 GLU N N 49 121.057 121.057 122.527 -1.470 18703 7946 1 22 . 1 1 49 49 GLU HA H 49 4.425 4.425 4.480 -0.055 18703 7947 1 22 . 1 1 49 49 GLU C C 49 177.072 177.072 178.628 -1.556 18703 7948 1 22 . 1 1 49 49 GLU CA C 49 56.330 56.330 56.428 -0.098 18703 7949 1 22 . 1 1 49 49 GLU CB C 49 29.602 29.602 30.321 -0.719 18703 7950 1 22 . 1 1 49 49 GLU H H 49 8.486 8.486 8.072 0.414 18703 7951 1 22 . 1 1 50 50 VAL N N 50 122.122 122.122 122.728 -0.606 18703 7952 1 22 . 1 1 50 50 VAL HA H 50 3.792 3.792 3.709 0.083 18703 7953 1 22 . 1 1 50 50 VAL C C 50 176.774 176.774 177.336 -0.562 18703 7954 1 22 . 1 1 50 50 VAL CA C 50 64.864 64.864 65.415 -0.551 18703 7955 1 22 . 1 1 50 50 VAL CB C 50 32.179 32.179 31.685 0.494 18703 7956 1 22 . 1 1 50 50 VAL H H 50 8.095 8.095 8.047 0.048 18703 7957 1 22 . 1 1 51 51 LYS N N 51 120.602 120.602 118.286 2.316 18703 7958 1 22 . 1 1 51 51 LYS HA H 51 4.195 4.195 4.076 0.119 18703 7959 1 22 . 1 1 51 51 LYS C C 51 178.530 178.530 178.452 0.078 18703 7960 1 22 . 1 1 51 51 LYS CA C 51 59.348 59.348 59.106 0.242 18703 7961 1 22 . 1 1 51 51 LYS CB C 51 32.265 32.265 32.106 0.159 18703 7962 1 22 . 1 1 51 51 LYS H H 51 8.268 8.268 8.307 -0.039 18703 7963 1 22 . 1 1 52 52 LYS N N 52 117.547 117.547 120.288 -2.741 18703 7964 1 22 . 1 1 52 52 LYS HA H 52 4.162 4.162 4.080 0.082 18703 7965 1 22 . 1 1 52 52 LYS C C 52 179.132 179.132 178.879 0.253 18703 7966 1 22 . 1 1 52 52 LYS CA C 52 58.811 58.811 59.380 -0.569 18703 7967 1 22 . 1 1 52 52 LYS CB C 52 32.054 32.054 32.425 -0.370 18703 7968 1 22 . 1 1 52 52 LYS H H 52 7.595 7.595 7.812 -0.217 18703 7969 1 22 . 1 1 53 53 VAL N N 53 119.190 119.190 118.323 0.867 18703 7970 1 22 . 1 1 53 53 VAL HA H 53 3.767 3.767 3.986 -0.219 18703 7971 1 22 . 1 1 53 53 VAL C C 53 177.933 177.933 178.367 -0.434 18703 7972 1 22 . 1 1 53 53 VAL CA C 53 66.065 66.065 65.471 0.595 18703 7973 1 22 . 1 1 53 53 VAL CB C 53 31.248 31.248 31.694 -0.446 18703 7974 1 22 . 1 1 53 53 VAL H H 53 7.597 7.597 7.593 0.004 18703 7975 1 22 . 1 1 54 54 GLU N N 54 120.226 120.226 119.393 0.833 18703 7976 1 22 . 1 1 54 54 GLU HA H 54 3.833 3.833 4.017 -0.184 18703 7977 1 22 . 1 1 54 54 GLU C C 54 179.352 179.352 178.405 0.947 18703 7978 1 22 . 1 1 54 54 GLU CA C 54 59.153 59.153 59.254 -0.101 18703 7979 1 22 . 1 1 54 54 GLU CB C 54 29.224 29.224 29.312 -0.088 18703 7980 1 22 . 1 1 54 54 GLU H H 54 8.609 8.609 7.697 0.912 18703 7981 1 22 . 1 1 55 55 GLU N N 55 119.148 119.148 119.153 -0.005 18703 7982 1 22 . 1 1 55 55 GLU HA H 55 4.084 4.084 4.116 -0.032 18703 7983 1 22 . 1 1 55 55 GLU C C 55 179.084 179.084 178.874 0.210 18703 7984 1 22 . 1 1 55 55 GLU CA C 55 59.295 59.295 59.033 0.262 18703 7985 1 22 . 1 1 55 55 GLU CB C 55 29.361 29.361 29.567 -0.206 18703 7986 1 22 . 1 1 55 55 GLU H H 55 7.713 7.713 7.729 -0.016 18703 7987 1 22 . 1 1 56 56 GLU N N 56 120.301 120.301 119.081 1.220 18703 7988 1 22 . 1 1 56 56 GLU HA H 56 4.079 4.079 4.122 -0.043 18703 7989 1 22 . 1 1 56 56 GLU C C 56 179.773 179.773 179.151 0.622 18703 7990 1 22 . 1 1 56 56 GLU CA C 56 59.528 59.528 59.074 0.454 18703 7991 1 22 . 1 1 56 56 GLU CB C 56 30.162 30.162 29.755 0.407 18703 7992 1 22 . 1 1 56 56 GLU H H 56 7.899 7.899 7.575 0.324 18703 7993 1 22 . 1 1 57 57 VAL N N 57 121.536 121.536 119.014 2.522 18703 7994 1 22 . 1 1 57 57 VAL HA H 57 3.540 3.540 3.809 -0.269 18703 7995 1 22 . 1 1 57 57 VAL C C 57 176.984 176.984 177.821 -0.837 18703 7996 1 22 . 1 1 57 57 VAL CA C 57 66.734 66.734 65.334 1.400 18703 7997 1 22 . 1 1 57 57 VAL CB C 57 31.425 31.425 31.672 -0.247 18703 7998 1 22 . 1 1 57 57 VAL H H 57 8.652 8.652 7.454 1.198 18703 7999 1 22 . 1 1 58 58 LYS N N 58 120.219 120.219 119.882 0.337 18703 8000 1 22 . 1 1 58 58 LYS HA H 58 4.199 4.199 4.100 0.099 18703 8001 1 22 . 1 1 58 58 LYS C C 58 178.972 178.972 178.331 0.641 18703 8002 1 22 . 1 1 58 58 LYS CA C 58 59.357 59.357 58.982 0.375 18703 8003 1 22 . 1 1 58 58 LYS CB C 58 32.186 32.186 31.919 0.267 18703 8004 1 22 . 1 1 58 58 LYS H H 58 7.791 7.791 7.458 0.333 18703 8005 1 22 . 1 1 59 59 LYS N N 59 118.252 118.252 119.989 -1.737 18703 8006 1 22 . 1 1 59 59 LYS HA H 59 4.069 4.069 4.162 -0.093 18703 8007 1 22 . 1 1 59 59 LYS C C 59 179.180 179.180 178.244 0.936 18703 8008 1 22 . 1 1 59 59 LYS CA C 59 59.285 59.285 58.926 0.359 18703 8009 1 22 . 1 1 59 59 LYS CB C 59 32.345 32.345 32.300 0.045 18703 8010 1 22 . 1 1 59 59 LYS H H 59 7.849 7.849 7.504 0.345 18703 8011 1 22 . 1 1 60 60 LEU N N 60 121.243 121.243 119.748 1.495 18703 8012 1 22 . 1 1 60 60 LEU HA H 60 4.242 4.242 4.189 0.053 18703 8013 1 22 . 1 1 60 60 LEU C C 60 178.413 178.413 178.088 0.325 18703 8014 1 22 . 1 1 60 60 LEU CA C 60 57.798 57.798 57.252 0.546 18703 8015 1 22 . 1 1 60 60 LEU CB C 60 41.150 41.150 42.185 -1.035 18703 8016 1 22 . 1 1 60 60 LEU H H 60 7.825 7.825 7.640 0.185 18703 8017 1 22 . 1 1 61 61 GLU N N 61 118.844 118.844 120.155 -1.311 18703 8018 1 22 . 1 1 61 61 GLU HA H 61 3.800 3.800 3.921 -0.121 18703 8019 1 22 . 1 1 61 61 GLU C C 61 179.078 179.078 178.591 0.487 18703 8020 1 22 . 1 1 61 61 GLU CA C 61 60.104 60.104 59.996 0.108 18703 8021 1 22 . 1 1 61 61 GLU CB C 61 29.864 29.864 29.626 0.238 18703 8022 1 22 . 1 1 61 61 GLU H H 61 8.582 8.582 7.720 0.862 18703 8023 1 22 . 1 1 62 62 GLU N N 62 117.659 117.659 118.776 -1.117 18703 8024 1 22 . 1 1 62 62 GLU HA H 62 3.990 3.990 4.060 -0.070 18703 8025 1 22 . 1 1 62 62 GLU C C 62 178.847 178.847 178.910 -0.063 18703 8026 1 22 . 1 1 62 62 GLU CA C 62 59.067 59.067 58.892 0.175 18703 8027 1 22 . 1 1 62 62 GLU CB C 62 29.440 29.440 29.651 -0.211 18703 8028 1 22 . 1 1 62 62 GLU H H 62 8.032 8.032 7.653 0.379 18703 8029 1 22 . 1 1 63 63 GLU N N 63 119.290 119.290 119.190 0.100 18703 8030 1 22 . 1 1 63 63 GLU HA H 63 4.012 4.012 4.073 -0.061 18703 8031 1 22 . 1 1 63 63 GLU C C 63 179.784 179.784 179.464 0.320 18703 8032 1 22 . 1 1 63 63 GLU CA C 63 59.300 59.300 59.338 -0.038 18703 8033 1 22 . 1 1 63 63 GLU CB C 63 29.728 29.728 29.615 0.113 18703 8034 1 22 . 1 1 63 63 GLU H H 63 7.958 7.958 7.477 0.481 18703 8035 1 22 . 1 1 64 64 ILE N N 64 118.453 118.453 119.438 -0.985 18703 8036 1 22 . 1 1 64 64 ILE HA H 64 3.711 3.711 3.799 -0.088 18703 8037 1 22 . 1 1 64 64 ILE C C 64 177.655 177.655 177.776 -0.121 18703 8038 1 22 . 1 1 64 64 ILE CA C 64 64.256 64.256 64.132 0.123 18703 8039 1 22 . 1 1 64 64 ILE CB C 64 38.002 38.002 37.625 0.377 18703 8040 1 22 . 1 1 64 64 ILE H H 64 8.160 8.160 7.614 0.546 18703 8041 1 22 . 1 1 65 65 LYS N N 65 118.871 118.871 119.828 -0.957 18703 8042 1 22 . 1 1 65 65 LYS HA H 65 4.111 4.111 4.120 -0.009 18703 8043 1 22 . 1 1 65 65 LYS C C 65 177.076 177.076 177.770 -0.694 18703 8044 1 22 . 1 1 65 65 LYS CA C 65 58.421 58.421 58.608 -0.187 18703 8045 1 22 . 1 1 65 65 LYS CB C 65 32.639 32.639 32.340 0.298 18703 8046 1 22 . 1 1 65 65 LYS H H 65 7.664 7.664 7.714 -0.050 18703 8047 1 22 . 1 1 66 66 LYS N N 66 116.944 116.944 118.709 -1.765 18703 8048 1 22 . 1 1 66 66 LYS HA H 66 4.320 4.320 4.087 0.233 18703 8049 1 22 . 1 1 66 66 LYS C C 66 175.897 175.897 177.760 -1.863 18703 8050 1 22 . 1 1 66 66 LYS CA C 66 56.352 56.352 58.225 -1.873 18703 8051 1 22 . 1 1 66 66 LYS CB C 66 33.024 33.024 32.720 0.304 18703 8052 1 22 . 1 1 66 66 LYS H H 66 7.246 7.246 7.514 -0.268 18703 8053 1 23 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.442 -0.196 18703 8054 1 23 . 1 1 3 3 ARG C C 3 178.379 178.379 178.017 0.362 18703 8055 1 23 . 1 1 3 3 ARG CA C 3 58.367 58.367 57.129 1.238 18703 8056 1 23 . 1 1 3 3 ARG CB C 3 30.691 30.691 30.272 0.419 18703 8057 1 23 . 1 1 3 3 ARG H H 3 7.905 7.905 8.650 -0.745 18703 8058 1 23 . 1 1 4 4 VAL N N 4 118.966 118.966 122.189 -3.223 18703 8059 1 23 . 1 1 4 4 VAL HA H 4 3.803 3.803 3.744 0.059 18703 8060 1 23 . 1 1 4 4 VAL C C 4 176.968 176.968 176.870 0.098 18703 8061 1 23 . 1 1 4 4 VAL CA C 4 65.441 65.441 64.963 0.478 18703 8062 1 23 . 1 1 4 4 VAL CB C 4 31.710 31.710 30.766 0.944 18703 8063 1 23 . 1 1 4 4 VAL H H 4 8.070 8.070 8.248 -0.178 18703 8064 1 23 . 1 1 5 5 LYS N N 5 122.058 122.058 118.947 3.111 18703 8065 1 23 . 1 1 5 5 LYS HA H 5 4.154 4.154 4.258 -0.104 18703 8066 1 23 . 1 1 5 5 LYS C C 5 178.553 178.553 178.920 -0.367 18703 8067 1 23 . 1 1 5 5 LYS CA C 5 58.712 58.712 58.959 -0.247 18703 8068 1 23 . 1 1 5 5 LYS CB C 5 31.788 31.788 31.719 0.069 18703 8069 1 23 . 1 1 5 5 LYS H H 5 7.798 7.798 8.513 -0.715 18703 8070 1 23 . 1 1 6 6 ALA N N 6 119.955 119.955 120.998 -1.043 18703 8071 1 23 . 1 1 6 6 ALA HA H 6 4.198 4.198 4.275 -0.077 18703 8072 1 23 . 1 1 6 6 ALA C C 6 180.974 180.974 179.510 1.464 18703 8073 1 23 . 1 1 6 6 ALA CA C 6 54.850 54.850 54.310 0.540 18703 8074 1 23 . 1 1 6 6 ALA CB C 6 17.995 17.995 18.441 -0.446 18703 8075 1 23 . 1 1 6 6 ALA H H 6 7.928 7.928 7.631 0.297 18703 8076 1 23 . 1 1 7 7 LEU N N 7 119.211 119.211 119.434 -0.223 18703 8077 1 23 . 1 1 7 7 LEU HA H 7 4.124 4.124 4.005 0.119 18703 8078 1 23 . 1 1 7 7 LEU C C 7 178.353 178.353 178.671 -0.318 18703 8079 1 23 . 1 1 7 7 LEU CA C 7 57.658 57.658 57.275 0.383 18703 8080 1 23 . 1 1 7 7 LEU CB C 7 41.971 41.971 42.107 -0.136 18703 8081 1 23 . 1 1 7 7 LEU H H 7 7.594 7.594 7.743 -0.149 18703 8082 1 23 . 1 1 8 8 GLU N N 8 120.258 120.258 118.243 2.015 18703 8083 1 23 . 1 1 8 8 GLU HA H 8 3.846 3.846 4.060 -0.214 18703 8084 1 23 . 1 1 8 8 GLU C C 8 179.546 179.546 178.723 0.823 18703 8085 1 23 . 1 1 8 8 GLU CA C 8 60.006 60.006 59.514 0.492 18703 8086 1 23 . 1 1 8 8 GLU CB C 8 29.683 29.683 29.677 0.007 18703 8087 1 23 . 1 1 8 8 GLU H H 8 8.382 8.382 7.765 0.617 18703 8088 1 23 . 1 1 9 9 GLU N N 9 118.584 118.584 119.058 -0.474 18703 8089 1 23 . 1 1 9 9 GLU HA H 9 4.039 4.039 4.094 -0.055 18703 8090 1 23 . 1 1 9 9 GLU C C 9 179.635 179.635 178.567 1.068 18703 8091 1 23 . 1 1 9 9 GLU CA C 9 59.235 59.235 58.594 0.641 18703 8092 1 23 . 1 1 9 9 GLU CB C 9 29.358 29.358 28.856 0.502 18703 8093 1 23 . 1 1 9 9 GLU H H 9 7.908 7.908 7.877 0.031 18703 8094 1 23 . 1 1 10 10 LYS N N 10 120.956 120.956 119.833 1.123 18703 8095 1 23 . 1 1 10 10 LYS HA H 10 4.190 4.190 4.098 0.092 18703 8096 1 23 . 1 1 10 10 LYS C C 10 179.395 179.395 178.898 0.497 18703 8097 1 23 . 1 1 10 10 LYS CA C 10 59.231 59.231 59.176 0.055 18703 8098 1 23 . 1 1 10 10 LYS CB C 10 32.211 32.211 32.607 -0.396 18703 8099 1 23 . 1 1 10 10 LYS H H 10 8.009 8.009 7.563 0.446 18703 8100 1 23 . 1 1 11 11 VAL N N 11 119.577 119.577 118.368 1.209 18703 8101 1 23 . 1 1 11 11 VAL HA H 11 3.844 3.844 3.601 0.243 18703 8102 1 23 . 1 1 11 11 VAL C C 11 177.078 177.078 177.433 -0.355 18703 8103 1 23 . 1 1 11 11 VAL CA C 11 66.407 66.407 66.668 -0.261 18703 8104 1 23 . 1 1 11 11 VAL CB C 11 31.252 31.252 31.659 -0.407 18703 8105 1 23 . 1 1 11 11 VAL H H 11 8.488 8.488 7.567 0.921 18703 8106 1 23 . 1 1 12 12 LYS N N 12 122.864 122.864 119.450 3.414 18703 8107 1 23 . 1 1 12 12 LYS HA H 12 4.189 4.189 3.941 0.248 18703 8108 1 23 . 1 1 12 12 LYS C C 12 178.755 178.755 177.991 0.764 18703 8109 1 23 . 1 1 12 12 LYS CA C 12 59.375 59.375 59.440 -0.065 18703 8110 1 23 . 1 1 12 12 LYS CB C 12 31.991 31.991 32.251 -0.260 18703 8111 1 23 . 1 1 12 12 LYS H H 12 7.944 7.944 7.610 0.334 18703 8112 1 23 . 1 1 13 13 ALA N N 13 121.202 121.202 120.770 0.432 18703 8113 1 23 . 1 1 13 13 ALA HA H 13 4.209 4.209 4.250 -0.041 18703 8114 1 23 . 1 1 13 13 ALA C C 13 181.060 181.060 179.689 1.371 18703 8115 1 23 . 1 1 13 13 ALA CA C 13 54.710 54.710 54.239 0.471 18703 8116 1 23 . 1 1 13 13 ALA CB C 13 17.861 17.861 18.316 -0.455 18703 8117 1 23 . 1 1 13 13 ALA H H 13 7.563 7.563 7.434 0.129 18703 8118 1 23 . 1 1 14 14 LEU N N 14 120.014 120.014 119.636 0.378 18703 8119 1 23 . 1 1 14 14 LEU HA H 14 4.072 4.072 3.984 0.088 18703 8120 1 23 . 1 1 14 14 LEU C C 14 177.862 177.862 178.226 -0.364 18703 8121 1 23 . 1 1 14 14 LEU CA C 14 57.864 57.864 57.154 0.709 18703 8122 1 23 . 1 1 14 14 LEU CB C 14 41.539 41.539 41.881 -0.342 18703 8123 1 23 . 1 1 14 14 LEU H H 14 8.087 8.087 7.475 0.612 18703 8124 1 23 . 1 1 15 15 GLU N N 15 121.644 121.644 120.313 1.331 18703 8125 1 23 . 1 1 15 15 GLU HA H 15 3.692 3.692 4.037 -0.345 18703 8126 1 23 . 1 1 15 15 GLU C C 15 177.819 177.819 178.260 -0.441 18703 8127 1 23 . 1 1 15 15 GLU CA C 15 59.239 59.239 59.250 -0.011 18703 8128 1 23 . 1 1 15 15 GLU CB C 15 28.865 28.865 29.786 -0.921 18703 8129 1 23 . 1 1 15 15 GLU H H 15 8.542 8.542 7.670 0.872 18703 8130 1 23 . 1 1 16 16 GLU N N 16 116.016 116.016 118.985 -2.969 18703 8131 1 23 . 1 1 16 16 GLU HA H 16 3.955 3.955 3.956 -0.001 18703 8132 1 23 . 1 1 16 16 GLU C C 16 179.159 179.159 179.133 0.026 18703 8133 1 23 . 1 1 16 16 GLU CA C 16 59.324 59.324 59.060 0.264 18703 8134 1 23 . 1 1 16 16 GLU CB C 16 29.060 29.060 28.943 0.117 18703 8135 1 23 . 1 1 16 16 GLU H H 16 7.492 7.492 7.895 -0.403 18703 8136 1 23 . 1 1 17 17 LYS N N 17 118.546 118.546 118.821 -0.275 18703 8137 1 23 . 1 1 17 17 LYS HA H 17 4.117 4.117 4.121 -0.004 18703 8138 1 23 . 1 1 17 17 LYS C C 17 178.976 178.976 177.868 1.108 18703 8139 1 23 . 1 1 17 17 LYS CA C 17 58.837 58.837 58.753 0.084 18703 8140 1 23 . 1 1 17 17 LYS CB C 17 32.538 32.538 32.676 -0.138 18703 8141 1 23 . 1 1 17 17 LYS H H 17 7.720 7.720 7.466 0.254 18703 8142 1 23 . 1 1 18 18 VAL N N 18 118.376 118.376 119.007 -0.631 18703 8143 1 23 . 1 1 18 18 VAL HA H 18 3.711 3.711 3.805 -0.094 18703 8144 1 23 . 1 1 18 18 VAL C C 18 178.765 178.765 178.400 0.365 18703 8145 1 23 . 1 1 18 18 VAL CA C 18 66.237 66.237 65.591 0.646 18703 8146 1 23 . 1 1 18 18 VAL CB C 18 31.682 31.682 32.064 -0.382 18703 8147 1 23 . 1 1 18 18 VAL H H 18 8.754 8.754 7.715 1.039 18703 8148 1 23 . 1 1 19 19 LYS N N 19 118.817 118.817 118.923 -0.106 18703 8149 1 23 . 1 1 19 19 LYS HA H 19 4.078 4.078 3.938 0.140 18703 8150 1 23 . 1 1 19 19 LYS C C 19 178.049 178.049 177.790 0.259 18703 8151 1 23 . 1 1 19 19 LYS CA C 19 59.731 59.731 59.443 0.288 18703 8152 1 23 . 1 1 19 19 LYS CB C 19 32.523 32.523 32.156 0.367 18703 8153 1 23 . 1 1 19 19 LYS H H 19 8.299 8.299 8.492 -0.193 18703 8154 1 23 . 1 1 20 20 ALA N N 20 119.656 119.656 119.623 0.033 18703 8155 1 23 . 1 1 20 20 ALA HA H 20 4.347 4.347 4.328 0.019 18703 8156 1 23 . 1 1 20 20 ALA C C 20 178.532 178.532 178.486 0.046 18703 8157 1 23 . 1 1 20 20 ALA CA C 20 52.853 52.853 52.986 -0.133 18703 8158 1 23 . 1 1 20 20 ALA CB C 20 18.832 18.832 18.787 0.045 18703 8159 1 23 . 1 1 20 20 ALA H H 20 7.425 7.425 7.534 -0.109 18703 8160 1 23 . 1 1 21 21 LEU N N 21 118.594 118.594 119.189 -0.595 18703 8161 1 23 . 1 1 21 21 LEU HA H 21 4.297 4.297 4.077 0.220 18703 8162 1 23 . 1 1 21 21 LEU C C 21 177.784 177.784 178.084 -0.300 18703 8163 1 23 . 1 1 21 21 LEU CA C 21 55.750 55.750 56.618 -0.868 18703 8164 1 23 . 1 1 21 21 LEU CB C 21 42.898 42.898 42.463 0.435 18703 8165 1 23 . 1 1 21 21 LEU H H 21 7.508 7.508 7.937 -0.429 18703 8166 1 23 . 1 1 22 22 GLY N N 22 106.650 106.650 104.135 2.515 18703 8167 1 23 . 1 1 22 22 GLY C C 22 173.605 173.605 173.098 0.507 18703 8168 1 23 . 1 1 22 22 GLY CA C 22 45.330 45.330 44.477 0.853 18703 8169 1 23 . 1 1 22 22 GLY H H 22 7.814 7.814 7.776 0.038 18703 8170 1 23 . 1 1 23 23 GLY N N 23 108.011 108.011 108.701 -0.690 18703 8171 1 23 . 1 1 23 23 GLY C C 23 174.061 174.061 173.201 0.860 18703 8172 1 23 . 1 1 23 23 GLY CA C 23 44.772 44.772 45.102 -0.330 18703 8173 1 23 . 1 1 23 23 GLY H H 23 8.139 8.139 7.901 0.238 18703 8174 1 23 . 1 1 24 24 GLY N N 24 107.826 107.826 107.235 0.591 18703 8175 1 23 . 1 1 24 24 GLY C C 24 175.046 175.046 173.213 1.833 18703 8176 1 23 . 1 1 24 24 GLY CA C 24 44.422 44.422 45.862 -1.440 18703 8177 1 23 . 1 1 24 24 GLY H H 24 8.497 8.497 8.091 0.406 18703 8178 1 23 . 1 1 25 25 GLY N N 25 108.830 108.830 109.658 -0.828 18703 8179 1 23 . 1 1 25 25 GLY C C 25 176.272 176.272 175.709 0.563 18703 8180 1 23 . 1 1 25 25 GLY CA C 25 47.101 47.101 45.019 2.082 18703 8181 1 23 . 1 1 25 25 GLY H H 25 8.616 8.616 8.438 0.178 18703 8182 1 23 . 1 1 26 26 ARG N N 26 123.109 123.109 122.379 0.730 18703 8183 1 23 . 1 1 26 26 ARG HA H 26 4.283 4.283 4.090 0.193 18703 8184 1 23 . 1 1 26 26 ARG C C 26 177.848 177.848 178.132 -0.284 18703 8185 1 23 . 1 1 26 26 ARG CA C 26 57.663 57.663 58.138 -0.475 18703 8186 1 23 . 1 1 26 26 ARG CB C 26 29.811 29.811 28.850 0.961 18703 8187 1 23 . 1 1 26 26 ARG H H 26 8.770 8.770 8.728 0.042 18703 8188 1 23 . 1 1 27 27 ILE N N 27 118.104 118.104 118.807 -0.703 18703 8189 1 23 . 1 1 27 27 ILE HA H 27 3.787 3.787 3.779 0.008 18703 8190 1 23 . 1 1 27 27 ILE C C 27 177.473 177.473 177.907 -0.434 18703 8191 1 23 . 1 1 27 27 ILE CA C 27 63.036 63.036 64.049 -1.013 18703 8192 1 23 . 1 1 27 27 ILE CB C 27 36.664 36.664 37.334 -0.670 18703 8193 1 23 . 1 1 27 27 ILE H H 27 7.708 7.708 8.031 -0.323 18703 8194 1 23 . 1 1 28 28 GLU N N 28 119.934 119.934 119.830 0.104 18703 8195 1 23 . 1 1 28 28 GLU HA H 28 3.954 3.954 3.909 0.045 18703 8196 1 23 . 1 1 28 28 GLU C C 28 179.514 179.514 178.613 0.901 18703 8197 1 23 . 1 1 28 28 GLU CA C 28 59.450 59.450 59.673 -0.223 18703 8198 1 23 . 1 1 28 28 GLU CB C 28 29.600 29.600 29.327 0.273 18703 8199 1 23 . 1 1 28 28 GLU H H 28 7.872 7.872 7.933 -0.061 18703 8200 1 23 . 1 1 29 29 GLU N N 29 118.134 118.134 119.782 -1.648 18703 8201 1 23 . 1 1 29 29 GLU HA H 29 4.028 4.028 4.078 -0.050 18703 8202 1 23 . 1 1 29 29 GLU C C 29 179.182 179.182 179.132 0.050 18703 8203 1 23 . 1 1 29 29 GLU CA C 29 59.173 59.173 59.175 -0.002 18703 8204 1 23 . 1 1 29 29 GLU CB C 29 29.503 29.503 29.456 0.047 18703 8205 1 23 . 1 1 29 29 GLU H H 29 8.166 8.166 7.636 0.530 18703 8206 1 23 . 1 1 30 30 LEU N N 30 120.242 120.242 117.687 2.555 18703 8207 1 23 . 1 1 30 30 LEU HA H 30 4.028 4.028 4.094 -0.066 18703 8208 1 23 . 1 1 30 30 LEU C C 30 178.796 178.796 178.938 -0.142 18703 8209 1 23 . 1 1 30 30 LEU CA C 30 57.654 57.654 56.629 1.026 18703 8210 1 23 . 1 1 30 30 LEU CB C 30 41.629 41.629 41.743 -0.114 18703 8211 1 23 . 1 1 30 30 LEU H H 30 7.695 7.695 7.609 0.086 18703 8212 1 23 . 1 1 31 31 LYS N N 31 120.506 120.506 120.252 0.254 18703 8213 1 23 . 1 1 31 31 LYS HA H 31 3.532 3.532 4.041 -0.509 18703 8214 1 23 . 1 1 31 31 LYS C C 31 178.919 178.919 178.289 0.630 18703 8215 1 23 . 1 1 31 31 LYS CA C 31 60.240 60.240 59.254 0.986 18703 8216 1 23 . 1 1 31 31 LYS CB C 31 32.015 32.015 32.238 -0.223 18703 8217 1 23 . 1 1 31 31 LYS H H 31 8.561 8.561 7.683 0.878 18703 8218 1 23 . 1 1 32 32 LYS N N 32 118.566 118.566 118.813 -0.247 18703 8219 1 23 . 1 1 32 32 LYS C C 32 179.392 179.392 178.849 0.543 18703 8220 1 23 . 1 1 32 32 LYS CA C 32 59.356 59.356 59.856 -0.500 18703 8221 1 23 . 1 1 32 32 LYS CB C 32 32.117 32.117 32.315 -0.198 18703 8222 1 23 . 1 1 32 32 LYS H H 32 7.699 7.699 7.518 0.181 18703 8223 1 23 . 1 1 33 33 LYS N N 33 118.964 118.964 117.780 1.184 18703 8224 1 23 . 1 1 33 33 LYS HA H 33 4.117 4.117 4.072 0.045 18703 8225 1 23 . 1 1 33 33 LYS C C 33 178.355 178.355 178.722 -0.367 18703 8226 1 23 . 1 1 33 33 LYS CA C 33 58.633 58.633 59.101 -0.468 18703 8227 1 23 . 1 1 33 33 LYS CB C 33 31.904 31.904 32.330 -0.426 18703 8228 1 23 . 1 1 33 33 LYS H H 33 7.752 7.752 7.593 0.159 18703 8229 1 23 . 1 1 34 34 CYS N N 34 119.956 119.956 118.583 1.373 18703 8230 1 23 . 1 1 34 34 CYS HA H 34 3.967 3.967 4.102 -0.135 18703 8231 1 23 . 1 1 34 34 CYS C C 34 175.521 175.521 176.859 -1.338 18703 8232 1 23 . 1 1 34 34 CYS CA C 34 60.987 60.987 62.899 -1.912 18703 8233 1 23 . 1 1 34 34 CYS CB C 34 36.600 36.600 26.656 9.944 18703 8234 1 23 . 1 1 34 34 CYS H H 34 8.393 8.393 7.546 0.847 18703 8235 1 23 . 1 1 35 35 GLU N N 35 120.327 120.327 120.095 0.232 18703 8236 1 23 . 1 1 35 35 GLU HA H 35 3.891 3.891 3.935 -0.044 18703 8237 1 23 . 1 1 35 35 GLU C C 35 179.684 179.684 178.710 0.974 18703 8238 1 23 . 1 1 35 35 GLU CA C 35 60.059 60.059 59.180 0.879 18703 8239 1 23 . 1 1 35 35 GLU CB C 35 29.718 29.718 28.685 1.033 18703 8240 1 23 . 1 1 35 35 GLU H H 35 8.558 8.558 7.825 0.733 18703 8241 1 23 . 1 1 36 36 GLU N N 36 120.190 120.190 119.988 0.202 18703 8242 1 23 . 1 1 36 36 GLU HA H 36 4.051 4.051 3.977 0.074 18703 8243 1 23 . 1 1 36 36 GLU C C 36 179.408 179.408 179.004 0.404 18703 8244 1 23 . 1 1 36 36 GLU CA C 36 59.148 59.148 59.024 0.124 18703 8245 1 23 . 1 1 36 36 GLU CB C 36 29.766 29.766 29.633 0.133 18703 8246 1 23 . 1 1 36 36 GLU H H 36 8.038 8.038 7.617 0.421 18703 8247 1 23 . 1 1 37 37 LEU N N 37 121.102 121.102 119.632 1.470 18703 8248 1 23 . 1 1 37 37 LEU HA H 37 4.079 4.079 4.190 -0.111 18703 8249 1 23 . 1 1 37 37 LEU C C 37 178.279 178.279 178.320 -0.041 18703 8250 1 23 . 1 1 37 37 LEU CA C 37 57.803 57.803 57.437 0.366 18703 8251 1 23 . 1 1 37 37 LEU CB C 37 41.502 41.502 41.791 -0.289 18703 8252 1 23 . 1 1 37 37 LEU H H 37 8.065 8.065 7.463 0.602 18703 8253 1 23 . 1 1 38 38 LYS N N 38 119.980 119.980 119.037 0.943 18703 8254 1 23 . 1 1 38 38 LYS HA H 38 3.851 3.851 3.872 -0.021 18703 8255 1 23 . 1 1 38 38 LYS C C 38 178.919 178.919 179.145 -0.226 18703 8256 1 23 . 1 1 38 38 LYS CA C 38 60.794 60.794 60.333 0.461 18703 8257 1 23 . 1 1 38 38 LYS CB C 38 32.863 32.863 32.267 0.596 18703 8258 1 23 . 1 1 38 38 LYS H H 38 8.741 8.741 8.021 0.720 18703 8259 1 23 . 1 1 39 39 LYS N N 39 118.307 118.307 118.522 -0.215 18703 8260 1 23 . 1 1 39 39 LYS HA H 39 4.125 4.125 3.970 0.155 18703 8261 1 23 . 1 1 39 39 LYS C C 39 178.622 178.622 178.491 0.131 18703 8262 1 23 . 1 1 39 39 LYS CA C 39 58.993 58.993 59.192 -0.199 18703 8263 1 23 . 1 1 39 39 LYS CB C 39 32.097 32.097 31.882 0.215 18703 8264 1 23 . 1 1 39 39 LYS H H 39 7.584 7.584 7.747 -0.163 18703 8265 1 23 . 1 1 40 40 LYS N N 40 118.826 118.826 120.053 -1.227 18703 8266 1 23 . 1 1 40 40 LYS HA H 40 4.069 4.069 4.373 -0.304 18703 8267 1 23 . 1 1 40 40 LYS C C 40 179.802 179.802 178.926 0.876 18703 8268 1 23 . 1 1 40 40 LYS CA C 40 59.322 59.322 58.891 0.431 18703 8269 1 23 . 1 1 40 40 LYS CB C 40 32.505 32.505 32.300 0.205 18703 8270 1 23 . 1 1 40 40 LYS H H 40 7.945 7.945 7.362 0.583 18703 8271 1 23 . 1 1 41 41 ILE N N 41 118.958 118.958 117.946 1.012 18703 8272 1 23 . 1 1 41 41 ILE HA H 41 3.659 3.659 3.810 -0.151 18703 8273 1 23 . 1 1 41 41 ILE C C 41 178.146 178.146 176.533 1.613 18703 8274 1 23 . 1 1 41 41 ILE CA C 41 65.037 65.037 64.040 0.997 18703 8275 1 23 . 1 1 41 41 ILE CB C 41 37.950 37.950 37.782 0.168 18703 8276 1 23 . 1 1 41 41 ILE H H 41 8.369 8.369 7.907 0.462 18703 8277 1 23 . 1 1 42 42 GLU N N 42 120.331 120.331 117.076 3.255 18703 8278 1 23 . 1 1 42 42 GLU HA H 42 4.094 4.094 4.056 0.038 18703 8279 1 23 . 1 1 42 42 GLU C C 42 178.697 178.697 178.015 0.682 18703 8280 1 23 . 1 1 42 42 GLU CA C 42 58.927 58.927 58.765 0.162 18703 8281 1 23 . 1 1 42 42 GLU CB C 42 29.399 29.399 29.948 -0.549 18703 8282 1 23 . 1 1 42 42 GLU H H 42 7.805 7.805 7.611 0.194 18703 8283 1 23 . 1 1 43 43 GLU N N 43 117.120 117.120 117.362 -0.242 18703 8284 1 23 . 1 1 43 43 GLU HA H 43 4.291 4.291 4.110 0.181 18703 8285 1 23 . 1 1 43 43 GLU C C 43 177.551 177.551 177.715 -0.164 18703 8286 1 23 . 1 1 43 43 GLU CA C 43 56.800 56.800 57.387 -0.587 18703 8287 1 23 . 1 1 43 43 GLU CB C 43 29.931 29.931 29.755 0.176 18703 8288 1 23 . 1 1 43 43 GLU H H 43 7.701 7.701 7.605 0.096 18703 8289 1 23 . 1 1 44 44 LEU N N 44 120.940 120.940 119.873 1.067 18703 8290 1 23 . 1 1 44 44 LEU HA H 44 4.251 4.251 4.005 0.246 18703 8291 1 23 . 1 1 44 44 LEU C C 44 178.596 178.596 177.963 0.633 18703 8292 1 23 . 1 1 44 44 LEU CA C 44 56.448 56.448 55.664 0.784 18703 8293 1 23 . 1 1 44 44 LEU CB C 44 42.519 42.519 42.339 0.180 18703 8294 1 23 . 1 1 44 44 LEU H H 44 7.581 7.581 7.369 0.212 18703 8295 1 23 . 1 1 45 45 GLY N N 45 108.689 108.689 106.736 1.953 18703 8296 1 23 . 1 1 45 45 GLY C C 45 174.853 174.853 174.464 0.389 18703 8297 1 23 . 1 1 45 45 GLY CA C 45 46.233 46.233 45.841 0.392 18703 8298 1 23 . 1 1 45 45 GLY H H 45 8.232 8.232 8.918 -0.686 18703 8299 1 23 . 1 1 46 46 GLY N N 46 108.029 108.029 107.891 0.138 18703 8300 1 23 . 1 1 46 46 GLY C C 46 174.351 174.351 174.605 -0.254 18703 8301 1 23 . 1 1 46 46 GLY CA C 46 45.105 45.105 45.827 -0.722 18703 8302 1 23 . 1 1 46 46 GLY H H 46 8.176 8.176 8.724 -0.548 18703 8303 1 23 . 1 1 47 47 GLY N N 47 108.183 108.183 109.240 -1.057 18703 8304 1 23 . 1 1 47 47 GLY C C 47 174.671 174.671 174.734 -0.063 18703 8305 1 23 . 1 1 47 47 GLY CA C 47 45.254 45.254 45.217 0.037 18703 8306 1 23 . 1 1 47 47 GLY H H 47 8.290 8.290 7.937 0.353 18703 8307 1 23 . 1 1 48 48 GLY N N 48 108.616 108.616 107.242 1.374 18703 8308 1 23 . 1 1 48 48 GLY C C 48 174.321 174.321 176.413 -2.092 18703 8309 1 23 . 1 1 48 48 GLY CA C 48 45.192 45.192 45.288 -0.096 18703 8310 1 23 . 1 1 48 48 GLY H H 48 8.027 8.027 8.123 -0.096 18703 8311 1 23 . 1 1 49 49 GLU N N 49 121.057 121.057 122.348 -1.291 18703 8312 1 23 . 1 1 49 49 GLU HA H 49 4.425 4.425 4.150 0.275 18703 8313 1 23 . 1 1 49 49 GLU C C 49 177.072 177.072 178.424 -1.352 18703 8314 1 23 . 1 1 49 49 GLU CA C 49 56.330 56.330 58.287 -1.957 18703 8315 1 23 . 1 1 49 49 GLU CB C 49 29.602 29.602 29.489 0.113 18703 8316 1 23 . 1 1 49 49 GLU H H 49 8.486 8.486 8.773 -0.287 18703 8317 1 23 . 1 1 50 50 VAL N N 50 122.122 122.122 117.989 4.133 18703 8318 1 23 . 1 1 50 50 VAL HA H 50 3.792 3.792 3.662 0.130 18703 8319 1 23 . 1 1 50 50 VAL C C 50 176.774 176.774 177.897 -1.123 18703 8320 1 23 . 1 1 50 50 VAL CA C 50 64.864 64.864 65.064 -0.200 18703 8321 1 23 . 1 1 50 50 VAL CB C 50 32.179 32.179 31.194 0.985 18703 8322 1 23 . 1 1 50 50 VAL H H 50 8.095 8.095 8.009 0.086 18703 8323 1 23 . 1 1 51 51 LYS N N 51 120.602 120.602 119.091 1.511 18703 8324 1 23 . 1 1 51 51 LYS HA H 51 4.195 4.195 4.063 0.132 18703 8325 1 23 . 1 1 51 51 LYS C C 51 178.530 178.530 178.319 0.211 18703 8326 1 23 . 1 1 51 51 LYS CA C 51 59.348 59.348 59.371 -0.023 18703 8327 1 23 . 1 1 51 51 LYS CB C 51 32.265 32.265 32.285 -0.020 18703 8328 1 23 . 1 1 51 51 LYS H H 51 8.268 8.268 8.055 0.213 18703 8329 1 23 . 1 1 52 52 LYS N N 52 117.547 117.547 120.439 -2.892 18703 8330 1 23 . 1 1 52 52 LYS HA H 52 4.162 4.162 4.030 0.132 18703 8331 1 23 . 1 1 52 52 LYS C C 52 179.132 179.132 178.764 0.368 18703 8332 1 23 . 1 1 52 52 LYS CA C 52 58.811 58.811 59.479 -0.668 18703 8333 1 23 . 1 1 52 52 LYS CB C 52 32.054 32.054 32.261 -0.207 18703 8334 1 23 . 1 1 52 52 LYS H H 52 7.595 7.595 7.663 -0.069 18703 8335 1 23 . 1 1 53 53 VAL N N 53 119.190 119.190 118.622 0.568 18703 8336 1 23 . 1 1 53 53 VAL HA H 53 3.767 3.767 3.631 0.136 18703 8337 1 23 . 1 1 53 53 VAL C C 53 177.933 177.933 178.084 -0.151 18703 8338 1 23 . 1 1 53 53 VAL CA C 53 66.065 66.065 65.993 0.072 18703 8339 1 23 . 1 1 53 53 VAL CB C 53 31.248 31.248 31.326 -0.078 18703 8340 1 23 . 1 1 53 53 VAL H H 53 7.597 7.597 7.573 0.024 18703 8341 1 23 . 1 1 54 54 GLU N N 54 120.226 120.226 119.106 1.120 18703 8342 1 23 . 1 1 54 54 GLU HA H 54 3.833 3.833 4.016 -0.183 18703 8343 1 23 . 1 1 54 54 GLU C C 54 179.352 179.352 178.673 0.679 18703 8344 1 23 . 1 1 54 54 GLU CA C 54 59.153 59.153 59.662 -0.509 18703 8345 1 23 . 1 1 54 54 GLU CB C 54 29.224 29.224 29.331 -0.107 18703 8346 1 23 . 1 1 54 54 GLU H H 54 8.609 8.609 7.725 0.884 18703 8347 1 23 . 1 1 55 55 GLU N N 55 119.148 119.148 119.604 -0.456 18703 8348 1 23 . 1 1 55 55 GLU HA H 55 4.084 4.084 4.111 -0.027 18703 8349 1 23 . 1 1 55 55 GLU C C 55 179.084 179.084 178.813 0.271 18703 8350 1 23 . 1 1 55 55 GLU CA C 55 59.295 59.295 59.047 0.248 18703 8351 1 23 . 1 1 55 55 GLU CB C 55 29.361 29.361 29.567 -0.206 18703 8352 1 23 . 1 1 55 55 GLU H H 55 7.713 7.713 7.788 -0.075 18703 8353 1 23 . 1 1 56 56 GLU N N 56 120.301 120.301 119.151 1.150 18703 8354 1 23 . 1 1 56 56 GLU HA H 56 4.079 4.079 4.119 -0.040 18703 8355 1 23 . 1 1 56 56 GLU C C 56 179.773 179.773 178.772 1.001 18703 8356 1 23 . 1 1 56 56 GLU CA C 56 59.528 59.528 59.411 0.117 18703 8357 1 23 . 1 1 56 56 GLU CB C 56 30.162 30.162 29.737 0.425 18703 8358 1 23 . 1 1 56 56 GLU H H 56 7.899 7.899 7.571 0.328 18703 8359 1 23 . 1 1 57 57 VAL N N 57 121.536 121.536 118.797 2.739 18703 8360 1 23 . 1 1 57 57 VAL HA H 57 3.540 3.540 3.874 -0.334 18703 8361 1 23 . 1 1 57 57 VAL C C 57 176.984 176.984 178.036 -1.052 18703 8362 1 23 . 1 1 57 57 VAL CA C 57 66.734 66.734 65.682 1.052 18703 8363 1 23 . 1 1 57 57 VAL CB C 57 31.425 31.425 31.057 0.368 18703 8364 1 23 . 1 1 57 57 VAL H H 57 8.652 8.652 7.530 1.122 18703 8365 1 23 . 1 1 58 58 LYS N N 58 120.219 120.219 119.988 0.231 18703 8366 1 23 . 1 1 58 58 LYS HA H 58 4.199 4.199 4.073 0.126 18703 8367 1 23 . 1 1 58 58 LYS C C 58 178.972 178.972 178.644 0.328 18703 8368 1 23 . 1 1 58 58 LYS CA C 58 59.357 59.357 59.762 -0.405 18703 8369 1 23 . 1 1 58 58 LYS CB C 58 32.186 32.186 32.103 0.083 18703 8370 1 23 . 1 1 58 58 LYS H H 58 7.791 7.791 7.488 0.303 18703 8371 1 23 . 1 1 59 59 LYS N N 59 118.252 118.252 119.820 -1.568 18703 8372 1 23 . 1 1 59 59 LYS HA H 59 4.069 4.069 4.136 -0.067 18703 8373 1 23 . 1 1 59 59 LYS C C 59 179.180 179.180 178.400 0.780 18703 8374 1 23 . 1 1 59 59 LYS CA C 59 59.285 59.285 59.197 0.088 18703 8375 1 23 . 1 1 59 59 LYS CB C 59 32.345 32.345 32.335 0.010 18703 8376 1 23 . 1 1 59 59 LYS H H 59 7.849 7.849 7.532 0.317 18703 8377 1 23 . 1 1 60 60 LEU N N 60 121.243 121.243 119.617 1.626 18703 8378 1 23 . 1 1 60 60 LEU HA H 60 4.242 4.242 4.145 0.097 18703 8379 1 23 . 1 1 60 60 LEU C C 60 178.413 178.413 178.178 0.235 18703 8380 1 23 . 1 1 60 60 LEU CA C 60 57.798 57.798 57.320 0.478 18703 8381 1 23 . 1 1 60 60 LEU CB C 60 41.150 41.150 42.284 -1.134 18703 8382 1 23 . 1 1 60 60 LEU H H 60 7.825 7.825 7.582 0.243 18703 8383 1 23 . 1 1 61 61 GLU N N 61 118.844 118.844 119.548 -0.704 18703 8384 1 23 . 1 1 61 61 GLU HA H 61 3.800 3.800 3.962 -0.162 18703 8385 1 23 . 1 1 61 61 GLU C C 61 179.078 179.078 178.508 0.570 18703 8386 1 23 . 1 1 61 61 GLU CA C 61 60.104 60.104 59.731 0.373 18703 8387 1 23 . 1 1 61 61 GLU CB C 61 29.864 29.864 29.658 0.206 18703 8388 1 23 . 1 1 61 61 GLU H H 61 8.582 8.582 7.748 0.834 18703 8389 1 23 . 1 1 62 62 GLU N N 62 117.659 117.659 118.565 -0.906 18703 8390 1 23 . 1 1 62 62 GLU HA H 62 3.990 3.990 4.127 -0.137 18703 8391 1 23 . 1 1 62 62 GLU C C 62 178.847 178.847 178.739 0.108 18703 8392 1 23 . 1 1 62 62 GLU CA C 62 59.067 59.067 58.722 0.345 18703 8393 1 23 . 1 1 62 62 GLU CB C 62 29.440 29.440 29.800 -0.360 18703 8394 1 23 . 1 1 62 62 GLU H H 62 8.032 8.032 7.620 0.412 18703 8395 1 23 . 1 1 63 63 GLU N N 63 119.290 119.290 119.818 -0.528 18703 8396 1 23 . 1 1 63 63 GLU HA H 63 4.012 4.012 4.094 -0.082 18703 8397 1 23 . 1 1 63 63 GLU C C 63 179.784 179.784 179.396 0.388 18703 8398 1 23 . 1 1 63 63 GLU CA C 63 59.300 59.300 59.394 -0.094 18703 8399 1 23 . 1 1 63 63 GLU CB C 63 29.728 29.728 29.604 0.124 18703 8400 1 23 . 1 1 63 63 GLU H H 63 7.958 7.958 7.439 0.519 18703 8401 1 23 . 1 1 64 64 ILE N N 64 118.453 118.453 119.125 -0.672 18703 8402 1 23 . 1 1 64 64 ILE HA H 64 3.711 3.711 3.712 -0.001 18703 8403 1 23 . 1 1 64 64 ILE C C 64 177.655 177.655 177.827 -0.172 18703 8404 1 23 . 1 1 64 64 ILE CA C 64 64.256 64.256 64.259 -0.003 18703 8405 1 23 . 1 1 64 64 ILE CB C 64 38.002 38.002 37.545 0.457 18703 8406 1 23 . 1 1 64 64 ILE H H 64 8.160 8.160 7.571 0.589 18703 8407 1 23 . 1 1 65 65 LYS N N 65 118.871 118.871 118.606 0.265 18703 8408 1 23 . 1 1 65 65 LYS HA H 65 4.111 4.111 4.081 0.030 18703 8409 1 23 . 1 1 65 65 LYS C C 65 177.076 177.076 177.970 -0.894 18703 8410 1 23 . 1 1 65 65 LYS CA C 65 58.421 58.421 58.777 -0.356 18703 8411 1 23 . 1 1 65 65 LYS CB C 65 32.639 32.639 32.218 0.421 18703 8412 1 23 . 1 1 65 65 LYS H H 65 7.664 7.664 7.679 -0.015 18703 8413 1 23 . 1 1 66 66 LYS N N 66 116.944 116.944 117.660 -0.716 18703 8414 1 23 . 1 1 66 66 LYS HA H 66 4.320 4.320 4.107 0.213 18703 8415 1 23 . 1 1 66 66 LYS C C 66 175.897 175.897 177.879 -1.982 18703 8416 1 23 . 1 1 66 66 LYS CA C 66 56.352 56.352 58.048 -1.696 18703 8417 1 23 . 1 1 66 66 LYS CB C 66 33.024 33.024 32.863 0.161 18703 8418 1 23 . 1 1 66 66 LYS H H 66 7.246 7.246 7.883 -0.637 18703 8419 1 24 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.545 -0.299 18703 8420 1 24 . 1 1 3 3 ARG C C 3 178.379 178.379 176.730 1.649 18703 8421 1 24 . 1 1 3 3 ARG CA C 3 58.367 58.367 57.310 1.057 18703 8422 1 24 . 1 1 3 3 ARG CB C 3 30.691 30.691 30.938 -0.247 18703 8423 1 24 . 1 1 3 3 ARG H H 3 7.905 7.905 8.314 -0.409 18703 8424 1 24 . 1 1 4 4 VAL N N 4 118.966 118.966 121.466 -2.500 18703 8425 1 24 . 1 1 4 4 VAL HA H 4 3.803 3.803 3.927 -0.124 18703 8426 1 24 . 1 1 4 4 VAL C C 4 176.968 176.968 177.052 -0.084 18703 8427 1 24 . 1 1 4 4 VAL CA C 4 65.441 65.441 64.862 0.579 18703 8428 1 24 . 1 1 4 4 VAL CB C 4 31.710 31.710 31.188 0.522 18703 8429 1 24 . 1 1 4 4 VAL H H 4 8.070 8.070 8.156 -0.086 18703 8430 1 24 . 1 1 5 5 LYS N N 5 122.058 122.058 121.116 0.942 18703 8431 1 24 . 1 1 5 5 LYS HA H 5 4.154 4.154 4.260 -0.106 18703 8432 1 24 . 1 1 5 5 LYS C C 5 178.553 178.553 178.778 -0.225 18703 8433 1 24 . 1 1 5 5 LYS CA C 5 58.712 58.712 59.255 -0.543 18703 8434 1 24 . 1 1 5 5 LYS CB C 5 31.788 31.788 32.100 -0.312 18703 8435 1 24 . 1 1 5 5 LYS H H 5 7.798 7.798 8.434 -0.636 18703 8436 1 24 . 1 1 6 6 ALA N N 6 119.955 119.955 119.792 0.163 18703 8437 1 24 . 1 1 6 6 ALA HA H 6 4.198 4.198 4.245 -0.047 18703 8438 1 24 . 1 1 6 6 ALA C C 6 180.974 180.974 179.166 1.808 18703 8439 1 24 . 1 1 6 6 ALA CA C 6 54.850 54.850 54.147 0.703 18703 8440 1 24 . 1 1 6 6 ALA CB C 6 17.995 17.995 18.280 -0.285 18703 8441 1 24 . 1 1 6 6 ALA H H 6 7.928 7.928 8.142 -0.214 18703 8442 1 24 . 1 1 7 7 LEU N N 7 119.211 119.211 120.091 -0.880 18703 8443 1 24 . 1 1 7 7 LEU HA H 7 4.124 4.124 3.940 0.184 18703 8444 1 24 . 1 1 7 7 LEU C C 7 178.353 178.353 178.518 -0.165 18703 8445 1 24 . 1 1 7 7 LEU CA C 7 57.658 57.658 57.332 0.326 18703 8446 1 24 . 1 1 7 7 LEU CB C 7 41.971 41.971 42.010 -0.039 18703 8447 1 24 . 1 1 7 7 LEU H H 7 7.594 7.594 7.612 -0.018 18703 8448 1 24 . 1 1 8 8 GLU N N 8 120.258 120.258 118.200 2.058 18703 8449 1 24 . 1 1 8 8 GLU HA H 8 3.846 3.846 3.986 -0.140 18703 8450 1 24 . 1 1 8 8 GLU C C 8 179.546 179.546 178.520 1.026 18703 8451 1 24 . 1 1 8 8 GLU CA C 8 60.006 60.006 59.861 0.145 18703 8452 1 24 . 1 1 8 8 GLU CB C 8 29.683 29.683 29.360 0.323 18703 8453 1 24 . 1 1 8 8 GLU H H 8 8.382 8.382 7.799 0.583 18703 8454 1 24 . 1 1 9 9 GLU N N 9 118.584 118.584 118.520 0.064 18703 8455 1 24 . 1 1 9 9 GLU HA H 9 4.039 4.039 4.141 -0.102 18703 8456 1 24 . 1 1 9 9 GLU C C 9 179.635 179.635 178.626 1.009 18703 8457 1 24 . 1 1 9 9 GLU CA C 9 59.235 59.235 58.535 0.700 18703 8458 1 24 . 1 1 9 9 GLU CB C 9 29.358 29.358 29.078 0.281 18703 8459 1 24 . 1 1 9 9 GLU H H 9 7.908 7.908 7.767 0.141 18703 8460 1 24 . 1 1 10 10 LYS N N 10 120.956 120.956 119.748 1.208 18703 8461 1 24 . 1 1 10 10 LYS HA H 10 4.190 4.190 4.172 0.018 18703 8462 1 24 . 1 1 10 10 LYS C C 10 179.395 179.395 178.886 0.509 18703 8463 1 24 . 1 1 10 10 LYS CA C 10 59.231 59.231 59.154 0.077 18703 8464 1 24 . 1 1 10 10 LYS CB C 10 32.211 32.211 32.614 -0.403 18703 8465 1 24 . 1 1 10 10 LYS H H 10 8.009 8.009 7.445 0.564 18703 8466 1 24 . 1 1 11 11 VAL N N 11 119.577 119.577 117.856 1.721 18703 8467 1 24 . 1 1 11 11 VAL HA H 11 3.844 3.844 3.741 0.103 18703 8468 1 24 . 1 1 11 11 VAL C C 11 177.078 177.078 177.363 -0.285 18703 8469 1 24 . 1 1 11 11 VAL CA C 11 66.407 66.407 65.419 0.988 18703 8470 1 24 . 1 1 11 11 VAL CB C 11 31.252 31.252 31.380 -0.127 18703 8471 1 24 . 1 1 11 11 VAL H H 11 8.488 8.488 7.568 0.920 18703 8472 1 24 . 1 1 12 12 LYS N N 12 122.864 122.864 119.809 3.055 18703 8473 1 24 . 1 1 12 12 LYS HA H 12 4.189 4.189 4.054 0.135 18703 8474 1 24 . 1 1 12 12 LYS C C 12 178.755 178.755 178.281 0.474 18703 8475 1 24 . 1 1 12 12 LYS CA C 12 59.375 59.375 59.556 -0.181 18703 8476 1 24 . 1 1 12 12 LYS CB C 12 31.991 31.991 31.745 0.246 18703 8477 1 24 . 1 1 12 12 LYS H H 12 7.944 7.944 7.626 0.318 18703 8478 1 24 . 1 1 13 13 ALA N N 13 121.202 121.202 121.674 -0.472 18703 8479 1 24 . 1 1 13 13 ALA HA H 13 4.209 4.209 4.502 -0.293 18703 8480 1 24 . 1 1 13 13 ALA C C 13 181.060 181.060 178.901 2.159 18703 8481 1 24 . 1 1 13 13 ALA CA C 13 54.710 54.710 53.644 1.066 18703 8482 1 24 . 1 1 13 13 ALA CB C 13 17.861 17.861 18.699 -0.838 18703 8483 1 24 . 1 1 13 13 ALA H H 13 7.563 7.563 7.517 0.046 18703 8484 1 24 . 1 1 14 14 LEU N N 14 120.014 120.014 119.618 0.396 18703 8485 1 24 . 1 1 14 14 LEU HA H 14 4.072 4.072 4.026 0.046 18703 8486 1 24 . 1 1 14 14 LEU C C 14 177.862 177.862 178.181 -0.319 18703 8487 1 24 . 1 1 14 14 LEU CA C 14 57.864 57.864 57.198 0.666 18703 8488 1 24 . 1 1 14 14 LEU CB C 14 41.539 41.539 42.001 -0.462 18703 8489 1 24 . 1 1 14 14 LEU H H 14 8.087 8.087 7.547 0.540 18703 8490 1 24 . 1 1 15 15 GLU N N 15 121.644 121.644 120.236 1.408 18703 8491 1 24 . 1 1 15 15 GLU HA H 15 3.692 3.692 4.014 -0.322 18703 8492 1 24 . 1 1 15 15 GLU C C 15 177.819 177.819 178.329 -0.510 18703 8493 1 24 . 1 1 15 15 GLU CA C 15 59.239 59.239 59.248 -0.009 18703 8494 1 24 . 1 1 15 15 GLU CB C 15 28.865 28.865 29.591 -0.726 18703 8495 1 24 . 1 1 15 15 GLU H H 15 8.542 8.542 7.676 0.866 18703 8496 1 24 . 1 1 16 16 GLU N N 16 116.016 116.016 118.526 -2.510 18703 8497 1 24 . 1 1 16 16 GLU HA H 16 3.955 3.955 3.981 -0.026 18703 8498 1 24 . 1 1 16 16 GLU C C 16 179.159 179.159 178.956 0.203 18703 8499 1 24 . 1 1 16 16 GLU CA C 16 59.324 59.324 58.918 0.406 18703 8500 1 24 . 1 1 16 16 GLU CB C 16 29.060 29.060 29.279 -0.220 18703 8501 1 24 . 1 1 16 16 GLU H H 16 7.492 7.492 7.861 -0.369 18703 8502 1 24 . 1 1 17 17 LYS N N 17 118.546 118.546 118.542 0.004 18703 8503 1 24 . 1 1 17 17 LYS HA H 17 4.117 4.117 4.153 -0.036 18703 8504 1 24 . 1 1 17 17 LYS C C 17 178.976 178.976 178.419 0.557 18703 8505 1 24 . 1 1 17 17 LYS CA C 17 58.837 58.837 58.738 0.099 18703 8506 1 24 . 1 1 17 17 LYS CB C 17 32.538 32.538 32.422 0.116 18703 8507 1 24 . 1 1 17 17 LYS H H 17 7.720 7.720 7.578 0.142 18703 8508 1 24 . 1 1 18 18 VAL N N 18 118.376 118.376 119.154 -0.778 18703 8509 1 24 . 1 1 18 18 VAL HA H 18 3.711 3.711 3.764 -0.053 18703 8510 1 24 . 1 1 18 18 VAL C C 18 178.765 178.765 178.484 0.281 18703 8511 1 24 . 1 1 18 18 VAL CA C 18 66.237 66.237 66.205 0.032 18703 8512 1 24 . 1 1 18 18 VAL CB C 18 31.682 31.682 31.819 -0.137 18703 8513 1 24 . 1 1 18 18 VAL H H 18 8.754 8.754 7.265 1.489 18703 8514 1 24 . 1 1 19 19 LYS N N 19 118.817 118.817 118.788 0.029 18703 8515 1 24 . 1 1 19 19 LYS HA H 19 4.078 4.078 3.998 0.080 18703 8516 1 24 . 1 1 19 19 LYS C C 19 178.049 178.049 177.445 0.604 18703 8517 1 24 . 1 1 19 19 LYS CA C 19 59.731 59.731 58.933 0.798 18703 8518 1 24 . 1 1 19 19 LYS CB C 19 32.523 32.523 32.141 0.382 18703 8519 1 24 . 1 1 19 19 LYS H H 19 8.299 8.299 8.448 -0.149 18703 8520 1 24 . 1 1 20 20 ALA N N 20 119.656 119.656 119.566 0.090 18703 8521 1 24 . 1 1 20 20 ALA HA H 20 4.347 4.347 4.351 -0.004 18703 8522 1 24 . 1 1 20 20 ALA C C 20 178.532 178.532 177.464 1.068 18703 8523 1 24 . 1 1 20 20 ALA CA C 20 52.853 52.853 52.658 0.195 18703 8524 1 24 . 1 1 20 20 ALA CB C 20 18.832 18.832 19.623 -0.791 18703 8525 1 24 . 1 1 20 20 ALA H H 20 7.425 7.425 7.680 -0.255 18703 8526 1 24 . 1 1 21 21 LEU N N 21 118.594 118.594 117.079 1.515 18703 8527 1 24 . 1 1 21 21 LEU HA H 21 4.297 4.297 4.876 -0.579 18703 8528 1 24 . 1 1 21 21 LEU C C 21 177.784 177.784 176.306 1.478 18703 8529 1 24 . 1 1 21 21 LEU CA C 21 55.750 55.750 54.129 1.621 18703 8530 1 24 . 1 1 21 21 LEU CB C 21 42.898 42.898 43.565 -0.667 18703 8531 1 24 . 1 1 21 21 LEU H H 21 7.508 7.508 7.657 -0.149 18703 8532 1 24 . 1 1 22 22 GLY N N 22 106.650 106.650 103.979 2.671 18703 8533 1 24 . 1 1 22 22 GLY C C 22 173.605 173.605 173.177 0.428 18703 8534 1 24 . 1 1 22 22 GLY CA C 22 45.330 45.330 44.594 0.736 18703 8535 1 24 . 1 1 22 22 GLY H H 22 7.814 7.814 8.116 -0.302 18703 8536 1 24 . 1 1 23 23 GLY N N 23 108.011 108.011 109.255 -1.244 18703 8537 1 24 . 1 1 23 23 GLY C C 23 174.061 174.061 173.391 0.670 18703 8538 1 24 . 1 1 23 23 GLY CA C 23 44.772 44.772 45.330 -0.558 18703 8539 1 24 . 1 1 23 23 GLY H H 23 8.139 8.139 8.551 -0.412 18703 8540 1 24 . 1 1 24 24 GLY N N 24 107.826 107.826 108.989 -1.163 18703 8541 1 24 . 1 1 24 24 GLY C C 24 175.046 175.046 175.105 -0.059 18703 8542 1 24 . 1 1 24 24 GLY CA C 24 44.422 44.422 44.776 -0.354 18703 8543 1 24 . 1 1 24 24 GLY H H 24 8.497 8.497 7.778 0.719 18703 8544 1 24 . 1 1 25 25 GLY N N 25 108.830 108.830 109.543 -0.713 18703 8545 1 24 . 1 1 25 25 GLY C C 25 176.272 176.272 176.036 0.236 18703 8546 1 24 . 1 1 25 25 GLY CA C 25 47.101 47.101 46.157 0.944 18703 8547 1 24 . 1 1 25 25 GLY H H 25 8.616 8.616 8.522 0.094 18703 8548 1 24 . 1 1 26 26 ARG N N 26 123.109 123.109 121.461 1.648 18703 8549 1 24 . 1 1 26 26 ARG HA H 26 4.283 4.283 4.085 0.198 18703 8550 1 24 . 1 1 26 26 ARG C C 26 177.848 177.848 177.947 -0.099 18703 8551 1 24 . 1 1 26 26 ARG CA C 26 57.663 57.663 58.219 -0.556 18703 8552 1 24 . 1 1 26 26 ARG CB C 26 29.811 29.811 28.841 0.970 18703 8553 1 24 . 1 1 26 26 ARG H H 26 8.770 8.770 8.697 0.073 18703 8554 1 24 . 1 1 27 27 ILE N N 27 118.104 118.104 119.230 -1.126 18703 8555 1 24 . 1 1 27 27 ILE HA H 27 3.787 3.787 3.753 0.034 18703 8556 1 24 . 1 1 27 27 ILE C C 27 177.473 177.473 177.806 -0.333 18703 8557 1 24 . 1 1 27 27 ILE CA C 27 63.036 63.036 64.317 -1.281 18703 8558 1 24 . 1 1 27 27 ILE CB C 27 36.664 36.664 37.578 -0.914 18703 8559 1 24 . 1 1 27 27 ILE H H 27 7.708 7.708 7.603 0.105 18703 8560 1 24 . 1 1 28 28 GLU N N 28 119.934 119.934 119.944 -0.010 18703 8561 1 24 . 1 1 28 28 GLU HA H 28 3.954 3.954 3.939 0.015 18703 8562 1 24 . 1 1 28 28 GLU C C 28 179.514 179.514 178.391 1.123 18703 8563 1 24 . 1 1 28 28 GLU CA C 28 59.450 59.450 59.791 -0.341 18703 8564 1 24 . 1 1 28 28 GLU CB C 28 29.600 29.600 29.311 0.289 18703 8565 1 24 . 1 1 28 28 GLU H H 28 7.872 7.872 7.954 -0.082 18703 8566 1 24 . 1 1 29 29 GLU N N 29 118.134 118.134 119.581 -1.447 18703 8567 1 24 . 1 1 29 29 GLU HA H 29 4.028 4.028 4.101 -0.073 18703 8568 1 24 . 1 1 29 29 GLU C C 29 179.182 179.182 179.251 -0.069 18703 8569 1 24 . 1 1 29 29 GLU CA C 29 59.173 59.173 59.085 0.088 18703 8570 1 24 . 1 1 29 29 GLU CB C 29 29.503 29.503 29.463 0.040 18703 8571 1 24 . 1 1 29 29 GLU H H 29 8.166 8.166 7.752 0.414 18703 8572 1 24 . 1 1 30 30 LEU N N 30 120.242 120.242 117.911 2.331 18703 8573 1 24 . 1 1 30 30 LEU HA H 30 4.028 4.028 4.140 -0.112 18703 8574 1 24 . 1 1 30 30 LEU C C 30 178.796 178.796 178.677 0.119 18703 8575 1 24 . 1 1 30 30 LEU CA C 30 57.654 57.654 56.503 1.151 18703 8576 1 24 . 1 1 30 30 LEU CB C 30 41.629 41.629 41.856 -0.227 18703 8577 1 24 . 1 1 30 30 LEU H H 30 7.695 7.695 7.529 0.166 18703 8578 1 24 . 1 1 31 31 LYS N N 31 120.506 120.506 120.522 -0.016 18703 8579 1 24 . 1 1 31 31 LYS HA H 31 3.532 3.532 4.050 -0.518 18703 8580 1 24 . 1 1 31 31 LYS C C 31 178.919 178.919 178.292 0.627 18703 8581 1 24 . 1 1 31 31 LYS CA C 31 60.240 60.240 59.347 0.893 18703 8582 1 24 . 1 1 31 31 LYS CB C 31 32.015 32.015 32.289 -0.274 18703 8583 1 24 . 1 1 31 31 LYS H H 31 8.561 8.561 7.700 0.861 18703 8584 1 24 . 1 1 32 32 LYS N N 32 118.566 118.566 118.421 0.145 18703 8585 1 24 . 1 1 32 32 LYS C C 32 179.392 179.392 179.289 0.103 18703 8586 1 24 . 1 1 32 32 LYS CA C 32 59.356 59.356 59.490 -0.134 18703 8587 1 24 . 1 1 32 32 LYS CB C 32 32.117 32.117 32.392 -0.275 18703 8588 1 24 . 1 1 32 32 LYS H H 32 7.699 7.699 7.558 0.141 18703 8589 1 24 . 1 1 33 33 LYS N N 33 118.964 118.964 118.171 0.793 18703 8590 1 24 . 1 1 33 33 LYS HA H 33 4.117 4.117 4.248 -0.131 18703 8591 1 24 . 1 1 33 33 LYS C C 33 178.355 178.355 178.493 -0.138 18703 8592 1 24 . 1 1 33 33 LYS CA C 33 58.633 58.633 58.662 -0.029 18703 8593 1 24 . 1 1 33 33 LYS CB C 33 31.904 31.904 32.341 -0.437 18703 8594 1 24 . 1 1 33 33 LYS H H 33 7.752 7.752 7.630 0.122 18703 8595 1 24 . 1 1 34 34 CYS N N 34 119.956 119.956 119.509 0.447 18703 8596 1 24 . 1 1 34 34 CYS HA H 34 3.967 3.967 4.116 -0.149 18703 8597 1 24 . 1 1 34 34 CYS C C 34 175.521 175.521 176.626 -1.105 18703 8598 1 24 . 1 1 34 34 CYS CA C 34 60.987 60.987 63.118 -2.131 18703 8599 1 24 . 1 1 34 34 CYS CB C 34 36.600 36.600 26.668 9.932 18703 8600 1 24 . 1 1 34 34 CYS H H 34 8.393 8.393 7.770 0.623 18703 8601 1 24 . 1 1 35 35 GLU N N 35 120.327 120.327 119.408 0.919 18703 8602 1 24 . 1 1 35 35 GLU HA H 35 3.891 3.891 3.942 -0.051 18703 8603 1 24 . 1 1 35 35 GLU C C 35 179.684 179.684 178.576 1.108 18703 8604 1 24 . 1 1 35 35 GLU CA C 35 60.059 60.059 59.285 0.774 18703 8605 1 24 . 1 1 35 35 GLU CB C 35 29.718 29.718 28.595 1.123 18703 8606 1 24 . 1 1 35 35 GLU H H 35 8.558 8.558 7.917 0.641 18703 8607 1 24 . 1 1 36 36 GLU N N 36 120.190 120.190 119.773 0.417 18703 8608 1 24 . 1 1 36 36 GLU HA H 36 4.051 4.051 4.048 0.003 18703 8609 1 24 . 1 1 36 36 GLU C C 36 179.408 179.408 178.850 0.558 18703 8610 1 24 . 1 1 36 36 GLU CA C 36 59.148 59.148 58.865 0.283 18703 8611 1 24 . 1 1 36 36 GLU CB C 36 29.766 29.766 29.845 -0.079 18703 8612 1 24 . 1 1 36 36 GLU H H 36 8.038 8.038 7.638 0.400 18703 8613 1 24 . 1 1 37 37 LEU N N 37 121.102 121.102 120.407 0.695 18703 8614 1 24 . 1 1 37 37 LEU HA H 37 4.079 4.079 4.097 -0.018 18703 8615 1 24 . 1 1 37 37 LEU C C 37 178.279 178.279 178.356 -0.077 18703 8616 1 24 . 1 1 37 37 LEU CA C 37 57.803 57.803 57.970 -0.167 18703 8617 1 24 . 1 1 37 37 LEU CB C 37 41.502 41.502 41.773 -0.272 18703 8618 1 24 . 1 1 37 37 LEU H H 37 8.065 8.065 7.453 0.612 18703 8619 1 24 . 1 1 38 38 LYS N N 38 119.980 119.980 118.413 1.567 18703 8620 1 24 . 1 1 38 38 LYS HA H 38 3.851 3.851 3.941 -0.090 18703 8621 1 24 . 1 1 38 38 LYS C C 38 178.919 178.919 179.186 -0.267 18703 8622 1 24 . 1 1 38 38 LYS CA C 38 60.794 60.794 59.795 0.999 18703 8623 1 24 . 1 1 38 38 LYS CB C 38 32.863 32.863 32.192 0.671 18703 8624 1 24 . 1 1 38 38 LYS H H 38 8.741 8.741 7.612 1.129 18703 8625 1 24 . 1 1 39 39 LYS N N 39 118.307 118.307 118.053 0.254 18703 8626 1 24 . 1 1 39 39 LYS HA H 39 4.125 4.125 3.990 0.135 18703 8627 1 24 . 1 1 39 39 LYS C C 39 178.622 178.622 178.554 0.068 18703 8628 1 24 . 1 1 39 39 LYS CA C 39 58.993 58.993 59.142 -0.149 18703 8629 1 24 . 1 1 39 39 LYS CB C 39 32.097 32.097 31.893 0.204 18703 8630 1 24 . 1 1 39 39 LYS H H 39 7.584 7.584 7.739 -0.155 18703 8631 1 24 . 1 1 40 40 LYS N N 40 118.826 118.826 119.674 -0.848 18703 8632 1 24 . 1 1 40 40 LYS HA H 40 4.069 4.069 4.161 -0.092 18703 8633 1 24 . 1 1 40 40 LYS C C 40 179.802 179.802 178.845 0.957 18703 8634 1 24 . 1 1 40 40 LYS CA C 40 59.322 59.322 58.723 0.599 18703 8635 1 24 . 1 1 40 40 LYS CB C 40 32.505 32.505 32.189 0.316 18703 8636 1 24 . 1 1 40 40 LYS H H 40 7.945 7.945 7.383 0.562 18703 8637 1 24 . 1 1 41 41 ILE N N 41 118.958 118.958 119.389 -0.431 18703 8638 1 24 . 1 1 41 41 ILE HA H 41 3.659 3.659 3.821 -0.162 18703 8639 1 24 . 1 1 41 41 ILE C C 41 178.146 178.146 177.697 0.449 18703 8640 1 24 . 1 1 41 41 ILE CA C 41 65.037 65.037 64.138 0.899 18703 8641 1 24 . 1 1 41 41 ILE CB C 41 37.950 37.950 37.767 0.183 18703 8642 1 24 . 1 1 41 41 ILE H H 41 8.369 8.369 8.090 0.279 18703 8643 1 24 . 1 1 42 42 GLU N N 42 120.331 120.331 118.826 1.505 18703 8644 1 24 . 1 1 42 42 GLU HA H 42 4.094 4.094 4.048 0.046 18703 8645 1 24 . 1 1 42 42 GLU C C 42 178.697 178.697 177.875 0.822 18703 8646 1 24 . 1 1 42 42 GLU CA C 42 58.927 58.927 58.992 -0.065 18703 8647 1 24 . 1 1 42 42 GLU CB C 42 29.399 29.399 29.615 -0.216 18703 8648 1 24 . 1 1 42 42 GLU H H 42 7.805 7.805 7.725 0.080 18703 8649 1 24 . 1 1 43 43 GLU N N 43 117.120 117.120 116.625 0.495 18703 8650 1 24 . 1 1 43 43 GLU HA H 43 4.291 4.291 4.227 0.064 18703 8651 1 24 . 1 1 43 43 GLU C C 43 177.551 177.551 177.500 0.051 18703 8652 1 24 . 1 1 43 43 GLU CA C 43 56.800 56.800 56.857 -0.057 18703 8653 1 24 . 1 1 43 43 GLU CB C 43 29.931 29.931 29.793 0.138 18703 8654 1 24 . 1 1 43 43 GLU H H 43 7.701 7.701 7.518 0.183 18703 8655 1 24 . 1 1 44 44 LEU N N 44 120.940 120.940 121.183 -0.243 18703 8656 1 24 . 1 1 44 44 LEU HA H 44 4.251 4.251 4.073 0.178 18703 8657 1 24 . 1 1 44 44 LEU C C 44 178.596 178.596 177.497 1.099 18703 8658 1 24 . 1 1 44 44 LEU CA C 44 56.448 56.448 55.494 0.954 18703 8659 1 24 . 1 1 44 44 LEU CB C 44 42.519 42.519 42.565 -0.046 18703 8660 1 24 . 1 1 44 44 LEU H H 44 7.581 7.581 7.369 0.212 18703 8661 1 24 . 1 1 45 45 GLY N N 45 108.689 108.689 109.799 -1.110 18703 8662 1 24 . 1 1 45 45 GLY C C 45 174.853 174.853 174.233 0.620 18703 8663 1 24 . 1 1 45 45 GLY CA C 45 46.233 46.233 45.105 1.129 18703 8664 1 24 . 1 1 45 45 GLY H H 45 8.232 8.232 8.573 -0.341 18703 8665 1 24 . 1 1 46 46 GLY N N 46 108.029 108.029 108.454 -0.425 18703 8666 1 24 . 1 1 46 46 GLY C C 46 174.351 174.351 173.911 0.440 18703 8667 1 24 . 1 1 46 46 GLY CA C 46 45.105 45.105 45.499 -0.394 18703 8668 1 24 . 1 1 46 46 GLY H H 46 8.176 8.176 8.055 0.121 18703 8669 1 24 . 1 1 47 47 GLY N N 47 108.183 108.183 110.474 -2.291 18703 8670 1 24 . 1 1 47 47 GLY C C 47 174.671 174.671 174.929 -0.258 18703 8671 1 24 . 1 1 47 47 GLY CA C 47 45.254 45.254 44.204 1.050 18703 8672 1 24 . 1 1 47 47 GLY H H 47 8.290 8.290 7.881 0.409 18703 8673 1 24 . 1 1 48 48 GLY N N 48 108.616 108.616 111.077 -2.461 18703 8674 1 24 . 1 1 48 48 GLY C C 48 174.321 174.321 175.409 -1.088 18703 8675 1 24 . 1 1 48 48 GLY CA C 48 45.192 45.192 45.384 -0.192 18703 8676 1 24 . 1 1 48 48 GLY H H 48 8.027 8.027 8.373 -0.346 18703 8677 1 24 . 1 1 49 49 GLU N N 49 121.057 121.057 122.741 -1.684 18703 8678 1 24 . 1 1 49 49 GLU HA H 49 4.425 4.425 4.234 0.191 18703 8679 1 24 . 1 1 49 49 GLU C C 49 177.072 177.072 177.724 -0.652 18703 8680 1 24 . 1 1 49 49 GLU CA C 49 56.330 56.330 58.229 -1.899 18703 8681 1 24 . 1 1 49 49 GLU CB C 49 29.602 29.602 29.703 -0.102 18703 8682 1 24 . 1 1 49 49 GLU H H 49 8.486 8.486 8.518 -0.032 18703 8683 1 24 . 1 1 50 50 VAL N N 50 122.122 122.122 118.906 3.216 18703 8684 1 24 . 1 1 50 50 VAL HA H 50 3.792 3.792 3.773 0.019 18703 8685 1 24 . 1 1 50 50 VAL C C 50 176.774 176.774 177.663 -0.889 18703 8686 1 24 . 1 1 50 50 VAL CA C 50 64.864 64.864 64.534 0.330 18703 8687 1 24 . 1 1 50 50 VAL CB C 50 32.179 32.179 30.982 1.197 18703 8688 1 24 . 1 1 50 50 VAL H H 50 8.095 8.095 7.952 0.143 18703 8689 1 24 . 1 1 51 51 LYS N N 51 120.602 120.602 118.915 1.687 18703 8690 1 24 . 1 1 51 51 LYS HA H 51 4.195 4.195 4.139 0.056 18703 8691 1 24 . 1 1 51 51 LYS C C 51 178.530 178.530 178.407 0.123 18703 8692 1 24 . 1 1 51 51 LYS CA C 51 59.348 59.348 58.951 0.397 18703 8693 1 24 . 1 1 51 51 LYS CB C 51 32.265 32.265 32.267 -0.001 18703 8694 1 24 . 1 1 51 51 LYS H H 51 8.268 8.268 7.690 0.578 18703 8695 1 24 . 1 1 52 52 LYS N N 52 117.547 117.547 119.896 -2.349 18703 8696 1 24 . 1 1 52 52 LYS HA H 52 4.162 4.162 4.194 -0.032 18703 8697 1 24 . 1 1 52 52 LYS C C 52 179.132 179.132 178.776 0.356 18703 8698 1 24 . 1 1 52 52 LYS CA C 52 58.811 58.811 58.167 0.644 18703 8699 1 24 . 1 1 52 52 LYS CB C 52 32.054 32.054 32.036 0.018 18703 8700 1 24 . 1 1 52 52 LYS H H 52 7.595 7.595 7.403 0.192 18703 8701 1 24 . 1 1 53 53 VAL N N 53 119.190 119.190 119.183 0.007 18703 8702 1 24 . 1 1 53 53 VAL HA H 53 3.767 3.767 3.872 -0.105 18703 8703 1 24 . 1 1 53 53 VAL C C 53 177.933 177.933 178.019 -0.086 18703 8704 1 24 . 1 1 53 53 VAL CA C 53 66.065 66.065 66.280 -0.215 18703 8705 1 24 . 1 1 53 53 VAL CB C 53 31.248 31.248 31.140 0.108 18703 8706 1 24 . 1 1 53 53 VAL H H 53 7.597 7.597 7.552 0.045 18703 8707 1 24 . 1 1 54 54 GLU N N 54 120.226 120.226 118.935 1.291 18703 8708 1 24 . 1 1 54 54 GLU HA H 54 3.833 3.833 3.998 -0.165 18703 8709 1 24 . 1 1 54 54 GLU C C 54 179.352 179.352 178.736 0.616 18703 8710 1 24 . 1 1 54 54 GLU CA C 54 59.153 59.153 59.711 -0.557 18703 8711 1 24 . 1 1 54 54 GLU CB C 54 29.224 29.224 29.261 -0.037 18703 8712 1 24 . 1 1 54 54 GLU H H 54 8.609 8.609 7.710 0.899 18703 8713 1 24 . 1 1 55 55 GLU N N 55 119.148 119.148 118.964 0.184 18703 8714 1 24 . 1 1 55 55 GLU HA H 55 4.084 4.084 4.116 -0.032 18703 8715 1 24 . 1 1 55 55 GLU C C 55 179.084 179.084 178.775 0.309 18703 8716 1 24 . 1 1 55 55 GLU CA C 55 59.295 59.295 59.051 0.244 18703 8717 1 24 . 1 1 55 55 GLU CB C 55 29.361 29.361 29.645 -0.284 18703 8718 1 24 . 1 1 55 55 GLU H H 55 7.713 7.713 7.797 -0.084 18703 8719 1 24 . 1 1 56 56 GLU N N 56 120.301 120.301 119.007 1.294 18703 8720 1 24 . 1 1 56 56 GLU HA H 56 4.079 4.079 4.111 -0.032 18703 8721 1 24 . 1 1 56 56 GLU C C 56 179.773 179.773 179.202 0.571 18703 8722 1 24 . 1 1 56 56 GLU CA C 56 59.528 59.528 59.209 0.320 18703 8723 1 24 . 1 1 56 56 GLU CB C 56 30.162 30.162 29.591 0.571 18703 8724 1 24 . 1 1 56 56 GLU H H 56 7.899 7.899 7.577 0.322 18703 8725 1 24 . 1 1 57 57 VAL N N 57 121.536 121.536 118.343 3.193 18703 8726 1 24 . 1 1 57 57 VAL HA H 57 3.540 3.540 3.849 -0.309 18703 8727 1 24 . 1 1 57 57 VAL C C 57 176.984 176.984 177.494 -0.510 18703 8728 1 24 . 1 1 57 57 VAL CA C 57 66.734 66.734 64.667 2.067 18703 8729 1 24 . 1 1 57 57 VAL CB C 57 31.425 31.425 30.602 0.824 18703 8730 1 24 . 1 1 57 57 VAL H H 57 8.652 8.652 7.536 1.116 18703 8731 1 24 . 1 1 58 58 LYS N N 58 120.219 120.219 119.710 0.509 18703 8732 1 24 . 1 1 58 58 LYS HA H 58 4.199 4.199 4.018 0.181 18703 8733 1 24 . 1 1 58 58 LYS C C 58 178.972 178.972 178.589 0.383 18703 8734 1 24 . 1 1 58 58 LYS CA C 58 59.357 59.357 58.794 0.563 18703 8735 1 24 . 1 1 58 58 LYS CB C 58 32.186 32.186 32.042 0.144 18703 8736 1 24 . 1 1 58 58 LYS H H 58 7.791 7.791 7.405 0.386 18703 8737 1 24 . 1 1 59 59 LYS N N 59 118.252 118.252 119.882 -1.630 18703 8738 1 24 . 1 1 59 59 LYS HA H 59 4.069 4.069 4.153 -0.084 18703 8739 1 24 . 1 1 59 59 LYS C C 59 179.180 179.180 178.816 0.364 18703 8740 1 24 . 1 1 59 59 LYS CA C 59 59.285 59.285 58.920 0.365 18703 8741 1 24 . 1 1 59 59 LYS CB C 59 32.345 32.345 32.454 -0.109 18703 8742 1 24 . 1 1 59 59 LYS H H 59 7.849 7.849 7.505 0.344 18703 8743 1 24 . 1 1 60 60 LEU N N 60 121.243 121.243 119.664 1.579 18703 8744 1 24 . 1 1 60 60 LEU HA H 60 4.242 4.242 4.140 0.102 18703 8745 1 24 . 1 1 60 60 LEU C C 60 178.413 178.413 178.115 0.298 18703 8746 1 24 . 1 1 60 60 LEU CA C 60 57.798 57.798 57.163 0.635 18703 8747 1 24 . 1 1 60 60 LEU CB C 60 41.150 41.150 42.168 -1.018 18703 8748 1 24 . 1 1 60 60 LEU H H 60 7.825 7.825 7.548 0.277 18703 8749 1 24 . 1 1 61 61 GLU N N 61 118.844 118.844 120.149 -1.305 18703 8750 1 24 . 1 1 61 61 GLU HA H 61 3.800 3.800 3.924 -0.124 18703 8751 1 24 . 1 1 61 61 GLU C C 61 179.078 179.078 178.525 0.553 18703 8752 1 24 . 1 1 61 61 GLU CA C 61 60.104 60.104 59.829 0.275 18703 8753 1 24 . 1 1 61 61 GLU CB C 61 29.864 29.864 29.662 0.202 18703 8754 1 24 . 1 1 61 61 GLU H H 61 8.582 8.582 7.730 0.852 18703 8755 1 24 . 1 1 62 62 GLU N N 62 117.659 117.659 118.694 -1.035 18703 8756 1 24 . 1 1 62 62 GLU HA H 62 3.990 3.990 4.038 -0.048 18703 8757 1 24 . 1 1 62 62 GLU C C 62 178.847 178.847 178.897 -0.050 18703 8758 1 24 . 1 1 62 62 GLU CA C 62 59.067 59.067 58.968 0.099 18703 8759 1 24 . 1 1 62 62 GLU CB C 62 29.440 29.440 29.666 -0.226 18703 8760 1 24 . 1 1 62 62 GLU H H 62 8.032 8.032 7.612 0.420 18703 8761 1 24 . 1 1 63 63 GLU N N 63 119.290 119.290 119.479 -0.189 18703 8762 1 24 . 1 1 63 63 GLU HA H 63 4.012 4.012 4.090 -0.078 18703 8763 1 24 . 1 1 63 63 GLU C C 63 179.784 179.784 179.415 0.369 18703 8764 1 24 . 1 1 63 63 GLU CA C 63 59.300 59.300 59.163 0.137 18703 8765 1 24 . 1 1 63 63 GLU CB C 63 29.728 29.728 29.438 0.290 18703 8766 1 24 . 1 1 63 63 GLU H H 63 7.958 7.958 7.443 0.515 18703 8767 1 24 . 1 1 64 64 ILE N N 64 118.453 118.453 119.579 -1.126 18703 8768 1 24 . 1 1 64 64 ILE HA H 64 3.711 3.711 3.767 -0.056 18703 8769 1 24 . 1 1 64 64 ILE C C 64 177.655 177.655 177.895 -0.240 18703 8770 1 24 . 1 1 64 64 ILE CA C 64 64.256 64.256 64.201 0.055 18703 8771 1 24 . 1 1 64 64 ILE CB C 64 38.002 38.002 37.643 0.359 18703 8772 1 24 . 1 1 64 64 ILE H H 64 8.160 8.160 7.593 0.567 18703 8773 1 24 . 1 1 65 65 LYS N N 65 118.871 118.871 119.063 -0.192 18703 8774 1 24 . 1 1 65 65 LYS HA H 65 4.111 4.111 4.074 0.037 18703 8775 1 24 . 1 1 65 65 LYS C C 65 177.076 177.076 177.943 -0.867 18703 8776 1 24 . 1 1 65 65 LYS CA C 65 58.421 58.421 58.767 -0.346 18703 8777 1 24 . 1 1 65 65 LYS CB C 65 32.639 32.639 32.270 0.369 18703 8778 1 24 . 1 1 65 65 LYS H H 65 7.664 7.664 7.735 -0.071 18703 8779 1 24 . 1 1 66 66 LYS N N 66 116.944 116.944 117.892 -0.948 18703 8780 1 24 . 1 1 66 66 LYS HA H 66 4.320 4.320 4.118 0.202 18703 8781 1 24 . 1 1 66 66 LYS C C 66 175.897 175.897 177.853 -1.956 18703 8782 1 24 . 1 1 66 66 LYS CA C 66 56.352 56.352 58.093 -1.740 18703 8783 1 24 . 1 1 66 66 LYS CB C 66 33.024 33.024 33.040 -0.016 18703 8784 1 24 . 1 1 66 66 LYS H H 66 7.246 7.246 7.770 -0.524 18703 8785 1 25 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.328 -0.082 18703 8786 1 25 . 1 1 3 3 ARG C C 3 178.379 178.379 176.458 1.921 18703 8787 1 25 . 1 1 3 3 ARG CA C 3 58.367 58.367 56.950 1.417 18703 8788 1 25 . 1 1 3 3 ARG CB C 3 30.691 30.691 31.350 -0.659 18703 8789 1 25 . 1 1 3 3 ARG H H 3 7.905 7.905 8.632 -0.727 18703 8790 1 25 . 1 1 4 4 VAL N N 4 118.966 118.966 119.834 -0.868 18703 8791 1 25 . 1 1 4 4 VAL HA H 4 3.803 3.803 3.945 -0.142 18703 8792 1 25 . 1 1 4 4 VAL C C 4 176.968 176.968 176.999 -0.031 18703 8793 1 25 . 1 1 4 4 VAL CA C 4 65.441 65.441 64.290 1.151 18703 8794 1 25 . 1 1 4 4 VAL CB C 4 31.710 31.710 31.452 0.258 18703 8795 1 25 . 1 1 4 4 VAL H H 4 8.070 8.070 8.364 -0.294 18703 8796 1 25 . 1 1 5 5 LYS N N 5 122.058 122.058 120.904 1.154 18703 8797 1 25 . 1 1 5 5 LYS HA H 5 4.154 4.154 4.025 0.129 18703 8798 1 25 . 1 1 5 5 LYS C C 5 178.553 178.553 178.388 0.165 18703 8799 1 25 . 1 1 5 5 LYS CA C 5 58.712 58.712 59.531 -0.819 18703 8800 1 25 . 1 1 5 5 LYS CB C 5 31.788 31.788 32.305 -0.517 18703 8801 1 25 . 1 1 5 5 LYS H H 5 7.798 7.798 8.290 -0.492 18703 8802 1 25 . 1 1 6 6 ALA N N 6 119.955 119.955 120.294 -0.339 18703 8803 1 25 . 1 1 6 6 ALA HA H 6 4.198 4.198 4.213 -0.015 18703 8804 1 25 . 1 1 6 6 ALA C C 6 180.974 180.974 179.365 1.609 18703 8805 1 25 . 1 1 6 6 ALA CA C 6 54.850 54.850 54.098 0.752 18703 8806 1 25 . 1 1 6 6 ALA CB C 6 17.995 17.995 18.279 -0.284 18703 8807 1 25 . 1 1 6 6 ALA H H 6 7.928 7.928 8.068 -0.140 18703 8808 1 25 . 1 1 7 7 LEU N N 7 119.211 119.211 119.334 -0.123 18703 8809 1 25 . 1 1 7 7 LEU HA H 7 4.124 4.124 3.958 0.166 18703 8810 1 25 . 1 1 7 7 LEU C C 7 178.353 178.353 178.568 -0.215 18703 8811 1 25 . 1 1 7 7 LEU CA C 7 57.658 57.658 57.223 0.435 18703 8812 1 25 . 1 1 7 7 LEU CB C 7 41.971 41.971 41.981 -0.010 18703 8813 1 25 . 1 1 7 7 LEU H H 7 7.594 7.594 7.369 0.225 18703 8814 1 25 . 1 1 8 8 GLU N N 8 120.258 120.258 118.094 2.164 18703 8815 1 25 . 1 1 8 8 GLU HA H 8 3.846 3.846 3.997 -0.151 18703 8816 1 25 . 1 1 8 8 GLU C C 8 179.546 179.546 178.536 1.010 18703 8817 1 25 . 1 1 8 8 GLU CA C 8 60.006 60.006 59.728 0.278 18703 8818 1 25 . 1 1 8 8 GLU CB C 8 29.683 29.683 29.468 0.215 18703 8819 1 25 . 1 1 8 8 GLU H H 8 8.382 8.382 7.779 0.603 18703 8820 1 25 . 1 1 9 9 GLU N N 9 118.584 118.584 118.710 -0.126 18703 8821 1 25 . 1 1 9 9 GLU HA H 9 4.039 4.039 4.143 -0.104 18703 8822 1 25 . 1 1 9 9 GLU C C 9 179.635 179.635 178.692 0.943 18703 8823 1 25 . 1 1 9 9 GLU CA C 9 59.235 59.235 58.548 0.687 18703 8824 1 25 . 1 1 9 9 GLU CB C 9 29.358 29.358 29.015 0.343 18703 8825 1 25 . 1 1 9 9 GLU H H 9 7.908 7.908 7.660 0.248 18703 8826 1 25 . 1 1 10 10 LYS N N 10 120.956 120.956 120.268 0.688 18703 8827 1 25 . 1 1 10 10 LYS HA H 10 4.190 4.190 4.111 0.079 18703 8828 1 25 . 1 1 10 10 LYS C C 10 179.395 179.395 178.934 0.461 18703 8829 1 25 . 1 1 10 10 LYS CA C 10 59.231 59.231 58.986 0.245 18703 8830 1 25 . 1 1 10 10 LYS CB C 10 32.211 32.211 32.352 -0.141 18703 8831 1 25 . 1 1 10 10 LYS H H 10 8.009 8.009 7.381 0.628 18703 8832 1 25 . 1 1 11 11 VAL N N 11 119.577 119.577 118.281 1.296 18703 8833 1 25 . 1 1 11 11 VAL HA H 11 3.844 3.844 3.661 0.183 18703 8834 1 25 . 1 1 11 11 VAL C C 11 177.078 177.078 177.395 -0.317 18703 8835 1 25 . 1 1 11 11 VAL CA C 11 66.407 66.407 66.159 0.248 18703 8836 1 25 . 1 1 11 11 VAL CB C 11 31.252 31.252 31.667 -0.415 18703 8837 1 25 . 1 1 11 11 VAL H H 11 8.488 8.488 7.481 1.007 18703 8838 1 25 . 1 1 12 12 LYS N N 12 122.864 122.864 119.633 3.231 18703 8839 1 25 . 1 1 12 12 LYS HA H 12 4.189 4.189 3.981 0.208 18703 8840 1 25 . 1 1 12 12 LYS C C 12 178.755 178.755 178.404 0.351 18703 8841 1 25 . 1 1 12 12 LYS CA C 12 59.375 59.375 59.633 -0.258 18703 8842 1 25 . 1 1 12 12 LYS CB C 12 31.991 31.991 32.333 -0.342 18703 8843 1 25 . 1 1 12 12 LYS H H 12 7.944 7.944 7.584 0.360 18703 8844 1 25 . 1 1 13 13 ALA N N 13 121.202 121.202 120.601 0.601 18703 8845 1 25 . 1 1 13 13 ALA HA H 13 4.209 4.209 4.270 -0.061 18703 8846 1 25 . 1 1 13 13 ALA C C 13 181.060 181.060 179.222 1.838 18703 8847 1 25 . 1 1 13 13 ALA CA C 13 54.710 54.710 54.232 0.478 18703 8848 1 25 . 1 1 13 13 ALA CB C 13 17.861 17.861 18.477 -0.617 18703 8849 1 25 . 1 1 13 13 ALA H H 13 7.563 7.563 7.451 0.112 18703 8850 1 25 . 1 1 14 14 LEU N N 14 120.014 120.014 119.676 0.338 18703 8851 1 25 . 1 1 14 14 LEU HA H 14 4.072 4.072 4.009 0.063 18703 8852 1 25 . 1 1 14 14 LEU C C 14 177.862 177.862 178.183 -0.321 18703 8853 1 25 . 1 1 14 14 LEU CA C 14 57.864 57.864 57.269 0.595 18703 8854 1 25 . 1 1 14 14 LEU CB C 14 41.539 41.539 42.005 -0.466 18703 8855 1 25 . 1 1 14 14 LEU H H 14 8.087 8.087 7.532 0.555 18703 8856 1 25 . 1 1 15 15 GLU N N 15 121.644 121.644 120.158 1.486 18703 8857 1 25 . 1 1 15 15 GLU HA H 15 3.692 3.692 4.025 -0.333 18703 8858 1 25 . 1 1 15 15 GLU C C 15 177.819 177.819 178.309 -0.490 18703 8859 1 25 . 1 1 15 15 GLU CA C 15 59.239 59.239 59.168 0.071 18703 8860 1 25 . 1 1 15 15 GLU CB C 15 28.865 28.865 29.619 -0.754 18703 8861 1 25 . 1 1 15 15 GLU H H 15 8.542 8.542 7.669 0.873 18703 8862 1 25 . 1 1 16 16 GLU N N 16 116.016 116.016 118.472 -2.456 18703 8863 1 25 . 1 1 16 16 GLU HA H 16 3.955 3.955 3.991 -0.036 18703 8864 1 25 . 1 1 16 16 GLU C C 16 179.159 179.159 178.766 0.393 18703 8865 1 25 . 1 1 16 16 GLU CA C 16 59.324 59.324 59.013 0.311 18703 8866 1 25 . 1 1 16 16 GLU CB C 16 29.060 29.060 29.302 -0.242 18703 8867 1 25 . 1 1 16 16 GLU H H 16 7.492 7.492 7.864 -0.372 18703 8868 1 25 . 1 1 17 17 LYS N N 17 118.546 118.546 118.044 0.502 18703 8869 1 25 . 1 1 17 17 LYS HA H 17 4.117 4.117 4.164 -0.047 18703 8870 1 25 . 1 1 17 17 LYS C C 17 178.976 178.976 178.778 0.198 18703 8871 1 25 . 1 1 17 17 LYS CA C 17 58.837 58.837 58.906 -0.069 18703 8872 1 25 . 1 1 17 17 LYS CB C 17 32.538 32.538 32.627 -0.089 18703 8873 1 25 . 1 1 17 17 LYS H H 17 7.720 7.720 7.461 0.259 18703 8874 1 25 . 1 1 18 18 VAL N N 18 118.376 118.376 119.581 -1.205 18703 8875 1 25 . 1 1 18 18 VAL HA H 18 3.711 3.711 3.667 0.044 18703 8876 1 25 . 1 1 18 18 VAL C C 18 178.765 178.765 177.813 0.952 18703 8877 1 25 . 1 1 18 18 VAL CA C 18 66.237 66.237 66.002 0.235 18703 8878 1 25 . 1 1 18 18 VAL CB C 18 31.682 31.682 31.073 0.609 18703 8879 1 25 . 1 1 18 18 VAL H H 18 8.754 8.754 7.418 1.336 18703 8880 1 25 . 1 1 19 19 LYS N N 19 118.817 118.817 119.399 -0.582 18703 8881 1 25 . 1 1 19 19 LYS HA H 19 4.078 4.078 4.010 0.068 18703 8882 1 25 . 1 1 19 19 LYS C C 19 178.049 178.049 178.177 -0.128 18703 8883 1 25 . 1 1 19 19 LYS CA C 19 59.731 59.731 59.317 0.414 18703 8884 1 25 . 1 1 19 19 LYS CB C 19 32.523 32.523 32.109 0.414 18703 8885 1 25 . 1 1 19 19 LYS H H 19 8.299 8.299 8.561 -0.262 18703 8886 1 25 . 1 1 20 20 ALA N N 20 119.656 119.656 119.807 -0.151 18703 8887 1 25 . 1 1 20 20 ALA HA H 20 4.347 4.347 4.339 0.008 18703 8888 1 25 . 1 1 20 20 ALA C C 20 178.532 178.532 178.433 0.099 18703 8889 1 25 . 1 1 20 20 ALA CA C 20 52.853 52.853 53.615 -0.762 18703 8890 1 25 . 1 1 20 20 ALA CB C 20 18.832 18.832 18.896 -0.064 18703 8891 1 25 . 1 1 20 20 ALA H H 20 7.425 7.425 7.675 -0.250 18703 8892 1 25 . 1 1 21 21 LEU N N 21 118.594 118.594 116.198 2.396 18703 8893 1 25 . 1 1 21 21 LEU HA H 21 4.297 4.297 4.633 -0.336 18703 8894 1 25 . 1 1 21 21 LEU C C 21 177.784 177.784 177.976 -0.192 18703 8895 1 25 . 1 1 21 21 LEU CA C 21 55.750 55.750 55.026 0.724 18703 8896 1 25 . 1 1 21 21 LEU CB C 21 42.898 42.898 43.234 -0.336 18703 8897 1 25 . 1 1 21 21 LEU H H 21 7.508 7.508 7.732 -0.224 18703 8898 1 25 . 1 1 22 22 GLY N N 22 106.650 106.650 108.440 -1.790 18703 8899 1 25 . 1 1 22 22 GLY C C 22 173.605 173.605 173.305 0.300 18703 8900 1 25 . 1 1 22 22 GLY CA C 22 45.330 45.330 44.494 0.836 18703 8901 1 25 . 1 1 22 22 GLY H H 22 7.814 7.814 8.201 -0.387 18703 8902 1 25 . 1 1 23 23 GLY N N 23 108.011 108.011 107.297 0.714 18703 8903 1 25 . 1 1 23 23 GLY C C 23 174.061 174.061 172.739 1.322 18703 8904 1 25 . 1 1 23 23 GLY CA C 23 44.772 44.772 44.598 0.174 18703 8905 1 25 . 1 1 23 23 GLY H H 23 8.139 8.139 8.122 0.017 18703 8906 1 25 . 1 1 24 24 GLY N N 24 107.826 107.826 108.240 -0.414 18703 8907 1 25 . 1 1 24 24 GLY C C 24 175.046 175.046 174.240 0.806 18703 8908 1 25 . 1 1 24 24 GLY CA C 24 44.422 44.422 45.209 -0.787 18703 8909 1 25 . 1 1 24 24 GLY H H 24 8.497 8.497 8.151 0.346 18703 8910 1 25 . 1 1 25 25 GLY N N 25 108.830 108.830 112.114 -3.284 18703 8911 1 25 . 1 1 25 25 GLY C C 25 176.272 176.272 175.669 0.603 18703 8912 1 25 . 1 1 25 25 GLY CA C 25 47.101 47.101 45.962 1.139 18703 8913 1 25 . 1 1 25 25 GLY H H 25 8.616 8.616 8.564 0.052 18703 8914 1 25 . 1 1 26 26 ARG N N 26 123.109 123.109 124.239 -1.130 18703 8915 1 25 . 1 1 26 26 ARG HA H 26 4.283 4.283 4.075 0.208 18703 8916 1 25 . 1 1 26 26 ARG C C 26 177.848 177.848 177.601 0.247 18703 8917 1 25 . 1 1 26 26 ARG CA C 26 57.663 57.663 58.316 -0.653 18703 8918 1 25 . 1 1 26 26 ARG CB C 26 29.811 29.811 29.177 0.634 18703 8919 1 25 . 1 1 26 26 ARG H H 26 8.770 8.770 8.645 0.125 18703 8920 1 25 . 1 1 27 27 ILE N N 27 118.104 118.104 119.303 -1.199 18703 8921 1 25 . 1 1 27 27 ILE HA H 27 3.787 3.787 3.763 0.024 18703 8922 1 25 . 1 1 27 27 ILE C C 27 177.473 177.473 177.734 -0.261 18703 8923 1 25 . 1 1 27 27 ILE CA C 27 63.036 63.036 64.436 -1.400 18703 8924 1 25 . 1 1 27 27 ILE CB C 27 36.664 36.664 37.704 -1.040 18703 8925 1 25 . 1 1 27 27 ILE H H 27 7.708 7.708 7.570 0.138 18703 8926 1 25 . 1 1 28 28 GLU N N 28 119.934 119.934 119.914 0.020 18703 8927 1 25 . 1 1 28 28 GLU HA H 28 3.954 3.954 3.908 0.046 18703 8928 1 25 . 1 1 28 28 GLU C C 28 179.514 179.514 178.597 0.917 18703 8929 1 25 . 1 1 28 28 GLU CA C 28 59.450 59.450 59.762 -0.312 18703 8930 1 25 . 1 1 28 28 GLU CB C 28 29.600 29.600 29.340 0.260 18703 8931 1 25 . 1 1 28 28 GLU H H 28 7.872 7.872 8.091 -0.219 18703 8932 1 25 . 1 1 29 29 GLU N N 29 118.134 118.134 119.357 -1.223 18703 8933 1 25 . 1 1 29 29 GLU HA H 29 4.028 4.028 4.083 -0.055 18703 8934 1 25 . 1 1 29 29 GLU C C 29 179.182 179.182 179.160 0.022 18703 8935 1 25 . 1 1 29 29 GLU CA C 29 59.173 59.173 59.080 0.093 18703 8936 1 25 . 1 1 29 29 GLU CB C 29 29.503 29.503 29.433 0.070 18703 8937 1 25 . 1 1 29 29 GLU H H 29 8.166 8.166 7.691 0.475 18703 8938 1 25 . 1 1 30 30 LEU N N 30 120.242 120.242 117.586 2.656 18703 8939 1 25 . 1 1 30 30 LEU HA H 30 4.028 4.028 4.189 -0.161 18703 8940 1 25 . 1 1 30 30 LEU C C 30 178.796 178.796 178.688 0.108 18703 8941 1 25 . 1 1 30 30 LEU CA C 30 57.654 57.654 56.268 1.386 18703 8942 1 25 . 1 1 30 30 LEU CB C 30 41.629 41.629 41.864 -0.235 18703 8943 1 25 . 1 1 30 30 LEU H H 30 7.695 7.695 7.451 0.244 18703 8944 1 25 . 1 1 31 31 LYS N N 31 120.506 120.506 120.761 -0.255 18703 8945 1 25 . 1 1 31 31 LYS HA H 31 3.532 3.532 4.034 -0.502 18703 8946 1 25 . 1 1 31 31 LYS C C 31 178.919 178.919 178.345 0.574 18703 8947 1 25 . 1 1 31 31 LYS CA C 31 60.240 60.240 59.437 0.803 18703 8948 1 25 . 1 1 31 31 LYS CB C 31 32.015 32.015 32.283 -0.268 18703 8949 1 25 . 1 1 31 31 LYS H H 31 8.561 8.561 7.938 0.623 18703 8950 1 25 . 1 1 32 32 LYS N N 32 118.566 118.566 118.686 -0.120 18703 8951 1 25 . 1 1 32 32 LYS C C 32 179.392 179.392 179.010 0.382 18703 8952 1 25 . 1 1 32 32 LYS CA C 32 59.356 59.356 59.859 -0.504 18703 8953 1 25 . 1 1 32 32 LYS CB C 32 32.117 32.117 32.340 -0.223 18703 8954 1 25 . 1 1 32 32 LYS H H 32 7.699 7.699 7.563 0.136 18703 8955 1 25 . 1 1 33 33 LYS N N 33 118.964 118.964 117.963 1.001 18703 8956 1 25 . 1 1 33 33 LYS HA H 33 4.117 4.117 4.080 0.037 18703 8957 1 25 . 1 1 33 33 LYS C C 33 178.355 178.355 178.679 -0.324 18703 8958 1 25 . 1 1 33 33 LYS CA C 33 58.633 58.633 58.916 -0.283 18703 8959 1 25 . 1 1 33 33 LYS CB C 33 31.904 31.904 32.295 -0.391 18703 8960 1 25 . 1 1 33 33 LYS H H 33 7.752 7.752 7.666 0.086 18703 8961 1 25 . 1 1 34 34 CYS N N 34 119.956 119.956 118.822 1.134 18703 8962 1 25 . 1 1 34 34 CYS HA H 34 3.967 3.967 4.082 -0.115 18703 8963 1 25 . 1 1 34 34 CYS C C 34 175.521 175.521 176.776 -1.255 18703 8964 1 25 . 1 1 34 34 CYS CA C 34 60.987 60.987 63.036 -2.049 18703 8965 1 25 . 1 1 34 34 CYS CB C 34 36.600 36.600 26.461 10.139 18703 8966 1 25 . 1 1 34 34 CYS H H 34 8.393 8.393 7.734 0.659 18703 8967 1 25 . 1 1 35 35 GLU N N 35 120.327 120.327 120.066 0.261 18703 8968 1 25 . 1 1 35 35 GLU HA H 35 3.891 3.891 3.922 -0.031 18703 8969 1 25 . 1 1 35 35 GLU C C 35 179.684 179.684 178.730 0.954 18703 8970 1 25 . 1 1 35 35 GLU CA C 35 60.059 60.059 59.119 0.940 18703 8971 1 25 . 1 1 35 35 GLU CB C 35 29.718 29.718 28.674 1.044 18703 8972 1 25 . 1 1 35 35 GLU H H 35 8.558 8.558 7.755 0.803 18703 8973 1 25 . 1 1 36 36 GLU N N 36 120.190 120.190 120.021 0.169 18703 8974 1 25 . 1 1 36 36 GLU HA H 36 4.051 4.051 3.976 0.075 18703 8975 1 25 . 1 1 36 36 GLU C C 36 179.408 179.408 178.999 0.409 18703 8976 1 25 . 1 1 36 36 GLU CA C 36 59.148 59.148 58.885 0.263 18703 8977 1 25 . 1 1 36 36 GLU CB C 36 29.766 29.766 29.755 0.011 18703 8978 1 25 . 1 1 36 36 GLU H H 36 8.038 8.038 7.607 0.431 18703 8979 1 25 . 1 1 37 37 LEU N N 37 121.102 121.102 119.610 1.492 18703 8980 1 25 . 1 1 37 37 LEU HA H 37 4.079 4.079 4.195 -0.116 18703 8981 1 25 . 1 1 37 37 LEU C C 37 178.279 178.279 178.415 -0.136 18703 8982 1 25 . 1 1 37 37 LEU CA C 37 57.803 57.803 57.247 0.556 18703 8983 1 25 . 1 1 37 37 LEU CB C 37 41.502 41.502 41.731 -0.229 18703 8984 1 25 . 1 1 37 37 LEU H H 37 8.065 8.065 7.565 0.500 18703 8985 1 25 . 1 1 38 38 LYS N N 38 119.980 119.980 118.889 1.091 18703 8986 1 25 . 1 1 38 38 LYS HA H 38 3.851 3.851 3.963 -0.112 18703 8987 1 25 . 1 1 38 38 LYS C C 38 178.919 178.919 179.172 -0.253 18703 8988 1 25 . 1 1 38 38 LYS CA C 38 60.794 60.794 60.057 0.737 18703 8989 1 25 . 1 1 38 38 LYS CB C 38 32.863 32.863 32.331 0.532 18703 8990 1 25 . 1 1 38 38 LYS H H 38 8.741 8.741 8.070 0.670 18703 8991 1 25 . 1 1 39 39 LYS N N 39 118.307 118.307 117.689 0.618 18703 8992 1 25 . 1 1 39 39 LYS HA H 39 4.125 4.125 3.973 0.152 18703 8993 1 25 . 1 1 39 39 LYS C C 39 178.622 178.622 178.325 0.297 18703 8994 1 25 . 1 1 39 39 LYS CA C 39 58.993 58.993 59.195 -0.202 18703 8995 1 25 . 1 1 39 39 LYS CB C 39 32.097 32.097 31.754 0.343 18703 8996 1 25 . 1 1 39 39 LYS H H 39 7.584 7.584 7.698 -0.114 18703 8997 1 25 . 1 1 40 40 LYS N N 40 118.826 118.826 119.563 -0.737 18703 8998 1 25 . 1 1 40 40 LYS HA H 40 4.069 4.069 4.158 -0.089 18703 8999 1 25 . 1 1 40 40 LYS C C 40 179.802 179.802 178.802 1.000 18703 9000 1 25 . 1 1 40 40 LYS CA C 40 59.322 59.322 58.790 0.532 18703 9001 1 25 . 1 1 40 40 LYS CB C 40 32.505 32.505 32.360 0.145 18703 9002 1 25 . 1 1 40 40 LYS H H 40 7.945 7.945 7.351 0.594 18703 9003 1 25 . 1 1 41 41 ILE N N 41 118.958 118.958 118.735 0.223 18703 9004 1 25 . 1 1 41 41 ILE HA H 41 3.659 3.659 3.803 -0.144 18703 9005 1 25 . 1 1 41 41 ILE C C 41 178.146 178.146 176.918 1.228 18703 9006 1 25 . 1 1 41 41 ILE CA C 41 65.037 65.037 64.172 0.865 18703 9007 1 25 . 1 1 41 41 ILE CB C 41 37.950 37.950 37.850 0.100 18703 9008 1 25 . 1 1 41 41 ILE H H 41 8.369 8.369 8.036 0.333 18703 9009 1 25 . 1 1 42 42 GLU N N 42 120.331 120.331 117.155 3.176 18703 9010 1 25 . 1 1 42 42 GLU HA H 42 4.094 4.094 4.075 0.019 18703 9011 1 25 . 1 1 42 42 GLU C C 42 178.697 178.697 177.726 0.971 18703 9012 1 25 . 1 1 42 42 GLU CA C 42 58.927 58.927 58.509 0.418 18703 9013 1 25 . 1 1 42 42 GLU CB C 42 29.399 29.399 30.196 -0.797 18703 9014 1 25 . 1 1 42 42 GLU H H 42 7.805 7.805 7.594 0.211 18703 9015 1 25 . 1 1 43 43 GLU N N 43 117.120 117.120 116.537 0.583 18703 9016 1 25 . 1 1 43 43 GLU HA H 43 4.291 4.291 4.223 0.068 18703 9017 1 25 . 1 1 43 43 GLU C C 43 177.551 177.551 177.516 0.035 18703 9018 1 25 . 1 1 43 43 GLU CA C 43 56.800 56.800 57.041 -0.241 18703 9019 1 25 . 1 1 43 43 GLU CB C 43 29.931 29.931 29.773 0.158 18703 9020 1 25 . 1 1 43 43 GLU H H 43 7.701 7.701 7.652 0.049 18703 9021 1 25 . 1 1 44 44 LEU N N 44 120.940 120.940 120.353 0.587 18703 9022 1 25 . 1 1 44 44 LEU HA H 44 4.251 4.251 4.006 0.245 18703 9023 1 25 . 1 1 44 44 LEU C C 44 178.596 178.596 177.099 1.497 18703 9024 1 25 . 1 1 44 44 LEU CA C 44 56.448 56.448 55.191 1.257 18703 9025 1 25 . 1 1 44 44 LEU CB C 44 42.519 42.519 42.539 -0.020 18703 9026 1 25 . 1 1 44 44 LEU H H 44 7.581 7.581 7.407 0.174 18703 9027 1 25 . 1 1 45 45 GLY N N 45 108.689 108.689 106.777 1.912 18703 9028 1 25 . 1 1 45 45 GLY C C 45 174.853 174.853 173.928 0.925 18703 9029 1 25 . 1 1 45 45 GLY CA C 45 46.233 46.233 45.228 1.005 18703 9030 1 25 . 1 1 45 45 GLY H H 45 8.232 8.232 8.556 -0.324 18703 9031 1 25 . 1 1 46 46 GLY N N 46 108.029 108.029 107.706 0.323 18703 9032 1 25 . 1 1 46 46 GLY C C 46 174.351 174.351 174.153 0.198 18703 9033 1 25 . 1 1 46 46 GLY CA C 46 45.105 45.105 44.697 0.408 18703 9034 1 25 . 1 1 46 46 GLY H H 46 8.176 8.176 8.008 0.168 18703 9035 1 25 . 1 1 47 47 GLY N N 47 108.183 108.183 108.735 -0.552 18703 9036 1 25 . 1 1 47 47 GLY C C 47 174.671 174.671 174.478 0.193 18703 9037 1 25 . 1 1 47 47 GLY CA C 47 45.254 45.254 44.883 0.371 18703 9038 1 25 . 1 1 47 47 GLY H H 47 8.290 8.290 8.258 0.032 18703 9039 1 25 . 1 1 48 48 GLY N N 48 108.616 108.616 110.046 -1.430 18703 9040 1 25 . 1 1 48 48 GLY C C 48 174.321 174.321 174.558 -0.237 18703 9041 1 25 . 1 1 48 48 GLY CA C 48 45.192 45.192 45.082 0.110 18703 9042 1 25 . 1 1 48 48 GLY H H 48 8.027 8.027 8.619 -0.592 18703 9043 1 25 . 1 1 49 49 GLU N N 49 121.057 121.057 120.179 0.878 18703 9044 1 25 . 1 1 49 49 GLU HA H 49 4.425 4.425 4.419 0.006 18703 9045 1 25 . 1 1 49 49 GLU C C 49 177.072 177.072 177.810 -0.738 18703 9046 1 25 . 1 1 49 49 GLU CA C 49 56.330 56.330 56.740 -0.410 18703 9047 1 25 . 1 1 49 49 GLU CB C 49 29.602 29.602 30.047 -0.445 18703 9048 1 25 . 1 1 49 49 GLU H H 49 8.486 8.486 8.212 0.274 18703 9049 1 25 . 1 1 50 50 VAL N N 50 122.122 122.122 120.526 1.596 18703 9050 1 25 . 1 1 50 50 VAL HA H 50 3.792 3.792 3.720 0.072 18703 9051 1 25 . 1 1 50 50 VAL C C 50 176.774 176.774 177.333 -0.559 18703 9052 1 25 . 1 1 50 50 VAL CA C 50 64.864 64.864 65.140 -0.276 18703 9053 1 25 . 1 1 50 50 VAL CB C 50 32.179 32.179 31.595 0.584 18703 9054 1 25 . 1 1 50 50 VAL H H 50 8.095 8.095 8.077 0.018 18703 9055 1 25 . 1 1 51 51 LYS N N 51 120.602 120.602 117.825 2.777 18703 9056 1 25 . 1 1 51 51 LYS HA H 51 4.195 4.195 4.041 0.154 18703 9057 1 25 . 1 1 51 51 LYS C C 51 178.530 178.530 178.727 -0.197 18703 9058 1 25 . 1 1 51 51 LYS CA C 51 59.348 59.348 59.520 -0.172 18703 9059 1 25 . 1 1 51 51 LYS CB C 51 32.265 32.265 31.970 0.295 18703 9060 1 25 . 1 1 51 51 LYS H H 51 8.268 8.268 8.339 -0.071 18703 9061 1 25 . 1 1 52 52 LYS N N 52 117.547 117.547 120.441 -2.894 18703 9062 1 25 . 1 1 52 52 LYS HA H 52 4.162 4.162 4.052 0.110 18703 9063 1 25 . 1 1 52 52 LYS C C 52 179.132 179.132 178.866 0.266 18703 9064 1 25 . 1 1 52 52 LYS CA C 52 58.811 58.811 58.867 -0.056 18703 9065 1 25 . 1 1 52 52 LYS CB C 52 32.054 32.054 31.742 0.312 18703 9066 1 25 . 1 1 52 52 LYS H H 52 7.595 7.595 7.678 -0.083 18703 9067 1 25 . 1 1 53 53 VAL N N 53 119.190 119.190 118.432 0.758 18703 9068 1 25 . 1 1 53 53 VAL HA H 53 3.767 3.767 3.681 0.086 18703 9069 1 25 . 1 1 53 53 VAL C C 53 177.933 177.933 178.306 -0.373 18703 9070 1 25 . 1 1 53 53 VAL CA C 53 66.065 66.065 65.725 0.340 18703 9071 1 25 . 1 1 53 53 VAL CB C 53 31.248 31.248 30.962 0.286 18703 9072 1 25 . 1 1 53 53 VAL H H 53 7.597 7.597 7.586 0.011 18703 9073 1 25 . 1 1 54 54 GLU N N 54 120.226 120.226 118.925 1.301 18703 9074 1 25 . 1 1 54 54 GLU HA H 54 3.833 3.833 3.997 -0.164 18703 9075 1 25 . 1 1 54 54 GLU C C 54 179.352 179.352 178.677 0.675 18703 9076 1 25 . 1 1 54 54 GLU CA C 54 59.153 59.153 59.681 -0.528 18703 9077 1 25 . 1 1 54 54 GLU CB C 54 29.224 29.224 29.321 -0.097 18703 9078 1 25 . 1 1 54 54 GLU H H 54 8.609 8.609 7.641 0.968 18703 9079 1 25 . 1 1 55 55 GLU N N 55 119.148 119.148 119.352 -0.204 18703 9080 1 25 . 1 1 55 55 GLU HA H 55 4.084 4.084 4.100 -0.016 18703 9081 1 25 . 1 1 55 55 GLU C C 55 179.084 179.084 178.805 0.279 18703 9082 1 25 . 1 1 55 55 GLU CA C 55 59.295 59.295 59.090 0.205 18703 9083 1 25 . 1 1 55 55 GLU CB C 55 29.361 29.361 29.634 -0.273 18703 9084 1 25 . 1 1 55 55 GLU H H 55 7.713 7.713 7.796 -0.083 18703 9085 1 25 . 1 1 56 56 GLU N N 56 120.301 120.301 118.815 1.486 18703 9086 1 25 . 1 1 56 56 GLU HA H 56 4.079 4.079 4.146 -0.067 18703 9087 1 25 . 1 1 56 56 GLU C C 56 179.773 179.773 179.258 0.515 18703 9088 1 25 . 1 1 56 56 GLU CA C 56 59.528 59.528 59.174 0.354 18703 9089 1 25 . 1 1 56 56 GLU CB C 56 30.162 30.162 29.805 0.357 18703 9090 1 25 . 1 1 56 56 GLU H H 56 7.899 7.899 7.555 0.344 18703 9091 1 25 . 1 1 57 57 VAL N N 57 121.536 121.536 119.137 2.399 18703 9092 1 25 . 1 1 57 57 VAL HA H 57 3.540 3.540 3.827 -0.287 18703 9093 1 25 . 1 1 57 57 VAL C C 57 176.984 176.984 177.797 -0.813 18703 9094 1 25 . 1 1 57 57 VAL CA C 57 66.734 66.734 65.466 1.268 18703 9095 1 25 . 1 1 57 57 VAL CB C 57 31.425 31.425 31.608 -0.183 18703 9096 1 25 . 1 1 57 57 VAL H H 57 8.652 8.652 7.449 1.203 18703 9097 1 25 . 1 1 58 58 LYS N N 58 120.219 120.219 119.860 0.359 18703 9098 1 25 . 1 1 58 58 LYS HA H 58 4.199 4.199 4.104 0.095 18703 9099 1 25 . 1 1 58 58 LYS C C 58 178.972 178.972 178.587 0.385 18703 9100 1 25 . 1 1 58 58 LYS CA C 58 59.357 59.357 59.097 0.260 18703 9101 1 25 . 1 1 58 58 LYS CB C 58 32.186 32.186 32.079 0.107 18703 9102 1 25 . 1 1 58 58 LYS H H 58 7.791 7.791 7.432 0.359 18703 9103 1 25 . 1 1 59 59 LYS N N 59 118.252 118.252 119.883 -1.631 18703 9104 1 25 . 1 1 59 59 LYS HA H 59 4.069 4.069 4.146 -0.077 18703 9105 1 25 . 1 1 59 59 LYS C C 59 179.180 179.180 178.578 0.602 18703 9106 1 25 . 1 1 59 59 LYS CA C 59 59.285 59.285 59.101 0.184 18703 9107 1 25 . 1 1 59 59 LYS CB C 59 32.345 32.345 32.175 0.170 18703 9108 1 25 . 1 1 59 59 LYS H H 59 7.849 7.849 7.500 0.349 18703 9109 1 25 . 1 1 60 60 LEU N N 60 121.243 121.243 119.708 1.535 18703 9110 1 25 . 1 1 60 60 LEU HA H 60 4.242 4.242 4.151 0.091 18703 9111 1 25 . 1 1 60 60 LEU C C 60 178.413 178.413 178.204 0.209 18703 9112 1 25 . 1 1 60 60 LEU CA C 60 57.798 57.798 57.285 0.513 18703 9113 1 25 . 1 1 60 60 LEU CB C 60 41.150 41.150 42.281 -1.131 18703 9114 1 25 . 1 1 60 60 LEU H H 60 7.825 7.825 7.570 0.255 18703 9115 1 25 . 1 1 61 61 GLU N N 61 118.844 118.844 119.861 -1.017 18703 9116 1 25 . 1 1 61 61 GLU HA H 61 3.800 3.800 3.930 -0.130 18703 9117 1 25 . 1 1 61 61 GLU C C 61 179.078 179.078 178.184 0.894 18703 9118 1 25 . 1 1 61 61 GLU CA C 61 60.104 60.104 59.955 0.149 18703 9119 1 25 . 1 1 61 61 GLU CB C 61 29.864 29.864 29.683 0.181 18703 9120 1 25 . 1 1 61 61 GLU H H 61 8.582 8.582 7.784 0.798 18703 9121 1 25 . 1 1 62 62 GLU N N 62 117.659 117.659 118.409 -0.750 18703 9122 1 25 . 1 1 62 62 GLU HA H 62 3.990 3.990 4.107 -0.117 18703 9123 1 25 . 1 1 62 62 GLU C C 62 178.847 178.847 178.927 -0.080 18703 9124 1 25 . 1 1 62 62 GLU CA C 62 59.067 59.067 58.857 0.210 18703 9125 1 25 . 1 1 62 62 GLU CB C 62 29.440 29.440 29.787 -0.347 18703 9126 1 25 . 1 1 62 62 GLU H H 62 8.032 8.032 7.631 0.401 18703 9127 1 25 . 1 1 63 63 GLU N N 63 119.290 119.290 119.800 -0.510 18703 9128 1 25 . 1 1 63 63 GLU HA H 63 4.012 4.012 4.098 -0.086 18703 9129 1 25 . 1 1 63 63 GLU C C 63 179.784 179.784 179.367 0.417 18703 9130 1 25 . 1 1 63 63 GLU CA C 63 59.300 59.300 59.357 -0.057 18703 9131 1 25 . 1 1 63 63 GLU CB C 63 29.728 29.728 29.613 0.115 18703 9132 1 25 . 1 1 63 63 GLU H H 63 7.958 7.958 7.428 0.530 18703 9133 1 25 . 1 1 64 64 ILE N N 64 118.453 118.453 119.348 -0.895 18703 9134 1 25 . 1 1 64 64 ILE HA H 64 3.711 3.711 3.773 -0.062 18703 9135 1 25 . 1 1 64 64 ILE C C 64 177.655 177.655 177.815 -0.160 18703 9136 1 25 . 1 1 64 64 ILE CA C 64 64.256 64.256 64.263 -0.007 18703 9137 1 25 . 1 1 64 64 ILE CB C 64 38.002 38.002 37.569 0.433 18703 9138 1 25 . 1 1 64 64 ILE H H 64 8.160 8.160 7.620 0.540 18703 9139 1 25 . 1 1 65 65 LYS N N 65 118.871 118.871 119.655 -0.784 18703 9140 1 25 . 1 1 65 65 LYS HA H 65 4.111 4.111 4.091 0.020 18703 9141 1 25 . 1 1 65 65 LYS C C 65 177.076 177.076 177.787 -0.711 18703 9142 1 25 . 1 1 65 65 LYS CA C 65 58.421 58.421 58.899 -0.478 18703 9143 1 25 . 1 1 65 65 LYS CB C 65 32.639 32.639 32.489 0.150 18703 9144 1 25 . 1 1 65 65 LYS H H 65 7.664 7.664 7.814 -0.150 18703 9145 1 25 . 1 1 66 66 LYS N N 66 116.944 116.944 117.746 -0.802 18703 9146 1 25 . 1 1 66 66 LYS HA H 66 4.320 4.320 4.116 0.204 18703 9147 1 25 . 1 1 66 66 LYS C C 66 175.897 175.897 177.774 -1.877 18703 9148 1 25 . 1 1 66 66 LYS CA C 66 56.352 56.352 58.217 -1.865 18703 9149 1 25 . 1 1 66 66 LYS CB C 66 33.024 33.024 33.060 -0.036 18703 9150 1 25 . 1 1 66 66 LYS H H 66 7.246 7.246 7.875 -0.629 18703 9151 1 26 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.495 -0.249 18703 9152 1 26 . 1 1 3 3 ARG C C 3 178.379 178.379 176.502 1.877 18703 9153 1 26 . 1 1 3 3 ARG CA C 3 58.367 58.367 56.857 1.510 18703 9154 1 26 . 1 1 3 3 ARG CB C 3 30.691 30.691 31.127 -0.436 18703 9155 1 26 . 1 1 3 3 ARG H H 3 7.905 7.905 8.446 -0.541 18703 9156 1 26 . 1 1 4 4 VAL N N 4 118.966 118.966 121.764 -2.798 18703 9157 1 26 . 1 1 4 4 VAL HA H 4 3.803 3.803 3.876 -0.073 18703 9158 1 26 . 1 1 4 4 VAL C C 4 176.968 176.968 177.003 -0.035 18703 9159 1 26 . 1 1 4 4 VAL CA C 4 65.441 65.441 64.231 1.210 18703 9160 1 26 . 1 1 4 4 VAL CB C 4 31.710 31.710 31.669 0.041 18703 9161 1 26 . 1 1 4 4 VAL H H 4 8.070 8.070 8.506 -0.436 18703 9162 1 26 . 1 1 5 5 LYS N N 5 122.058 122.058 119.079 2.979 18703 9163 1 26 . 1 1 5 5 LYS HA H 5 4.154 4.154 3.984 0.170 18703 9164 1 26 . 1 1 5 5 LYS C C 5 178.553 178.553 178.311 0.242 18703 9165 1 26 . 1 1 5 5 LYS CA C 5 58.712 58.712 59.521 -0.809 18703 9166 1 26 . 1 1 5 5 LYS CB C 5 31.788 31.788 31.713 0.075 18703 9167 1 26 . 1 1 5 5 LYS H H 5 7.798 7.798 8.557 -0.759 18703 9168 1 26 . 1 1 6 6 ALA N N 6 119.955 119.955 120.857 -0.902 18703 9169 1 26 . 1 1 6 6 ALA HA H 6 4.198 4.198 4.227 -0.029 18703 9170 1 26 . 1 1 6 6 ALA C C 6 180.974 180.974 179.331 1.643 18703 9171 1 26 . 1 1 6 6 ALA CA C 6 54.850 54.850 54.373 0.477 18703 9172 1 26 . 1 1 6 6 ALA CB C 6 17.995 17.995 18.396 -0.401 18703 9173 1 26 . 1 1 6 6 ALA H H 6 7.928 7.928 7.536 0.392 18703 9174 1 26 . 1 1 7 7 LEU N N 7 119.211 119.211 119.298 -0.087 18703 9175 1 26 . 1 1 7 7 LEU HA H 7 4.124 4.124 3.981 0.143 18703 9176 1 26 . 1 1 7 7 LEU C C 7 178.353 178.353 178.461 -0.108 18703 9177 1 26 . 1 1 7 7 LEU CA C 7 57.658 57.658 57.147 0.511 18703 9178 1 26 . 1 1 7 7 LEU CB C 7 41.971 41.971 42.019 -0.048 18703 9179 1 26 . 1 1 7 7 LEU H H 7 7.594 7.594 7.484 0.110 18703 9180 1 26 . 1 1 8 8 GLU N N 8 120.258 120.258 117.967 2.291 18703 9181 1 26 . 1 1 8 8 GLU HA H 8 3.846 3.846 4.011 -0.165 18703 9182 1 26 . 1 1 8 8 GLU C C 8 179.546 179.546 178.813 0.733 18703 9183 1 26 . 1 1 8 8 GLU CA C 8 60.006 60.006 59.551 0.455 18703 9184 1 26 . 1 1 8 8 GLU CB C 8 29.683 29.683 29.473 0.210 18703 9185 1 26 . 1 1 8 8 GLU H H 8 8.382 8.382 7.824 0.558 18703 9186 1 26 . 1 1 9 9 GLU N N 9 118.584 118.584 118.902 -0.318 18703 9187 1 26 . 1 1 9 9 GLU HA H 9 4.039 4.039 4.139 -0.100 18703 9188 1 26 . 1 1 9 9 GLU C C 9 179.635 179.635 178.615 1.020 18703 9189 1 26 . 1 1 9 9 GLU CA C 9 59.235 59.235 58.694 0.541 18703 9190 1 26 . 1 1 9 9 GLU CB C 9 29.358 29.358 29.171 0.187 18703 9191 1 26 . 1 1 9 9 GLU H H 9 7.908 7.908 7.734 0.174 18703 9192 1 26 . 1 1 10 10 LYS N N 10 120.956 120.956 120.109 0.847 18703 9193 1 26 . 1 1 10 10 LYS HA H 10 4.190 4.190 4.094 0.096 18703 9194 1 26 . 1 1 10 10 LYS C C 10 179.395 179.395 179.011 0.384 18703 9195 1 26 . 1 1 10 10 LYS CA C 10 59.231 59.231 59.345 -0.114 18703 9196 1 26 . 1 1 10 10 LYS CB C 10 32.211 32.211 32.647 -0.436 18703 9197 1 26 . 1 1 10 10 LYS H H 10 8.009 8.009 7.542 0.467 18703 9198 1 26 . 1 1 11 11 VAL N N 11 119.577 119.577 117.668 1.909 18703 9199 1 26 . 1 1 11 11 VAL HA H 11 3.844 3.844 3.719 0.125 18703 9200 1 26 . 1 1 11 11 VAL C C 11 177.078 177.078 177.545 -0.467 18703 9201 1 26 . 1 1 11 11 VAL CA C 11 66.407 66.407 65.828 0.579 18703 9202 1 26 . 1 1 11 11 VAL CB C 11 31.252 31.252 31.450 -0.197 18703 9203 1 26 . 1 1 11 11 VAL H H 11 8.488 8.488 7.497 0.991 18703 9204 1 26 . 1 1 12 12 LYS N N 12 122.864 122.864 120.394 2.470 18703 9205 1 26 . 1 1 12 12 LYS HA H 12 4.189 4.189 3.946 0.243 18703 9206 1 26 . 1 1 12 12 LYS C C 12 178.755 178.755 178.219 0.536 18703 9207 1 26 . 1 1 12 12 LYS CA C 12 59.375 59.375 59.697 -0.322 18703 9208 1 26 . 1 1 12 12 LYS CB C 12 31.991 31.991 32.220 -0.229 18703 9209 1 26 . 1 1 12 12 LYS H H 12 7.944 7.944 7.559 0.385 18703 9210 1 26 . 1 1 13 13 ALA N N 13 121.202 121.202 120.542 0.660 18703 9211 1 26 . 1 1 13 13 ALA HA H 13 4.209 4.209 4.265 -0.056 18703 9212 1 26 . 1 1 13 13 ALA C C 13 181.060 181.060 179.507 1.553 18703 9213 1 26 . 1 1 13 13 ALA CA C 13 54.710 54.710 54.199 0.511 18703 9214 1 26 . 1 1 13 13 ALA CB C 13 17.861 17.861 18.422 -0.561 18703 9215 1 26 . 1 1 13 13 ALA H H 13 7.563 7.563 7.458 0.105 18703 9216 1 26 . 1 1 14 14 LEU N N 14 120.014 120.014 119.670 0.344 18703 9217 1 26 . 1 1 14 14 LEU HA H 14 4.072 4.072 4.008 0.064 18703 9218 1 26 . 1 1 14 14 LEU C C 14 177.862 177.862 178.135 -0.273 18703 9219 1 26 . 1 1 14 14 LEU CA C 14 57.864 57.864 57.353 0.510 18703 9220 1 26 . 1 1 14 14 LEU CB C 14 41.539 41.539 42.126 -0.587 18703 9221 1 26 . 1 1 14 14 LEU H H 14 8.087 8.087 7.503 0.584 18703 9222 1 26 . 1 1 15 15 GLU N N 15 121.644 121.644 120.284 1.360 18703 9223 1 26 . 1 1 15 15 GLU HA H 15 3.692 3.692 3.967 -0.275 18703 9224 1 26 . 1 1 15 15 GLU C C 15 177.819 177.819 178.303 -0.484 18703 9225 1 26 . 1 1 15 15 GLU CA C 15 59.239 59.239 59.401 -0.162 18703 9226 1 26 . 1 1 15 15 GLU CB C 15 28.865 28.865 29.432 -0.567 18703 9227 1 26 . 1 1 15 15 GLU H H 15 8.542 8.542 7.672 0.870 18703 9228 1 26 . 1 1 16 16 GLU N N 16 116.016 116.016 118.087 -2.071 18703 9229 1 26 . 1 1 16 16 GLU HA H 16 3.955 3.955 3.983 -0.028 18703 9230 1 26 . 1 1 16 16 GLU C C 16 179.159 179.159 179.014 0.145 18703 9231 1 26 . 1 1 16 16 GLU CA C 16 59.324 59.324 59.474 -0.150 18703 9232 1 26 . 1 1 16 16 GLU CB C 16 29.060 29.060 29.282 -0.223 18703 9233 1 26 . 1 1 16 16 GLU H H 16 7.492 7.492 8.232 -0.740 18703 9234 1 26 . 1 1 17 17 LYS N N 17 118.546 118.546 118.349 0.197 18703 9235 1 26 . 1 1 17 17 LYS HA H 17 4.117 4.117 4.141 -0.024 18703 9236 1 26 . 1 1 17 17 LYS C C 17 178.976 178.976 177.781 1.195 18703 9237 1 26 . 1 1 17 17 LYS CA C 17 58.837 58.837 58.594 0.243 18703 9238 1 26 . 1 1 17 17 LYS CB C 17 32.538 32.538 32.273 0.265 18703 9239 1 26 . 1 1 17 17 LYS H H 17 7.720 7.720 7.500 0.220 18703 9240 1 26 . 1 1 18 18 VAL N N 18 118.376 118.376 118.634 -0.258 18703 9241 1 26 . 1 1 18 18 VAL HA H 18 3.711 3.711 3.755 -0.044 18703 9242 1 26 . 1 1 18 18 VAL C C 18 178.765 178.765 177.674 1.091 18703 9243 1 26 . 1 1 18 18 VAL CA C 18 66.237 66.237 65.631 0.606 18703 9244 1 26 . 1 1 18 18 VAL CB C 18 31.682 31.682 31.867 -0.185 18703 9245 1 26 . 1 1 18 18 VAL H H 18 8.754 8.754 7.525 1.229 18703 9246 1 26 . 1 1 19 19 LYS N N 19 118.817 118.817 118.591 0.226 18703 9247 1 26 . 1 1 19 19 LYS HA H 19 4.078 4.078 3.949 0.129 18703 9248 1 26 . 1 1 19 19 LYS C C 19 178.049 178.049 178.330 -0.281 18703 9249 1 26 . 1 1 19 19 LYS CA C 19 59.731 59.731 59.597 0.134 18703 9250 1 26 . 1 1 19 19 LYS CB C 19 32.523 32.523 32.174 0.349 18703 9251 1 26 . 1 1 19 19 LYS H H 19 8.299 8.299 8.540 -0.241 18703 9252 1 26 . 1 1 20 20 ALA N N 20 119.656 119.656 119.328 0.328 18703 9253 1 26 . 1 1 20 20 ALA HA H 20 4.347 4.347 4.348 -0.001 18703 9254 1 26 . 1 1 20 20 ALA C C 20 178.532 178.532 178.582 -0.050 18703 9255 1 26 . 1 1 20 20 ALA CA C 20 52.853 52.853 53.045 -0.192 18703 9256 1 26 . 1 1 20 20 ALA CB C 20 18.832 18.832 18.857 -0.024 18703 9257 1 26 . 1 1 20 20 ALA H H 20 7.425 7.425 7.547 -0.122 18703 9258 1 26 . 1 1 21 21 LEU N N 21 118.594 118.594 120.323 -1.729 18703 9259 1 26 . 1 1 21 21 LEU HA H 21 4.297 4.297 4.200 0.097 18703 9260 1 26 . 1 1 21 21 LEU C C 21 177.784 177.784 177.992 -0.208 18703 9261 1 26 . 1 1 21 21 LEU CA C 21 55.750 55.750 55.532 0.218 18703 9262 1 26 . 1 1 21 21 LEU CB C 21 42.898 42.898 42.657 0.241 18703 9263 1 26 . 1 1 21 21 LEU H H 21 7.508 7.508 7.670 -0.162 18703 9264 1 26 . 1 1 22 22 GLY N N 22 106.650 106.650 105.182 1.468 18703 9265 1 26 . 1 1 22 22 GLY C C 22 173.605 173.605 172.802 0.803 18703 9266 1 26 . 1 1 22 22 GLY CA C 22 45.330 45.330 44.551 0.779 18703 9267 1 26 . 1 1 22 22 GLY H H 22 7.814 7.814 7.951 -0.137 18703 9268 1 26 . 1 1 23 23 GLY N N 23 108.011 108.011 107.508 0.503 18703 9269 1 26 . 1 1 23 23 GLY C C 23 174.061 174.061 172.906 1.155 18703 9270 1 26 . 1 1 23 23 GLY CA C 23 44.772 44.772 45.107 -0.335 18703 9271 1 26 . 1 1 23 23 GLY H H 23 8.139 8.139 8.159 -0.020 18703 9272 1 26 . 1 1 24 24 GLY N N 24 107.826 107.826 107.621 0.205 18703 9273 1 26 . 1 1 24 24 GLY C C 24 175.046 175.046 173.208 1.838 18703 9274 1 26 . 1 1 24 24 GLY CA C 24 44.422 44.422 45.304 -0.882 18703 9275 1 26 . 1 1 24 24 GLY H H 24 8.497 8.497 8.107 0.390 18703 9276 1 26 . 1 1 25 25 GLY N N 25 108.830 108.830 109.832 -1.002 18703 9277 1 26 . 1 1 25 25 GLY C C 25 176.272 176.272 175.117 1.155 18703 9278 1 26 . 1 1 25 25 GLY CA C 25 47.101 47.101 44.973 2.128 18703 9279 1 26 . 1 1 25 25 GLY H H 25 8.616 8.616 7.990 0.626 18703 9280 1 26 . 1 1 26 26 ARG N N 26 123.109 123.109 122.215 0.894 18703 9281 1 26 . 1 1 26 26 ARG HA H 26 4.283 4.283 4.124 0.159 18703 9282 1 26 . 1 1 26 26 ARG C C 26 177.848 177.848 178.397 -0.549 18703 9283 1 26 . 1 1 26 26 ARG CA C 26 57.663 57.663 58.339 -0.676 18703 9284 1 26 . 1 1 26 26 ARG CB C 26 29.811 29.811 29.324 0.487 18703 9285 1 26 . 1 1 26 26 ARG H H 26 8.770 8.770 8.644 0.126 18703 9286 1 26 . 1 1 27 27 ILE N N 27 118.104 118.104 118.463 -0.359 18703 9287 1 26 . 1 1 27 27 ILE HA H 27 3.787 3.787 3.823 -0.036 18703 9288 1 26 . 1 1 27 27 ILE C C 27 177.473 177.473 177.561 -0.088 18703 9289 1 26 . 1 1 27 27 ILE CA C 27 63.036 63.036 64.138 -1.102 18703 9290 1 26 . 1 1 27 27 ILE CB C 27 36.664 36.664 37.673 -1.009 18703 9291 1 26 . 1 1 27 27 ILE H H 27 7.708 7.708 8.073 -0.365 18703 9292 1 26 . 1 1 28 28 GLU N N 28 119.934 119.934 119.970 -0.036 18703 9293 1 26 . 1 1 28 28 GLU HA H 28 3.954 3.954 3.912 0.043 18703 9294 1 26 . 1 1 28 28 GLU C C 28 179.514 179.514 178.671 0.843 18703 9295 1 26 . 1 1 28 28 GLU CA C 28 59.450 59.450 59.972 -0.522 18703 9296 1 26 . 1 1 28 28 GLU CB C 28 29.600 29.600 29.435 0.165 18703 9297 1 26 . 1 1 28 28 GLU H H 28 7.872 7.872 7.804 0.068 18703 9298 1 26 . 1 1 29 29 GLU N N 29 118.134 118.134 119.830 -1.696 18703 9299 1 26 . 1 1 29 29 GLU HA H 29 4.028 4.028 4.093 -0.065 18703 9300 1 26 . 1 1 29 29 GLU C C 29 179.182 179.182 179.246 -0.064 18703 9301 1 26 . 1 1 29 29 GLU CA C 29 59.173 59.173 59.236 -0.063 18703 9302 1 26 . 1 1 29 29 GLU CB C 29 29.503 29.503 29.455 0.048 18703 9303 1 26 . 1 1 29 29 GLU H H 29 8.166 8.166 7.603 0.563 18703 9304 1 26 . 1 1 30 30 LEU N N 30 120.242 120.242 117.812 2.430 18703 9305 1 26 . 1 1 30 30 LEU HA H 30 4.028 4.028 4.098 -0.070 18703 9306 1 26 . 1 1 30 30 LEU C C 30 178.796 178.796 178.818 -0.022 18703 9307 1 26 . 1 1 30 30 LEU CA C 30 57.654 57.654 56.632 1.022 18703 9308 1 26 . 1 1 30 30 LEU CB C 30 41.629 41.629 41.796 -0.167 18703 9309 1 26 . 1 1 30 30 LEU H H 30 7.695 7.695 7.616 0.079 18703 9310 1 26 . 1 1 31 31 LYS N N 31 120.506 120.506 120.486 0.020 18703 9311 1 26 . 1 1 31 31 LYS HA H 31 3.532 3.532 4.040 -0.508 18703 9312 1 26 . 1 1 31 31 LYS C C 31 178.919 178.919 178.318 0.601 18703 9313 1 26 . 1 1 31 31 LYS CA C 31 60.240 60.240 59.366 0.874 18703 9314 1 26 . 1 1 31 31 LYS CB C 31 32.015 32.015 32.298 -0.283 18703 9315 1 26 . 1 1 31 31 LYS H H 31 8.561 8.561 7.676 0.885 18703 9316 1 26 . 1 1 32 32 LYS N N 32 118.566 118.566 118.272 0.294 18703 9317 1 26 . 1 1 32 32 LYS C C 32 179.392 179.392 179.191 0.201 18703 9318 1 26 . 1 1 32 32 LYS CA C 32 59.356 59.356 59.711 -0.355 18703 9319 1 26 . 1 1 32 32 LYS CB C 32 32.117 32.117 32.351 -0.234 18703 9320 1 26 . 1 1 32 32 LYS H H 32 7.699 7.699 7.557 0.142 18703 9321 1 26 . 1 1 33 33 LYS N N 33 118.964 118.964 118.175 0.789 18703 9322 1 26 . 1 1 33 33 LYS HA H 33 4.117 4.117 4.175 -0.058 18703 9323 1 26 . 1 1 33 33 LYS C C 33 178.355 178.355 178.688 -0.333 18703 9324 1 26 . 1 1 33 33 LYS CA C 33 58.633 58.633 59.104 -0.471 18703 9325 1 26 . 1 1 33 33 LYS CB C 33 31.904 31.904 32.523 -0.619 18703 9326 1 26 . 1 1 33 33 LYS H H 33 7.752 7.752 7.622 0.130 18703 9327 1 26 . 1 1 34 34 CYS N N 34 119.956 119.956 118.817 1.139 18703 9328 1 26 . 1 1 34 34 CYS HA H 34 3.967 3.967 4.109 -0.142 18703 9329 1 26 . 1 1 34 34 CYS C C 34 175.521 175.521 176.797 -1.276 18703 9330 1 26 . 1 1 34 34 CYS CA C 34 60.987 60.987 62.876 -1.889 18703 9331 1 26 . 1 1 34 34 CYS CB C 34 36.600 36.600 26.695 9.905 18703 9332 1 26 . 1 1 34 34 CYS H H 34 8.393 8.393 7.550 0.843 18703 9333 1 26 . 1 1 35 35 GLU N N 35 120.327 120.327 120.005 0.322 18703 9334 1 26 . 1 1 35 35 GLU HA H 35 3.891 3.891 3.930 -0.039 18703 9335 1 26 . 1 1 35 35 GLU C C 35 179.684 179.684 178.604 1.080 18703 9336 1 26 . 1 1 35 35 GLU CA C 35 60.059 60.059 59.270 0.789 18703 9337 1 26 . 1 1 35 35 GLU CB C 35 29.718 29.718 28.604 1.114 18703 9338 1 26 . 1 1 35 35 GLU H H 35 8.558 8.558 7.803 0.755 18703 9339 1 26 . 1 1 36 36 GLU N N 36 120.190 120.190 119.787 0.403 18703 9340 1 26 . 1 1 36 36 GLU HA H 36 4.051 4.051 3.987 0.064 18703 9341 1 26 . 1 1 36 36 GLU C C 36 179.408 179.408 179.050 0.358 18703 9342 1 26 . 1 1 36 36 GLU CA C 36 59.148 59.148 58.837 0.311 18703 9343 1 26 . 1 1 36 36 GLU CB C 36 29.766 29.766 29.717 0.049 18703 9344 1 26 . 1 1 36 36 GLU H H 36 8.038 8.038 7.605 0.433 18703 9345 1 26 . 1 1 37 37 LEU N N 37 121.102 121.102 119.342 1.760 18703 9346 1 26 . 1 1 37 37 LEU HA H 37 4.079 4.079 4.208 -0.129 18703 9347 1 26 . 1 1 37 37 LEU C C 37 178.279 178.279 178.246 0.033 18703 9348 1 26 . 1 1 37 37 LEU CA C 37 57.803 57.803 57.231 0.572 18703 9349 1 26 . 1 1 37 37 LEU CB C 37 41.502 41.502 41.684 -0.182 18703 9350 1 26 . 1 1 37 37 LEU H H 37 8.065 8.065 7.433 0.632 18703 9351 1 26 . 1 1 38 38 LYS N N 38 119.980 119.980 119.183 0.797 18703 9352 1 26 . 1 1 38 38 LYS HA H 38 3.851 3.851 3.912 -0.061 18703 9353 1 26 . 1 1 38 38 LYS C C 38 178.919 178.919 179.136 -0.217 18703 9354 1 26 . 1 1 38 38 LYS CA C 38 60.794 60.794 59.766 1.028 18703 9355 1 26 . 1 1 38 38 LYS CB C 38 32.863 32.863 32.225 0.638 18703 9356 1 26 . 1 1 38 38 LYS H H 38 8.741 8.741 7.947 0.794 18703 9357 1 26 . 1 1 39 39 LYS N N 39 118.307 118.307 117.307 1.000 18703 9358 1 26 . 1 1 39 39 LYS HA H 39 4.125 4.125 4.261 -0.136 18703 9359 1 26 . 1 1 39 39 LYS C C 39 178.622 178.622 178.582 0.040 18703 9360 1 26 . 1 1 39 39 LYS CA C 39 58.993 58.993 59.033 -0.040 18703 9361 1 26 . 1 1 39 39 LYS CB C 39 32.097 32.097 31.592 0.505 18703 9362 1 26 . 1 1 39 39 LYS H H 39 7.584 7.584 7.683 -0.099 18703 9363 1 26 . 1 1 40 40 LYS N N 40 118.826 118.826 119.513 -0.687 18703 9364 1 26 . 1 1 40 40 LYS HA H 40 4.069 4.069 4.145 -0.076 18703 9365 1 26 . 1 1 40 40 LYS C C 40 179.802 179.802 178.991 0.811 18703 9366 1 26 . 1 1 40 40 LYS CA C 40 59.322 59.322 58.812 0.510 18703 9367 1 26 . 1 1 40 40 LYS CB C 40 32.505 32.505 32.468 0.037 18703 9368 1 26 . 1 1 40 40 LYS H H 40 7.945 7.945 7.340 0.605 18703 9369 1 26 . 1 1 41 41 ILE N N 41 118.958 118.958 117.749 1.209 18703 9370 1 26 . 1 1 41 41 ILE HA H 41 3.659 3.659 3.840 -0.181 18703 9371 1 26 . 1 1 41 41 ILE C C 41 178.146 178.146 176.735 1.411 18703 9372 1 26 . 1 1 41 41 ILE CA C 41 65.037 65.037 63.751 1.286 18703 9373 1 26 . 1 1 41 41 ILE CB C 41 37.950 37.950 38.023 -0.073 18703 9374 1 26 . 1 1 41 41 ILE H H 41 8.369 8.369 8.038 0.331 18703 9375 1 26 . 1 1 42 42 GLU N N 42 120.331 120.331 116.207 4.124 18703 9376 1 26 . 1 1 42 42 GLU HA H 42 4.094 4.094 4.065 0.029 18703 9377 1 26 . 1 1 42 42 GLU C C 42 178.697 178.697 177.783 0.914 18703 9378 1 26 . 1 1 42 42 GLU CA C 42 58.927 58.927 58.478 0.448 18703 9379 1 26 . 1 1 42 42 GLU CB C 42 29.399 29.399 29.948 -0.549 18703 9380 1 26 . 1 1 42 42 GLU H H 42 7.805 7.805 7.604 0.201 18703 9381 1 26 . 1 1 43 43 GLU N N 43 117.120 117.120 117.003 0.117 18703 9382 1 26 . 1 1 43 43 GLU HA H 43 4.291 4.291 4.187 0.104 18703 9383 1 26 . 1 1 43 43 GLU C C 43 177.551 177.551 177.537 0.014 18703 9384 1 26 . 1 1 43 43 GLU CA C 43 56.800 56.800 57.045 -0.245 18703 9385 1 26 . 1 1 43 43 GLU CB C 43 29.931 29.931 29.742 0.189 18703 9386 1 26 . 1 1 43 43 GLU H H 43 7.701 7.701 7.556 0.145 18703 9387 1 26 . 1 1 44 44 LEU N N 44 120.940 120.940 120.272 0.668 18703 9388 1 26 . 1 1 44 44 LEU HA H 44 4.251 4.251 4.140 0.111 18703 9389 1 26 . 1 1 44 44 LEU C C 44 178.596 178.596 176.691 1.905 18703 9390 1 26 . 1 1 44 44 LEU CA C 44 56.448 56.448 55.410 1.038 18703 9391 1 26 . 1 1 44 44 LEU CB C 44 42.519 42.519 42.679 -0.160 18703 9392 1 26 . 1 1 44 44 LEU H H 44 7.581 7.581 7.341 0.240 18703 9393 1 26 . 1 1 45 45 GLY N N 45 108.689 108.689 106.076 2.613 18703 9394 1 26 . 1 1 45 45 GLY C C 45 174.853 174.853 173.138 1.715 18703 9395 1 26 . 1 1 45 45 GLY CA C 45 46.233 46.233 45.308 0.925 18703 9396 1 26 . 1 1 45 45 GLY H H 45 8.232 8.232 8.575 -0.343 18703 9397 1 26 . 1 1 46 46 GLY N N 46 108.029 108.029 108.083 -0.054 18703 9398 1 26 . 1 1 46 46 GLY C C 46 174.351 174.351 173.702 0.649 18703 9399 1 26 . 1 1 46 46 GLY CA C 46 45.105 45.105 45.366 -0.261 18703 9400 1 26 . 1 1 46 46 GLY H H 46 8.176 8.176 7.918 0.258 18703 9401 1 26 . 1 1 47 47 GLY N N 47 108.183 108.183 110.905 -2.722 18703 9402 1 26 . 1 1 47 47 GLY C C 47 174.671 174.671 174.939 -0.268 18703 9403 1 26 . 1 1 47 47 GLY CA C 47 45.254 45.254 44.205 1.049 18703 9404 1 26 . 1 1 47 47 GLY H H 47 8.290 8.290 8.141 0.149 18703 9405 1 26 . 1 1 48 48 GLY N N 48 108.616 108.616 109.085 -0.469 18703 9406 1 26 . 1 1 48 48 GLY C C 48 174.321 174.321 175.565 -1.244 18703 9407 1 26 . 1 1 48 48 GLY CA C 48 45.192 45.192 46.013 -0.821 18703 9408 1 26 . 1 1 48 48 GLY H H 48 8.027 8.027 8.463 -0.436 18703 9409 1 26 . 1 1 49 49 GLU N N 49 121.057 121.057 124.557 -3.500 18703 9410 1 26 . 1 1 49 49 GLU HA H 49 4.425 4.425 4.232 0.193 18703 9411 1 26 . 1 1 49 49 GLU C C 49 177.072 177.072 178.457 -1.385 18703 9412 1 26 . 1 1 49 49 GLU CA C 49 56.330 56.330 58.179 -1.849 18703 9413 1 26 . 1 1 49 49 GLU CB C 49 29.602 29.602 29.668 -0.066 18703 9414 1 26 . 1 1 49 49 GLU H H 49 8.486 8.486 8.448 0.038 18703 9415 1 26 . 1 1 50 50 VAL N N 50 122.122 122.122 118.825 3.297 18703 9416 1 26 . 1 1 50 50 VAL HA H 50 3.792 3.792 3.673 0.119 18703 9417 1 26 . 1 1 50 50 VAL C C 50 176.774 176.774 178.065 -1.291 18703 9418 1 26 . 1 1 50 50 VAL CA C 50 64.864 64.864 65.287 -0.423 18703 9419 1 26 . 1 1 50 50 VAL CB C 50 32.179 32.179 31.147 1.032 18703 9420 1 26 . 1 1 50 50 VAL H H 50 8.095 8.095 7.497 0.598 18703 9421 1 26 . 1 1 51 51 LYS N N 51 120.602 120.602 118.704 1.898 18703 9422 1 26 . 1 1 51 51 LYS HA H 51 4.195 4.195 4.090 0.105 18703 9423 1 26 . 1 1 51 51 LYS C C 51 178.530 178.530 178.604 -0.074 18703 9424 1 26 . 1 1 51 51 LYS CA C 51 59.348 59.348 59.262 0.086 18703 9425 1 26 . 1 1 51 51 LYS CB C 51 32.265 32.265 32.175 0.090 18703 9426 1 26 . 1 1 51 51 LYS H H 51 8.268 8.268 7.577 0.691 18703 9427 1 26 . 1 1 52 52 LYS N N 52 117.547 117.547 120.231 -2.684 18703 9428 1 26 . 1 1 52 52 LYS HA H 52 4.162 4.162 4.097 0.065 18703 9429 1 26 . 1 1 52 52 LYS C C 52 179.132 179.132 178.994 0.138 18703 9430 1 26 . 1 1 52 52 LYS CA C 52 58.811 58.811 59.218 -0.407 18703 9431 1 26 . 1 1 52 52 LYS CB C 52 32.054 32.054 32.387 -0.333 18703 9432 1 26 . 1 1 52 52 LYS H H 52 7.595 7.595 7.681 -0.086 18703 9433 1 26 . 1 1 53 53 VAL N N 53 119.190 119.190 119.157 0.033 18703 9434 1 26 . 1 1 53 53 VAL HA H 53 3.767 3.767 3.622 0.145 18703 9435 1 26 . 1 1 53 53 VAL C C 53 177.933 177.933 177.821 0.112 18703 9436 1 26 . 1 1 53 53 VAL CA C 53 66.065 66.065 66.018 0.047 18703 9437 1 26 . 1 1 53 53 VAL CB C 53 31.248 31.248 31.405 -0.157 18703 9438 1 26 . 1 1 53 53 VAL H H 53 7.597 7.597 7.613 -0.016 18703 9439 1 26 . 1 1 54 54 GLU N N 54 120.226 120.226 118.686 1.540 18703 9440 1 26 . 1 1 54 54 GLU HA H 54 3.833 3.833 4.013 -0.180 18703 9441 1 26 . 1 1 54 54 GLU C C 54 179.352 179.352 178.737 0.615 18703 9442 1 26 . 1 1 54 54 GLU CA C 54 59.153 59.153 59.475 -0.322 18703 9443 1 26 . 1 1 54 54 GLU CB C 54 29.224 29.224 29.260 -0.036 18703 9444 1 26 . 1 1 54 54 GLU H H 54 8.609 8.609 7.639 0.970 18703 9445 1 26 . 1 1 55 55 GLU N N 55 119.148 119.148 119.416 -0.268 18703 9446 1 26 . 1 1 55 55 GLU HA H 55 4.084 4.084 4.141 -0.057 18703 9447 1 26 . 1 1 55 55 GLU C C 55 179.084 179.084 178.657 0.427 18703 9448 1 26 . 1 1 55 55 GLU CA C 55 59.295 59.295 58.969 0.326 18703 9449 1 26 . 1 1 55 55 GLU CB C 55 29.361 29.361 29.787 -0.426 18703 9450 1 26 . 1 1 55 55 GLU H H 55 7.713 7.713 8.289 -0.576 18703 9451 1 26 . 1 1 56 56 GLU N N 56 120.301 120.301 119.226 1.075 18703 9452 1 26 . 1 1 56 56 GLU HA H 56 4.079 4.079 4.138 -0.059 18703 9453 1 26 . 1 1 56 56 GLU C C 56 179.773 179.773 179.257 0.516 18703 9454 1 26 . 1 1 56 56 GLU CA C 56 59.528 59.528 59.149 0.379 18703 9455 1 26 . 1 1 56 56 GLU CB C 56 30.162 30.162 29.794 0.367 18703 9456 1 26 . 1 1 56 56 GLU H H 56 7.899 7.899 7.547 0.352 18703 9457 1 26 . 1 1 57 57 VAL N N 57 121.536 121.536 118.319 3.217 18703 9458 1 26 . 1 1 57 57 VAL HA H 57 3.540 3.540 3.774 -0.234 18703 9459 1 26 . 1 1 57 57 VAL C C 57 176.984 176.984 177.483 -0.499 18703 9460 1 26 . 1 1 57 57 VAL CA C 57 66.734 66.734 65.451 1.283 18703 9461 1 26 . 1 1 57 57 VAL CB C 57 31.425 31.425 31.698 -0.273 18703 9462 1 26 . 1 1 57 57 VAL H H 57 8.652 8.652 7.569 1.083 18703 9463 1 26 . 1 1 58 58 LYS N N 58 120.219 120.219 119.868 0.351 18703 9464 1 26 . 1 1 58 58 LYS HA H 58 4.199 4.199 4.075 0.124 18703 9465 1 26 . 1 1 58 58 LYS C C 58 178.972 178.972 178.383 0.589 18703 9466 1 26 . 1 1 58 58 LYS CA C 58 59.357 59.357 59.698 -0.341 18703 9467 1 26 . 1 1 58 58 LYS CB C 58 32.186 32.186 32.156 0.031 18703 9468 1 26 . 1 1 58 58 LYS H H 58 7.791 7.791 7.531 0.260 18703 9469 1 26 . 1 1 59 59 LYS N N 59 118.252 118.252 119.929 -1.677 18703 9470 1 26 . 1 1 59 59 LYS HA H 59 4.069 4.069 4.121 -0.052 18703 9471 1 26 . 1 1 59 59 LYS C C 59 179.180 179.180 178.547 0.633 18703 9472 1 26 . 1 1 59 59 LYS CA C 59 59.285 59.285 58.999 0.286 18703 9473 1 26 . 1 1 59 59 LYS CB C 59 32.345 32.345 32.505 -0.160 18703 9474 1 26 . 1 1 59 59 LYS H H 59 7.849 7.849 7.533 0.316 18703 9475 1 26 . 1 1 60 60 LEU N N 60 121.243 121.243 119.844 1.399 18703 9476 1 26 . 1 1 60 60 LEU HA H 60 4.242 4.242 4.150 0.092 18703 9477 1 26 . 1 1 60 60 LEU C C 60 178.413 178.413 178.231 0.182 18703 9478 1 26 . 1 1 60 60 LEU CA C 60 57.798 57.798 57.241 0.557 18703 9479 1 26 . 1 1 60 60 LEU CB C 60 41.150 41.150 42.212 -1.062 18703 9480 1 26 . 1 1 60 60 LEU H H 60 7.825 7.825 7.606 0.219 18703 9481 1 26 . 1 1 61 61 GLU N N 61 118.844 118.844 119.824 -0.980 18703 9482 1 26 . 1 1 61 61 GLU HA H 61 3.800 3.800 3.953 -0.153 18703 9483 1 26 . 1 1 61 61 GLU C C 61 179.078 179.078 178.583 0.495 18703 9484 1 26 . 1 1 61 61 GLU CA C 61 60.104 60.104 59.990 0.114 18703 9485 1 26 . 1 1 61 61 GLU CB C 61 29.864 29.864 29.644 0.220 18703 9486 1 26 . 1 1 61 61 GLU H H 61 8.582 8.582 7.732 0.850 18703 9487 1 26 . 1 1 62 62 GLU N N 62 117.659 117.659 118.548 -0.889 18703 9488 1 26 . 1 1 62 62 GLU HA H 62 3.990 3.990 4.099 -0.109 18703 9489 1 26 . 1 1 62 62 GLU C C 62 178.847 178.847 178.855 -0.008 18703 9490 1 26 . 1 1 62 62 GLU CA C 62 59.067 59.067 58.764 0.303 18703 9491 1 26 . 1 1 62 62 GLU CB C 62 29.440 29.440 29.755 -0.315 18703 9492 1 26 . 1 1 62 62 GLU H H 62 8.032 8.032 7.616 0.416 18703 9493 1 26 . 1 1 63 63 GLU N N 63 119.290 119.290 119.642 -0.352 18703 9494 1 26 . 1 1 63 63 GLU HA H 63 4.012 4.012 4.090 -0.078 18703 9495 1 26 . 1 1 63 63 GLU C C 63 179.784 179.784 179.363 0.421 18703 9496 1 26 . 1 1 63 63 GLU CA C 63 59.300 59.300 59.255 0.045 18703 9497 1 26 . 1 1 63 63 GLU CB C 63 29.728 29.728 29.530 0.198 18703 9498 1 26 . 1 1 63 63 GLU H H 63 7.958 7.958 7.430 0.528 18703 9499 1 26 . 1 1 64 64 ILE N N 64 118.453 118.453 119.205 -0.752 18703 9500 1 26 . 1 1 64 64 ILE HA H 64 3.711 3.711 3.745 -0.034 18703 9501 1 26 . 1 1 64 64 ILE C C 64 177.655 177.655 178.213 -0.558 18703 9502 1 26 . 1 1 64 64 ILE CA C 64 64.256 64.256 64.428 -0.172 18703 9503 1 26 . 1 1 64 64 ILE CB C 64 38.002 38.002 37.506 0.496 18703 9504 1 26 . 1 1 64 64 ILE H H 64 8.160 8.160 7.609 0.551 18703 9505 1 26 . 1 1 65 65 LYS N N 65 118.871 118.871 118.961 -0.090 18703 9506 1 26 . 1 1 65 65 LYS HA H 65 4.111 4.111 4.099 0.012 18703 9507 1 26 . 1 1 65 65 LYS C C 65 177.076 177.076 177.845 -0.769 18703 9508 1 26 . 1 1 65 65 LYS CA C 65 58.421 58.421 58.647 -0.226 18703 9509 1 26 . 1 1 65 65 LYS CB C 65 32.639 32.639 32.143 0.496 18703 9510 1 26 . 1 1 65 65 LYS H H 65 7.664 7.664 7.739 -0.075 18703 9511 1 26 . 1 1 66 66 LYS N N 66 116.944 116.944 118.098 -1.154 18703 9512 1 26 . 1 1 66 66 LYS HA H 66 4.320 4.320 4.116 0.204 18703 9513 1 26 . 1 1 66 66 LYS C C 66 175.897 175.897 177.016 -1.119 18703 9514 1 26 . 1 1 66 66 LYS CA C 66 56.352 56.352 58.222 -1.870 18703 9515 1 26 . 1 1 66 66 LYS CB C 66 33.024 33.024 32.910 0.114 18703 9516 1 26 . 1 1 66 66 LYS H H 66 7.246 7.246 8.077 -0.831 18703 9517 1 27 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.411 -0.165 18703 9518 1 27 . 1 1 3 3 ARG C C 3 178.379 178.379 176.805 1.574 18703 9519 1 27 . 1 1 3 3 ARG CA C 3 58.367 58.367 57.019 1.348 18703 9520 1 27 . 1 1 3 3 ARG CB C 3 30.691 30.691 31.088 -0.397 18703 9521 1 27 . 1 1 3 3 ARG H H 3 7.905 7.905 7.963 -0.058 18703 9522 1 27 . 1 1 4 4 VAL N N 4 118.966 118.966 122.303 -3.337 18703 9523 1 27 . 1 1 4 4 VAL HA H 4 3.803 3.803 3.807 -0.004 18703 9524 1 27 . 1 1 4 4 VAL C C 4 176.968 176.968 177.026 -0.058 18703 9525 1 27 . 1 1 4 4 VAL CA C 4 65.441 65.441 64.425 1.016 18703 9526 1 27 . 1 1 4 4 VAL CB C 4 31.710 31.710 31.419 0.290 18703 9527 1 27 . 1 1 4 4 VAL H H 4 8.070 8.070 8.464 -0.394 18703 9528 1 27 . 1 1 5 5 LYS N N 5 122.058 122.058 118.895 3.163 18703 9529 1 27 . 1 1 5 5 LYS HA H 5 4.154 4.154 4.020 0.134 18703 9530 1 27 . 1 1 5 5 LYS C C 5 178.553 178.553 178.673 -0.120 18703 9531 1 27 . 1 1 5 5 LYS CA C 5 58.712 58.712 59.556 -0.844 18703 9532 1 27 . 1 1 5 5 LYS CB C 5 31.788 31.788 32.110 -0.322 18703 9533 1 27 . 1 1 5 5 LYS H H 5 7.798 7.798 8.408 -0.610 18703 9534 1 27 . 1 1 6 6 ALA N N 6 119.955 119.955 120.804 -0.849 18703 9535 1 27 . 1 1 6 6 ALA HA H 6 4.198 4.198 4.244 -0.046 18703 9536 1 27 . 1 1 6 6 ALA C C 6 180.974 180.974 178.932 2.042 18703 9537 1 27 . 1 1 6 6 ALA CA C 6 54.850 54.850 54.112 0.737 18703 9538 1 27 . 1 1 6 6 ALA CB C 6 17.995 17.995 18.646 -0.651 18703 9539 1 27 . 1 1 6 6 ALA H H 6 7.928 7.928 7.442 0.486 18703 9540 1 27 . 1 1 7 7 LEU N N 7 119.211 119.211 119.531 -0.320 18703 9541 1 27 . 1 1 7 7 LEU HA H 7 4.124 4.124 3.959 0.165 18703 9542 1 27 . 1 1 7 7 LEU C C 7 178.353 178.353 178.595 -0.242 18703 9543 1 27 . 1 1 7 7 LEU CA C 7 57.658 57.658 57.436 0.222 18703 9544 1 27 . 1 1 7 7 LEU CB C 7 41.971 41.971 42.034 -0.063 18703 9545 1 27 . 1 1 7 7 LEU H H 7 7.594 7.594 7.558 0.036 18703 9546 1 27 . 1 1 8 8 GLU N N 8 120.258 120.258 118.147 2.111 18703 9547 1 27 . 1 1 8 8 GLU HA H 8 3.846 3.846 4.008 -0.162 18703 9548 1 27 . 1 1 8 8 GLU C C 8 179.546 179.546 178.498 1.048 18703 9549 1 27 . 1 1 8 8 GLU CA C 8 60.006 60.006 59.722 0.284 18703 9550 1 27 . 1 1 8 8 GLU CB C 8 29.683 29.683 29.405 0.278 18703 9551 1 27 . 1 1 8 8 GLU H H 8 8.382 8.382 7.839 0.543 18703 9552 1 27 . 1 1 9 9 GLU N N 9 118.584 118.584 118.787 -0.203 18703 9553 1 27 . 1 1 9 9 GLU HA H 9 4.039 4.039 4.140 -0.101 18703 9554 1 27 . 1 1 9 9 GLU C C 9 179.635 179.635 178.642 0.993 18703 9555 1 27 . 1 1 9 9 GLU CA C 9 59.235 59.235 58.541 0.694 18703 9556 1 27 . 1 1 9 9 GLU CB C 9 29.358 29.358 29.102 0.256 18703 9557 1 27 . 1 1 9 9 GLU H H 9 7.908 7.908 7.705 0.203 18703 9558 1 27 . 1 1 10 10 LYS N N 10 120.956 120.956 119.929 1.027 18703 9559 1 27 . 1 1 10 10 LYS HA H 10 4.190 4.190 4.160 0.030 18703 9560 1 27 . 1 1 10 10 LYS C C 10 179.395 179.395 178.914 0.481 18703 9561 1 27 . 1 1 10 10 LYS CA C 10 59.231 59.231 59.216 0.015 18703 9562 1 27 . 1 1 10 10 LYS CB C 10 32.211 32.211 32.607 -0.396 18703 9563 1 27 . 1 1 10 10 LYS H H 10 8.009 8.009 7.405 0.604 18703 9564 1 27 . 1 1 11 11 VAL N N 11 119.577 119.577 118.381 1.196 18703 9565 1 27 . 1 1 11 11 VAL HA H 11 3.844 3.844 3.750 0.094 18703 9566 1 27 . 1 1 11 11 VAL C C 11 177.078 177.078 177.486 -0.408 18703 9567 1 27 . 1 1 11 11 VAL CA C 11 66.407 66.407 64.871 1.536 18703 9568 1 27 . 1 1 11 11 VAL CB C 11 31.252 31.252 30.931 0.321 18703 9569 1 27 . 1 1 11 11 VAL H H 11 8.488 8.488 7.516 0.972 18703 9570 1 27 . 1 1 12 12 LYS N N 12 122.864 122.864 120.298 2.566 18703 9571 1 27 . 1 1 12 12 LYS HA H 12 4.189 4.189 3.996 0.193 18703 9572 1 27 . 1 1 12 12 LYS C C 12 178.755 178.755 178.253 0.502 18703 9573 1 27 . 1 1 12 12 LYS CA C 12 59.375 59.375 59.270 0.105 18703 9574 1 27 . 1 1 12 12 LYS CB C 12 31.991 31.991 31.967 0.024 18703 9575 1 27 . 1 1 12 12 LYS H H 12 7.944 7.944 7.559 0.385 18703 9576 1 27 . 1 1 13 13 ALA N N 13 121.202 121.202 120.371 0.831 18703 9577 1 27 . 1 1 13 13 ALA HA H 13 4.209 4.209 4.275 -0.066 18703 9578 1 27 . 1 1 13 13 ALA C C 13 181.060 181.060 179.666 1.394 18703 9579 1 27 . 1 1 13 13 ALA CA C 13 54.710 54.710 54.186 0.524 18703 9580 1 27 . 1 1 13 13 ALA CB C 13 17.861 17.861 18.357 -0.496 18703 9581 1 27 . 1 1 13 13 ALA H H 13 7.563 7.563 7.473 0.090 18703 9582 1 27 . 1 1 14 14 LEU N N 14 120.014 120.014 119.875 0.139 18703 9583 1 27 . 1 1 14 14 LEU HA H 14 4.072 4.072 3.981 0.091 18703 9584 1 27 . 1 1 14 14 LEU C C 14 177.862 177.862 178.124 -0.262 18703 9585 1 27 . 1 1 14 14 LEU CA C 14 57.864 57.864 57.494 0.370 18703 9586 1 27 . 1 1 14 14 LEU CB C 14 41.539 41.539 42.051 -0.512 18703 9587 1 27 . 1 1 14 14 LEU H H 14 8.087 8.087 7.509 0.578 18703 9588 1 27 . 1 1 15 15 GLU N N 15 121.644 121.644 120.214 1.430 18703 9589 1 27 . 1 1 15 15 GLU HA H 15 3.692 3.692 3.993 -0.301 18703 9590 1 27 . 1 1 15 15 GLU C C 15 177.819 177.819 178.168 -0.349 18703 9591 1 27 . 1 1 15 15 GLU CA C 15 59.239 59.239 59.471 -0.232 18703 9592 1 27 . 1 1 15 15 GLU CB C 15 28.865 28.865 29.647 -0.782 18703 9593 1 27 . 1 1 15 15 GLU H H 15 8.542 8.542 7.714 0.828 18703 9594 1 27 . 1 1 16 16 GLU N N 16 116.016 116.016 118.989 -2.973 18703 9595 1 27 . 1 1 16 16 GLU HA H 16 3.955 3.955 4.001 -0.046 18703 9596 1 27 . 1 1 16 16 GLU C C 16 179.159 179.159 179.235 -0.076 18703 9597 1 27 . 1 1 16 16 GLU CA C 16 59.324 59.324 59.051 0.273 18703 9598 1 27 . 1 1 16 16 GLU CB C 16 29.060 29.060 28.915 0.145 18703 9599 1 27 . 1 1 16 16 GLU H H 16 7.492 7.492 7.972 -0.480 18703 9600 1 27 . 1 1 17 17 LYS N N 17 118.546 118.546 118.736 -0.190 18703 9601 1 27 . 1 1 17 17 LYS HA H 17 4.117 4.117 4.135 -0.017 18703 9602 1 27 . 1 1 17 17 LYS C C 17 178.976 178.976 177.892 1.084 18703 9603 1 27 . 1 1 17 17 LYS CA C 17 58.837 58.837 58.733 0.104 18703 9604 1 27 . 1 1 17 17 LYS CB C 17 32.538 32.538 32.613 -0.075 18703 9605 1 27 . 1 1 17 17 LYS H H 17 7.720 7.720 7.545 0.175 18703 9606 1 27 . 1 1 18 18 VAL N N 18 118.376 118.376 118.896 -0.520 18703 9607 1 27 . 1 1 18 18 VAL HA H 18 3.711 3.711 3.822 -0.111 18703 9608 1 27 . 1 1 18 18 VAL C C 18 178.765 178.765 178.589 0.176 18703 9609 1 27 . 1 1 18 18 VAL CA C 18 66.237 66.237 65.771 0.466 18703 9610 1 27 . 1 1 18 18 VAL CB C 18 31.682 31.682 32.078 -0.396 18703 9611 1 27 . 1 1 18 18 VAL H H 18 8.754 8.754 7.525 1.229 18703 9612 1 27 . 1 1 19 19 LYS N N 19 118.817 118.817 118.989 -0.172 18703 9613 1 27 . 1 1 19 19 LYS HA H 19 4.078 4.078 3.943 0.135 18703 9614 1 27 . 1 1 19 19 LYS C C 19 178.049 178.049 177.759 0.290 18703 9615 1 27 . 1 1 19 19 LYS CA C 19 59.731 59.731 59.418 0.313 18703 9616 1 27 . 1 1 19 19 LYS CB C 19 32.523 32.523 32.194 0.329 18703 9617 1 27 . 1 1 19 19 LYS H H 19 8.299 8.299 8.490 -0.191 18703 9618 1 27 . 1 1 20 20 ALA N N 20 119.656 119.656 119.450 0.206 18703 9619 1 27 . 1 1 20 20 ALA HA H 20 4.347 4.347 4.348 -0.001 18703 9620 1 27 . 1 1 20 20 ALA C C 20 178.532 178.532 178.400 0.132 18703 9621 1 27 . 1 1 20 20 ALA CA C 20 52.853 52.853 52.875 -0.022 18703 9622 1 27 . 1 1 20 20 ALA CB C 20 18.832 18.832 18.839 -0.007 18703 9623 1 27 . 1 1 20 20 ALA H H 20 7.425 7.425 7.558 -0.133 18703 9624 1 27 . 1 1 21 21 LEU N N 21 118.594 118.594 119.148 -0.554 18703 9625 1 27 . 1 1 21 21 LEU HA H 21 4.297 4.297 4.135 0.162 18703 9626 1 27 . 1 1 21 21 LEU C C 21 177.784 177.784 177.810 -0.026 18703 9627 1 27 . 1 1 21 21 LEU CA C 21 55.750 55.750 56.559 -0.809 18703 9628 1 27 . 1 1 21 21 LEU CB C 21 42.898 42.898 42.536 0.362 18703 9629 1 27 . 1 1 21 21 LEU H H 21 7.508 7.508 7.917 -0.409 18703 9630 1 27 . 1 1 22 22 GLY N N 22 106.650 106.650 104.201 2.449 18703 9631 1 27 . 1 1 22 22 GLY C C 22 173.605 173.605 172.879 0.726 18703 9632 1 27 . 1 1 22 22 GLY CA C 22 45.330 45.330 44.328 1.002 18703 9633 1 27 . 1 1 22 22 GLY H H 22 7.814 7.814 7.685 0.129 18703 9634 1 27 . 1 1 23 23 GLY N N 23 108.011 108.011 108.028 -0.017 18703 9635 1 27 . 1 1 23 23 GLY C C 23 174.061 174.061 173.271 0.790 18703 9636 1 27 . 1 1 23 23 GLY CA C 23 44.772 44.772 45.453 -0.681 18703 9637 1 27 . 1 1 23 23 GLY H H 23 8.139 8.139 7.967 0.172 18703 9638 1 27 . 1 1 24 24 GLY N N 24 107.826 107.826 106.237 1.589 18703 9639 1 27 . 1 1 24 24 GLY C C 24 175.046 175.046 175.218 -0.172 18703 9640 1 27 . 1 1 24 24 GLY CA C 24 44.422 44.422 46.422 -2.000 18703 9641 1 27 . 1 1 24 24 GLY H H 24 8.497 8.497 9.698 -1.201 18703 9642 1 27 . 1 1 25 25 GLY N N 25 108.830 108.830 109.048 -0.218 18703 9643 1 27 . 1 1 25 25 GLY C C 25 176.272 176.272 174.656 1.616 18703 9644 1 27 . 1 1 25 25 GLY CA C 25 47.101 47.101 45.153 1.948 18703 9645 1 27 . 1 1 25 25 GLY H H 25 8.616 8.616 7.861 0.755 18703 9646 1 27 . 1 1 26 26 ARG N N 26 123.109 123.109 122.178 0.931 18703 9647 1 27 . 1 1 26 26 ARG HA H 26 4.283 4.283 4.201 0.082 18703 9648 1 27 . 1 1 26 26 ARG C C 26 177.848 177.848 178.338 -0.490 18703 9649 1 27 . 1 1 26 26 ARG CA C 26 57.663 57.663 58.069 -0.406 18703 9650 1 27 . 1 1 26 26 ARG CB C 26 29.811 29.811 29.845 -0.034 18703 9651 1 27 . 1 1 26 26 ARG H H 26 8.770 8.770 8.559 0.211 18703 9652 1 27 . 1 1 27 27 ILE N N 27 118.104 118.104 117.089 1.015 18703 9653 1 27 . 1 1 27 27 ILE HA H 27 3.787 3.787 3.842 -0.055 18703 9654 1 27 . 1 1 27 27 ILE C C 27 177.473 177.473 177.951 -0.478 18703 9655 1 27 . 1 1 27 27 ILE CA C 27 63.036 63.036 64.068 -1.032 18703 9656 1 27 . 1 1 27 27 ILE CB C 27 36.664 36.664 37.404 -0.740 18703 9657 1 27 . 1 1 27 27 ILE H H 27 7.708 7.708 7.998 -0.290 18703 9658 1 27 . 1 1 28 28 GLU N N 28 119.934 119.934 120.439 -0.505 18703 9659 1 27 . 1 1 28 28 GLU HA H 28 3.954 3.954 3.868 0.086 18703 9660 1 27 . 1 1 28 28 GLU C C 28 179.514 179.514 178.298 1.216 18703 9661 1 27 . 1 1 28 28 GLU CA C 28 59.450 59.450 59.905 -0.455 18703 9662 1 27 . 1 1 28 28 GLU CB C 28 29.600 29.600 29.300 0.300 18703 9663 1 27 . 1 1 28 28 GLU H H 28 7.872 7.872 7.548 0.324 18703 9664 1 27 . 1 1 29 29 GLU N N 29 118.134 118.134 119.775 -1.641 18703 9665 1 27 . 1 1 29 29 GLU HA H 29 4.028 4.028 4.057 -0.029 18703 9666 1 27 . 1 1 29 29 GLU C C 29 179.182 179.182 179.122 0.060 18703 9667 1 27 . 1 1 29 29 GLU CA C 29 59.173 59.173 59.421 -0.248 18703 9668 1 27 . 1 1 29 29 GLU CB C 29 29.503 29.503 29.508 -0.005 18703 9669 1 27 . 1 1 29 29 GLU H H 29 8.166 8.166 7.558 0.608 18703 9670 1 27 . 1 1 30 30 LEU N N 30 120.242 120.242 117.777 2.465 18703 9671 1 27 . 1 1 30 30 LEU HA H 30 4.028 4.028 4.018 0.010 18703 9672 1 27 . 1 1 30 30 LEU C C 30 178.796 178.796 179.017 -0.221 18703 9673 1 27 . 1 1 30 30 LEU CA C 30 57.654 57.654 56.882 0.772 18703 9674 1 27 . 1 1 30 30 LEU CB C 30 41.629 41.629 41.625 0.004 18703 9675 1 27 . 1 1 30 30 LEU H H 30 7.695 7.695 7.654 0.041 18703 9676 1 27 . 1 1 31 31 LYS N N 31 120.506 120.506 119.951 0.555 18703 9677 1 27 . 1 1 31 31 LYS HA H 31 3.532 3.532 4.025 -0.493 18703 9678 1 27 . 1 1 31 31 LYS C C 31 178.919 178.919 178.261 0.658 18703 9679 1 27 . 1 1 31 31 LYS CA C 31 60.240 60.240 59.194 1.046 18703 9680 1 27 . 1 1 31 31 LYS CB C 31 32.015 32.015 32.196 -0.180 18703 9681 1 27 . 1 1 31 31 LYS H H 31 8.561 8.561 7.488 1.073 18703 9682 1 27 . 1 1 32 32 LYS N N 32 118.566 118.566 118.672 -0.106 18703 9683 1 27 . 1 1 32 32 LYS C C 32 179.392 179.392 179.086 0.306 18703 9684 1 27 . 1 1 32 32 LYS CA C 32 59.356 59.356 59.889 -0.533 18703 9685 1 27 . 1 1 32 32 LYS CB C 32 32.117 32.117 32.395 -0.278 18703 9686 1 27 . 1 1 32 32 LYS H H 32 7.699 7.699 7.542 0.157 18703 9687 1 27 . 1 1 33 33 LYS N N 33 118.964 118.964 117.436 1.528 18703 9688 1 27 . 1 1 33 33 LYS HA H 33 4.117 4.117 4.127 -0.010 18703 9689 1 27 . 1 1 33 33 LYS C C 33 178.355 178.355 178.404 -0.049 18703 9690 1 27 . 1 1 33 33 LYS CA C 33 58.633 58.633 58.745 -0.112 18703 9691 1 27 . 1 1 33 33 LYS CB C 33 31.904 31.904 32.432 -0.528 18703 9692 1 27 . 1 1 33 33 LYS H H 33 7.752 7.752 7.571 0.181 18703 9693 1 27 . 1 1 34 34 CYS N N 34 119.956 119.956 119.054 0.902 18703 9694 1 27 . 1 1 34 34 CYS HA H 34 3.967 3.967 4.110 -0.143 18703 9695 1 27 . 1 1 34 34 CYS C C 34 175.521 175.521 176.704 -1.183 18703 9696 1 27 . 1 1 34 34 CYS CA C 34 60.987 60.987 63.071 -2.084 18703 9697 1 27 . 1 1 34 34 CYS CB C 34 36.600 36.600 26.637 9.963 18703 9698 1 27 . 1 1 34 34 CYS H H 34 8.393 8.393 7.669 0.724 18703 9699 1 27 . 1 1 35 35 GLU N N 35 120.327 120.327 119.653 0.674 18703 9700 1 27 . 1 1 35 35 GLU HA H 35 3.891 3.891 3.924 -0.033 18703 9701 1 27 . 1 1 35 35 GLU C C 35 179.684 179.684 178.584 1.100 18703 9702 1 27 . 1 1 35 35 GLU CA C 35 60.059 60.059 59.327 0.732 18703 9703 1 27 . 1 1 35 35 GLU CB C 35 29.718 29.718 28.553 1.165 18703 9704 1 27 . 1 1 35 35 GLU H H 35 8.558 8.558 7.816 0.742 18703 9705 1 27 . 1 1 36 36 GLU N N 36 120.190 120.190 119.744 0.446 18703 9706 1 27 . 1 1 36 36 GLU HA H 36 4.051 4.051 4.036 0.015 18703 9707 1 27 . 1 1 36 36 GLU C C 36 179.408 179.408 178.922 0.486 18703 9708 1 27 . 1 1 36 36 GLU CA C 36 59.148 59.148 58.984 0.163 18703 9709 1 27 . 1 1 36 36 GLU CB C 36 29.766 29.766 29.814 -0.048 18703 9710 1 27 . 1 1 36 36 GLU H H 36 8.038 8.038 7.599 0.439 18703 9711 1 27 . 1 1 37 37 LEU N N 37 121.102 121.102 119.911 1.191 18703 9712 1 27 . 1 1 37 37 LEU HA H 37 4.079 4.079 4.202 -0.123 18703 9713 1 27 . 1 1 37 37 LEU C C 37 178.279 178.279 178.295 -0.016 18703 9714 1 27 . 1 1 37 37 LEU CA C 37 57.803 57.803 57.511 0.292 18703 9715 1 27 . 1 1 37 37 LEU CB C 37 41.502 41.502 41.725 -0.223 18703 9716 1 27 . 1 1 37 37 LEU H H 37 8.065 8.065 7.465 0.600 18703 9717 1 27 . 1 1 38 38 LYS N N 38 119.980 119.980 118.780 1.200 18703 9718 1 27 . 1 1 38 38 LYS HA H 38 3.851 3.851 3.909 -0.058 18703 9719 1 27 . 1 1 38 38 LYS C C 38 178.919 178.919 179.167 -0.248 18703 9720 1 27 . 1 1 38 38 LYS CA C 38 60.794 60.794 60.055 0.739 18703 9721 1 27 . 1 1 38 38 LYS CB C 38 32.863 32.863 32.166 0.697 18703 9722 1 27 . 1 1 38 38 LYS H H 38 8.741 8.741 7.457 1.284 18703 9723 1 27 . 1 1 39 39 LYS N N 39 118.307 118.307 117.819 0.488 18703 9724 1 27 . 1 1 39 39 LYS HA H 39 4.125 4.125 4.109 0.016 18703 9725 1 27 . 1 1 39 39 LYS C C 39 178.622 178.622 178.330 0.292 18703 9726 1 27 . 1 1 39 39 LYS CA C 39 58.993 58.993 59.252 -0.259 18703 9727 1 27 . 1 1 39 39 LYS CB C 39 32.097 32.097 32.040 0.057 18703 9728 1 27 . 1 1 39 39 LYS H H 39 7.584 7.584 7.694 -0.110 18703 9729 1 27 . 1 1 40 40 LYS N N 40 118.826 118.826 118.880 -0.054 18703 9730 1 27 . 1 1 40 40 LYS HA H 40 4.069 4.069 4.179 -0.110 18703 9731 1 27 . 1 1 40 40 LYS C C 40 179.802 179.802 178.496 1.306 18703 9732 1 27 . 1 1 40 40 LYS CA C 40 59.322 59.322 58.576 0.746 18703 9733 1 27 . 1 1 40 40 LYS CB C 40 32.505 32.505 32.299 0.206 18703 9734 1 27 . 1 1 40 40 LYS H H 40 7.945 7.945 7.351 0.594 18703 9735 1 27 . 1 1 41 41 ILE N N 41 118.958 118.958 118.202 0.756 18703 9736 1 27 . 1 1 41 41 ILE HA H 41 3.659 3.659 3.714 -0.055 18703 9737 1 27 . 1 1 41 41 ILE C C 41 178.146 178.146 176.605 1.541 18703 9738 1 27 . 1 1 41 41 ILE CA C 41 65.037 65.037 64.320 0.717 18703 9739 1 27 . 1 1 41 41 ILE CB C 41 37.950 37.950 38.087 -0.137 18703 9740 1 27 . 1 1 41 41 ILE H H 41 8.369 8.369 7.993 0.376 18703 9741 1 27 . 1 1 42 42 GLU N N 42 120.331 120.331 116.580 3.751 18703 9742 1 27 . 1 1 42 42 GLU HA H 42 4.094 4.094 4.025 0.069 18703 9743 1 27 . 1 1 42 42 GLU C C 42 178.697 178.697 177.832 0.865 18703 9744 1 27 . 1 1 42 42 GLU CA C 42 58.927 58.927 58.469 0.458 18703 9745 1 27 . 1 1 42 42 GLU CB C 42 29.399 29.399 29.765 -0.366 18703 9746 1 27 . 1 1 42 42 GLU H H 42 7.805 7.805 7.747 0.058 18703 9747 1 27 . 1 1 43 43 GLU N N 43 117.120 117.120 118.142 -1.022 18703 9748 1 27 . 1 1 43 43 GLU HA H 43 4.291 4.291 4.182 0.109 18703 9749 1 27 . 1 1 43 43 GLU C C 43 177.551 177.551 177.472 0.079 18703 9750 1 27 . 1 1 43 43 GLU CA C 43 56.800 56.800 56.985 -0.185 18703 9751 1 27 . 1 1 43 43 GLU CB C 43 29.931 29.931 29.561 0.370 18703 9752 1 27 . 1 1 43 43 GLU H H 43 7.701 7.701 7.636 0.065 18703 9753 1 27 . 1 1 44 44 LEU N N 44 120.940 120.940 120.697 0.243 18703 9754 1 27 . 1 1 44 44 LEU HA H 44 4.251 4.251 4.022 0.229 18703 9755 1 27 . 1 1 44 44 LEU C C 44 178.596 178.596 177.191 1.405 18703 9756 1 27 . 1 1 44 44 LEU CA C 44 56.448 56.448 55.447 1.001 18703 9757 1 27 . 1 1 44 44 LEU CB C 44 42.519 42.519 42.512 0.007 18703 9758 1 27 . 1 1 44 44 LEU H H 44 7.581 7.581 7.392 0.189 18703 9759 1 27 . 1 1 45 45 GLY N N 45 108.689 108.689 106.330 2.359 18703 9760 1 27 . 1 1 45 45 GLY C C 45 174.853 174.853 173.475 1.378 18703 9761 1 27 . 1 1 45 45 GLY CA C 45 46.233 46.233 45.491 0.742 18703 9762 1 27 . 1 1 45 45 GLY H H 45 8.232 8.232 8.457 -0.225 18703 9763 1 27 . 1 1 46 46 GLY N N 46 108.029 108.029 107.760 0.269 18703 9764 1 27 . 1 1 46 46 GLY C C 46 174.351 174.351 173.272 1.079 18703 9765 1 27 . 1 1 46 46 GLY CA C 46 45.105 45.105 44.862 0.242 18703 9766 1 27 . 1 1 46 46 GLY H H 46 8.176 8.176 7.849 0.327 18703 9767 1 27 . 1 1 47 47 GLY N N 47 108.183 108.183 109.712 -1.529 18703 9768 1 27 . 1 1 47 47 GLY C C 47 174.671 174.671 174.779 -0.108 18703 9769 1 27 . 1 1 47 47 GLY CA C 47 45.254 45.254 46.111 -0.857 18703 9770 1 27 . 1 1 47 47 GLY H H 47 8.290 8.290 7.882 0.408 18703 9771 1 27 . 1 1 48 48 GLY N N 48 108.616 108.616 107.665 0.951 18703 9772 1 27 . 1 1 48 48 GLY C C 48 174.321 174.321 175.105 -0.784 18703 9773 1 27 . 1 1 48 48 GLY CA C 48 45.192 45.192 45.140 0.052 18703 9774 1 27 . 1 1 48 48 GLY H H 48 8.027 8.027 8.211 -0.184 18703 9775 1 27 . 1 1 49 49 GLU N N 49 121.057 121.057 120.180 0.877 18703 9776 1 27 . 1 1 49 49 GLU HA H 49 4.425 4.425 4.431 -0.006 18703 9777 1 27 . 1 1 49 49 GLU C C 49 177.072 177.072 178.595 -1.523 18703 9778 1 27 . 1 1 49 49 GLU CA C 49 56.330 56.330 56.436 -0.106 18703 9779 1 27 . 1 1 49 49 GLU CB C 49 29.602 29.602 30.062 -0.460 18703 9780 1 27 . 1 1 49 49 GLU H H 49 8.486 8.486 8.333 0.153 18703 9781 1 27 . 1 1 50 50 VAL N N 50 122.122 122.122 121.335 0.787 18703 9782 1 27 . 1 1 50 50 VAL HA H 50 3.792 3.792 3.662 0.130 18703 9783 1 27 . 1 1 50 50 VAL C C 50 176.774 176.774 176.846 -0.072 18703 9784 1 27 . 1 1 50 50 VAL CA C 50 64.864 64.864 65.456 -0.592 18703 9785 1 27 . 1 1 50 50 VAL CB C 50 32.179 32.179 31.816 0.363 18703 9786 1 27 . 1 1 50 50 VAL H H 50 8.095 8.095 8.142 -0.047 18703 9787 1 27 . 1 1 51 51 LYS N N 51 120.602 120.602 118.656 1.946 18703 9788 1 27 . 1 1 51 51 LYS HA H 51 4.195 4.195 4.271 -0.076 18703 9789 1 27 . 1 1 51 51 LYS C C 51 178.530 178.530 178.432 0.098 18703 9790 1 27 . 1 1 51 51 LYS CA C 51 59.348 59.348 58.859 0.489 18703 9791 1 27 . 1 1 51 51 LYS CB C 51 32.265 32.265 32.015 0.250 18703 9792 1 27 . 1 1 51 51 LYS H H 51 8.268 8.268 8.269 -0.001 18703 9793 1 27 . 1 1 52 52 LYS N N 52 117.547 117.547 120.449 -2.902 18703 9794 1 27 . 1 1 52 52 LYS HA H 52 4.162 4.162 4.087 0.075 18703 9795 1 27 . 1 1 52 52 LYS C C 52 179.132 179.132 178.728 0.404 18703 9796 1 27 . 1 1 52 52 LYS CA C 52 58.811 58.811 58.711 0.100 18703 9797 1 27 . 1 1 52 52 LYS CB C 52 32.054 32.054 31.878 0.176 18703 9798 1 27 . 1 1 52 52 LYS H H 52 7.595 7.595 7.851 -0.256 18703 9799 1 27 . 1 1 53 53 VAL N N 53 119.190 119.190 118.094 1.096 18703 9800 1 27 . 1 1 53 53 VAL HA H 53 3.767 3.767 4.005 -0.238 18703 9801 1 27 . 1 1 53 53 VAL C C 53 177.933 177.933 178.570 -0.637 18703 9802 1 27 . 1 1 53 53 VAL CA C 53 66.065 66.065 65.234 0.831 18703 9803 1 27 . 1 1 53 53 VAL CB C 53 31.248 31.248 30.650 0.598 18703 9804 1 27 . 1 1 53 53 VAL H H 53 7.597 7.597 7.556 0.041 18703 9805 1 27 . 1 1 54 54 GLU N N 54 120.226 120.226 119.243 0.983 18703 9806 1 27 . 1 1 54 54 GLU HA H 54 3.833 3.833 3.988 -0.155 18703 9807 1 27 . 1 1 54 54 GLU C C 54 179.352 179.352 178.796 0.556 18703 9808 1 27 . 1 1 54 54 GLU CA C 54 59.153 59.153 59.420 -0.267 18703 9809 1 27 . 1 1 54 54 GLU CB C 54 29.224 29.224 29.254 -0.030 18703 9810 1 27 . 1 1 54 54 GLU H H 54 8.609 8.609 7.675 0.934 18703 9811 1 27 . 1 1 55 55 GLU N N 55 119.148 119.148 119.633 -0.485 18703 9812 1 27 . 1 1 55 55 GLU HA H 55 4.084 4.084 4.103 -0.019 18703 9813 1 27 . 1 1 55 55 GLU C C 55 179.084 179.084 178.768 0.316 18703 9814 1 27 . 1 1 55 55 GLU CA C 55 59.295 59.295 58.962 0.333 18703 9815 1 27 . 1 1 55 55 GLU CB C 55 29.361 29.361 29.589 -0.228 18703 9816 1 27 . 1 1 55 55 GLU H H 55 7.713 7.713 7.871 -0.158 18703 9817 1 27 . 1 1 56 56 GLU N N 56 120.301 120.301 118.957 1.344 18703 9818 1 27 . 1 1 56 56 GLU HA H 56 4.079 4.079 4.108 -0.029 18703 9819 1 27 . 1 1 56 56 GLU C C 56 179.773 179.773 179.130 0.643 18703 9820 1 27 . 1 1 56 56 GLU CA C 56 59.528 59.528 59.289 0.239 18703 9821 1 27 . 1 1 56 56 GLU CB C 56 30.162 30.162 29.669 0.493 18703 9822 1 27 . 1 1 56 56 GLU H H 56 7.899 7.899 7.574 0.325 18703 9823 1 27 . 1 1 57 57 VAL N N 57 121.536 121.536 119.005 2.531 18703 9824 1 27 . 1 1 57 57 VAL HA H 57 3.540 3.540 3.790 -0.250 18703 9825 1 27 . 1 1 57 57 VAL C C 57 176.984 176.984 177.461 -0.477 18703 9826 1 27 . 1 1 57 57 VAL CA C 57 66.734 66.734 65.969 0.765 18703 9827 1 27 . 1 1 57 57 VAL CB C 57 31.425 31.425 31.652 -0.227 18703 9828 1 27 . 1 1 57 57 VAL H H 57 8.652 8.652 7.463 1.189 18703 9829 1 27 . 1 1 58 58 LYS N N 58 120.219 120.219 120.069 0.150 18703 9830 1 27 . 1 1 58 58 LYS HA H 58 4.199 4.199 4.076 0.123 18703 9831 1 27 . 1 1 58 58 LYS C C 58 178.972 178.972 178.351 0.621 18703 9832 1 27 . 1 1 58 58 LYS CA C 58 59.357 59.357 59.659 -0.302 18703 9833 1 27 . 1 1 58 58 LYS CB C 58 32.186 32.186 32.203 -0.017 18703 9834 1 27 . 1 1 58 58 LYS H H 58 7.791 7.791 7.468 0.323 18703 9835 1 27 . 1 1 59 59 LYS N N 59 118.252 118.252 119.796 -1.544 18703 9836 1 27 . 1 1 59 59 LYS HA H 59 4.069 4.069 4.144 -0.075 18703 9837 1 27 . 1 1 59 59 LYS C C 59 179.180 179.180 178.314 0.866 18703 9838 1 27 . 1 1 59 59 LYS CA C 59 59.285 59.285 59.093 0.193 18703 9839 1 27 . 1 1 59 59 LYS CB C 59 32.345 32.345 32.356 -0.011 18703 9840 1 27 . 1 1 59 59 LYS H H 59 7.849 7.849 7.533 0.316 18703 9841 1 27 . 1 1 60 60 LEU N N 60 121.243 121.243 119.767 1.476 18703 9842 1 27 . 1 1 60 60 LEU HA H 60 4.242 4.242 4.152 0.090 18703 9843 1 27 . 1 1 60 60 LEU C C 60 178.413 178.413 178.215 0.198 18703 9844 1 27 . 1 1 60 60 LEU CA C 60 57.798 57.798 57.211 0.587 18703 9845 1 27 . 1 1 60 60 LEU CB C 60 41.150 41.150 42.211 -1.061 18703 9846 1 27 . 1 1 60 60 LEU H H 60 7.825 7.825 7.578 0.247 18703 9847 1 27 . 1 1 61 61 GLU N N 61 118.844 118.844 119.940 -1.096 18703 9848 1 27 . 1 1 61 61 GLU HA H 61 3.800 3.800 3.945 -0.145 18703 9849 1 27 . 1 1 61 61 GLU C C 61 179.078 179.078 178.555 0.523 18703 9850 1 27 . 1 1 61 61 GLU CA C 61 60.104 60.104 59.939 0.165 18703 9851 1 27 . 1 1 61 61 GLU CB C 61 29.864 29.864 29.665 0.199 18703 9852 1 27 . 1 1 61 61 GLU H H 61 8.582 8.582 7.729 0.853 18703 9853 1 27 . 1 1 62 62 GLU N N 62 117.659 117.659 118.597 -0.938 18703 9854 1 27 . 1 1 62 62 GLU HA H 62 3.990 3.990 4.077 -0.087 18703 9855 1 27 . 1 1 62 62 GLU C C 62 178.847 178.847 178.921 -0.074 18703 9856 1 27 . 1 1 62 62 GLU CA C 62 59.067 59.067 58.880 0.187 18703 9857 1 27 . 1 1 62 62 GLU CB C 62 29.440 29.440 29.698 -0.258 18703 9858 1 27 . 1 1 62 62 GLU H H 62 8.032 8.032 7.612 0.420 18703 9859 1 27 . 1 1 63 63 GLU N N 63 119.290 119.290 119.421 -0.131 18703 9860 1 27 . 1 1 63 63 GLU HA H 63 4.012 4.012 4.092 -0.080 18703 9861 1 27 . 1 1 63 63 GLU C C 63 179.784 179.784 179.454 0.330 18703 9862 1 27 . 1 1 63 63 GLU CA C 63 59.300 59.300 59.160 0.140 18703 9863 1 27 . 1 1 63 63 GLU CB C 63 29.728 29.728 29.447 0.281 18703 9864 1 27 . 1 1 63 63 GLU H H 63 7.958 7.958 7.471 0.487 18703 9865 1 27 . 1 1 64 64 ILE N N 64 118.453 118.453 119.560 -1.107 18703 9866 1 27 . 1 1 64 64 ILE HA H 64 3.711 3.711 3.786 -0.075 18703 9867 1 27 . 1 1 64 64 ILE C C 64 177.655 177.655 177.811 -0.156 18703 9868 1 27 . 1 1 64 64 ILE CA C 64 64.256 64.256 64.176 0.080 18703 9869 1 27 . 1 1 64 64 ILE CB C 64 38.002 38.002 37.610 0.392 18703 9870 1 27 . 1 1 64 64 ILE H H 64 8.160 8.160 7.599 0.561 18703 9871 1 27 . 1 1 65 65 LYS N N 65 118.871 118.871 119.150 -0.279 18703 9872 1 27 . 1 1 65 65 LYS HA H 65 4.111 4.111 4.115 -0.004 18703 9873 1 27 . 1 1 65 65 LYS C C 65 177.076 177.076 177.663 -0.587 18703 9874 1 27 . 1 1 65 65 LYS CA C 65 58.421 58.421 58.589 -0.168 18703 9875 1 27 . 1 1 65 65 LYS CB C 65 32.639 32.639 32.194 0.445 18703 9876 1 27 . 1 1 65 65 LYS H H 65 7.664 7.664 7.841 -0.177 18703 9877 1 27 . 1 1 66 66 LYS N N 66 116.944 116.944 118.516 -1.572 18703 9878 1 27 . 1 1 66 66 LYS HA H 66 4.320 4.320 4.108 0.212 18703 9879 1 27 . 1 1 66 66 LYS C C 66 175.897 175.897 177.756 -1.859 18703 9880 1 27 . 1 1 66 66 LYS CA C 66 56.352 56.352 58.006 -1.654 18703 9881 1 27 . 1 1 66 66 LYS CB C 66 33.024 33.024 32.763 0.261 18703 9882 1 27 . 1 1 66 66 LYS H H 66 7.246 7.246 7.662 -0.415 18703 9883 1 28 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.475 -0.229 18703 9884 1 28 . 1 1 3 3 ARG C C 3 178.379 178.379 177.494 0.885 18703 9885 1 28 . 1 1 3 3 ARG CA C 3 58.367 58.367 56.900 1.467 18703 9886 1 28 . 1 1 3 3 ARG CB C 3 30.691 30.691 30.961 -0.270 18703 9887 1 28 . 1 1 3 3 ARG H H 3 7.905 7.905 8.355 -0.450 18703 9888 1 28 . 1 1 4 4 VAL N N 4 118.966 118.966 119.908 -0.942 18703 9889 1 28 . 1 1 4 4 VAL HA H 4 3.803 3.803 3.670 0.133 18703 9890 1 28 . 1 1 4 4 VAL C C 4 176.968 176.968 177.118 -0.150 18703 9891 1 28 . 1 1 4 4 VAL CA C 4 65.441 65.441 65.349 0.092 18703 9892 1 28 . 1 1 4 4 VAL CB C 4 31.710 31.710 31.685 0.025 18703 9893 1 28 . 1 1 4 4 VAL H H 4 8.070 8.070 8.227 -0.157 18703 9894 1 28 . 1 1 5 5 LYS N N 5 122.058 122.058 118.499 3.559 18703 9895 1 28 . 1 1 5 5 LYS HA H 5 4.154 4.154 4.154 -0.000 18703 9896 1 28 . 1 1 5 5 LYS C C 5 178.553 178.553 178.235 0.318 18703 9897 1 28 . 1 1 5 5 LYS CA C 5 58.712 58.712 59.454 -0.742 18703 9898 1 28 . 1 1 5 5 LYS CB C 5 31.788 31.788 32.033 -0.245 18703 9899 1 28 . 1 1 5 5 LYS H H 5 7.798 7.798 8.356 -0.558 18703 9900 1 28 . 1 1 6 6 ALA N N 6 119.955 119.955 120.736 -0.781 18703 9901 1 28 . 1 1 6 6 ALA HA H 6 4.198 4.198 4.240 -0.042 18703 9902 1 28 . 1 1 6 6 ALA C C 6 180.974 180.974 179.296 1.678 18703 9903 1 28 . 1 1 6 6 ALA CA C 6 54.850 54.850 54.288 0.561 18703 9904 1 28 . 1 1 6 6 ALA CB C 6 17.995 17.995 18.340 -0.345 18703 9905 1 28 . 1 1 6 6 ALA H H 6 7.928 7.928 7.448 0.480 18703 9906 1 28 . 1 1 7 7 LEU N N 7 119.211 119.211 119.156 0.055 18703 9907 1 28 . 1 1 7 7 LEU HA H 7 4.124 4.124 4.012 0.112 18703 9908 1 28 . 1 1 7 7 LEU C C 7 178.353 178.353 178.713 -0.360 18703 9909 1 28 . 1 1 7 7 LEU CA C 7 57.658 57.658 57.293 0.365 18703 9910 1 28 . 1 1 7 7 LEU CB C 7 41.971 41.971 42.097 -0.126 18703 9911 1 28 . 1 1 7 7 LEU H H 7 7.594 7.594 7.661 -0.067 18703 9912 1 28 . 1 1 8 8 GLU N N 8 120.258 120.258 118.358 1.900 18703 9913 1 28 . 1 1 8 8 GLU HA H 8 3.846 3.846 4.029 -0.183 18703 9914 1 28 . 1 1 8 8 GLU C C 8 179.546 179.546 178.751 0.795 18703 9915 1 28 . 1 1 8 8 GLU CA C 8 60.006 60.006 59.596 0.410 18703 9916 1 28 . 1 1 8 8 GLU CB C 8 29.683 29.683 29.593 0.090 18703 9917 1 28 . 1 1 8 8 GLU H H 8 8.382 8.382 7.773 0.609 18703 9918 1 28 . 1 1 9 9 GLU N N 9 118.584 118.584 118.971 -0.387 18703 9919 1 28 . 1 1 9 9 GLU HA H 9 4.039 4.039 4.096 -0.057 18703 9920 1 28 . 1 1 9 9 GLU C C 9 179.635 179.635 178.733 0.902 18703 9921 1 28 . 1 1 9 9 GLU CA C 9 59.235 59.235 58.838 0.397 18703 9922 1 28 . 1 1 9 9 GLU CB C 9 29.358 29.358 29.055 0.302 18703 9923 1 28 . 1 1 9 9 GLU H H 9 7.908 7.908 7.787 0.121 18703 9924 1 28 . 1 1 10 10 LYS N N 10 120.956 120.956 120.070 0.886 18703 9925 1 28 . 1 1 10 10 LYS HA H 10 4.190 4.190 4.128 0.062 18703 9926 1 28 . 1 1 10 10 LYS C C 10 179.395 179.395 178.776 0.619 18703 9927 1 28 . 1 1 10 10 LYS CA C 10 59.231 59.231 59.240 -0.009 18703 9928 1 28 . 1 1 10 10 LYS CB C 10 32.211 32.211 32.407 -0.196 18703 9929 1 28 . 1 1 10 10 LYS H H 10 8.009 8.009 7.573 0.436 18703 9930 1 28 . 1 1 11 11 VAL N N 11 119.577 119.577 117.605 1.972 18703 9931 1 28 . 1 1 11 11 VAL HA H 11 3.844 3.844 3.747 0.097 18703 9932 1 28 . 1 1 11 11 VAL C C 11 177.078 177.078 177.648 -0.570 18703 9933 1 28 . 1 1 11 11 VAL CA C 11 66.407 66.407 65.689 0.718 18703 9934 1 28 . 1 1 11 11 VAL CB C 11 31.252 31.252 31.384 -0.132 18703 9935 1 28 . 1 1 11 11 VAL H H 11 8.488 8.488 7.651 0.837 18703 9936 1 28 . 1 1 12 12 LYS N N 12 122.864 122.864 120.011 2.853 18703 9937 1 28 . 1 1 12 12 LYS HA H 12 4.189 4.189 3.968 0.221 18703 9938 1 28 . 1 1 12 12 LYS C C 12 178.755 178.755 178.575 0.180 18703 9939 1 28 . 1 1 12 12 LYS CA C 12 59.375 59.375 59.742 -0.367 18703 9940 1 28 . 1 1 12 12 LYS CB C 12 31.991 31.991 32.260 -0.269 18703 9941 1 28 . 1 1 12 12 LYS H H 12 7.944 7.944 7.574 0.370 18703 9942 1 28 . 1 1 13 13 ALA N N 13 121.202 121.202 120.384 0.818 18703 9943 1 28 . 1 1 13 13 ALA HA H 13 4.209 4.209 4.267 -0.058 18703 9944 1 28 . 1 1 13 13 ALA C C 13 181.060 181.060 179.246 1.814 18703 9945 1 28 . 1 1 13 13 ALA CA C 13 54.710 54.710 54.121 0.589 18703 9946 1 28 . 1 1 13 13 ALA CB C 13 17.861 17.861 18.505 -0.644 18703 9947 1 28 . 1 1 13 13 ALA H H 13 7.563 7.563 7.425 0.138 18703 9948 1 28 . 1 1 14 14 LEU N N 14 120.014 120.014 119.724 0.290 18703 9949 1 28 . 1 1 14 14 LEU HA H 14 4.072 4.072 4.013 0.058 18703 9950 1 28 . 1 1 14 14 LEU C C 14 177.862 177.862 178.129 -0.267 18703 9951 1 28 . 1 1 14 14 LEU CA C 14 57.864 57.864 57.331 0.533 18703 9952 1 28 . 1 1 14 14 LEU CB C 14 41.539 41.539 42.093 -0.554 18703 9953 1 28 . 1 1 14 14 LEU H H 14 8.087 8.087 7.511 0.576 18703 9954 1 28 . 1 1 15 15 GLU N N 15 121.644 121.644 120.126 1.518 18703 9955 1 28 . 1 1 15 15 GLU HA H 15 3.692 3.692 4.003 -0.311 18703 9956 1 28 . 1 1 15 15 GLU C C 15 177.819 177.819 178.258 -0.439 18703 9957 1 28 . 1 1 15 15 GLU CA C 15 59.239 59.239 59.305 -0.066 18703 9958 1 28 . 1 1 15 15 GLU CB C 15 28.865 28.865 29.475 -0.610 18703 9959 1 28 . 1 1 15 15 GLU H H 15 8.542 8.542 7.708 0.834 18703 9960 1 28 . 1 1 16 16 GLU N N 16 116.016 116.016 118.553 -2.537 18703 9961 1 28 . 1 1 16 16 GLU HA H 16 3.955 3.955 3.988 -0.033 18703 9962 1 28 . 1 1 16 16 GLU C C 16 179.159 179.159 179.030 0.129 18703 9963 1 28 . 1 1 16 16 GLU CA C 16 59.324 59.324 59.118 0.206 18703 9964 1 28 . 1 1 16 16 GLU CB C 16 29.060 29.060 29.334 -0.274 18703 9965 1 28 . 1 1 16 16 GLU H H 16 7.492 7.492 8.093 -0.601 18703 9966 1 28 . 1 1 17 17 LYS N N 17 118.546 118.546 119.366 -0.820 18703 9967 1 28 . 1 1 17 17 LYS HA H 17 4.117 4.117 4.140 -0.023 18703 9968 1 28 . 1 1 17 17 LYS C C 17 178.976 178.976 178.687 0.289 18703 9969 1 28 . 1 1 17 17 LYS CA C 17 58.837 58.837 58.870 -0.033 18703 9970 1 28 . 1 1 17 17 LYS CB C 17 32.538 32.538 32.506 0.032 18703 9971 1 28 . 1 1 17 17 LYS H H 17 7.720 7.720 7.487 0.233 18703 9972 1 28 . 1 1 18 18 VAL N N 18 118.376 118.376 118.966 -0.590 18703 9973 1 28 . 1 1 18 18 VAL HA H 18 3.711 3.711 3.686 0.025 18703 9974 1 28 . 1 1 18 18 VAL C C 18 178.765 178.765 178.607 0.158 18703 9975 1 28 . 1 1 18 18 VAL CA C 18 66.237 66.237 66.084 0.153 18703 9976 1 28 . 1 1 18 18 VAL CB C 18 31.682 31.682 31.691 -0.009 18703 9977 1 28 . 1 1 18 18 VAL H H 18 8.754 8.754 7.436 1.318 18703 9978 1 28 . 1 1 19 19 LYS N N 19 118.817 118.817 118.514 0.303 18703 9979 1 28 . 1 1 19 19 LYS HA H 19 4.078 4.078 3.986 0.092 18703 9980 1 28 . 1 1 19 19 LYS C C 19 178.049 178.049 177.755 0.294 18703 9981 1 28 . 1 1 19 19 LYS CA C 19 59.731 59.731 59.090 0.641 18703 9982 1 28 . 1 1 19 19 LYS CB C 19 32.523 32.523 32.112 0.411 18703 9983 1 28 . 1 1 19 19 LYS H H 19 8.299 8.299 8.527 -0.228 18703 9984 1 28 . 1 1 20 20 ALA N N 20 119.656 119.656 119.574 0.082 18703 9985 1 28 . 1 1 20 20 ALA HA H 20 4.347 4.347 4.382 -0.035 18703 9986 1 28 . 1 1 20 20 ALA C C 20 178.532 178.532 177.925 0.607 18703 9987 1 28 . 1 1 20 20 ALA CA C 20 52.853 52.853 52.262 0.591 18703 9988 1 28 . 1 1 20 20 ALA CB C 20 18.832 18.832 19.464 -0.632 18703 9989 1 28 . 1 1 20 20 ALA H H 20 7.425 7.425 7.620 -0.195 18703 9990 1 28 . 1 1 21 21 LEU N N 21 118.594 118.594 120.474 -1.880 18703 9991 1 28 . 1 1 21 21 LEU HA H 21 4.297 4.297 4.505 -0.208 18703 9992 1 28 . 1 1 21 21 LEU C C 21 177.784 177.784 177.513 0.271 18703 9993 1 28 . 1 1 21 21 LEU CA C 21 55.750 55.750 55.213 0.537 18703 9994 1 28 . 1 1 21 21 LEU CB C 21 42.898 42.898 42.290 0.608 18703 9995 1 28 . 1 1 21 21 LEU H H 21 7.508 7.508 8.100 -0.592 18703 9996 1 28 . 1 1 22 22 GLY N N 22 106.650 106.650 106.710 -0.060 18703 9997 1 28 . 1 1 22 22 GLY C C 22 173.605 173.605 173.773 -0.168 18703 9998 1 28 . 1 1 22 22 GLY CA C 22 45.330 45.330 44.731 0.599 18703 9999 1 28 . 1 1 22 22 GLY H H 22 7.814 7.814 8.486 -0.672 18703 10000 1 28 . 1 1 23 23 GLY N N 23 108.011 108.011 105.797 2.214 18703 10001 1 28 . 1 1 23 23 GLY C C 23 174.061 174.061 172.821 1.240 18703 10002 1 28 . 1 1 23 23 GLY CA C 23 44.772 44.772 45.377 -0.605 18703 10003 1 28 . 1 1 23 23 GLY H H 23 8.139 8.139 7.656 0.483 18703 10004 1 28 . 1 1 24 24 GLY N N 24 107.826 107.826 106.141 1.685 18703 10005 1 28 . 1 1 24 24 GLY C C 24 175.046 175.046 173.844 1.202 18703 10006 1 28 . 1 1 24 24 GLY CA C 24 44.422 44.422 45.596 -1.174 18703 10007 1 28 . 1 1 24 24 GLY H H 24 8.497 8.497 8.486 0.011 18703 10008 1 28 . 1 1 25 25 GLY N N 25 108.830 108.830 108.981 -0.151 18703 10009 1 28 . 1 1 25 25 GLY C C 25 176.272 176.272 174.559 1.713 18703 10010 1 28 . 1 1 25 25 GLY CA C 25 47.101 47.101 45.886 1.216 18703 10011 1 28 . 1 1 25 25 GLY H H 25 8.616 8.616 7.804 0.812 18703 10012 1 28 . 1 1 26 26 ARG N N 26 123.109 123.109 122.507 0.602 18703 10013 1 28 . 1 1 26 26 ARG HA H 26 4.283 4.283 4.196 0.087 18703 10014 1 28 . 1 1 26 26 ARG C C 26 177.848 177.848 178.674 -0.826 18703 10015 1 28 . 1 1 26 26 ARG CA C 26 57.663 57.663 58.308 -0.645 18703 10016 1 28 . 1 1 26 26 ARG CB C 26 29.811 29.811 29.751 0.060 18703 10017 1 28 . 1 1 26 26 ARG H H 26 8.770 8.770 8.516 0.254 18703 10018 1 28 . 1 1 27 27 ILE N N 27 118.104 118.104 118.530 -0.426 18703 10019 1 28 . 1 1 27 27 ILE HA H 27 3.787 3.787 3.700 0.087 18703 10020 1 28 . 1 1 27 27 ILE C C 27 177.473 177.473 177.623 -0.150 18703 10021 1 28 . 1 1 27 27 ILE CA C 27 63.036 63.036 64.844 -1.808 18703 10022 1 28 . 1 1 27 27 ILE CB C 27 36.664 36.664 37.531 -0.867 18703 10023 1 28 . 1 1 27 27 ILE H H 27 7.708 7.708 8.216 -0.508 18703 10024 1 28 . 1 1 28 28 GLU N N 28 119.934 119.934 120.123 -0.189 18703 10025 1 28 . 1 1 28 28 GLU HA H 28 3.954 3.954 3.845 0.109 18703 10026 1 28 . 1 1 28 28 GLU C C 28 179.514 179.514 178.449 1.065 18703 10027 1 28 . 1 1 28 28 GLU CA C 28 59.450 59.450 60.277 -0.827 18703 10028 1 28 . 1 1 28 28 GLU CB C 28 29.600 29.600 29.317 0.283 18703 10029 1 28 . 1 1 28 28 GLU H H 28 7.872 7.872 8.247 -0.375 18703 10030 1 28 . 1 1 29 29 GLU N N 29 118.134 118.134 119.440 -1.306 18703 10031 1 28 . 1 1 29 29 GLU HA H 29 4.028 4.028 4.072 -0.044 18703 10032 1 28 . 1 1 29 29 GLU C C 29 179.182 179.182 179.163 0.019 18703 10033 1 28 . 1 1 29 29 GLU CA C 29 59.173 59.173 59.142 0.031 18703 10034 1 28 . 1 1 29 29 GLU CB C 29 29.503 29.503 29.476 0.027 18703 10035 1 28 . 1 1 29 29 GLU H H 29 8.166 8.166 7.758 0.408 18703 10036 1 28 . 1 1 30 30 LEU N N 30 120.242 120.242 117.795 2.447 18703 10037 1 28 . 1 1 30 30 LEU HA H 30 4.028 4.028 4.105 -0.077 18703 10038 1 28 . 1 1 30 30 LEU C C 30 178.796 178.796 178.721 0.075 18703 10039 1 28 . 1 1 30 30 LEU CA C 30 57.654 57.654 57.345 0.309 18703 10040 1 28 . 1 1 30 30 LEU CB C 30 41.629 41.629 41.838 -0.209 18703 10041 1 28 . 1 1 30 30 LEU H H 30 7.695 7.695 7.527 0.168 18703 10042 1 28 . 1 1 31 31 LYS N N 31 120.506 120.506 120.322 0.184 18703 10043 1 28 . 1 1 31 31 LYS HA H 31 3.532 3.532 4.047 -0.515 18703 10044 1 28 . 1 1 31 31 LYS C C 31 178.919 178.919 178.296 0.623 18703 10045 1 28 . 1 1 31 31 LYS CA C 31 60.240 60.240 59.337 0.903 18703 10046 1 28 . 1 1 31 31 LYS CB C 31 32.015 32.015 32.264 -0.249 18703 10047 1 28 . 1 1 31 31 LYS H H 31 8.561 8.561 7.824 0.737 18703 10048 1 28 . 1 1 32 32 LYS N N 32 118.566 118.566 118.469 0.097 18703 10049 1 28 . 1 1 32 32 LYS C C 32 179.392 179.392 179.335 0.057 18703 10050 1 28 . 1 1 32 32 LYS CA C 32 59.356 59.356 59.675 -0.319 18703 10051 1 28 . 1 1 32 32 LYS CB C 32 32.117 32.117 32.430 -0.313 18703 10052 1 28 . 1 1 32 32 LYS H H 32 7.699 7.699 7.558 0.141 18703 10053 1 28 . 1 1 33 33 LYS N N 33 118.964 118.964 118.370 0.594 18703 10054 1 28 . 1 1 33 33 LYS HA H 33 4.117 4.117 4.229 -0.112 18703 10055 1 28 . 1 1 33 33 LYS C C 33 178.355 178.355 178.432 -0.077 18703 10056 1 28 . 1 1 33 33 LYS CA C 33 58.633 58.633 58.708 -0.075 18703 10057 1 28 . 1 1 33 33 LYS CB C 33 31.904 31.904 32.427 -0.523 18703 10058 1 28 . 1 1 33 33 LYS H H 33 7.752 7.752 7.544 0.208 18703 10059 1 28 . 1 1 34 34 CYS N N 34 119.956 119.956 119.307 0.649 18703 10060 1 28 . 1 1 34 34 CYS HA H 34 3.967 3.967 4.103 -0.136 18703 10061 1 28 . 1 1 34 34 CYS C C 34 175.521 175.521 176.698 -1.177 18703 10062 1 28 . 1 1 34 34 CYS CA C 34 60.987 60.987 63.095 -2.108 18703 10063 1 28 . 1 1 34 34 CYS CB C 34 36.600 36.600 26.687 9.913 18703 10064 1 28 . 1 1 34 34 CYS H H 34 8.393 8.393 7.570 0.823 18703 10065 1 28 . 1 1 35 35 GLU N N 35 120.327 120.327 119.513 0.814 18703 10066 1 28 . 1 1 35 35 GLU HA H 35 3.891 3.891 3.939 -0.048 18703 10067 1 28 . 1 1 35 35 GLU C C 35 179.684 179.684 178.519 1.165 18703 10068 1 28 . 1 1 35 35 GLU CA C 35 60.059 60.059 59.283 0.776 18703 10069 1 28 . 1 1 35 35 GLU CB C 35 29.718 29.718 28.584 1.133 18703 10070 1 28 . 1 1 35 35 GLU H H 35 8.558 8.558 7.912 0.646 18703 10071 1 28 . 1 1 36 36 GLU N N 36 120.190 120.190 119.888 0.302 18703 10072 1 28 . 1 1 36 36 GLU HA H 36 4.051 4.051 4.036 0.015 18703 10073 1 28 . 1 1 36 36 GLU C C 36 179.408 179.408 178.834 0.574 18703 10074 1 28 . 1 1 36 36 GLU CA C 36 59.148 59.148 58.812 0.336 18703 10075 1 28 . 1 1 36 36 GLU CB C 36 29.766 29.766 29.845 -0.079 18703 10076 1 28 . 1 1 36 36 GLU H H 36 8.038 8.038 7.627 0.411 18703 10077 1 28 . 1 1 37 37 LEU N N 37 121.102 121.102 120.722 0.380 18703 10078 1 28 . 1 1 37 37 LEU HA H 37 4.079 4.079 4.165 -0.086 18703 10079 1 28 . 1 1 37 37 LEU C C 37 178.279 178.279 178.327 -0.048 18703 10080 1 28 . 1 1 37 37 LEU CA C 37 57.803 57.803 57.286 0.517 18703 10081 1 28 . 1 1 37 37 LEU CB C 37 41.502 41.502 41.623 -0.121 18703 10082 1 28 . 1 1 37 37 LEU H H 37 8.065 8.065 7.429 0.636 18703 10083 1 28 . 1 1 38 38 LYS N N 38 119.980 119.980 119.232 0.748 18703 10084 1 28 . 1 1 38 38 LYS HA H 38 3.851 3.851 3.835 0.016 18703 10085 1 28 . 1 1 38 38 LYS C C 38 178.919 178.919 179.170 -0.251 18703 10086 1 28 . 1 1 38 38 LYS CA C 38 60.794 60.794 59.946 0.848 18703 10087 1 28 . 1 1 38 38 LYS CB C 38 32.863 32.863 32.376 0.487 18703 10088 1 28 . 1 1 38 38 LYS H H 38 8.741 8.741 7.534 1.207 18703 10089 1 28 . 1 1 39 39 LYS N N 39 118.307 118.307 117.454 0.853 18703 10090 1 28 . 1 1 39 39 LYS HA H 39 4.125 4.125 3.987 0.138 18703 10091 1 28 . 1 1 39 39 LYS C C 39 178.622 178.622 178.359 0.263 18703 10092 1 28 . 1 1 39 39 LYS CA C 39 58.993 58.993 59.296 -0.303 18703 10093 1 28 . 1 1 39 39 LYS CB C 39 32.097 32.097 31.940 0.157 18703 10094 1 28 . 1 1 39 39 LYS H H 39 7.584 7.584 7.768 -0.184 18703 10095 1 28 . 1 1 40 40 LYS N N 40 118.826 118.826 119.582 -0.756 18703 10096 1 28 . 1 1 40 40 LYS HA H 40 4.069 4.069 4.139 -0.070 18703 10097 1 28 . 1 1 40 40 LYS C C 40 179.802 179.802 178.687 1.115 18703 10098 1 28 . 1 1 40 40 LYS CA C 40 59.322 59.322 58.665 0.657 18703 10099 1 28 . 1 1 40 40 LYS CB C 40 32.505 32.505 32.278 0.227 18703 10100 1 28 . 1 1 40 40 LYS H H 40 7.945 7.945 7.279 0.666 18703 10101 1 28 . 1 1 41 41 ILE N N 41 118.958 118.958 118.863 0.095 18703 10102 1 28 . 1 1 41 41 ILE HA H 41 3.659 3.659 3.807 -0.148 18703 10103 1 28 . 1 1 41 41 ILE C C 41 178.146 178.146 176.945 1.201 18703 10104 1 28 . 1 1 41 41 ILE CA C 41 65.037 65.037 64.138 0.899 18703 10105 1 28 . 1 1 41 41 ILE CB C 41 37.950 37.950 37.735 0.215 18703 10106 1 28 . 1 1 41 41 ILE H H 41 8.369 8.369 7.986 0.383 18703 10107 1 28 . 1 1 42 42 GLU N N 42 120.331 120.331 116.890 3.441 18703 10108 1 28 . 1 1 42 42 GLU HA H 42 4.094 4.094 4.097 -0.003 18703 10109 1 28 . 1 1 42 42 GLU C C 42 178.697 178.697 177.581 1.116 18703 10110 1 28 . 1 1 42 42 GLU CA C 42 58.927 58.927 58.622 0.305 18703 10111 1 28 . 1 1 42 42 GLU CB C 42 29.399 29.399 30.299 -0.900 18703 10112 1 28 . 1 1 42 42 GLU H H 42 7.805 7.805 7.623 0.182 18703 10113 1 28 . 1 1 43 43 GLU N N 43 117.120 117.120 116.453 0.667 18703 10114 1 28 . 1 1 43 43 GLU HA H 43 4.291 4.291 4.218 0.073 18703 10115 1 28 . 1 1 43 43 GLU C C 43 177.551 177.551 177.619 -0.068 18703 10116 1 28 . 1 1 43 43 GLU CA C 43 56.800 56.800 57.154 -0.354 18703 10117 1 28 . 1 1 43 43 GLU CB C 43 29.931 29.931 29.734 0.197 18703 10118 1 28 . 1 1 43 43 GLU H H 43 7.701 7.701 7.562 0.139 18703 10119 1 28 . 1 1 44 44 LEU N N 44 120.940 120.940 121.016 -0.076 18703 10120 1 28 . 1 1 44 44 LEU HA H 44 4.251 4.251 4.026 0.225 18703 10121 1 28 . 1 1 44 44 LEU C C 44 178.596 178.596 176.932 1.664 18703 10122 1 28 . 1 1 44 44 LEU CA C 44 56.448 56.448 55.253 1.195 18703 10123 1 28 . 1 1 44 44 LEU CB C 44 42.519 42.519 42.502 0.017 18703 10124 1 28 . 1 1 44 44 LEU H H 44 7.581 7.581 7.378 0.203 18703 10125 1 28 . 1 1 45 45 GLY N N 45 108.689 108.689 108.628 0.061 18703 10126 1 28 . 1 1 45 45 GLY C C 45 174.853 174.853 173.553 1.300 18703 10127 1 28 . 1 1 45 45 GLY CA C 45 46.233 46.233 45.169 1.064 18703 10128 1 28 . 1 1 45 45 GLY H H 45 8.232 8.232 8.315 -0.083 18703 10129 1 28 . 1 1 46 46 GLY N N 46 108.029 108.029 108.860 -0.831 18703 10130 1 28 . 1 1 46 46 GLY C C 46 174.351 174.351 174.161 0.190 18703 10131 1 28 . 1 1 46 46 GLY CA C 46 45.105 45.105 45.020 0.085 18703 10132 1 28 . 1 1 46 46 GLY H H 46 8.176 8.176 8.113 0.063 18703 10133 1 28 . 1 1 47 47 GLY N N 47 108.183 108.183 108.518 -0.335 18703 10134 1 28 . 1 1 47 47 GLY C C 47 174.671 174.671 175.299 -0.628 18703 10135 1 28 . 1 1 47 47 GLY CA C 47 45.254 45.254 44.614 0.640 18703 10136 1 28 . 1 1 47 47 GLY H H 47 8.290 8.290 8.125 0.165 18703 10137 1 28 . 1 1 48 48 GLY N N 48 108.616 108.616 107.987 0.629 18703 10138 1 28 . 1 1 48 48 GLY C C 48 174.321 174.321 174.559 -0.238 18703 10139 1 28 . 1 1 48 48 GLY CA C 48 45.192 45.192 44.998 0.194 18703 10140 1 28 . 1 1 48 48 GLY H H 48 8.027 8.027 8.629 -0.602 18703 10141 1 28 . 1 1 49 49 GLU N N 49 121.057 121.057 120.268 0.789 18703 10142 1 28 . 1 1 49 49 GLU HA H 49 4.425 4.425 4.428 -0.003 18703 10143 1 28 . 1 1 49 49 GLU C C 49 177.072 177.072 177.973 -0.901 18703 10144 1 28 . 1 1 49 49 GLU CA C 49 56.330 56.330 57.418 -1.088 18703 10145 1 28 . 1 1 49 49 GLU CB C 49 29.602 29.602 29.923 -0.321 18703 10146 1 28 . 1 1 49 49 GLU H H 49 8.486 8.486 8.212 0.274 18703 10147 1 28 . 1 1 50 50 VAL N N 50 122.122 122.122 119.509 2.613 18703 10148 1 28 . 1 1 50 50 VAL HA H 50 3.792 3.792 3.680 0.112 18703 10149 1 28 . 1 1 50 50 VAL C C 50 176.774 176.774 177.772 -0.998 18703 10150 1 28 . 1 1 50 50 VAL CA C 50 64.864 64.864 65.820 -0.956 18703 10151 1 28 . 1 1 50 50 VAL CB C 50 32.179 32.179 31.354 0.825 18703 10152 1 28 . 1 1 50 50 VAL H H 50 8.095 8.095 8.070 0.025 18703 10153 1 28 . 1 1 51 51 LYS N N 51 120.602 120.602 118.190 2.412 18703 10154 1 28 . 1 1 51 51 LYS HA H 51 4.195 4.195 3.996 0.199 18703 10155 1 28 . 1 1 51 51 LYS C C 51 178.530 178.530 178.106 0.424 18703 10156 1 28 . 1 1 51 51 LYS CA C 51 59.348 59.348 59.237 0.111 18703 10157 1 28 . 1 1 51 51 LYS CB C 51 32.265 32.265 32.186 0.079 18703 10158 1 28 . 1 1 51 51 LYS H H 51 8.268 8.268 8.075 0.193 18703 10159 1 28 . 1 1 52 52 LYS N N 52 117.547 117.547 120.574 -3.027 18703 10160 1 28 . 1 1 52 52 LYS HA H 52 4.162 4.162 4.073 0.089 18703 10161 1 28 . 1 1 52 52 LYS C C 52 179.132 179.132 178.809 0.323 18703 10162 1 28 . 1 1 52 52 LYS CA C 52 58.811 58.811 58.785 0.026 18703 10163 1 28 . 1 1 52 52 LYS CB C 52 32.054 32.054 31.884 0.170 18703 10164 1 28 . 1 1 52 52 LYS H H 52 7.595 7.595 7.702 -0.107 18703 10165 1 28 . 1 1 53 53 VAL N N 53 119.190 119.190 118.073 1.117 18703 10166 1 28 . 1 1 53 53 VAL HA H 53 3.767 3.767 3.730 0.037 18703 10167 1 28 . 1 1 53 53 VAL C C 53 177.933 177.933 177.899 0.034 18703 10168 1 28 . 1 1 53 53 VAL CA C 53 66.065 66.065 66.348 -0.283 18703 10169 1 28 . 1 1 53 53 VAL CB C 53 31.248 31.248 30.884 0.363 18703 10170 1 28 . 1 1 53 53 VAL H H 53 7.597 7.597 7.520 0.077 18703 10171 1 28 . 1 1 54 54 GLU N N 54 120.226 120.226 119.828 0.398 18703 10172 1 28 . 1 1 54 54 GLU HA H 54 3.833 3.833 4.002 -0.169 18703 10173 1 28 . 1 1 54 54 GLU C C 54 179.352 179.352 178.516 0.836 18703 10174 1 28 . 1 1 54 54 GLU CA C 54 59.153 59.153 59.809 -0.656 18703 10175 1 28 . 1 1 54 54 GLU CB C 54 29.224 29.224 29.392 -0.168 18703 10176 1 28 . 1 1 54 54 GLU H H 54 8.609 8.609 7.696 0.913 18703 10177 1 28 . 1 1 55 55 GLU N N 55 119.148 119.148 119.357 -0.209 18703 10178 1 28 . 1 1 55 55 GLU HA H 55 4.084 4.084 4.093 -0.009 18703 10179 1 28 . 1 1 55 55 GLU C C 55 179.084 179.084 178.924 0.160 18703 10180 1 28 . 1 1 55 55 GLU CA C 55 59.295 59.295 59.072 0.223 18703 10181 1 28 . 1 1 55 55 GLU CB C 55 29.361 29.361 29.544 -0.183 18703 10182 1 28 . 1 1 55 55 GLU H H 55 7.713 7.713 7.725 -0.012 18703 10183 1 28 . 1 1 56 56 GLU N N 56 120.301 120.301 118.451 1.850 18703 10184 1 28 . 1 1 56 56 GLU HA H 56 4.079 4.079 4.110 -0.031 18703 10185 1 28 . 1 1 56 56 GLU C C 56 179.773 179.773 178.646 1.127 18703 10186 1 28 . 1 1 56 56 GLU CA C 56 59.528 59.528 59.307 0.221 18703 10187 1 28 . 1 1 56 56 GLU CB C 56 30.162 30.162 29.791 0.371 18703 10188 1 28 . 1 1 56 56 GLU H H 56 7.899 7.899 7.632 0.267 18703 10189 1 28 . 1 1 57 57 VAL N N 57 121.536 121.536 117.513 4.023 18703 10190 1 28 . 1 1 57 57 VAL HA H 57 3.540 3.540 3.797 -0.257 18703 10191 1 28 . 1 1 57 57 VAL C C 57 176.984 176.984 177.840 -0.856 18703 10192 1 28 . 1 1 57 57 VAL CA C 57 66.734 66.734 65.511 1.223 18703 10193 1 28 . 1 1 57 57 VAL CB C 57 31.425 31.425 31.508 -0.083 18703 10194 1 28 . 1 1 57 57 VAL H H 57 8.652 8.652 7.280 1.372 18703 10195 1 28 . 1 1 58 58 LYS N N 58 120.219 120.219 119.762 0.457 18703 10196 1 28 . 1 1 58 58 LYS HA H 58 4.199 4.199 4.162 0.037 18703 10197 1 28 . 1 1 58 58 LYS C C 58 178.972 178.972 178.384 0.588 18703 10198 1 28 . 1 1 58 58 LYS CA C 58 59.357 59.357 58.588 0.769 18703 10199 1 28 . 1 1 58 58 LYS CB C 58 32.186 32.186 31.778 0.408 18703 10200 1 28 . 1 1 58 58 LYS H H 58 7.791 7.791 7.528 0.263 18703 10201 1 28 . 1 1 59 59 LYS N N 59 118.252 118.252 119.980 -1.728 18703 10202 1 28 . 1 1 59 59 LYS HA H 59 4.069 4.069 4.150 -0.081 18703 10203 1 28 . 1 1 59 59 LYS C C 59 179.180 179.180 178.653 0.527 18703 10204 1 28 . 1 1 59 59 LYS CA C 59 59.285 59.285 59.000 0.285 18703 10205 1 28 . 1 1 59 59 LYS CB C 59 32.345 32.345 32.543 -0.198 18703 10206 1 28 . 1 1 59 59 LYS H H 59 7.849 7.849 7.519 0.330 18703 10207 1 28 . 1 1 60 60 LEU N N 60 121.243 121.243 119.813 1.430 18703 10208 1 28 . 1 1 60 60 LEU HA H 60 4.242 4.242 4.135 0.107 18703 10209 1 28 . 1 1 60 60 LEU C C 60 178.413 178.413 178.110 0.303 18703 10210 1 28 . 1 1 60 60 LEU CA C 60 57.798 57.798 57.264 0.534 18703 10211 1 28 . 1 1 60 60 LEU CB C 60 41.150 41.150 42.112 -0.962 18703 10212 1 28 . 1 1 60 60 LEU H H 60 7.825 7.825 7.547 0.278 18703 10213 1 28 . 1 1 61 61 GLU N N 61 118.844 118.844 120.063 -1.219 18703 10214 1 28 . 1 1 61 61 GLU HA H 61 3.800 3.800 3.902 -0.102 18703 10215 1 28 . 1 1 61 61 GLU C C 61 179.078 179.078 178.646 0.432 18703 10216 1 28 . 1 1 61 61 GLU CA C 61 60.104 60.104 60.004 0.100 18703 10217 1 28 . 1 1 61 61 GLU CB C 61 29.864 29.864 29.591 0.273 18703 10218 1 28 . 1 1 61 61 GLU H H 61 8.582 8.582 7.683 0.899 18703 10219 1 28 . 1 1 62 62 GLU N N 62 117.659 117.659 118.749 -1.090 18703 10220 1 28 . 1 1 62 62 GLU HA H 62 3.990 3.990 4.057 -0.067 18703 10221 1 28 . 1 1 62 62 GLU C C 62 178.847 178.847 178.911 -0.064 18703 10222 1 28 . 1 1 62 62 GLU CA C 62 59.067 59.067 58.968 0.099 18703 10223 1 28 . 1 1 62 62 GLU CB C 62 29.440 29.440 29.633 -0.193 18703 10224 1 28 . 1 1 62 62 GLU H H 62 8.032 8.032 7.644 0.388 18703 10225 1 28 . 1 1 63 63 GLU N N 63 119.290 119.290 119.171 0.119 18703 10226 1 28 . 1 1 63 63 GLU HA H 63 4.012 4.012 4.070 -0.058 18703 10227 1 28 . 1 1 63 63 GLU C C 63 179.784 179.784 179.169 0.615 18703 10228 1 28 . 1 1 63 63 GLU CA C 63 59.300 59.300 59.373 -0.073 18703 10229 1 28 . 1 1 63 63 GLU CB C 63 29.728 29.728 29.618 0.110 18703 10230 1 28 . 1 1 63 63 GLU H H 63 7.958 7.958 7.485 0.473 18703 10231 1 28 . 1 1 64 64 ILE N N 64 118.453 118.453 118.374 0.079 18703 10232 1 28 . 1 1 64 64 ILE HA H 64 3.711 3.711 3.837 -0.126 18703 10233 1 28 . 1 1 64 64 ILE C C 64 177.655 177.655 178.014 -0.359 18703 10234 1 28 . 1 1 64 64 ILE CA C 64 64.256 64.256 63.892 0.363 18703 10235 1 28 . 1 1 64 64 ILE CB C 64 38.002 38.002 37.713 0.289 18703 10236 1 28 . 1 1 64 64 ILE H H 64 8.160 8.160 7.537 0.623 18703 10237 1 28 . 1 1 65 65 LYS N N 65 118.871 118.871 120.002 -1.131 18703 10238 1 28 . 1 1 65 65 LYS HA H 65 4.111 4.111 4.138 -0.027 18703 10239 1 28 . 1 1 65 65 LYS C C 65 177.076 177.076 177.685 -0.609 18703 10240 1 28 . 1 1 65 65 LYS CA C 65 58.421 58.421 58.523 -0.102 18703 10241 1 28 . 1 1 65 65 LYS CB C 65 32.639 32.639 32.280 0.359 18703 10242 1 28 . 1 1 65 65 LYS H H 65 7.664 7.664 7.715 -0.051 18703 10243 1 28 . 1 1 66 66 LYS N N 66 116.944 116.944 118.681 -1.737 18703 10244 1 28 . 1 1 66 66 LYS HA H 66 4.320 4.320 4.093 0.227 18703 10245 1 28 . 1 1 66 66 LYS C C 66 175.897 175.897 177.790 -1.893 18703 10246 1 28 . 1 1 66 66 LYS CA C 66 56.352 56.352 58.028 -1.676 18703 10247 1 28 . 1 1 66 66 LYS CB C 66 33.024 33.024 32.535 0.489 18703 10248 1 28 . 1 1 66 66 LYS H H 66 7.246 7.246 7.473 -0.227 18703 10249 1 29 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.180 0.066 18703 10250 1 29 . 1 1 3 3 ARG C C 3 178.379 178.379 177.641 0.738 18703 10251 1 29 . 1 1 3 3 ARG CA C 3 58.367 58.367 58.202 0.165 18703 10252 1 29 . 1 1 3 3 ARG CB C 3 30.691 30.691 30.379 0.312 18703 10253 1 29 . 1 1 3 3 ARG H H 3 7.905 7.905 8.889 -0.984 18703 10254 1 29 . 1 1 4 4 VAL N N 4 118.966 118.966 118.153 0.813 18703 10255 1 29 . 1 1 4 4 VAL HA H 4 3.803 3.803 3.765 0.038 18703 10256 1 29 . 1 1 4 4 VAL C C 4 176.968 176.968 177.370 -0.402 18703 10257 1 29 . 1 1 4 4 VAL CA C 4 65.441 65.441 65.432 0.009 18703 10258 1 29 . 1 1 4 4 VAL CB C 4 31.710 31.710 31.424 0.286 18703 10259 1 29 . 1 1 4 4 VAL H H 4 8.070 8.070 8.203 -0.133 18703 10260 1 29 . 1 1 5 5 LYS N N 5 122.058 122.058 119.922 2.136 18703 10261 1 29 . 1 1 5 5 LYS HA H 5 4.154 4.154 4.106 0.048 18703 10262 1 29 . 1 1 5 5 LYS C C 5 178.553 178.553 178.379 0.174 18703 10263 1 29 . 1 1 5 5 LYS CA C 5 58.712 58.712 59.358 -0.645 18703 10264 1 29 . 1 1 5 5 LYS CB C 5 31.788 31.788 32.192 -0.404 18703 10265 1 29 . 1 1 5 5 LYS H H 5 7.798 7.798 7.557 0.241 18703 10266 1 29 . 1 1 6 6 ALA N N 6 119.955 119.955 120.045 -0.090 18703 10267 1 29 . 1 1 6 6 ALA HA H 6 4.198 4.198 4.228 -0.030 18703 10268 1 29 . 1 1 6 6 ALA C C 6 180.974 180.974 179.055 1.919 18703 10269 1 29 . 1 1 6 6 ALA CA C 6 54.850 54.850 54.266 0.584 18703 10270 1 29 . 1 1 6 6 ALA CB C 6 17.995 17.995 18.521 -0.526 18703 10271 1 29 . 1 1 6 6 ALA H H 6 7.928 7.928 7.485 0.443 18703 10272 1 29 . 1 1 7 7 LEU N N 7 119.211 119.211 119.639 -0.428 18703 10273 1 29 . 1 1 7 7 LEU HA H 7 4.124 4.124 4.002 0.122 18703 10274 1 29 . 1 1 7 7 LEU C C 7 178.353 178.353 178.597 -0.244 18703 10275 1 29 . 1 1 7 7 LEU CA C 7 57.658 57.658 57.187 0.471 18703 10276 1 29 . 1 1 7 7 LEU CB C 7 41.971 41.971 42.023 -0.052 18703 10277 1 29 . 1 1 7 7 LEU H H 7 7.594 7.594 7.748 -0.154 18703 10278 1 29 . 1 1 8 8 GLU N N 8 120.258 120.258 118.117 2.141 18703 10279 1 29 . 1 1 8 8 GLU HA H 8 3.846 3.846 4.012 -0.166 18703 10280 1 29 . 1 1 8 8 GLU C C 8 179.546 179.546 178.771 0.775 18703 10281 1 29 . 1 1 8 8 GLU CA C 8 60.006 60.006 59.601 0.405 18703 10282 1 29 . 1 1 8 8 GLU CB C 8 29.683 29.683 29.484 0.199 18703 10283 1 29 . 1 1 8 8 GLU H H 8 8.382 8.382 7.828 0.554 18703 10284 1 29 . 1 1 9 9 GLU N N 9 118.584 118.584 118.927 -0.343 18703 10285 1 29 . 1 1 9 9 GLU HA H 9 4.039 4.039 4.115 -0.076 18703 10286 1 29 . 1 1 9 9 GLU C C 9 179.635 179.635 178.623 1.012 18703 10287 1 29 . 1 1 9 9 GLU CA C 9 59.235 59.235 58.737 0.498 18703 10288 1 29 . 1 1 9 9 GLU CB C 9 29.358 29.358 29.164 0.194 18703 10289 1 29 . 1 1 9 9 GLU H H 9 7.908 7.908 7.753 0.155 18703 10290 1 29 . 1 1 10 10 LYS N N 10 120.956 120.956 119.936 1.020 18703 10291 1 29 . 1 1 10 10 LYS HA H 10 4.190 4.190 4.125 0.065 18703 10292 1 29 . 1 1 10 10 LYS C C 10 179.395 179.395 178.949 0.446 18703 10293 1 29 . 1 1 10 10 LYS CA C 10 59.231 59.231 59.255 -0.025 18703 10294 1 29 . 1 1 10 10 LYS CB C 10 32.211 32.211 32.668 -0.457 18703 10295 1 29 . 1 1 10 10 LYS H H 10 8.009 8.009 7.466 0.543 18703 10296 1 29 . 1 1 11 11 VAL N N 11 119.577 119.577 118.131 1.446 18703 10297 1 29 . 1 1 11 11 VAL HA H 11 3.844 3.844 3.727 0.117 18703 10298 1 29 . 1 1 11 11 VAL C C 11 177.078 177.078 177.482 -0.404 18703 10299 1 29 . 1 1 11 11 VAL CA C 11 66.407 66.407 65.342 1.065 18703 10300 1 29 . 1 1 11 11 VAL CB C 11 31.252 31.252 30.828 0.424 18703 10301 1 29 . 1 1 11 11 VAL H H 11 8.488 8.488 7.510 0.978 18703 10302 1 29 . 1 1 12 12 LYS N N 12 122.864 122.864 119.786 3.078 18703 10303 1 29 . 1 1 12 12 LYS HA H 12 4.189 4.189 3.926 0.263 18703 10304 1 29 . 1 1 12 12 LYS C C 12 178.755 178.755 178.371 0.384 18703 10305 1 29 . 1 1 12 12 LYS CA C 12 59.375 59.375 59.789 -0.414 18703 10306 1 29 . 1 1 12 12 LYS CB C 12 31.991 31.991 32.090 -0.100 18703 10307 1 29 . 1 1 12 12 LYS H H 12 7.944 7.944 7.617 0.327 18703 10308 1 29 . 1 1 13 13 ALA N N 13 121.202 121.202 120.945 0.257 18703 10309 1 29 . 1 1 13 13 ALA HA H 13 4.209 4.209 4.226 -0.017 18703 10310 1 29 . 1 1 13 13 ALA C C 13 181.060 181.060 179.592 1.468 18703 10311 1 29 . 1 1 13 13 ALA CA C 13 54.710 54.710 54.284 0.426 18703 10312 1 29 . 1 1 13 13 ALA CB C 13 17.861 17.861 18.325 -0.464 18703 10313 1 29 . 1 1 13 13 ALA H H 13 7.563 7.563 7.481 0.082 18703 10314 1 29 . 1 1 14 14 LEU N N 14 120.014 120.014 119.515 0.499 18703 10315 1 29 . 1 1 14 14 LEU HA H 14 4.072 4.072 3.974 0.098 18703 10316 1 29 . 1 1 14 14 LEU C C 14 177.862 177.862 178.353 -0.491 18703 10317 1 29 . 1 1 14 14 LEU CA C 14 57.864 57.864 57.307 0.557 18703 10318 1 29 . 1 1 14 14 LEU CB C 14 41.539 41.539 41.951 -0.412 18703 10319 1 29 . 1 1 14 14 LEU H H 14 8.087 8.087 7.493 0.594 18703 10320 1 29 . 1 1 15 15 GLU N N 15 121.644 121.644 119.788 1.856 18703 10321 1 29 . 1 1 15 15 GLU HA H 15 3.692 3.692 4.018 -0.326 18703 10322 1 29 . 1 1 15 15 GLU C C 15 177.819 177.819 178.289 -0.470 18703 10323 1 29 . 1 1 15 15 GLU CA C 15 59.239 59.239 59.165 0.074 18703 10324 1 29 . 1 1 15 15 GLU CB C 15 28.865 28.865 29.638 -0.773 18703 10325 1 29 . 1 1 15 15 GLU H H 15 8.542 8.542 7.663 0.879 18703 10326 1 29 . 1 1 16 16 GLU N N 16 116.016 116.016 118.805 -2.789 18703 10327 1 29 . 1 1 16 16 GLU HA H 16 3.955 3.955 3.996 -0.041 18703 10328 1 29 . 1 1 16 16 GLU C C 16 179.159 179.159 179.195 -0.036 18703 10329 1 29 . 1 1 16 16 GLU CA C 16 59.324 59.324 59.274 0.050 18703 10330 1 29 . 1 1 16 16 GLU CB C 16 29.060 29.060 29.146 -0.086 18703 10331 1 29 . 1 1 16 16 GLU H H 16 7.492 7.492 7.901 -0.409 18703 10332 1 29 . 1 1 17 17 LYS N N 17 118.546 118.546 118.605 -0.059 18703 10333 1 29 . 1 1 17 17 LYS HA H 17 4.117 4.117 4.128 -0.011 18703 10334 1 29 . 1 1 17 17 LYS C C 17 178.976 178.976 178.244 0.732 18703 10335 1 29 . 1 1 17 17 LYS CA C 17 58.837 58.837 58.877 -0.040 18703 10336 1 29 . 1 1 17 17 LYS CB C 17 32.538 32.538 32.556 -0.018 18703 10337 1 29 . 1 1 17 17 LYS H H 17 7.720 7.720 7.422 0.298 18703 10338 1 29 . 1 1 18 18 VAL N N 18 118.376 118.376 118.903 -0.527 18703 10339 1 29 . 1 1 18 18 VAL HA H 18 3.711 3.711 3.785 -0.074 18703 10340 1 29 . 1 1 18 18 VAL C C 18 178.765 178.765 178.339 0.426 18703 10341 1 29 . 1 1 18 18 VAL CA C 18 66.237 66.237 65.947 0.290 18703 10342 1 29 . 1 1 18 18 VAL CB C 18 31.682 31.682 32.068 -0.386 18703 10343 1 29 . 1 1 18 18 VAL H H 18 8.754 8.754 7.312 1.442 18703 10344 1 29 . 1 1 19 19 LYS N N 19 118.817 118.817 118.852 -0.035 18703 10345 1 29 . 1 1 19 19 LYS HA H 19 4.078 4.078 3.949 0.129 18703 10346 1 29 . 1 1 19 19 LYS C C 19 178.049 178.049 177.689 0.360 18703 10347 1 29 . 1 1 19 19 LYS CA C 19 59.731 59.731 59.404 0.327 18703 10348 1 29 . 1 1 19 19 LYS CB C 19 32.523 32.523 32.214 0.309 18703 10349 1 29 . 1 1 19 19 LYS H H 19 8.299 8.299 8.529 -0.230 18703 10350 1 29 . 1 1 20 20 ALA N N 20 119.656 119.656 118.915 0.741 18703 10351 1 29 . 1 1 20 20 ALA HA H 20 4.347 4.347 4.332 0.015 18703 10352 1 29 . 1 1 20 20 ALA C C 20 178.532 178.532 178.486 0.046 18703 10353 1 29 . 1 1 20 20 ALA CA C 20 52.853 52.853 52.898 -0.045 18703 10354 1 29 . 1 1 20 20 ALA CB C 20 18.832 18.832 18.845 -0.012 18703 10355 1 29 . 1 1 20 20 ALA H H 20 7.425 7.425 7.474 -0.049 18703 10356 1 29 . 1 1 21 21 LEU N N 21 118.594 118.594 119.216 -0.622 18703 10357 1 29 . 1 1 21 21 LEU HA H 21 4.297 4.297 4.057 0.240 18703 10358 1 29 . 1 1 21 21 LEU C C 21 177.784 177.784 177.668 0.116 18703 10359 1 29 . 1 1 21 21 LEU CA C 21 55.750 55.750 56.673 -0.923 18703 10360 1 29 . 1 1 21 21 LEU CB C 21 42.898 42.898 42.645 0.253 18703 10361 1 29 . 1 1 21 21 LEU H H 21 7.508 7.508 7.915 -0.407 18703 10362 1 29 . 1 1 22 22 GLY N N 22 106.650 106.650 104.234 2.416 18703 10363 1 29 . 1 1 22 22 GLY C C 22 173.605 173.605 172.392 1.213 18703 10364 1 29 . 1 1 22 22 GLY CA C 22 45.330 45.330 44.617 0.713 18703 10365 1 29 . 1 1 22 22 GLY H H 22 7.814 7.814 7.758 0.056 18703 10366 1 29 . 1 1 23 23 GLY N N 23 108.011 108.011 107.967 0.044 18703 10367 1 29 . 1 1 23 23 GLY C C 23 174.061 174.061 172.821 1.240 18703 10368 1 29 . 1 1 23 23 GLY CA C 23 44.772 44.772 45.241 -0.469 18703 10369 1 29 . 1 1 23 23 GLY H H 23 8.139 8.139 8.058 0.081 18703 10370 1 29 . 1 1 24 24 GLY N N 24 107.826 107.826 109.620 -1.794 18703 10371 1 29 . 1 1 24 24 GLY C C 24 175.046 175.046 174.391 0.655 18703 10372 1 29 . 1 1 24 24 GLY CA C 24 44.422 44.422 44.692 -0.270 18703 10373 1 29 . 1 1 24 24 GLY H H 24 8.497 8.497 8.171 0.326 18703 10374 1 29 . 1 1 25 25 GLY N N 25 108.830 108.830 112.198 -3.368 18703 10375 1 29 . 1 1 25 25 GLY C C 25 176.272 176.272 175.743 0.529 18703 10376 1 29 . 1 1 25 25 GLY CA C 25 47.101 47.101 45.528 1.573 18703 10377 1 29 . 1 1 25 25 GLY H H 25 8.616 8.616 8.321 0.295 18703 10378 1 29 . 1 1 26 26 ARG N N 26 123.109 123.109 124.961 -1.852 18703 10379 1 29 . 1 1 26 26 ARG HA H 26 4.283 4.283 4.110 0.173 18703 10380 1 29 . 1 1 26 26 ARG C C 26 177.848 177.848 177.676 0.172 18703 10381 1 29 . 1 1 26 26 ARG CA C 26 57.663 57.663 58.164 -0.501 18703 10382 1 29 . 1 1 26 26 ARG CB C 26 29.811 29.811 29.444 0.367 18703 10383 1 29 . 1 1 26 26 ARG H H 26 8.770 8.770 8.607 0.163 18703 10384 1 29 . 1 1 27 27 ILE N N 27 118.104 118.104 119.825 -1.721 18703 10385 1 29 . 1 1 27 27 ILE HA H 27 3.787 3.787 3.823 -0.036 18703 10386 1 29 . 1 1 27 27 ILE C C 27 177.473 177.473 177.495 -0.022 18703 10387 1 29 . 1 1 27 27 ILE CA C 27 63.036 63.036 64.158 -1.122 18703 10388 1 29 . 1 1 27 27 ILE CB C 27 36.664 36.664 37.679 -1.015 18703 10389 1 29 . 1 1 27 27 ILE H H 27 7.708 7.708 7.586 0.122 18703 10390 1 29 . 1 1 28 28 GLU N N 28 119.934 119.934 120.689 -0.755 18703 10391 1 29 . 1 1 28 28 GLU HA H 28 3.954 3.954 3.912 0.042 18703 10392 1 29 . 1 1 28 28 GLU C C 28 179.514 179.514 178.391 1.123 18703 10393 1 29 . 1 1 28 28 GLU CA C 28 59.450 59.450 59.970 -0.520 18703 10394 1 29 . 1 1 28 28 GLU CB C 28 29.600 29.600 29.402 0.198 18703 10395 1 29 . 1 1 28 28 GLU H H 28 7.872 7.872 7.809 0.063 18703 10396 1 29 . 1 1 29 29 GLU N N 29 118.134 118.134 119.718 -1.584 18703 10397 1 29 . 1 1 29 29 GLU HA H 29 4.028 4.028 4.092 -0.064 18703 10398 1 29 . 1 1 29 29 GLU C C 29 179.182 179.182 179.268 -0.086 18703 10399 1 29 . 1 1 29 29 GLU CA C 29 59.173 59.173 59.214 -0.041 18703 10400 1 29 . 1 1 29 29 GLU CB C 29 29.503 29.503 29.460 0.043 18703 10401 1 29 . 1 1 29 29 GLU H H 29 8.166 8.166 7.593 0.573 18703 10402 1 29 . 1 1 30 30 LEU N N 30 120.242 120.242 117.732 2.510 18703 10403 1 29 . 1 1 30 30 LEU HA H 30 4.028 4.028 4.077 -0.049 18703 10404 1 29 . 1 1 30 30 LEU C C 30 178.796 178.796 178.861 -0.065 18703 10405 1 29 . 1 1 30 30 LEU CA C 30 57.654 57.654 56.735 0.919 18703 10406 1 29 . 1 1 30 30 LEU CB C 30 41.629 41.629 41.729 -0.100 18703 10407 1 29 . 1 1 30 30 LEU H H 30 7.695 7.695 7.629 0.066 18703 10408 1 29 . 1 1 31 31 LYS N N 31 120.506 120.506 120.327 0.179 18703 10409 1 29 . 1 1 31 31 LYS HA H 31 3.532 3.532 4.033 -0.501 18703 10410 1 29 . 1 1 31 31 LYS C C 31 178.919 178.919 178.265 0.654 18703 10411 1 29 . 1 1 31 31 LYS CA C 31 60.240 60.240 59.285 0.955 18703 10412 1 29 . 1 1 31 31 LYS CB C 31 32.015 32.015 32.275 -0.260 18703 10413 1 29 . 1 1 31 31 LYS H H 31 8.561 8.561 7.612 0.949 18703 10414 1 29 . 1 1 32 32 LYS N N 32 118.566 118.566 118.878 -0.312 18703 10415 1 29 . 1 1 32 32 LYS C C 32 179.392 179.392 179.074 0.318 18703 10416 1 29 . 1 1 32 32 LYS CA C 32 59.356 59.356 59.798 -0.442 18703 10417 1 29 . 1 1 32 32 LYS CB C 32 32.117 32.117 32.429 -0.312 18703 10418 1 29 . 1 1 32 32 LYS H H 32 7.699 7.699 7.545 0.154 18703 10419 1 29 . 1 1 33 33 LYS N N 33 118.964 118.964 118.389 0.575 18703 10420 1 29 . 1 1 33 33 LYS HA H 33 4.117 4.117 4.163 -0.046 18703 10421 1 29 . 1 1 33 33 LYS C C 33 178.355 178.355 178.588 -0.233 18703 10422 1 29 . 1 1 33 33 LYS CA C 33 58.633 58.633 58.911 -0.278 18703 10423 1 29 . 1 1 33 33 LYS CB C 33 31.904 31.904 32.411 -0.507 18703 10424 1 29 . 1 1 33 33 LYS H H 33 7.752 7.752 7.548 0.204 18703 10425 1 29 . 1 1 34 34 CYS N N 34 119.956 119.956 118.924 1.032 18703 10426 1 29 . 1 1 34 34 CYS HA H 34 3.967 3.967 4.112 -0.145 18703 10427 1 29 . 1 1 34 34 CYS C C 34 175.521 175.521 176.805 -1.284 18703 10428 1 29 . 1 1 34 34 CYS CA C 34 60.987 60.987 62.962 -1.975 18703 10429 1 29 . 1 1 34 34 CYS CB C 34 36.600 36.600 26.672 9.928 18703 10430 1 29 . 1 1 34 34 CYS H H 34 8.393 8.393 7.563 0.830 18703 10431 1 29 . 1 1 35 35 GLU N N 35 120.327 120.327 119.794 0.533 18703 10432 1 29 . 1 1 35 35 GLU HA H 35 3.891 3.891 3.940 -0.049 18703 10433 1 29 . 1 1 35 35 GLU C C 35 179.684 179.684 178.660 1.024 18703 10434 1 29 . 1 1 35 35 GLU CA C 35 60.059 60.059 59.177 0.882 18703 10435 1 29 . 1 1 35 35 GLU CB C 35 29.718 29.718 28.648 1.070 18703 10436 1 29 . 1 1 35 35 GLU H H 35 8.558 8.558 7.822 0.736 18703 10437 1 29 . 1 1 36 36 GLU N N 36 120.190 120.190 119.884 0.306 18703 10438 1 29 . 1 1 36 36 GLU HA H 36 4.051 4.051 3.999 0.052 18703 10439 1 29 . 1 1 36 36 GLU C C 36 179.408 179.408 178.954 0.454 18703 10440 1 29 . 1 1 36 36 GLU CA C 36 59.148 59.148 58.950 0.198 18703 10441 1 29 . 1 1 36 36 GLU CB C 36 29.766 29.766 29.786 -0.020 18703 10442 1 29 . 1 1 36 36 GLU H H 36 8.038 8.038 7.632 0.406 18703 10443 1 29 . 1 1 37 37 LEU N N 37 121.102 121.102 119.548 1.554 18703 10444 1 29 . 1 1 37 37 LEU HA H 37 4.079 4.079 4.185 -0.106 18703 10445 1 29 . 1 1 37 37 LEU C C 37 178.279 178.279 178.330 -0.051 18703 10446 1 29 . 1 1 37 37 LEU CA C 37 57.803 57.803 57.498 0.305 18703 10447 1 29 . 1 1 37 37 LEU CB C 37 41.502 41.502 41.735 -0.233 18703 10448 1 29 . 1 1 37 37 LEU H H 37 8.065 8.065 7.478 0.587 18703 10449 1 29 . 1 1 38 38 LYS N N 38 119.980 119.980 119.064 0.916 18703 10450 1 29 . 1 1 38 38 LYS HA H 38 3.851 3.851 3.896 -0.045 18703 10451 1 29 . 1 1 38 38 LYS C C 38 178.919 178.919 179.130 -0.211 18703 10452 1 29 . 1 1 38 38 LYS CA C 38 60.794 60.794 59.755 1.040 18703 10453 1 29 . 1 1 38 38 LYS CB C 38 32.863 32.863 32.247 0.616 18703 10454 1 29 . 1 1 38 38 LYS H H 38 8.741 8.741 7.808 0.933 18703 10455 1 29 . 1 1 39 39 LYS N N 39 118.307 118.307 118.017 0.290 18703 10456 1 29 . 1 1 39 39 LYS HA H 39 4.125 4.125 3.989 0.136 18703 10457 1 29 . 1 1 39 39 LYS C C 39 178.622 178.622 178.662 -0.040 18703 10458 1 29 . 1 1 39 39 LYS CA C 39 58.993 58.993 59.169 -0.176 18703 10459 1 29 . 1 1 39 39 LYS CB C 39 32.097 32.097 31.860 0.237 18703 10460 1 29 . 1 1 39 39 LYS H H 39 7.584 7.584 7.745 -0.161 18703 10461 1 29 . 1 1 40 40 LYS N N 40 118.826 118.826 119.103 -0.277 18703 10462 1 29 . 1 1 40 40 LYS HA H 40 4.069 4.069 4.158 -0.089 18703 10463 1 29 . 1 1 40 40 LYS C C 40 179.802 179.802 178.818 0.984 18703 10464 1 29 . 1 1 40 40 LYS CA C 40 59.322 59.322 57.979 1.343 18703 10465 1 29 . 1 1 40 40 LYS CB C 40 32.505 32.505 31.935 0.570 18703 10466 1 29 . 1 1 40 40 LYS H H 40 7.945 7.945 7.358 0.587 18703 10467 1 29 . 1 1 41 41 ILE N N 41 118.958 118.958 117.002 1.956 18703 10468 1 29 . 1 1 41 41 ILE HA H 41 3.659 3.659 3.817 -0.158 18703 10469 1 29 . 1 1 41 41 ILE C C 41 178.146 178.146 176.663 1.483 18703 10470 1 29 . 1 1 41 41 ILE CA C 41 65.037 65.037 63.945 1.092 18703 10471 1 29 . 1 1 41 41 ILE CB C 41 37.950 37.950 38.206 -0.256 18703 10472 1 29 . 1 1 41 41 ILE H H 41 8.369 8.369 7.997 0.372 18703 10473 1 29 . 1 1 42 42 GLU N N 42 120.331 120.331 116.922 3.409 18703 10474 1 29 . 1 1 42 42 GLU HA H 42 4.094 4.094 4.166 -0.072 18703 10475 1 29 . 1 1 42 42 GLU C C 42 178.697 178.697 177.554 1.143 18703 10476 1 29 . 1 1 42 42 GLU CA C 42 58.927 58.927 58.115 0.812 18703 10477 1 29 . 1 1 42 42 GLU CB C 42 29.399 29.399 30.073 -0.674 18703 10478 1 29 . 1 1 42 42 GLU H H 42 7.805 7.805 7.656 0.149 18703 10479 1 29 . 1 1 43 43 GLU N N 43 117.120 117.120 117.997 -0.877 18703 10480 1 29 . 1 1 43 43 GLU HA H 43 4.291 4.291 4.192 0.099 18703 10481 1 29 . 1 1 43 43 GLU C C 43 177.551 177.551 177.460 0.091 18703 10482 1 29 . 1 1 43 43 GLU CA C 43 56.800 56.800 56.902 -0.102 18703 10483 1 29 . 1 1 43 43 GLU CB C 43 29.931 29.931 29.496 0.435 18703 10484 1 29 . 1 1 43 43 GLU H H 43 7.701 7.701 7.633 0.068 18703 10485 1 29 . 1 1 44 44 LEU N N 44 120.940 120.940 121.125 -0.185 18703 10486 1 29 . 1 1 44 44 LEU HA H 44 4.251 4.251 4.075 0.176 18703 10487 1 29 . 1 1 44 44 LEU C C 44 178.596 178.596 176.904 1.692 18703 10488 1 29 . 1 1 44 44 LEU CA C 44 56.448 56.448 55.759 0.689 18703 10489 1 29 . 1 1 44 44 LEU CB C 44 42.519 42.519 42.502 0.017 18703 10490 1 29 . 1 1 44 44 LEU H H 44 7.581 7.581 7.412 0.169 18703 10491 1 29 . 1 1 45 45 GLY N N 45 108.689 108.689 108.179 0.510 18703 10492 1 29 . 1 1 45 45 GLY C C 45 174.853 174.853 173.178 1.675 18703 10493 1 29 . 1 1 45 45 GLY CA C 45 46.233 46.233 44.775 1.458 18703 10494 1 29 . 1 1 45 45 GLY H H 45 8.232 8.232 8.510 -0.278 18703 10495 1 29 . 1 1 46 46 GLY N N 46 108.029 108.029 108.038 -0.009 18703 10496 1 29 . 1 1 46 46 GLY C C 46 174.351 174.351 174.362 -0.011 18703 10497 1 29 . 1 1 46 46 GLY CA C 46 45.105 45.105 44.371 0.734 18703 10498 1 29 . 1 1 46 46 GLY H H 46 8.176 8.176 8.060 0.116 18703 10499 1 29 . 1 1 47 47 GLY N N 47 108.183 108.183 108.533 -0.350 18703 10500 1 29 . 1 1 47 47 GLY C C 47 174.671 174.671 174.223 0.448 18703 10501 1 29 . 1 1 47 47 GLY CA C 47 45.254 45.254 44.923 0.331 18703 10502 1 29 . 1 1 47 47 GLY H H 47 8.290 8.290 8.320 -0.030 18703 10503 1 29 . 1 1 48 48 GLY N N 48 108.616 108.616 110.682 -2.066 18703 10504 1 29 . 1 1 48 48 GLY C C 48 174.321 174.321 174.064 0.257 18703 10505 1 29 . 1 1 48 48 GLY CA C 48 45.192 45.192 45.537 -0.345 18703 10506 1 29 . 1 1 48 48 GLY H H 48 8.027 8.027 8.624 -0.597 18703 10507 1 29 . 1 1 49 49 GLU N N 49 121.057 121.057 120.443 0.614 18703 10508 1 29 . 1 1 49 49 GLU HA H 49 4.425 4.425 4.412 0.013 18703 10509 1 29 . 1 1 49 49 GLU C C 49 177.072 177.072 177.766 -0.694 18703 10510 1 29 . 1 1 49 49 GLU CA C 49 56.330 56.330 57.520 -1.190 18703 10511 1 29 . 1 1 49 49 GLU CB C 49 29.602 29.602 30.104 -0.502 18703 10512 1 29 . 1 1 49 49 GLU H H 49 8.486 8.486 8.315 0.172 18703 10513 1 29 . 1 1 50 50 VAL N N 50 122.122 122.122 120.142 1.980 18703 10514 1 29 . 1 1 50 50 VAL HA H 50 3.792 3.792 3.715 0.077 18703 10515 1 29 . 1 1 50 50 VAL C C 50 176.774 176.774 177.220 -0.446 18703 10516 1 29 . 1 1 50 50 VAL CA C 50 64.864 64.864 64.719 0.145 18703 10517 1 29 . 1 1 50 50 VAL CB C 50 32.179 32.179 31.266 0.913 18703 10518 1 29 . 1 1 50 50 VAL H H 50 8.095 8.095 8.082 0.013 18703 10519 1 29 . 1 1 51 51 LYS N N 51 120.602 120.602 118.630 1.972 18703 10520 1 29 . 1 1 51 51 LYS HA H 51 4.195 4.195 4.114 0.081 18703 10521 1 29 . 1 1 51 51 LYS C C 51 178.530 178.530 178.928 -0.398 18703 10522 1 29 . 1 1 51 51 LYS CA C 51 59.348 59.348 58.922 0.426 18703 10523 1 29 . 1 1 51 51 LYS CB C 51 32.265 32.265 31.950 0.316 18703 10524 1 29 . 1 1 51 51 LYS H H 51 8.268 8.268 8.343 -0.075 18703 10525 1 29 . 1 1 52 52 LYS N N 52 117.547 117.547 120.761 -3.214 18703 10526 1 29 . 1 1 52 52 LYS HA H 52 4.162 4.162 4.097 0.065 18703 10527 1 29 . 1 1 52 52 LYS C C 52 179.132 179.132 178.871 0.261 18703 10528 1 29 . 1 1 52 52 LYS CA C 52 58.811 58.811 59.411 -0.600 18703 10529 1 29 . 1 1 52 52 LYS CB C 52 32.054 32.054 32.279 -0.225 18703 10530 1 29 . 1 1 52 52 LYS H H 52 7.595 7.595 7.627 -0.032 18703 10531 1 29 . 1 1 53 53 VAL N N 53 119.190 119.190 118.344 0.846 18703 10532 1 29 . 1 1 53 53 VAL HA H 53 3.767 3.767 3.702 0.065 18703 10533 1 29 . 1 1 53 53 VAL C C 53 177.933 177.933 178.100 -0.167 18703 10534 1 29 . 1 1 53 53 VAL CA C 53 66.065 66.065 66.340 -0.275 18703 10535 1 29 . 1 1 53 53 VAL CB C 53 31.248 31.248 31.499 -0.251 18703 10536 1 29 . 1 1 53 53 VAL H H 53 7.597 7.597 7.589 0.008 18703 10537 1 29 . 1 1 54 54 GLU N N 54 120.226 120.226 119.291 0.935 18703 10538 1 29 . 1 1 54 54 GLU HA H 54 3.833 3.833 3.983 -0.150 18703 10539 1 29 . 1 1 54 54 GLU C C 54 179.352 179.352 178.471 0.881 18703 10540 1 29 . 1 1 54 54 GLU CA C 54 59.153 59.153 59.702 -0.549 18703 10541 1 29 . 1 1 54 54 GLU CB C 54 29.224 29.224 29.503 -0.279 18703 10542 1 29 . 1 1 54 54 GLU H H 54 8.609 8.609 7.723 0.886 18703 10543 1 29 . 1 1 55 55 GLU N N 55 119.148 119.148 119.131 0.017 18703 10544 1 29 . 1 1 55 55 GLU HA H 55 4.084 4.084 4.080 0.004 18703 10545 1 29 . 1 1 55 55 GLU C C 55 179.084 179.084 178.818 0.266 18703 10546 1 29 . 1 1 55 55 GLU CA C 55 59.295 59.295 59.047 0.248 18703 10547 1 29 . 1 1 55 55 GLU CB C 55 29.361 29.361 29.574 -0.213 18703 10548 1 29 . 1 1 55 55 GLU H H 55 7.713 7.713 7.722 -0.009 18703 10549 1 29 . 1 1 56 56 GLU N N 56 120.301 120.301 119.064 1.237 18703 10550 1 29 . 1 1 56 56 GLU HA H 56 4.079 4.079 4.113 -0.034 18703 10551 1 29 . 1 1 56 56 GLU C C 56 179.773 179.773 178.872 0.901 18703 10552 1 29 . 1 1 56 56 GLU CA C 56 59.528 59.528 59.430 0.098 18703 10553 1 29 . 1 1 56 56 GLU CB C 56 30.162 30.162 29.704 0.458 18703 10554 1 29 . 1 1 56 56 GLU H H 56 7.899 7.899 7.559 0.340 18703 10555 1 29 . 1 1 57 57 VAL N N 57 121.536 121.536 118.085 3.451 18703 10556 1 29 . 1 1 57 57 VAL HA H 57 3.540 3.540 3.874 -0.334 18703 10557 1 29 . 1 1 57 57 VAL C C 57 176.984 176.984 177.956 -0.972 18703 10558 1 29 . 1 1 57 57 VAL CA C 57 66.734 66.734 64.635 2.099 18703 10559 1 29 . 1 1 57 57 VAL CB C 57 31.425 31.425 30.806 0.619 18703 10560 1 29 . 1 1 57 57 VAL H H 57 8.652 8.652 7.560 1.092 18703 10561 1 29 . 1 1 58 58 LYS N N 58 120.219 120.219 120.152 0.067 18703 10562 1 29 . 1 1 58 58 LYS HA H 58 4.199 4.199 4.097 0.102 18703 10563 1 29 . 1 1 58 58 LYS C C 58 178.972 178.972 178.489 0.483 18703 10564 1 29 . 1 1 58 58 LYS CA C 58 59.357 59.357 59.170 0.187 18703 10565 1 29 . 1 1 58 58 LYS CB C 58 32.186 32.186 32.080 0.106 18703 10566 1 29 . 1 1 58 58 LYS H H 58 7.791 7.791 7.490 0.301 18703 10567 1 29 . 1 1 59 59 LYS N N 59 118.252 118.252 119.925 -1.673 18703 10568 1 29 . 1 1 59 59 LYS HA H 59 4.069 4.069 4.147 -0.078 18703 10569 1 29 . 1 1 59 59 LYS C C 59 179.180 179.180 178.217 0.963 18703 10570 1 29 . 1 1 59 59 LYS CA C 59 59.285 59.285 59.290 -0.005 18703 10571 1 29 . 1 1 59 59 LYS CB C 59 32.345 32.345 32.386 -0.041 18703 10572 1 29 . 1 1 59 59 LYS H H 59 7.849 7.849 7.516 0.333 18703 10573 1 29 . 1 1 60 60 LEU N N 60 121.243 121.243 119.642 1.601 18703 10574 1 29 . 1 1 60 60 LEU HA H 60 4.242 4.242 4.135 0.107 18703 10575 1 29 . 1 1 60 60 LEU C C 60 178.413 178.413 178.088 0.325 18703 10576 1 29 . 1 1 60 60 LEU CA C 60 57.798 57.798 57.188 0.610 18703 10577 1 29 . 1 1 60 60 LEU CB C 60 41.150 41.150 42.151 -1.001 18703 10578 1 29 . 1 1 60 60 LEU H H 60 7.825 7.825 7.576 0.249 18703 10579 1 29 . 1 1 61 61 GLU N N 61 118.844 118.844 120.153 -1.309 18703 10580 1 29 . 1 1 61 61 GLU HA H 61 3.800 3.800 3.925 -0.125 18703 10581 1 29 . 1 1 61 61 GLU C C 61 179.078 179.078 178.555 0.523 18703 10582 1 29 . 1 1 61 61 GLU CA C 61 60.104 60.104 59.920 0.183 18703 10583 1 29 . 1 1 61 61 GLU CB C 61 29.864 29.864 29.672 0.192 18703 10584 1 29 . 1 1 61 61 GLU H H 61 8.582 8.582 7.724 0.858 18703 10585 1 29 . 1 1 62 62 GLU N N 62 117.659 117.659 118.646 -0.987 18703 10586 1 29 . 1 1 62 62 GLU HA H 62 3.990 3.990 4.042 -0.052 18703 10587 1 29 . 1 1 62 62 GLU C C 62 178.847 178.847 178.915 -0.068 18703 10588 1 29 . 1 1 62 62 GLU CA C 62 59.067 59.067 58.952 0.115 18703 10589 1 29 . 1 1 62 62 GLU CB C 62 29.440 29.440 29.662 -0.222 18703 10590 1 29 . 1 1 62 62 GLU H H 62 8.032 8.032 7.630 0.402 18703 10591 1 29 . 1 1 63 63 GLU N N 63 119.290 119.290 119.475 -0.185 18703 10592 1 29 . 1 1 63 63 GLU HA H 63 4.012 4.012 4.086 -0.074 18703 10593 1 29 . 1 1 63 63 GLU C C 63 179.784 179.784 179.367 0.417 18703 10594 1 29 . 1 1 63 63 GLU CA C 63 59.300 59.300 59.235 0.065 18703 10595 1 29 . 1 1 63 63 GLU CB C 63 29.728 29.728 29.486 0.242 18703 10596 1 29 . 1 1 63 63 GLU H H 63 7.958 7.958 7.440 0.518 18703 10597 1 29 . 1 1 64 64 ILE N N 64 118.453 118.453 119.135 -0.682 18703 10598 1 29 . 1 1 64 64 ILE HA H 64 3.711 3.711 3.783 -0.072 18703 10599 1 29 . 1 1 64 64 ILE C C 64 177.655 177.655 177.905 -0.250 18703 10600 1 29 . 1 1 64 64 ILE CA C 64 64.256 64.256 64.376 -0.120 18703 10601 1 29 . 1 1 64 64 ILE CB C 64 38.002 38.002 37.577 0.425 18703 10602 1 29 . 1 1 64 64 ILE H H 64 8.160 8.160 7.612 0.548 18703 10603 1 29 . 1 1 65 65 LYS N N 65 118.871 118.871 118.399 0.472 18703 10604 1 29 . 1 1 65 65 LYS HA H 65 4.111 4.111 4.144 -0.033 18703 10605 1 29 . 1 1 65 65 LYS C C 65 177.076 177.076 177.768 -0.692 18703 10606 1 29 . 1 1 65 65 LYS CA C 65 58.421 58.421 58.502 -0.081 18703 10607 1 29 . 1 1 65 65 LYS CB C 65 32.639 32.639 32.164 0.475 18703 10608 1 29 . 1 1 65 65 LYS H H 65 7.664 7.664 7.695 -0.031 18703 10609 1 29 . 1 1 66 66 LYS N N 66 116.944 116.944 118.499 -1.555 18703 10610 1 29 . 1 1 66 66 LYS HA H 66 4.320 4.320 4.130 0.190 18703 10611 1 29 . 1 1 66 66 LYS C C 66 175.897 175.897 176.646 -0.749 18703 10612 1 29 . 1 1 66 66 LYS CA C 66 56.352 56.352 58.051 -1.699 18703 10613 1 29 . 1 1 66 66 LYS CB C 66 33.024 33.024 33.060 -0.036 18703 10614 1 29 . 1 1 66 66 LYS H H 66 7.246 7.246 7.918 -0.672 18703 10615 1 30 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.101 0.145 18703 10616 1 30 . 1 1 3 3 ARG C C 3 178.379 178.379 178.702 -0.323 18703 10617 1 30 . 1 1 3 3 ARG CA C 3 58.367 58.367 59.051 -0.684 18703 10618 1 30 . 1 1 3 3 ARG CB C 3 30.691 30.691 29.881 0.810 18703 10619 1 30 . 1 1 3 3 ARG H H 3 7.905 7.905 8.455 -0.550 18703 10620 1 30 . 1 1 4 4 VAL N N 4 118.966 118.966 119.050 -0.084 18703 10621 1 30 . 1 1 4 4 VAL HA H 4 3.803 3.803 3.756 0.047 18703 10622 1 30 . 1 1 4 4 VAL C C 4 176.968 176.968 177.743 -0.775 18703 10623 1 30 . 1 1 4 4 VAL CA C 4 65.441 65.441 65.525 -0.084 18703 10624 1 30 . 1 1 4 4 VAL CB C 4 31.710 31.710 31.388 0.322 18703 10625 1 30 . 1 1 4 4 VAL H H 4 8.070 8.070 7.709 0.361 18703 10626 1 30 . 1 1 5 5 LYS N N 5 122.058 122.058 119.295 2.763 18703 10627 1 30 . 1 1 5 5 LYS HA H 5 4.154 4.154 3.985 0.169 18703 10628 1 30 . 1 1 5 5 LYS C C 5 178.553 178.553 179.023 -0.470 18703 10629 1 30 . 1 1 5 5 LYS CA C 5 58.712 58.712 59.726 -1.014 18703 10630 1 30 . 1 1 5 5 LYS CB C 5 31.788 31.788 32.191 -0.403 18703 10631 1 30 . 1 1 5 5 LYS H H 5 7.798 7.798 8.187 -0.389 18703 10632 1 30 . 1 1 6 6 ALA N N 6 119.955 119.955 121.644 -1.689 18703 10633 1 30 . 1 1 6 6 ALA HA H 6 4.198 4.198 4.241 -0.043 18703 10634 1 30 . 1 1 6 6 ALA C C 6 180.974 180.974 179.190 1.784 18703 10635 1 30 . 1 1 6 6 ALA CA C 6 54.850 54.850 54.519 0.331 18703 10636 1 30 . 1 1 6 6 ALA CB C 6 17.995 17.995 18.492 -0.497 18703 10637 1 30 . 1 1 6 6 ALA H H 6 7.928 7.928 7.865 0.063 18703 10638 1 30 . 1 1 7 7 LEU N N 7 119.211 119.211 119.187 0.024 18703 10639 1 30 . 1 1 7 7 LEU HA H 7 4.124 4.124 3.995 0.129 18703 10640 1 30 . 1 1 7 7 LEU C C 7 178.353 178.353 178.666 -0.313 18703 10641 1 30 . 1 1 7 7 LEU CA C 7 57.658 57.658 57.213 0.445 18703 10642 1 30 . 1 1 7 7 LEU CB C 7 41.971 41.971 42.008 -0.036 18703 10643 1 30 . 1 1 7 7 LEU H H 7 7.594 7.594 7.335 0.259 18703 10644 1 30 . 1 1 8 8 GLU N N 8 120.258 120.258 118.081 2.177 18703 10645 1 30 . 1 1 8 8 GLU HA H 8 3.846 3.846 4.016 -0.170 18703 10646 1 30 . 1 1 8 8 GLU C C 8 179.546 179.546 178.692 0.854 18703 10647 1 30 . 1 1 8 8 GLU CA C 8 60.006 60.006 59.668 0.338 18703 10648 1 30 . 1 1 8 8 GLU CB C 8 29.683 29.683 29.491 0.192 18703 10649 1 30 . 1 1 8 8 GLU H H 8 8.382 8.382 7.821 0.561 18703 10650 1 30 . 1 1 9 9 GLU N N 9 118.584 118.584 118.936 -0.352 18703 10651 1 30 . 1 1 9 9 GLU HA H 9 4.039 4.039 4.099 -0.060 18703 10652 1 30 . 1 1 9 9 GLU C C 9 179.635 179.635 178.650 0.985 18703 10653 1 30 . 1 1 9 9 GLU CA C 9 59.235 59.235 58.656 0.579 18703 10654 1 30 . 1 1 9 9 GLU CB C 9 29.358 29.358 29.122 0.236 18703 10655 1 30 . 1 1 9 9 GLU H H 9 7.908 7.908 7.916 -0.008 18703 10656 1 30 . 1 1 10 10 LYS N N 10 120.956 120.956 119.830 1.126 18703 10657 1 30 . 1 1 10 10 LYS HA H 10 4.190 4.190 4.119 0.071 18703 10658 1 30 . 1 1 10 10 LYS C C 10 179.395 179.395 178.915 0.480 18703 10659 1 30 . 1 1 10 10 LYS CA C 10 59.231 59.231 59.139 0.092 18703 10660 1 30 . 1 1 10 10 LYS CB C 10 32.211 32.211 32.640 -0.429 18703 10661 1 30 . 1 1 10 10 LYS H H 10 8.009 8.009 7.505 0.504 18703 10662 1 30 . 1 1 11 11 VAL N N 11 119.577 119.577 118.250 1.327 18703 10663 1 30 . 1 1 11 11 VAL HA H 11 3.844 3.844 3.669 0.175 18703 10664 1 30 . 1 1 11 11 VAL C C 11 177.078 177.078 177.516 -0.438 18703 10665 1 30 . 1 1 11 11 VAL CA C 11 66.407 66.407 65.446 0.961 18703 10666 1 30 . 1 1 11 11 VAL CB C 11 31.252 31.252 31.140 0.112 18703 10667 1 30 . 1 1 11 11 VAL H H 11 8.488 8.488 7.483 1.005 18703 10668 1 30 . 1 1 12 12 LYS N N 12 122.864 122.864 119.598 3.266 18703 10669 1 30 . 1 1 12 12 LYS HA H 12 4.189 4.189 3.913 0.276 18703 10670 1 30 . 1 1 12 12 LYS C C 12 178.755 178.755 178.247 0.508 18703 10671 1 30 . 1 1 12 12 LYS CA C 12 59.375 59.375 59.807 -0.432 18703 10672 1 30 . 1 1 12 12 LYS CB C 12 31.991 31.991 32.237 -0.246 18703 10673 1 30 . 1 1 12 12 LYS H H 12 7.944 7.944 7.592 0.352 18703 10674 1 30 . 1 1 13 13 ALA N N 13 121.202 121.202 120.504 0.698 18703 10675 1 30 . 1 1 13 13 ALA HA H 13 4.209 4.209 4.251 -0.042 18703 10676 1 30 . 1 1 13 13 ALA C C 13 181.060 181.060 179.297 1.763 18703 10677 1 30 . 1 1 13 13 ALA CA C 13 54.710 54.710 54.046 0.664 18703 10678 1 30 . 1 1 13 13 ALA CB C 13 17.861 17.861 18.524 -0.663 18703 10679 1 30 . 1 1 13 13 ALA H H 13 7.563 7.563 7.367 0.196 18703 10680 1 30 . 1 1 14 14 LEU N N 14 120.014 120.014 119.827 0.187 18703 10681 1 30 . 1 1 14 14 LEU HA H 14 4.072 4.072 3.999 0.073 18703 10682 1 30 . 1 1 14 14 LEU C C 14 177.862 177.862 178.071 -0.209 18703 10683 1 30 . 1 1 14 14 LEU CA C 14 57.864 57.864 57.571 0.293 18703 10684 1 30 . 1 1 14 14 LEU CB C 14 41.539 41.539 42.151 -0.612 18703 10685 1 30 . 1 1 14 14 LEU H H 14 8.087 8.087 7.493 0.594 18703 10686 1 30 . 1 1 15 15 GLU N N 15 121.644 121.644 120.132 1.512 18703 10687 1 30 . 1 1 15 15 GLU HA H 15 3.692 3.692 3.991 -0.299 18703 10688 1 30 . 1 1 15 15 GLU C C 15 177.819 177.819 178.269 -0.450 18703 10689 1 30 . 1 1 15 15 GLU CA C 15 59.239 59.239 59.391 -0.152 18703 10690 1 30 . 1 1 15 15 GLU CB C 15 28.865 28.865 29.443 -0.578 18703 10691 1 30 . 1 1 15 15 GLU H H 15 8.542 8.542 7.718 0.824 18703 10692 1 30 . 1 1 16 16 GLU N N 16 116.016 116.016 118.412 -2.396 18703 10693 1 30 . 1 1 16 16 GLU HA H 16 3.955 3.955 4.004 -0.049 18703 10694 1 30 . 1 1 16 16 GLU C C 16 179.159 179.159 178.917 0.242 18703 10695 1 30 . 1 1 16 16 GLU CA C 16 59.324 59.324 58.944 0.380 18703 10696 1 30 . 1 1 16 16 GLU CB C 16 29.060 29.060 29.297 -0.238 18703 10697 1 30 . 1 1 16 16 GLU H H 16 7.492 7.492 8.106 -0.614 18703 10698 1 30 . 1 1 17 17 LYS N N 17 118.546 118.546 119.242 -0.696 18703 10699 1 30 . 1 1 17 17 LYS HA H 17 4.117 4.117 4.155 -0.038 18703 10700 1 30 . 1 1 17 17 LYS C C 17 178.976 178.976 178.644 0.332 18703 10701 1 30 . 1 1 17 17 LYS CA C 17 58.837 58.837 58.687 0.150 18703 10702 1 30 . 1 1 17 17 LYS CB C 17 32.538 32.538 32.524 0.014 18703 10703 1 30 . 1 1 17 17 LYS H H 17 7.720 7.720 7.374 0.346 18703 10704 1 30 . 1 1 18 18 VAL N N 18 118.376 118.376 119.038 -0.662 18703 10705 1 30 . 1 1 18 18 VAL HA H 18 3.711 3.711 3.679 0.032 18703 10706 1 30 . 1 1 18 18 VAL C C 18 178.765 178.765 178.578 0.187 18703 10707 1 30 . 1 1 18 18 VAL CA C 18 66.237 66.237 66.235 0.002 18703 10708 1 30 . 1 1 18 18 VAL CB C 18 31.682 31.682 31.653 0.029 18703 10709 1 30 . 1 1 18 18 VAL H H 18 8.754 8.754 7.453 1.301 18703 10710 1 30 . 1 1 19 19 LYS N N 19 118.817 118.817 119.994 -1.177 18703 10711 1 30 . 1 1 19 19 LYS HA H 19 4.078 4.078 4.010 0.068 18703 10712 1 30 . 1 1 19 19 LYS C C 19 178.049 178.049 177.287 0.762 18703 10713 1 30 . 1 1 19 19 LYS CA C 19 59.731 59.731 58.991 0.740 18703 10714 1 30 . 1 1 19 19 LYS CB C 19 32.523 32.523 32.232 0.291 18703 10715 1 30 . 1 1 19 19 LYS H H 19 8.299 8.299 8.587 -0.288 18703 10716 1 30 . 1 1 20 20 ALA N N 20 119.656 119.656 119.304 0.352 18703 10717 1 30 . 1 1 20 20 ALA HA H 20 4.347 4.347 4.404 -0.057 18703 10718 1 30 . 1 1 20 20 ALA C C 20 178.532 178.532 178.029 0.503 18703 10719 1 30 . 1 1 20 20 ALA CA C 20 52.853 52.853 52.220 0.633 18703 10720 1 30 . 1 1 20 20 ALA CB C 20 18.832 18.832 19.325 -0.493 18703 10721 1 30 . 1 1 20 20 ALA H H 20 7.425 7.425 7.282 0.143 18703 10722 1 30 . 1 1 21 21 LEU N N 21 118.594 118.594 119.449 -0.855 18703 10723 1 30 . 1 1 21 21 LEU HA H 21 4.297 4.297 4.279 0.018 18703 10724 1 30 . 1 1 21 21 LEU C C 21 177.784 177.784 176.671 1.113 18703 10725 1 30 . 1 1 21 21 LEU CA C 21 55.750 55.750 55.346 0.404 18703 10726 1 30 . 1 1 21 21 LEU CB C 21 42.898 42.898 42.997 -0.099 18703 10727 1 30 . 1 1 21 21 LEU H H 21 7.508 7.508 7.822 -0.314 18703 10728 1 30 . 1 1 22 22 GLY N N 22 106.650 106.650 105.384 1.266 18703 10729 1 30 . 1 1 22 22 GLY C C 22 173.605 173.605 173.346 0.259 18703 10730 1 30 . 1 1 22 22 GLY CA C 22 45.330 45.330 44.355 0.975 18703 10731 1 30 . 1 1 22 22 GLY H H 22 7.814 7.814 8.462 -0.648 18703 10732 1 30 . 1 1 23 23 GLY N N 23 108.011 108.011 109.072 -1.061 18703 10733 1 30 . 1 1 23 23 GLY C C 23 174.061 174.061 173.672 0.389 18703 10734 1 30 . 1 1 23 23 GLY CA C 23 44.772 44.772 44.855 -0.083 18703 10735 1 30 . 1 1 23 23 GLY H H 23 8.139 8.139 8.352 -0.213 18703 10736 1 30 . 1 1 24 24 GLY N N 24 107.826 107.826 109.173 -1.347 18703 10737 1 30 . 1 1 24 24 GLY C C 24 175.046 175.046 174.036 1.010 18703 10738 1 30 . 1 1 24 24 GLY CA C 24 44.422 44.422 44.723 -0.301 18703 10739 1 30 . 1 1 24 24 GLY H H 24 8.497 8.497 7.641 0.856 18703 10740 1 30 . 1 1 25 25 GLY N N 25 108.830 108.830 106.314 2.516 18703 10741 1 30 . 1 1 25 25 GLY C C 25 176.272 176.272 175.744 0.528 18703 10742 1 30 . 1 1 25 25 GLY CA C 25 47.101 47.101 45.219 1.882 18703 10743 1 30 . 1 1 25 25 GLY H H 25 8.616 8.616 8.389 0.227 18703 10744 1 30 . 1 1 26 26 ARG N N 26 123.109 123.109 121.986 1.123 18703 10745 1 30 . 1 1 26 26 ARG HA H 26 4.283 4.283 4.212 0.071 18703 10746 1 30 . 1 1 26 26 ARG C C 26 177.848 177.848 178.333 -0.485 18703 10747 1 30 . 1 1 26 26 ARG CA C 26 57.663 57.663 58.066 -0.403 18703 10748 1 30 . 1 1 26 26 ARG CB C 26 29.811 29.811 29.233 0.578 18703 10749 1 30 . 1 1 26 26 ARG H H 26 8.770 8.770 8.771 -0.001 18703 10750 1 30 . 1 1 27 27 ILE N N 27 118.104 118.104 118.605 -0.501 18703 10751 1 30 . 1 1 27 27 ILE HA H 27 3.787 3.787 3.785 0.002 18703 10752 1 30 . 1 1 27 27 ILE C C 27 177.473 177.473 177.621 -0.148 18703 10753 1 30 . 1 1 27 27 ILE CA C 27 63.036 63.036 64.288 -1.252 18703 10754 1 30 . 1 1 27 27 ILE CB C 27 36.664 36.664 37.586 -0.922 18703 10755 1 30 . 1 1 27 27 ILE H H 27 7.708 7.708 8.072 -0.364 18703 10756 1 30 . 1 1 28 28 GLU N N 28 119.934 119.934 119.629 0.305 18703 10757 1 30 . 1 1 28 28 GLU HA H 28 3.954 3.954 3.942 0.012 18703 10758 1 30 . 1 1 28 28 GLU C C 28 179.514 179.514 178.728 0.786 18703 10759 1 30 . 1 1 28 28 GLU CA C 28 59.450 59.450 59.839 -0.389 18703 10760 1 30 . 1 1 28 28 GLU CB C 28 29.600 29.600 29.255 0.345 18703 10761 1 30 . 1 1 28 28 GLU H H 28 7.872 7.872 7.790 0.082 18703 10762 1 30 . 1 1 29 29 GLU N N 29 118.134 118.134 119.664 -1.530 18703 10763 1 30 . 1 1 29 29 GLU HA H 29 4.028 4.028 4.113 -0.085 18703 10764 1 30 . 1 1 29 29 GLU C C 29 179.182 179.182 179.319 -0.137 18703 10765 1 30 . 1 1 29 29 GLU CA C 29 59.173 59.173 59.048 0.125 18703 10766 1 30 . 1 1 29 29 GLU CB C 29 29.503 29.503 29.433 0.070 18703 10767 1 30 . 1 1 29 29 GLU H H 29 8.166 8.166 7.650 0.516 18703 10768 1 30 . 1 1 30 30 LEU N N 30 120.242 120.242 117.980 2.262 18703 10769 1 30 . 1 1 30 30 LEU HA H 30 4.028 4.028 4.115 -0.087 18703 10770 1 30 . 1 1 30 30 LEU C C 30 178.796 178.796 178.712 0.084 18703 10771 1 30 . 1 1 30 30 LEU CA C 30 57.654 57.654 56.584 1.070 18703 10772 1 30 . 1 1 30 30 LEU CB C 30 41.629 41.629 41.834 -0.205 18703 10773 1 30 . 1 1 30 30 LEU H H 30 7.695 7.695 7.546 0.149 18703 10774 1 30 . 1 1 31 31 LYS N N 31 120.506 120.506 120.578 -0.072 18703 10775 1 30 . 1 1 31 31 LYS HA H 31 3.532 3.532 4.037 -0.505 18703 10776 1 30 . 1 1 31 31 LYS C C 31 178.919 178.919 178.304 0.615 18703 10777 1 30 . 1 1 31 31 LYS CA C 31 60.240 60.240 59.381 0.859 18703 10778 1 30 . 1 1 31 31 LYS CB C 31 32.015 32.015 32.333 -0.318 18703 10779 1 30 . 1 1 31 31 LYS H H 31 8.561 8.561 7.697 0.864 18703 10780 1 30 . 1 1 32 32 LYS N N 32 118.566 118.566 118.667 -0.101 18703 10781 1 30 . 1 1 32 32 LYS C C 32 179.392 179.392 179.454 -0.062 18703 10782 1 30 . 1 1 32 32 LYS CA C 32 59.356 59.356 59.658 -0.302 18703 10783 1 30 . 1 1 32 32 LYS CB C 32 32.117 32.117 32.383 -0.266 18703 10784 1 30 . 1 1 32 32 LYS H H 32 7.699 7.699 7.608 0.091 18703 10785 1 30 . 1 1 33 33 LYS N N 33 118.964 118.964 117.881 1.083 18703 10786 1 30 . 1 1 33 33 LYS HA H 33 4.117 4.117 4.188 -0.071 18703 10787 1 30 . 1 1 33 33 LYS C C 33 178.355 178.355 177.981 0.374 18703 10788 1 30 . 1 1 33 33 LYS CA C 33 58.633 58.633 58.500 0.133 18703 10789 1 30 . 1 1 33 33 LYS CB C 33 31.904 31.904 32.577 -0.673 18703 10790 1 30 . 1 1 33 33 LYS H H 33 7.752 7.752 7.619 0.133 18703 10791 1 30 . 1 1 34 34 CYS N N 34 119.956 119.956 119.568 0.388 18703 10792 1 30 . 1 1 34 34 CYS HA H 34 3.967 3.967 4.125 -0.158 18703 10793 1 30 . 1 1 34 34 CYS C C 34 175.521 175.521 176.626 -1.105 18703 10794 1 30 . 1 1 34 34 CYS CA C 34 60.987 60.987 63.059 -2.072 18703 10795 1 30 . 1 1 34 34 CYS CB C 34 36.600 36.600 26.680 9.920 18703 10796 1 30 . 1 1 34 34 CYS H H 34 8.393 8.393 7.819 0.574 18703 10797 1 30 . 1 1 35 35 GLU N N 35 120.327 120.327 119.448 0.879 18703 10798 1 30 . 1 1 35 35 GLU HA H 35 3.891 3.891 3.957 -0.066 18703 10799 1 30 . 1 1 35 35 GLU C C 35 179.684 179.684 178.537 1.147 18703 10800 1 30 . 1 1 35 35 GLU CA C 35 60.059 60.059 59.382 0.677 18703 10801 1 30 . 1 1 35 35 GLU CB C 35 29.718 29.718 28.858 0.861 18703 10802 1 30 . 1 1 35 35 GLU H H 35 8.558 8.558 7.959 0.599 18703 10803 1 30 . 1 1 36 36 GLU N N 36 120.190 120.190 119.684 0.506 18703 10804 1 30 . 1 1 36 36 GLU HA H 36 4.051 4.051 4.040 0.011 18703 10805 1 30 . 1 1 36 36 GLU C C 36 179.408 179.408 178.899 0.509 18703 10806 1 30 . 1 1 36 36 GLU CA C 36 59.148 59.148 58.712 0.437 18703 10807 1 30 . 1 1 36 36 GLU CB C 36 29.766 29.766 29.788 -0.022 18703 10808 1 30 . 1 1 36 36 GLU H H 36 8.038 8.038 7.623 0.415 18703 10809 1 30 . 1 1 37 37 LEU N N 37 121.102 121.102 119.844 1.258 18703 10810 1 30 . 1 1 37 37 LEU HA H 37 4.079 4.079 4.191 -0.112 18703 10811 1 30 . 1 1 37 37 LEU C C 37 178.279 178.279 178.237 0.042 18703 10812 1 30 . 1 1 37 37 LEU CA C 37 57.803 57.803 57.575 0.229 18703 10813 1 30 . 1 1 37 37 LEU CB C 37 41.502 41.502 41.715 -0.213 18703 10814 1 30 . 1 1 37 37 LEU H H 37 8.065 8.065 7.419 0.646 18703 10815 1 30 . 1 1 38 38 LYS N N 38 119.980 119.980 118.804 1.176 18703 10816 1 30 . 1 1 38 38 LYS HA H 38 3.851 3.851 3.896 -0.045 18703 10817 1 30 . 1 1 38 38 LYS C C 38 178.919 178.919 179.106 -0.187 18703 10818 1 30 . 1 1 38 38 LYS CA C 38 60.794 60.794 59.883 0.911 18703 10819 1 30 . 1 1 38 38 LYS CB C 38 32.863 32.863 32.145 0.718 18703 10820 1 30 . 1 1 38 38 LYS H H 38 8.741 8.741 7.477 1.264 18703 10821 1 30 . 1 1 39 39 LYS N N 39 118.307 118.307 117.366 0.941 18703 10822 1 30 . 1 1 39 39 LYS HA H 39 4.125 4.125 4.257 -0.132 18703 10823 1 30 . 1 1 39 39 LYS C C 39 178.622 178.622 178.694 -0.072 18703 10824 1 30 . 1 1 39 39 LYS CA C 39 58.993 58.993 59.024 -0.031 18703 10825 1 30 . 1 1 39 39 LYS CB C 39 32.097 32.097 31.779 0.318 18703 10826 1 30 . 1 1 39 39 LYS H H 39 7.584 7.584 7.718 -0.134 18703 10827 1 30 . 1 1 40 40 LYS N N 40 118.826 118.826 119.521 -0.695 18703 10828 1 30 . 1 1 40 40 LYS HA H 40 4.069 4.069 4.131 -0.062 18703 10829 1 30 . 1 1 40 40 LYS C C 40 179.802 179.802 178.951 0.851 18703 10830 1 30 . 1 1 40 40 LYS CA C 40 59.322 59.322 58.490 0.832 18703 10831 1 30 . 1 1 40 40 LYS CB C 40 32.505 32.505 32.226 0.279 18703 10832 1 30 . 1 1 40 40 LYS H H 40 7.945 7.945 7.383 0.562 18703 10833 1 30 . 1 1 41 41 ILE N N 41 118.958 118.958 117.440 1.518 18703 10834 1 30 . 1 1 41 41 ILE HA H 41 3.659 3.659 3.824 -0.165 18703 10835 1 30 . 1 1 41 41 ILE C C 41 178.146 178.146 176.919 1.227 18703 10836 1 30 . 1 1 41 41 ILE CA C 41 65.037 65.037 63.827 1.210 18703 10837 1 30 . 1 1 41 41 ILE CB C 41 37.950 37.950 37.983 -0.033 18703 10838 1 30 . 1 1 41 41 ILE H H 41 8.369 8.369 8.030 0.339 18703 10839 1 30 . 1 1 42 42 GLU N N 42 120.331 120.331 117.044 3.287 18703 10840 1 30 . 1 1 42 42 GLU HA H 42 4.094 4.094 4.057 0.037 18703 10841 1 30 . 1 1 42 42 GLU C C 42 178.697 178.697 177.793 0.904 18703 10842 1 30 . 1 1 42 42 GLU CA C 42 58.927 58.927 58.728 0.199 18703 10843 1 30 . 1 1 42 42 GLU CB C 42 29.399 29.399 30.160 -0.761 18703 10844 1 30 . 1 1 42 42 GLU H H 42 7.805 7.805 7.656 0.149 18703 10845 1 30 . 1 1 43 43 GLU N N 43 117.120 117.120 116.643 0.477 18703 10846 1 30 . 1 1 43 43 GLU HA H 43 4.291 4.291 4.176 0.115 18703 10847 1 30 . 1 1 43 43 GLU C C 43 177.551 177.551 177.581 -0.030 18703 10848 1 30 . 1 1 43 43 GLU CA C 43 56.800 56.800 57.147 -0.347 18703 10849 1 30 . 1 1 43 43 GLU CB C 43 29.931 29.931 29.688 0.243 18703 10850 1 30 . 1 1 43 43 GLU H H 43 7.701 7.701 7.655 0.046 18703 10851 1 30 . 1 1 44 44 LEU N N 44 120.940 120.940 120.561 0.379 18703 10852 1 30 . 1 1 44 44 LEU HA H 44 4.251 4.251 4.149 0.102 18703 10853 1 30 . 1 1 44 44 LEU C C 44 178.596 178.596 176.824 1.772 18703 10854 1 30 . 1 1 44 44 LEU CA C 44 56.448 56.448 55.565 0.883 18703 10855 1 30 . 1 1 44 44 LEU CB C 44 42.519 42.519 42.603 -0.084 18703 10856 1 30 . 1 1 44 44 LEU H H 44 7.581 7.581 7.391 0.190 18703 10857 1 30 . 1 1 45 45 GLY N N 45 108.689 108.689 107.331 1.358 18703 10858 1 30 . 1 1 45 45 GLY C C 45 174.853 174.853 174.150 0.703 18703 10859 1 30 . 1 1 45 45 GLY CA C 45 46.233 46.233 44.712 1.521 18703 10860 1 30 . 1 1 45 45 GLY H H 45 8.232 8.232 8.328 -0.096 18703 10861 1 30 . 1 1 46 46 GLY N N 46 108.029 108.029 109.127 -1.098 18703 10862 1 30 . 1 1 46 46 GLY C C 46 174.351 174.351 174.696 -0.345 18703 10863 1 30 . 1 1 46 46 GLY CA C 46 45.105 45.105 44.627 0.478 18703 10864 1 30 . 1 1 46 46 GLY H H 46 8.176 8.176 8.097 0.079 18703 10865 1 30 . 1 1 47 47 GLY N N 47 108.183 108.183 106.476 1.707 18703 10866 1 30 . 1 1 47 47 GLY C C 47 174.671 174.671 174.841 -0.170 18703 10867 1 30 . 1 1 47 47 GLY CA C 47 45.254 45.254 44.467 0.787 18703 10868 1 30 . 1 1 47 47 GLY H H 47 8.290 8.290 8.214 0.076 18703 10869 1 30 . 1 1 48 48 GLY N N 48 108.616 108.616 109.055 -0.439 18703 10870 1 30 . 1 1 48 48 GLY C C 48 174.321 174.321 176.141 -1.820 18703 10871 1 30 . 1 1 48 48 GLY CA C 48 45.192 45.192 45.697 -0.505 18703 10872 1 30 . 1 1 48 48 GLY H H 48 8.027 8.027 8.203 -0.176 18703 10873 1 30 . 1 1 49 49 GLU N N 49 121.057 121.057 123.997 -2.940 18703 10874 1 30 . 1 1 49 49 GLU HA H 49 4.425 4.425 4.218 0.207 18703 10875 1 30 . 1 1 49 49 GLU C C 49 177.072 177.072 178.167 -1.095 18703 10876 1 30 . 1 1 49 49 GLU CA C 49 56.330 56.330 57.869 -1.539 18703 10877 1 30 . 1 1 49 49 GLU CB C 49 29.602 29.602 29.695 -0.093 18703 10878 1 30 . 1 1 49 49 GLU H H 49 8.486 8.486 8.328 0.158 18703 10879 1 30 . 1 1 50 50 VAL N N 50 122.122 122.122 118.418 3.704 18703 10880 1 30 . 1 1 50 50 VAL HA H 50 3.792 3.792 3.696 0.096 18703 10881 1 30 . 1 1 50 50 VAL C C 50 176.774 176.774 177.886 -1.112 18703 10882 1 30 . 1 1 50 50 VAL CA C 50 64.864 64.864 65.466 -0.602 18703 10883 1 30 . 1 1 50 50 VAL CB C 50 32.179 32.179 31.315 0.864 18703 10884 1 30 . 1 1 50 50 VAL H H 50 8.095 8.095 8.095 -0.000 18703 10885 1 30 . 1 1 51 51 LYS N N 51 120.602 120.602 119.018 1.584 18703 10886 1 30 . 1 1 51 51 LYS HA H 51 4.195 4.195 4.066 0.129 18703 10887 1 30 . 1 1 51 51 LYS C C 51 178.530 178.530 178.260 0.270 18703 10888 1 30 . 1 1 51 51 LYS CA C 51 59.348 59.348 59.261 0.087 18703 10889 1 30 . 1 1 51 51 LYS CB C 51 32.265 32.265 32.319 -0.054 18703 10890 1 30 . 1 1 51 51 LYS H H 51 8.268 8.268 7.614 0.654 18703 10891 1 30 . 1 1 52 52 LYS N N 52 117.547 117.547 120.502 -2.955 18703 10892 1 30 . 1 1 52 52 LYS HA H 52 4.162 4.162 4.103 0.059 18703 10893 1 30 . 1 1 52 52 LYS C C 52 179.132 179.132 178.967 0.165 18703 10894 1 30 . 1 1 52 52 LYS CA C 52 58.811 58.811 59.183 -0.372 18703 10895 1 30 . 1 1 52 52 LYS CB C 52 32.054 32.054 32.458 -0.404 18703 10896 1 30 . 1 1 52 52 LYS H H 52 7.595 7.595 7.651 -0.056 18703 10897 1 30 . 1 1 53 53 VAL N N 53 119.190 119.190 118.883 0.307 18703 10898 1 30 . 1 1 53 53 VAL HA H 53 3.767 3.767 3.926 -0.159 18703 10899 1 30 . 1 1 53 53 VAL C C 53 177.933 177.933 177.857 0.076 18703 10900 1 30 . 1 1 53 53 VAL CA C 53 66.065 66.065 65.928 0.137 18703 10901 1 30 . 1 1 53 53 VAL CB C 53 31.248 31.248 31.287 -0.039 18703 10902 1 30 . 1 1 53 53 VAL H H 53 7.597 7.597 7.649 -0.052 18703 10903 1 30 . 1 1 54 54 GLU N N 54 120.226 120.226 118.947 1.279 18703 10904 1 30 . 1 1 54 54 GLU HA H 54 3.833 3.833 4.055 -0.222 18703 10905 1 30 . 1 1 54 54 GLU C C 54 179.352 179.352 178.724 0.628 18703 10906 1 30 . 1 1 54 54 GLU CA C 54 59.153 59.153 59.579 -0.426 18703 10907 1 30 . 1 1 54 54 GLU CB C 54 29.224 29.224 29.250 -0.026 18703 10908 1 30 . 1 1 54 54 GLU H H 54 8.609 8.609 7.822 0.786 18703 10909 1 30 . 1 1 55 55 GLU N N 55 119.148 119.148 119.750 -0.602 18703 10910 1 30 . 1 1 55 55 GLU HA H 55 4.084 4.084 4.127 -0.043 18703 10911 1 30 . 1 1 55 55 GLU C C 55 179.084 179.084 178.733 0.351 18703 10912 1 30 . 1 1 55 55 GLU CA C 55 59.295 59.295 58.970 0.325 18703 10913 1 30 . 1 1 55 55 GLU CB C 55 29.361 29.361 29.666 -0.305 18703 10914 1 30 . 1 1 55 55 GLU H H 55 7.713 7.713 7.878 -0.165 18703 10915 1 30 . 1 1 56 56 GLU N N 56 120.301 120.301 118.951 1.350 18703 10916 1 30 . 1 1 56 56 GLU HA H 56 4.079 4.079 4.118 -0.039 18703 10917 1 30 . 1 1 56 56 GLU C C 56 179.773 179.773 179.342 0.431 18703 10918 1 30 . 1 1 56 56 GLU CA C 56 59.528 59.528 59.161 0.367 18703 10919 1 30 . 1 1 56 56 GLU CB C 56 30.162 30.162 29.704 0.458 18703 10920 1 30 . 1 1 56 56 GLU H H 56 7.899 7.899 7.595 0.304 18703 10921 1 30 . 1 1 57 57 VAL N N 57 121.536 121.536 119.002 2.534 18703 10922 1 30 . 1 1 57 57 VAL HA H 57 3.540 3.540 3.845 -0.305 18703 10923 1 30 . 1 1 57 57 VAL C C 57 176.984 176.984 177.433 -0.449 18703 10924 1 30 . 1 1 57 57 VAL CA C 57 66.734 66.734 65.449 1.285 18703 10925 1 30 . 1 1 57 57 VAL CB C 57 31.425 31.425 31.426 -0.001 18703 10926 1 30 . 1 1 57 57 VAL H H 57 8.652 8.652 7.686 0.966 18703 10927 1 30 . 1 1 58 58 LYS N N 58 120.219 120.219 119.991 0.228 18703 10928 1 30 . 1 1 58 58 LYS HA H 58 4.199 4.199 4.094 0.105 18703 10929 1 30 . 1 1 58 58 LYS C C 58 178.972 178.972 178.483 0.489 18703 10930 1 30 . 1 1 58 58 LYS CA C 58 59.357 59.357 59.332 0.025 18703 10931 1 30 . 1 1 58 58 LYS CB C 58 32.186 32.186 32.073 0.113 18703 10932 1 30 . 1 1 58 58 LYS H H 58 7.791 7.791 7.460 0.331 18703 10933 1 30 . 1 1 59 59 LYS N N 59 118.252 118.252 119.989 -1.737 18703 10934 1 30 . 1 1 59 59 LYS HA H 59 4.069 4.069 4.157 -0.088 18703 10935 1 30 . 1 1 59 59 LYS C C 59 179.180 179.180 178.216 0.964 18703 10936 1 30 . 1 1 59 59 LYS CA C 59 59.285 59.285 59.062 0.223 18703 10937 1 30 . 1 1 59 59 LYS CB C 59 32.345 32.345 32.384 -0.039 18703 10938 1 30 . 1 1 59 59 LYS H H 59 7.849 7.849 7.524 0.325 18703 10939 1 30 . 1 1 60 60 LEU N N 60 121.243 121.243 119.695 1.548 18703 10940 1 30 . 1 1 60 60 LEU HA H 60 4.242 4.242 4.150 0.092 18703 10941 1 30 . 1 1 60 60 LEU C C 60 178.413 178.413 178.178 0.235 18703 10942 1 30 . 1 1 60 60 LEU CA C 60 57.798 57.798 57.180 0.618 18703 10943 1 30 . 1 1 60 60 LEU CB C 60 41.150 41.150 42.204 -1.054 18703 10944 1 30 . 1 1 60 60 LEU H H 60 7.825 7.825 7.575 0.250 18703 10945 1 30 . 1 1 61 61 GLU N N 61 118.844 118.844 120.051 -1.207 18703 10946 1 30 . 1 1 61 61 GLU HA H 61 3.800 3.800 3.940 -0.140 18703 10947 1 30 . 1 1 61 61 GLU C C 61 179.078 179.078 178.552 0.526 18703 10948 1 30 . 1 1 61 61 GLU CA C 61 60.104 60.104 59.951 0.153 18703 10949 1 30 . 1 1 61 61 GLU CB C 61 29.864 29.864 29.680 0.184 18703 10950 1 30 . 1 1 61 61 GLU H H 61 8.582 8.582 7.738 0.844 18703 10951 1 30 . 1 1 62 62 GLU N N 62 117.659 117.659 118.700 -1.041 18703 10952 1 30 . 1 1 62 62 GLU HA H 62 3.990 3.990 4.059 -0.069 18703 10953 1 30 . 1 1 62 62 GLU C C 62 178.847 178.847 178.928 -0.081 18703 10954 1 30 . 1 1 62 62 GLU CA C 62 59.067 59.067 58.941 0.126 18703 10955 1 30 . 1 1 62 62 GLU CB C 62 29.440 29.440 29.676 -0.236 18703 10956 1 30 . 1 1 62 62 GLU H H 62 8.032 8.032 7.631 0.401 18703 10957 1 30 . 1 1 63 63 GLU N N 63 119.290 119.290 119.433 -0.143 18703 10958 1 30 . 1 1 63 63 GLU HA H 63 4.012 4.012 4.091 -0.079 18703 10959 1 30 . 1 1 63 63 GLU C C 63 179.784 179.784 179.416 0.368 18703 10960 1 30 . 1 1 63 63 GLU CA C 63 59.300 59.300 59.224 0.076 18703 10961 1 30 . 1 1 63 63 GLU CB C 63 29.728 29.728 29.500 0.228 18703 10962 1 30 . 1 1 63 63 GLU H H 63 7.958 7.958 7.467 0.491 18703 10963 1 30 . 1 1 64 64 ILE N N 64 118.453 118.453 119.067 -0.614 18703 10964 1 30 . 1 1 64 64 ILE HA H 64 3.711 3.711 3.769 -0.058 18703 10965 1 30 . 1 1 64 64 ILE C C 64 177.655 177.655 177.128 0.527 18703 10966 1 30 . 1 1 64 64 ILE CA C 64 64.256 64.256 64.011 0.245 18703 10967 1 30 . 1 1 64 64 ILE CB C 64 38.002 38.002 37.580 0.423 18703 10968 1 30 . 1 1 64 64 ILE H H 64 8.160 8.160 7.521 0.639 18703 10969 1 30 . 1 1 65 65 LYS N N 65 118.871 118.871 118.137 0.734 18703 10970 1 30 . 1 1 65 65 LYS HA H 65 4.111 4.111 4.084 0.027 18703 10971 1 30 . 1 1 65 65 LYS C C 65 177.076 177.076 177.922 -0.846 18703 10972 1 30 . 1 1 65 65 LYS CA C 65 58.421 58.421 58.488 -0.067 18703 10973 1 30 . 1 1 65 65 LYS CB C 65 32.639 32.639 32.356 0.283 18703 10974 1 30 . 1 1 65 65 LYS H H 65 7.664 7.664 7.478 0.186 18703 10975 1 30 . 1 1 66 66 LYS N N 66 116.944 116.944 118.756 -1.812 18703 10976 1 30 . 1 1 66 66 LYS HA H 66 4.320 4.320 4.130 0.190 18703 10977 1 30 . 1 1 66 66 LYS C C 66 175.897 175.897 177.793 -1.896 18703 10978 1 30 . 1 1 66 66 LYS CA C 66 56.352 56.352 57.982 -1.630 18703 10979 1 30 . 1 1 66 66 LYS CB C 66 33.024 33.024 32.748 0.276 18703 10980 1 30 . 1 1 66 66 LYS H H 66 7.246 7.246 7.591 -0.345 18703 10981 1 31 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.379 -0.133 18703 10982 1 31 . 1 1 3 3 ARG C C 3 178.379 178.379 177.033 1.346 18703 10983 1 31 . 1 1 3 3 ARG CA C 3 58.367 58.367 56.978 1.389 18703 10984 1 31 . 1 1 3 3 ARG CB C 3 30.691 30.691 30.679 0.012 18703 10985 1 31 . 1 1 3 3 ARG H H 3 7.905 7.905 7.943 -0.038 18703 10986 1 31 . 1 1 4 4 VAL N N 4 118.966 118.966 121.353 -2.387 18703 10987 1 31 . 1 1 4 4 VAL HA H 4 3.803 3.803 3.791 0.012 18703 10988 1 31 . 1 1 4 4 VAL C C 4 176.968 176.968 177.555 -0.587 18703 10989 1 31 . 1 1 4 4 VAL CA C 4 65.441 65.441 65.593 -0.152 18703 10990 1 31 . 1 1 4 4 VAL CB C 4 31.710 31.710 31.480 0.230 18703 10991 1 31 . 1 1 4 4 VAL H H 4 8.070 8.070 8.432 -0.362 18703 10992 1 31 . 1 1 5 5 LYS N N 5 122.058 122.058 119.908 2.150 18703 10993 1 31 . 1 1 5 5 LYS HA H 5 4.154 4.154 4.005 0.149 18703 10994 1 31 . 1 1 5 5 LYS C C 5 178.553 178.553 178.502 0.051 18703 10995 1 31 . 1 1 5 5 LYS CA C 5 58.712 58.712 59.411 -0.699 18703 10996 1 31 . 1 1 5 5 LYS CB C 5 31.788 31.788 32.277 -0.489 18703 10997 1 31 . 1 1 5 5 LYS H H 5 7.798 7.798 8.428 -0.630 18703 10998 1 31 . 1 1 6 6 ALA N N 6 119.955 119.955 120.675 -0.720 18703 10999 1 31 . 1 1 6 6 ALA HA H 6 4.198 4.198 4.260 -0.062 18703 11000 1 31 . 1 1 6 6 ALA C C 6 180.974 180.974 179.120 1.854 18703 11001 1 31 . 1 1 6 6 ALA CA C 6 54.850 54.850 54.039 0.811 18703 11002 1 31 . 1 1 6 6 ALA CB C 6 17.995 17.995 18.670 -0.675 18703 11003 1 31 . 1 1 6 6 ALA H H 6 7.928 7.928 7.362 0.566 18703 11004 1 31 . 1 1 7 7 LEU N N 7 119.211 119.211 119.834 -0.623 18703 11005 1 31 . 1 1 7 7 LEU HA H 7 4.124 4.124 3.943 0.181 18703 11006 1 31 . 1 1 7 7 LEU C C 7 178.353 178.353 178.553 -0.200 18703 11007 1 31 . 1 1 7 7 LEU CA C 7 57.658 57.658 57.547 0.112 18703 11008 1 31 . 1 1 7 7 LEU CB C 7 41.971 41.971 42.050 -0.079 18703 11009 1 31 . 1 1 7 7 LEU H H 7 7.594 7.594 7.515 0.079 18703 11010 1 31 . 1 1 8 8 GLU N N 8 120.258 120.258 118.006 2.252 18703 11011 1 31 . 1 1 8 8 GLU HA H 8 3.846 3.846 4.010 -0.164 18703 11012 1 31 . 1 1 8 8 GLU C C 8 179.546 179.546 178.542 1.004 18703 11013 1 31 . 1 1 8 8 GLU CA C 8 60.006 60.006 59.583 0.423 18703 11014 1 31 . 1 1 8 8 GLU CB C 8 29.683 29.683 29.553 0.130 18703 11015 1 31 . 1 1 8 8 GLU H H 8 8.382 8.382 7.831 0.551 18703 11016 1 31 . 1 1 9 9 GLU N N 9 118.584 118.584 118.768 -0.184 18703 11017 1 31 . 1 1 9 9 GLU HA H 9 4.039 4.039 4.141 -0.102 18703 11018 1 31 . 1 1 9 9 GLU C C 9 179.635 179.635 178.691 0.944 18703 11019 1 31 . 1 1 9 9 GLU CA C 9 59.235 59.235 58.607 0.628 18703 11020 1 31 . 1 1 9 9 GLU CB C 9 29.358 29.358 29.119 0.239 18703 11021 1 31 . 1 1 9 9 GLU H H 9 7.908 7.908 7.606 0.302 18703 11022 1 31 . 1 1 10 10 LYS N N 10 120.956 120.956 120.110 0.846 18703 11023 1 31 . 1 1 10 10 LYS HA H 10 4.190 4.190 4.120 0.070 18703 11024 1 31 . 1 1 10 10 LYS C C 10 179.395 179.395 179.080 0.315 18703 11025 1 31 . 1 1 10 10 LYS CA C 10 59.231 59.231 59.105 0.126 18703 11026 1 31 . 1 1 10 10 LYS CB C 10 32.211 32.211 32.534 -0.323 18703 11027 1 31 . 1 1 10 10 LYS H H 10 8.009 8.009 7.497 0.512 18703 11028 1 31 . 1 1 11 11 VAL N N 11 119.577 119.577 117.515 2.062 18703 11029 1 31 . 1 1 11 11 VAL HA H 11 3.844 3.844 3.714 0.130 18703 11030 1 31 . 1 1 11 11 VAL C C 11 177.078 177.078 178.177 -1.099 18703 11031 1 31 . 1 1 11 11 VAL CA C 11 66.407 66.407 66.542 -0.135 18703 11032 1 31 . 1 1 11 11 VAL CB C 11 31.252 31.252 31.729 -0.477 18703 11033 1 31 . 1 1 11 11 VAL H H 11 8.488 8.488 7.509 0.979 18703 11034 1 31 . 1 1 12 12 LYS N N 12 122.864 122.864 120.745 2.119 18703 11035 1 31 . 1 1 12 12 LYS HA H 12 4.189 4.189 3.962 0.227 18703 11036 1 31 . 1 1 12 12 LYS C C 12 178.755 178.755 177.871 0.884 18703 11037 1 31 . 1 1 12 12 LYS CA C 12 59.375 59.375 59.559 -0.184 18703 11038 1 31 . 1 1 12 12 LYS CB C 12 31.991 31.991 32.292 -0.301 18703 11039 1 31 . 1 1 12 12 LYS H H 12 7.944 7.944 7.616 0.328 18703 11040 1 31 . 1 1 13 13 ALA N N 13 121.202 121.202 120.576 0.626 18703 11041 1 31 . 1 1 13 13 ALA HA H 13 4.209 4.209 4.276 -0.067 18703 11042 1 31 . 1 1 13 13 ALA C C 13 181.060 181.060 179.451 1.609 18703 11043 1 31 . 1 1 13 13 ALA CA C 13 54.710 54.710 54.214 0.496 18703 11044 1 31 . 1 1 13 13 ALA CB C 13 17.861 17.861 18.421 -0.560 18703 11045 1 31 . 1 1 13 13 ALA H H 13 7.563 7.563 7.480 0.083 18703 11046 1 31 . 1 1 14 14 LEU N N 14 120.014 120.014 119.659 0.355 18703 11047 1 31 . 1 1 14 14 LEU HA H 14 4.072 4.072 4.013 0.059 18703 11048 1 31 . 1 1 14 14 LEU C C 14 177.862 177.862 178.174 -0.312 18703 11049 1 31 . 1 1 14 14 LEU CA C 14 57.864 57.864 57.385 0.479 18703 11050 1 31 . 1 1 14 14 LEU CB C 14 41.539 41.539 42.103 -0.564 18703 11051 1 31 . 1 1 14 14 LEU H H 14 8.087 8.087 7.516 0.571 18703 11052 1 31 . 1 1 15 15 GLU N N 15 121.644 121.644 120.230 1.414 18703 11053 1 31 . 1 1 15 15 GLU HA H 15 3.692 3.692 3.998 -0.306 18703 11054 1 31 . 1 1 15 15 GLU C C 15 177.819 177.819 178.299 -0.480 18703 11055 1 31 . 1 1 15 15 GLU CA C 15 59.239 59.239 59.286 -0.048 18703 11056 1 31 . 1 1 15 15 GLU CB C 15 28.865 28.865 29.524 -0.659 18703 11057 1 31 . 1 1 15 15 GLU H H 15 8.542 8.542 7.662 0.880 18703 11058 1 31 . 1 1 16 16 GLU N N 16 116.016 116.016 118.708 -2.692 18703 11059 1 31 . 1 1 16 16 GLU HA H 16 3.955 3.955 3.984 -0.029 18703 11060 1 31 . 1 1 16 16 GLU C C 16 179.159 179.159 179.174 -0.015 18703 11061 1 31 . 1 1 16 16 GLU CA C 16 59.324 59.324 59.170 0.154 18703 11062 1 31 . 1 1 16 16 GLU CB C 16 29.060 29.060 29.186 -0.126 18703 11063 1 31 . 1 1 16 16 GLU H H 16 7.492 7.492 7.925 -0.433 18703 11064 1 31 . 1 1 17 17 LYS N N 17 118.546 118.546 118.527 0.019 18703 11065 1 31 . 1 1 17 17 LYS HA H 17 4.117 4.117 4.143 -0.026 18703 11066 1 31 . 1 1 17 17 LYS C C 17 178.976 178.976 178.301 0.675 18703 11067 1 31 . 1 1 17 17 LYS CA C 17 58.837 58.837 58.843 -0.006 18703 11068 1 31 . 1 1 17 17 LYS CB C 17 32.538 32.538 32.620 -0.082 18703 11069 1 31 . 1 1 17 17 LYS H H 17 7.720 7.720 7.523 0.197 18703 11070 1 31 . 1 1 18 18 VAL N N 18 118.376 118.376 118.618 -0.242 18703 11071 1 31 . 1 1 18 18 VAL HA H 18 3.711 3.711 3.780 -0.069 18703 11072 1 31 . 1 1 18 18 VAL C C 18 178.765 178.765 178.567 0.198 18703 11073 1 31 . 1 1 18 18 VAL CA C 18 66.237 66.237 65.542 0.695 18703 11074 1 31 . 1 1 18 18 VAL CB C 18 31.682 31.682 31.877 -0.195 18703 11075 1 31 . 1 1 18 18 VAL H H 18 8.754 8.754 7.473 1.281 18703 11076 1 31 . 1 1 19 19 LYS N N 19 118.817 118.817 118.541 0.276 18703 11077 1 31 . 1 1 19 19 LYS HA H 19 4.078 4.078 3.975 0.103 18703 11078 1 31 . 1 1 19 19 LYS C C 19 178.049 178.049 177.757 0.292 18703 11079 1 31 . 1 1 19 19 LYS CA C 19 59.731 59.731 59.302 0.429 18703 11080 1 31 . 1 1 19 19 LYS CB C 19 32.523 32.523 32.141 0.382 18703 11081 1 31 . 1 1 19 19 LYS H H 19 8.299 8.299 8.452 -0.153 18703 11082 1 31 . 1 1 20 20 ALA N N 20 119.656 119.656 119.574 0.082 18703 11083 1 31 . 1 1 20 20 ALA HA H 20 4.347 4.347 4.342 0.005 18703 11084 1 31 . 1 1 20 20 ALA C C 20 178.532 178.532 178.304 0.228 18703 11085 1 31 . 1 1 20 20 ALA CA C 20 52.853 52.853 52.914 -0.061 18703 11086 1 31 . 1 1 20 20 ALA CB C 20 18.832 18.832 18.863 -0.031 18703 11087 1 31 . 1 1 20 20 ALA H H 20 7.425 7.425 7.573 -0.148 18703 11088 1 31 . 1 1 21 21 LEU N N 21 118.594 118.594 119.135 -0.541 18703 11089 1 31 . 1 1 21 21 LEU HA H 21 4.297 4.297 4.158 0.139 18703 11090 1 31 . 1 1 21 21 LEU C C 21 177.784 177.784 177.792 -0.008 18703 11091 1 31 . 1 1 21 21 LEU CA C 21 55.750 55.750 56.504 -0.754 18703 11092 1 31 . 1 1 21 21 LEU CB C 21 42.898 42.898 42.575 0.323 18703 11093 1 31 . 1 1 21 21 LEU H H 21 7.508 7.508 7.943 -0.435 18703 11094 1 31 . 1 1 22 22 GLY N N 22 106.650 106.650 104.631 2.019 18703 11095 1 31 . 1 1 22 22 GLY C C 22 173.605 173.605 172.968 0.637 18703 11096 1 31 . 1 1 22 22 GLY CA C 22 45.330 45.330 44.440 0.890 18703 11097 1 31 . 1 1 22 22 GLY H H 22 7.814 7.814 7.550 0.264 18703 11098 1 31 . 1 1 23 23 GLY N N 23 108.011 108.011 107.672 0.339 18703 11099 1 31 . 1 1 23 23 GLY C C 23 174.061 174.061 173.344 0.717 18703 11100 1 31 . 1 1 23 23 GLY CA C 23 44.772 44.772 45.116 -0.344 18703 11101 1 31 . 1 1 23 23 GLY H H 23 8.139 8.139 8.187 -0.048 18703 11102 1 31 . 1 1 24 24 GLY N N 24 107.826 107.826 108.566 -0.740 18703 11103 1 31 . 1 1 24 24 GLY C C 24 175.046 175.046 173.998 1.048 18703 11104 1 31 . 1 1 24 24 GLY CA C 24 44.422 44.422 45.422 -1.000 18703 11105 1 31 . 1 1 24 24 GLY H H 24 8.497 8.497 7.811 0.686 18703 11106 1 31 . 1 1 25 25 GLY N N 25 108.830 108.830 107.899 0.931 18703 11107 1 31 . 1 1 25 25 GLY C C 25 176.272 176.272 176.018 0.254 18703 11108 1 31 . 1 1 25 25 GLY CA C 25 47.101 47.101 46.431 0.670 18703 11109 1 31 . 1 1 25 25 GLY H H 25 8.616 8.616 8.645 -0.029 18703 11110 1 31 . 1 1 26 26 ARG N N 26 123.109 123.109 120.698 2.411 18703 11111 1 31 . 1 1 26 26 ARG HA H 26 4.283 4.283 4.039 0.244 18703 11112 1 31 . 1 1 26 26 ARG C C 26 177.848 177.848 178.155 -0.307 18703 11113 1 31 . 1 1 26 26 ARG CA C 26 57.663 57.663 58.222 -0.559 18703 11114 1 31 . 1 1 26 26 ARG CB C 26 29.811 29.811 28.973 0.838 18703 11115 1 31 . 1 1 26 26 ARG H H 26 8.770 8.770 8.625 0.145 18703 11116 1 31 . 1 1 27 27 ILE N N 27 118.104 118.104 119.479 -1.375 18703 11117 1 31 . 1 1 27 27 ILE HA H 27 3.787 3.787 3.886 -0.099 18703 11118 1 31 . 1 1 27 27 ILE C C 27 177.473 177.473 178.075 -0.602 18703 11119 1 31 . 1 1 27 27 ILE CA C 27 63.036 63.036 64.086 -1.050 18703 11120 1 31 . 1 1 27 27 ILE CB C 27 36.664 36.664 37.386 -0.722 18703 11121 1 31 . 1 1 27 27 ILE H H 27 7.708 7.708 7.766 -0.058 18703 11122 1 31 . 1 1 28 28 GLU N N 28 119.934 119.934 120.713 -0.779 18703 11123 1 31 . 1 1 28 28 GLU HA H 28 3.954 3.954 3.914 0.040 18703 11124 1 31 . 1 1 28 28 GLU C C 28 179.514 179.514 178.579 0.935 18703 11125 1 31 . 1 1 28 28 GLU CA C 28 59.450 59.450 59.907 -0.457 18703 11126 1 31 . 1 1 28 28 GLU CB C 28 29.600 29.600 29.579 0.021 18703 11127 1 31 . 1 1 28 28 GLU H H 28 7.872 7.872 8.116 -0.244 18703 11128 1 31 . 1 1 29 29 GLU N N 29 118.134 118.134 119.709 -1.575 18703 11129 1 31 . 1 1 29 29 GLU HA H 29 4.028 4.028 4.161 -0.133 18703 11130 1 31 . 1 1 29 29 GLU C C 29 179.182 179.182 179.180 0.002 18703 11131 1 31 . 1 1 29 29 GLU CA C 29 59.173 59.173 58.652 0.521 18703 11132 1 31 . 1 1 29 29 GLU CB C 29 29.503 29.503 29.409 0.094 18703 11133 1 31 . 1 1 29 29 GLU H H 29 8.166 8.166 7.708 0.458 18703 11134 1 31 . 1 1 30 30 LEU N N 30 120.242 120.242 117.909 2.333 18703 11135 1 31 . 1 1 30 30 LEU HA H 30 4.028 4.028 4.163 -0.135 18703 11136 1 31 . 1 1 30 30 LEU C C 30 178.796 178.796 178.518 0.278 18703 11137 1 31 . 1 1 30 30 LEU CA C 30 57.654 57.654 56.914 0.740 18703 11138 1 31 . 1 1 30 30 LEU CB C 30 41.629 41.629 41.972 -0.343 18703 11139 1 31 . 1 1 30 30 LEU H H 30 7.695 7.695 7.446 0.249 18703 11140 1 31 . 1 1 31 31 LYS N N 31 120.506 120.506 119.682 0.824 18703 11141 1 31 . 1 1 31 31 LYS HA H 31 3.532 3.532 4.086 -0.554 18703 11142 1 31 . 1 1 31 31 LYS C C 31 178.919 178.919 178.298 0.621 18703 11143 1 31 . 1 1 31 31 LYS CA C 31 60.240 60.240 59.156 1.084 18703 11144 1 31 . 1 1 31 31 LYS CB C 31 32.015 32.015 32.466 -0.451 18703 11145 1 31 . 1 1 31 31 LYS H H 31 8.561 8.561 7.202 1.359 18703 11146 1 31 . 1 1 32 32 LYS N N 32 118.566 118.566 118.955 -0.389 18703 11147 1 31 . 1 1 32 32 LYS C C 32 179.392 179.392 179.210 0.182 18703 11148 1 31 . 1 1 32 32 LYS CA C 32 59.356 59.356 59.413 -0.057 18703 11149 1 31 . 1 1 32 32 LYS CB C 32 32.117 32.117 32.059 0.058 18703 11150 1 31 . 1 1 32 32 LYS H H 32 7.699 7.699 7.547 0.152 18703 11151 1 31 . 1 1 33 33 LYS N N 33 118.964 118.964 117.994 0.970 18703 11152 1 31 . 1 1 33 33 LYS HA H 33 4.117 4.117 4.101 0.017 18703 11153 1 31 . 1 1 33 33 LYS C C 33 178.355 178.355 178.812 -0.457 18703 11154 1 31 . 1 1 33 33 LYS CA C 33 58.633 58.633 58.319 0.314 18703 11155 1 31 . 1 1 33 33 LYS CB C 33 31.904 31.904 31.999 -0.095 18703 11156 1 31 . 1 1 33 33 LYS H H 33 7.752 7.752 7.772 -0.020 18703 11157 1 31 . 1 1 34 34 CYS N N 34 119.956 119.956 118.101 1.855 18703 11158 1 31 . 1 1 34 34 CYS HA H 34 3.967 3.967 4.122 -0.155 18703 11159 1 31 . 1 1 34 34 CYS C C 34 175.521 175.521 176.884 -1.363 18703 11160 1 31 . 1 1 34 34 CYS CA C 34 60.987 60.987 62.892 -1.905 18703 11161 1 31 . 1 1 34 34 CYS CB C 34 36.600 36.600 26.833 9.767 18703 11162 1 31 . 1 1 34 34 CYS H H 34 8.393 8.393 7.556 0.837 18703 11163 1 31 . 1 1 35 35 GLU N N 35 120.327 120.327 120.075 0.252 18703 11164 1 31 . 1 1 35 35 GLU HA H 35 3.891 3.891 3.939 -0.048 18703 11165 1 31 . 1 1 35 35 GLU C C 35 179.684 179.684 178.697 0.987 18703 11166 1 31 . 1 1 35 35 GLU CA C 35 60.059 60.059 59.161 0.898 18703 11167 1 31 . 1 1 35 35 GLU CB C 35 29.718 29.718 28.688 1.030 18703 11168 1 31 . 1 1 35 35 GLU H H 35 8.558 8.558 7.815 0.743 18703 11169 1 31 . 1 1 36 36 GLU N N 36 120.190 120.190 120.086 0.104 18703 11170 1 31 . 1 1 36 36 GLU HA H 36 4.051 4.051 3.978 0.073 18703 11171 1 31 . 1 1 36 36 GLU C C 36 179.408 179.408 178.969 0.439 18703 11172 1 31 . 1 1 36 36 GLU CA C 36 59.148 59.148 59.099 0.049 18703 11173 1 31 . 1 1 36 36 GLU CB C 36 29.766 29.766 29.599 0.167 18703 11174 1 31 . 1 1 36 36 GLU H H 36 8.038 8.038 7.641 0.397 18703 11175 1 31 . 1 1 37 37 LEU N N 37 121.102 121.102 119.529 1.573 18703 11176 1 31 . 1 1 37 37 LEU HA H 37 4.079 4.079 4.208 -0.129 18703 11177 1 31 . 1 1 37 37 LEU C C 37 178.279 178.279 178.269 0.010 18703 11178 1 31 . 1 1 37 37 LEU CA C 37 57.803 57.803 57.244 0.559 18703 11179 1 31 . 1 1 37 37 LEU CB C 37 41.502 41.502 41.734 -0.232 18703 11180 1 31 . 1 1 37 37 LEU H H 37 8.065 8.065 7.533 0.532 18703 11181 1 31 . 1 1 38 38 LYS N N 38 119.980 119.980 118.963 1.017 18703 11182 1 31 . 1 1 38 38 LYS HA H 38 3.851 3.851 3.937 -0.086 18703 11183 1 31 . 1 1 38 38 LYS C C 38 178.919 178.919 179.173 -0.254 18703 11184 1 31 . 1 1 38 38 LYS CA C 38 60.794 60.794 59.941 0.853 18703 11185 1 31 . 1 1 38 38 LYS CB C 38 32.863 32.863 32.298 0.565 18703 11186 1 31 . 1 1 38 38 LYS H H 38 8.741 8.741 8.111 0.630 18703 11187 1 31 . 1 1 39 39 LYS N N 39 118.307 118.307 118.094 0.213 18703 11188 1 31 . 1 1 39 39 LYS HA H 39 4.125 4.125 3.966 0.159 18703 11189 1 31 . 1 1 39 39 LYS C C 39 178.622 178.622 178.555 0.067 18703 11190 1 31 . 1 1 39 39 LYS CA C 39 58.993 58.993 59.126 -0.133 18703 11191 1 31 . 1 1 39 39 LYS CB C 39 32.097 32.097 31.797 0.300 18703 11192 1 31 . 1 1 39 39 LYS H H 39 7.584 7.584 7.779 -0.195 18703 11193 1 31 . 1 1 40 40 LYS N N 40 118.826 118.826 119.682 -0.856 18703 11194 1 31 . 1 1 40 40 LYS HA H 40 4.069 4.069 4.132 -0.063 18703 11195 1 31 . 1 1 40 40 LYS C C 40 179.802 179.802 178.981 0.821 18703 11196 1 31 . 1 1 40 40 LYS CA C 40 59.322 59.322 58.743 0.579 18703 11197 1 31 . 1 1 40 40 LYS CB C 40 32.505 32.505 32.433 0.072 18703 11198 1 31 . 1 1 40 40 LYS H H 40 7.945 7.945 7.350 0.595 18703 11199 1 31 . 1 1 41 41 ILE N N 41 118.958 118.958 117.837 1.121 18703 11200 1 31 . 1 1 41 41 ILE HA H 41 3.659 3.659 3.812 -0.153 18703 11201 1 31 . 1 1 41 41 ILE C C 41 178.146 178.146 176.857 1.289 18703 11202 1 31 . 1 1 41 41 ILE CA C 41 65.037 65.037 63.792 1.245 18703 11203 1 31 . 1 1 41 41 ILE CB C 41 37.950 37.950 38.022 -0.072 18703 11204 1 31 . 1 1 41 41 ILE H H 41 8.369 8.369 8.043 0.326 18703 11205 1 31 . 1 1 42 42 GLU N N 42 120.331 120.331 117.008 3.323 18703 11206 1 31 . 1 1 42 42 GLU HA H 42 4.094 4.094 4.060 0.034 18703 11207 1 31 . 1 1 42 42 GLU C C 42 178.697 178.697 177.786 0.911 18703 11208 1 31 . 1 1 42 42 GLU CA C 42 58.927 58.927 58.499 0.428 18703 11209 1 31 . 1 1 42 42 GLU CB C 42 29.399 29.399 30.021 -0.622 18703 11210 1 31 . 1 1 42 42 GLU H H 42 7.805 7.805 7.535 0.270 18703 11211 1 31 . 1 1 43 43 GLU N N 43 117.120 117.120 116.940 0.180 18703 11212 1 31 . 1 1 43 43 GLU HA H 43 4.291 4.291 4.169 0.122 18703 11213 1 31 . 1 1 43 43 GLU C C 43 177.551 177.551 177.536 0.015 18703 11214 1 31 . 1 1 43 43 GLU CA C 43 56.800 56.800 57.090 -0.290 18703 11215 1 31 . 1 1 43 43 GLU CB C 43 29.931 29.931 29.684 0.247 18703 11216 1 31 . 1 1 43 43 GLU H H 43 7.701 7.701 7.627 0.074 18703 11217 1 31 . 1 1 44 44 LEU N N 44 120.940 120.940 120.779 0.161 18703 11218 1 31 . 1 1 44 44 LEU HA H 44 4.251 4.251 4.084 0.167 18703 11219 1 31 . 1 1 44 44 LEU C C 44 178.596 178.596 176.771 1.825 18703 11220 1 31 . 1 1 44 44 LEU CA C 44 56.448 56.448 55.392 1.056 18703 11221 1 31 . 1 1 44 44 LEU CB C 44 42.519 42.519 42.545 -0.026 18703 11222 1 31 . 1 1 44 44 LEU H H 44 7.581 7.581 7.337 0.244 18703 11223 1 31 . 1 1 45 45 GLY N N 45 108.689 108.689 107.547 1.142 18703 11224 1 31 . 1 1 45 45 GLY C C 45 174.853 174.853 174.534 0.319 18703 11225 1 31 . 1 1 45 45 GLY CA C 45 46.233 46.233 45.092 1.141 18703 11226 1 31 . 1 1 45 45 GLY H H 45 8.232 8.232 8.620 -0.388 18703 11227 1 31 . 1 1 46 46 GLY N N 46 108.029 108.029 110.683 -2.654 18703 11228 1 31 . 1 1 46 46 GLY C C 46 174.351 174.351 174.195 0.156 18703 11229 1 31 . 1 1 46 46 GLY CA C 46 45.105 45.105 45.230 -0.125 18703 11230 1 31 . 1 1 46 46 GLY H H 46 8.176 8.176 8.312 -0.136 18703 11231 1 31 . 1 1 47 47 GLY N N 47 108.183 108.183 106.412 1.771 18703 11232 1 31 . 1 1 47 47 GLY C C 47 174.671 174.671 174.289 0.382 18703 11233 1 31 . 1 1 47 47 GLY CA C 47 45.254 45.254 44.486 0.768 18703 11234 1 31 . 1 1 47 47 GLY H H 47 8.290 8.290 7.782 0.508 18703 11235 1 31 . 1 1 48 48 GLY N N 48 108.616 108.616 109.581 -0.965 18703 11236 1 31 . 1 1 48 48 GLY C C 48 174.321 174.321 176.556 -2.235 18703 11237 1 31 . 1 1 48 48 GLY CA C 48 45.192 45.192 46.424 -1.232 18703 11238 1 31 . 1 1 48 48 GLY H H 48 8.027 8.027 8.204 -0.177 18703 11239 1 31 . 1 1 49 49 GLU N N 49 121.057 121.057 124.204 -3.147 18703 11240 1 31 . 1 1 49 49 GLU HA H 49 4.425 4.425 4.165 0.260 18703 11241 1 31 . 1 1 49 49 GLU C C 49 177.072 177.072 179.034 -1.962 18703 11242 1 31 . 1 1 49 49 GLU CA C 49 56.330 56.330 58.329 -1.999 18703 11243 1 31 . 1 1 49 49 GLU CB C 49 29.602 29.602 29.731 -0.129 18703 11244 1 31 . 1 1 49 49 GLU H H 49 8.486 8.486 8.201 0.285 18703 11245 1 31 . 1 1 50 50 VAL N N 50 122.122 122.122 118.815 3.307 18703 11246 1 31 . 1 1 50 50 VAL HA H 50 3.792 3.792 3.562 0.230 18703 11247 1 31 . 1 1 50 50 VAL C C 50 176.774 176.774 177.331 -0.557 18703 11248 1 31 . 1 1 50 50 VAL CA C 50 64.864 64.864 65.428 -0.564 18703 11249 1 31 . 1 1 50 50 VAL CB C 50 32.179 32.179 31.570 0.609 18703 11250 1 31 . 1 1 50 50 VAL H H 50 8.095 8.095 7.391 0.704 18703 11251 1 31 . 1 1 51 51 LYS N N 51 120.602 120.602 118.246 2.356 18703 11252 1 31 . 1 1 51 51 LYS HA H 51 4.195 4.195 4.062 0.133 18703 11253 1 31 . 1 1 51 51 LYS C C 51 178.530 178.530 178.566 -0.036 18703 11254 1 31 . 1 1 51 51 LYS CA C 51 59.348 59.348 59.163 0.185 18703 11255 1 31 . 1 1 51 51 LYS CB C 51 32.265 32.265 32.047 0.217 18703 11256 1 31 . 1 1 51 51 LYS H H 51 8.268 8.268 7.661 0.607 18703 11257 1 31 . 1 1 52 52 LYS N N 52 117.547 117.547 120.694 -3.147 18703 11258 1 31 . 1 1 52 52 LYS HA H 52 4.162 4.162 4.125 0.037 18703 11259 1 31 . 1 1 52 52 LYS C C 52 179.132 179.132 179.014 0.118 18703 11260 1 31 . 1 1 52 52 LYS CA C 52 58.811 58.811 58.451 0.360 18703 11261 1 31 . 1 1 52 52 LYS CB C 52 32.054 32.054 32.028 0.026 18703 11262 1 31 . 1 1 52 52 LYS H H 52 7.595 7.595 7.772 -0.177 18703 11263 1 31 . 1 1 53 53 VAL N N 53 119.190 119.190 119.914 -0.724 18703 11264 1 31 . 1 1 53 53 VAL HA H 53 3.767 3.767 3.600 0.167 18703 11265 1 31 . 1 1 53 53 VAL C C 53 177.933 177.933 177.541 0.392 18703 11266 1 31 . 1 1 53 53 VAL CA C 53 66.065 66.065 66.409 -0.344 18703 11267 1 31 . 1 1 53 53 VAL CB C 53 31.248 31.248 31.357 -0.109 18703 11268 1 31 . 1 1 53 53 VAL H H 53 7.597 7.597 7.568 0.029 18703 11269 1 31 . 1 1 54 54 GLU N N 54 120.226 120.226 119.339 0.887 18703 11270 1 31 . 1 1 54 54 GLU HA H 54 3.833 3.833 4.006 -0.173 18703 11271 1 31 . 1 1 54 54 GLU C C 54 179.352 179.352 178.650 0.702 18703 11272 1 31 . 1 1 54 54 GLU CA C 54 59.153 59.153 59.568 -0.415 18703 11273 1 31 . 1 1 54 54 GLU CB C 54 29.224 29.224 29.511 -0.287 18703 11274 1 31 . 1 1 54 54 GLU H H 54 8.609 8.609 7.731 0.878 18703 11275 1 31 . 1 1 55 55 GLU N N 55 119.148 119.148 119.368 -0.220 18703 11276 1 31 . 1 1 55 55 GLU HA H 55 4.084 4.084 4.172 -0.088 18703 11277 1 31 . 1 1 55 55 GLU C C 55 179.084 179.084 178.744 0.340 18703 11278 1 31 . 1 1 55 55 GLU CA C 55 59.295 59.295 58.570 0.725 18703 11279 1 31 . 1 1 55 55 GLU CB C 55 29.361 29.361 29.639 -0.278 18703 11280 1 31 . 1 1 55 55 GLU H H 55 7.713 7.713 7.937 -0.224 18703 11281 1 31 . 1 1 56 56 GLU N N 56 120.301 120.301 119.643 0.658 18703 11282 1 31 . 1 1 56 56 GLU HA H 56 4.079 4.079 4.112 -0.033 18703 11283 1 31 . 1 1 56 56 GLU C C 56 179.773 179.773 179.180 0.593 18703 11284 1 31 . 1 1 56 56 GLU CA C 56 59.528 59.528 59.218 0.310 18703 11285 1 31 . 1 1 56 56 GLU CB C 56 30.162 30.162 29.693 0.469 18703 11286 1 31 . 1 1 56 56 GLU H H 56 7.899 7.899 7.578 0.321 18703 11287 1 31 . 1 1 57 57 VAL N N 57 121.536 121.536 118.231 3.305 18703 11288 1 31 . 1 1 57 57 VAL HA H 57 3.540 3.540 3.719 -0.179 18703 11289 1 31 . 1 1 57 57 VAL C C 57 176.984 176.984 177.375 -0.391 18703 11290 1 31 . 1 1 57 57 VAL CA C 57 66.734 66.734 65.581 1.153 18703 11291 1 31 . 1 1 57 57 VAL CB C 57 31.425 31.425 31.564 -0.139 18703 11292 1 31 . 1 1 57 57 VAL H H 57 8.652 8.652 7.566 1.086 18703 11293 1 31 . 1 1 58 58 LYS N N 58 120.219 120.219 119.809 0.410 18703 11294 1 31 . 1 1 58 58 LYS HA H 58 4.199 4.199 4.100 0.099 18703 11295 1 31 . 1 1 58 58 LYS C C 58 178.972 178.972 178.533 0.439 18703 11296 1 31 . 1 1 58 58 LYS CA C 58 59.357 59.357 59.490 -0.133 18703 11297 1 31 . 1 1 58 58 LYS CB C 58 32.186 32.186 32.106 0.080 18703 11298 1 31 . 1 1 58 58 LYS H H 58 7.791 7.791 7.553 0.238 18703 11299 1 31 . 1 1 59 59 LYS N N 59 118.252 118.252 119.771 -1.519 18703 11300 1 31 . 1 1 59 59 LYS HA H 59 4.069 4.069 4.174 -0.105 18703 11301 1 31 . 1 1 59 59 LYS C C 59 179.180 179.180 178.615 0.565 18703 11302 1 31 . 1 1 59 59 LYS CA C 59 59.285 59.285 58.588 0.697 18703 11303 1 31 . 1 1 59 59 LYS CB C 59 32.345 32.345 32.239 0.106 18703 11304 1 31 . 1 1 59 59 LYS H H 59 7.849 7.849 7.499 0.350 18703 11305 1 31 . 1 1 60 60 LEU N N 60 121.243 121.243 119.690 1.553 18703 11306 1 31 . 1 1 60 60 LEU HA H 60 4.242 4.242 4.143 0.099 18703 11307 1 31 . 1 1 60 60 LEU C C 60 178.413 178.413 178.133 0.280 18703 11308 1 31 . 1 1 60 60 LEU CA C 60 57.798 57.798 57.211 0.587 18703 11309 1 31 . 1 1 60 60 LEU CB C 60 41.150 41.150 42.177 -1.027 18703 11310 1 31 . 1 1 60 60 LEU H H 60 7.825 7.825 7.533 0.292 18703 11311 1 31 . 1 1 61 61 GLU N N 61 118.844 118.844 120.121 -1.277 18703 11312 1 31 . 1 1 61 61 GLU HA H 61 3.800 3.800 3.917 -0.117 18703 11313 1 31 . 1 1 61 61 GLU C C 61 179.078 179.078 178.557 0.521 18703 11314 1 31 . 1 1 61 61 GLU CA C 61 60.104 60.104 60.003 0.101 18703 11315 1 31 . 1 1 61 61 GLU CB C 61 29.864 29.864 29.650 0.214 18703 11316 1 31 . 1 1 61 61 GLU H H 61 8.582 8.582 7.733 0.849 18703 11317 1 31 . 1 1 62 62 GLU N N 62 117.659 117.659 118.890 -1.231 18703 11318 1 31 . 1 1 62 62 GLU HA H 62 3.990 3.990 4.035 -0.045 18703 11319 1 31 . 1 1 62 62 GLU C C 62 178.847 178.847 178.947 -0.100 18703 11320 1 31 . 1 1 62 62 GLU CA C 62 59.067 59.067 59.043 0.024 18703 11321 1 31 . 1 1 62 62 GLU CB C 62 29.440 29.440 29.586 -0.146 18703 11322 1 31 . 1 1 62 62 GLU H H 62 8.032 8.032 7.656 0.376 18703 11323 1 31 . 1 1 63 63 GLU N N 63 119.290 119.290 119.140 0.150 18703 11324 1 31 . 1 1 63 63 GLU HA H 63 4.012 4.012 4.065 -0.053 18703 11325 1 31 . 1 1 63 63 GLU C C 63 179.784 179.784 179.088 0.696 18703 11326 1 31 . 1 1 63 63 GLU CA C 63 59.300 59.300 59.555 -0.255 18703 11327 1 31 . 1 1 63 63 GLU CB C 63 29.728 29.728 29.635 0.093 18703 11328 1 31 . 1 1 63 63 GLU H H 63 7.958 7.958 7.480 0.478 18703 11329 1 31 . 1 1 64 64 ILE N N 64 118.453 118.453 118.303 0.150 18703 11330 1 31 . 1 1 64 64 ILE HA H 64 3.711 3.711 3.842 -0.131 18703 11331 1 31 . 1 1 64 64 ILE C C 64 177.655 177.655 178.129 -0.474 18703 11332 1 31 . 1 1 64 64 ILE CA C 64 64.256 64.256 63.848 0.408 18703 11333 1 31 . 1 1 64 64 ILE CB C 64 38.002 38.002 37.651 0.351 18703 11334 1 31 . 1 1 64 64 ILE H H 64 8.160 8.160 7.530 0.630 18703 11335 1 31 . 1 1 65 65 LYS N N 65 118.871 118.871 120.224 -1.353 18703 11336 1 31 . 1 1 65 65 LYS HA H 65 4.111 4.111 4.095 0.016 18703 11337 1 31 . 1 1 65 65 LYS C C 65 177.076 177.076 177.441 -0.365 18703 11338 1 31 . 1 1 65 65 LYS CA C 65 58.421 58.421 58.991 -0.570 18703 11339 1 31 . 1 1 65 65 LYS CB C 65 32.639 32.639 32.401 0.238 18703 11340 1 31 . 1 1 65 65 LYS H H 65 7.664 7.664 7.729 -0.065 18703 11341 1 31 . 1 1 66 66 LYS N N 66 116.944 116.944 116.504 0.440 18703 11342 1 31 . 1 1 66 66 LYS HA H 66 4.320 4.320 4.292 0.028 18703 11343 1 31 . 1 1 66 66 LYS C C 66 175.897 175.897 177.238 -1.341 18703 11344 1 31 . 1 1 66 66 LYS CA C 66 56.352 56.352 56.606 -0.254 18703 11345 1 31 . 1 1 66 66 LYS CB C 66 33.024 33.024 33.602 -0.578 18703 11346 1 31 . 1 1 66 66 LYS H H 66 7.246 7.246 7.557 -0.311 18703 11347 1 32 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.339 -0.093 18703 11348 1 32 . 1 1 3 3 ARG C C 3 178.379 178.379 177.391 0.988 18703 11349 1 32 . 1 1 3 3 ARG CA C 3 58.367 58.367 57.806 0.561 18703 11350 1 32 . 1 1 3 3 ARG CB C 3 30.691 30.691 31.088 -0.397 18703 11351 1 32 . 1 1 3 3 ARG H H 3 7.905 7.905 8.149 -0.244 18703 11352 1 32 . 1 1 4 4 VAL N N 4 118.966 118.966 117.980 0.986 18703 11353 1 32 . 1 1 4 4 VAL HA H 4 3.803 3.803 3.816 -0.013 18703 11354 1 32 . 1 1 4 4 VAL C C 4 176.968 176.968 177.448 -0.480 18703 11355 1 32 . 1 1 4 4 VAL CA C 4 65.441 65.441 65.637 -0.196 18703 11356 1 32 . 1 1 4 4 VAL CB C 4 31.710 31.710 31.480 0.230 18703 11357 1 32 . 1 1 4 4 VAL H H 4 8.070 8.070 8.387 -0.317 18703 11358 1 32 . 1 1 5 5 LYS N N 5 122.058 122.058 118.627 3.431 18703 11359 1 32 . 1 1 5 5 LYS HA H 5 4.154 4.154 4.002 0.152 18703 11360 1 32 . 1 1 5 5 LYS C C 5 178.553 178.553 178.029 0.524 18703 11361 1 32 . 1 1 5 5 LYS CA C 5 58.712 58.712 59.192 -0.480 18703 11362 1 32 . 1 1 5 5 LYS CB C 5 31.788 31.788 31.520 0.268 18703 11363 1 32 . 1 1 5 5 LYS H H 5 7.798 7.798 8.638 -0.840 18703 11364 1 32 . 1 1 6 6 ALA N N 6 119.955 119.955 121.352 -1.397 18703 11365 1 32 . 1 1 6 6 ALA HA H 6 4.198 4.198 4.314 -0.116 18703 11366 1 32 . 1 1 6 6 ALA C C 6 180.974 180.974 179.038 1.936 18703 11367 1 32 . 1 1 6 6 ALA CA C 6 54.850 54.850 53.337 1.513 18703 11368 1 32 . 1 1 6 6 ALA CB C 6 17.995 17.995 18.378 -0.383 18703 11369 1 32 . 1 1 6 6 ALA H H 6 7.928 7.928 7.877 0.051 18703 11370 1 32 . 1 1 7 7 LEU N N 7 119.211 119.211 119.910 -0.699 18703 11371 1 32 . 1 1 7 7 LEU HA H 7 4.124 4.124 3.954 0.170 18703 11372 1 32 . 1 1 7 7 LEU C C 7 178.353 178.353 178.484 -0.131 18703 11373 1 32 . 1 1 7 7 LEU CA C 7 57.658 57.658 57.254 0.404 18703 11374 1 32 . 1 1 7 7 LEU CB C 7 41.971 41.971 42.066 -0.095 18703 11375 1 32 . 1 1 7 7 LEU H H 7 7.594 7.594 7.873 -0.279 18703 11376 1 32 . 1 1 8 8 GLU N N 8 120.258 120.258 117.927 2.331 18703 11377 1 32 . 1 1 8 8 GLU HA H 8 3.846 3.846 4.022 -0.176 18703 11378 1 32 . 1 1 8 8 GLU C C 8 179.546 179.546 178.726 0.820 18703 11379 1 32 . 1 1 8 8 GLU CA C 8 60.006 60.006 59.544 0.462 18703 11380 1 32 . 1 1 8 8 GLU CB C 8 29.683 29.683 29.517 0.166 18703 11381 1 32 . 1 1 8 8 GLU H H 8 8.382 8.382 7.831 0.551 18703 11382 1 32 . 1 1 9 9 GLU N N 9 118.584 118.584 118.776 -0.192 18703 11383 1 32 . 1 1 9 9 GLU HA H 9 4.039 4.039 4.148 -0.109 18703 11384 1 32 . 1 1 9 9 GLU C C 9 179.635 179.635 178.725 0.910 18703 11385 1 32 . 1 1 9 9 GLU CA C 9 59.235 59.235 58.709 0.526 18703 11386 1 32 . 1 1 9 9 GLU CB C 9 29.358 29.358 29.188 0.170 18703 11387 1 32 . 1 1 9 9 GLU H H 9 7.908 7.908 7.821 0.087 18703 11388 1 32 . 1 1 10 10 LYS N N 10 120.956 120.956 119.648 1.308 18703 11389 1 32 . 1 1 10 10 LYS HA H 10 4.190 4.190 4.169 0.021 18703 11390 1 32 . 1 1 10 10 LYS C C 10 179.395 179.395 178.917 0.478 18703 11391 1 32 . 1 1 10 10 LYS CA C 10 59.231 59.231 59.080 0.151 18703 11392 1 32 . 1 1 10 10 LYS CB C 10 32.211 32.211 32.722 -0.512 18703 11393 1 32 . 1 1 10 10 LYS H H 10 8.009 8.009 7.522 0.487 18703 11394 1 32 . 1 1 11 11 VAL N N 11 119.577 119.577 118.123 1.454 18703 11395 1 32 . 1 1 11 11 VAL HA H 11 3.844 3.844 3.709 0.135 18703 11396 1 32 . 1 1 11 11 VAL C C 11 177.078 177.078 177.530 -0.452 18703 11397 1 32 . 1 1 11 11 VAL CA C 11 66.407 66.407 66.245 0.162 18703 11398 1 32 . 1 1 11 11 VAL CB C 11 31.252 31.252 31.690 -0.438 18703 11399 1 32 . 1 1 11 11 VAL H H 11 8.488 8.488 7.488 1.000 18703 11400 1 32 . 1 1 12 12 LYS N N 12 122.864 122.864 119.967 2.897 18703 11401 1 32 . 1 1 12 12 LYS HA H 12 4.189 4.189 3.985 0.204 18703 11402 1 32 . 1 1 12 12 LYS C C 12 178.755 178.755 178.081 0.674 18703 11403 1 32 . 1 1 12 12 LYS CA C 12 59.375 59.375 59.587 -0.212 18703 11404 1 32 . 1 1 12 12 LYS CB C 12 31.991 31.991 32.357 -0.366 18703 11405 1 32 . 1 1 12 12 LYS H H 12 7.944 7.944 7.579 0.365 18703 11406 1 32 . 1 1 13 13 ALA N N 13 121.202 121.202 120.548 0.654 18703 11407 1 32 . 1 1 13 13 ALA HA H 13 4.209 4.209 4.280 -0.071 18703 11408 1 32 . 1 1 13 13 ALA C C 13 181.060 181.060 179.459 1.601 18703 11409 1 32 . 1 1 13 13 ALA CA C 13 54.710 54.710 54.185 0.525 18703 11410 1 32 . 1 1 13 13 ALA CB C 13 17.861 17.861 18.448 -0.587 18703 11411 1 32 . 1 1 13 13 ALA H H 13 7.563 7.563 7.487 0.076 18703 11412 1 32 . 1 1 14 14 LEU N N 14 120.014 120.014 119.618 0.396 18703 11413 1 32 . 1 1 14 14 LEU HA H 14 4.072 4.072 4.026 0.046 18703 11414 1 32 . 1 1 14 14 LEU C C 14 177.862 177.862 178.137 -0.275 18703 11415 1 32 . 1 1 14 14 LEU CA C 14 57.864 57.864 57.290 0.574 18703 11416 1 32 . 1 1 14 14 LEU CB C 14 41.539 41.539 42.093 -0.554 18703 11417 1 32 . 1 1 14 14 LEU H H 14 8.087 8.087 7.534 0.553 18703 11418 1 32 . 1 1 15 15 GLU N N 15 121.644 121.644 120.368 1.276 18703 11419 1 32 . 1 1 15 15 GLU HA H 15 3.692 3.692 3.989 -0.297 18703 11420 1 32 . 1 1 15 15 GLU C C 15 177.819 177.819 178.182 -0.363 18703 11421 1 32 . 1 1 15 15 GLU CA C 15 59.239 59.239 59.502 -0.263 18703 11422 1 32 . 1 1 15 15 GLU CB C 15 28.865 28.865 29.655 -0.790 18703 11423 1 32 . 1 1 15 15 GLU H H 15 8.542 8.542 7.816 0.726 18703 11424 1 32 . 1 1 16 16 GLU N N 16 116.016 116.016 118.881 -2.865 18703 11425 1 32 . 1 1 16 16 GLU HA H 16 3.955 3.955 3.976 -0.021 18703 11426 1 32 . 1 1 16 16 GLU C C 16 179.159 179.159 179.132 0.027 18703 11427 1 32 . 1 1 16 16 GLU CA C 16 59.324 59.324 59.011 0.313 18703 11428 1 32 . 1 1 16 16 GLU CB C 16 29.060 29.060 28.909 0.151 18703 11429 1 32 . 1 1 16 16 GLU H H 16 7.492 7.492 7.993 -0.501 18703 11430 1 32 . 1 1 17 17 LYS N N 17 118.546 118.546 119.319 -0.773 18703 11431 1 32 . 1 1 17 17 LYS HA H 17 4.117 4.117 4.143 -0.026 18703 11432 1 32 . 1 1 17 17 LYS C C 17 178.976 178.976 177.903 1.073 18703 11433 1 32 . 1 1 17 17 LYS CA C 17 58.837 58.837 58.677 0.160 18703 11434 1 32 . 1 1 17 17 LYS CB C 17 32.538 32.538 32.571 -0.033 18703 11435 1 32 . 1 1 17 17 LYS H H 17 7.720 7.720 7.563 0.157 18703 11436 1 32 . 1 1 18 18 VAL N N 18 118.376 118.376 118.729 -0.353 18703 11437 1 32 . 1 1 18 18 VAL HA H 18 3.711 3.711 3.808 -0.097 18703 11438 1 32 . 1 1 18 18 VAL C C 18 178.765 178.765 178.697 0.068 18703 11439 1 32 . 1 1 18 18 VAL CA C 18 66.237 66.237 65.512 0.725 18703 11440 1 32 . 1 1 18 18 VAL CB C 18 31.682 31.682 31.919 -0.237 18703 11441 1 32 . 1 1 18 18 VAL H H 18 8.754 8.754 7.397 1.357 18703 11442 1 32 . 1 1 19 19 LYS N N 19 118.817 118.817 118.935 -0.118 18703 11443 1 32 . 1 1 19 19 LYS HA H 19 4.078 4.078 3.977 0.101 18703 11444 1 32 . 1 1 19 19 LYS C C 19 178.049 178.049 177.706 0.343 18703 11445 1 32 . 1 1 19 19 LYS CA C 19 59.731 59.731 59.361 0.370 18703 11446 1 32 . 1 1 19 19 LYS CB C 19 32.523 32.523 32.187 0.336 18703 11447 1 32 . 1 1 19 19 LYS H H 19 8.299 8.299 8.507 -0.208 18703 11448 1 32 . 1 1 20 20 ALA N N 20 119.656 119.656 118.708 0.948 18703 11449 1 32 . 1 1 20 20 ALA HA H 20 4.347 4.347 4.345 0.002 18703 11450 1 32 . 1 1 20 20 ALA C C 20 178.532 178.532 178.425 0.107 18703 11451 1 32 . 1 1 20 20 ALA CA C 20 52.853 52.853 52.863 -0.010 18703 11452 1 32 . 1 1 20 20 ALA CB C 20 18.832 18.832 18.883 -0.051 18703 11453 1 32 . 1 1 20 20 ALA H H 20 7.425 7.425 7.506 -0.081 18703 11454 1 32 . 1 1 21 21 LEU N N 21 118.594 118.594 118.773 -0.179 18703 11455 1 32 . 1 1 21 21 LEU HA H 21 4.297 4.297 4.105 0.192 18703 11456 1 32 . 1 1 21 21 LEU C C 21 177.784 177.784 177.683 0.101 18703 11457 1 32 . 1 1 21 21 LEU CA C 21 55.750 55.750 56.468 -0.718 18703 11458 1 32 . 1 1 21 21 LEU CB C 21 42.898 42.898 42.859 0.039 18703 11459 1 32 . 1 1 21 21 LEU H H 21 7.508 7.508 7.851 -0.343 18703 11460 1 32 . 1 1 22 22 GLY N N 22 106.650 106.650 104.590 2.060 18703 11461 1 32 . 1 1 22 22 GLY C C 22 173.605 173.605 172.865 0.740 18703 11462 1 32 . 1 1 22 22 GLY CA C 22 45.330 45.330 45.027 0.303 18703 11463 1 32 . 1 1 22 22 GLY H H 22 7.814 7.814 7.861 -0.047 18703 11464 1 32 . 1 1 23 23 GLY N N 23 108.011 108.011 107.008 1.003 18703 11465 1 32 . 1 1 23 23 GLY C C 23 174.061 174.061 172.368 1.693 18703 11466 1 32 . 1 1 23 23 GLY CA C 23 44.772 44.772 45.217 -0.445 18703 11467 1 32 . 1 1 23 23 GLY H H 23 8.139 8.139 7.893 0.246 18703 11468 1 32 . 1 1 24 24 GLY N N 24 107.826 107.826 109.913 -2.087 18703 11469 1 32 . 1 1 24 24 GLY C C 24 175.046 175.046 174.816 0.230 18703 11470 1 32 . 1 1 24 24 GLY CA C 24 44.422 44.422 44.867 -0.445 18703 11471 1 32 . 1 1 24 24 GLY H H 24 8.497 8.497 8.466 0.031 18703 11472 1 32 . 1 1 25 25 GLY N N 25 108.830 108.830 112.219 -3.389 18703 11473 1 32 . 1 1 25 25 GLY C C 25 176.272 176.272 175.800 0.472 18703 11474 1 32 . 1 1 25 25 GLY CA C 25 47.101 47.101 46.006 1.095 18703 11475 1 32 . 1 1 25 25 GLY H H 25 8.616 8.616 8.379 0.237 18703 11476 1 32 . 1 1 26 26 ARG N N 26 123.109 123.109 124.720 -1.611 18703 11477 1 32 . 1 1 26 26 ARG HA H 26 4.283 4.283 4.100 0.183 18703 11478 1 32 . 1 1 26 26 ARG C C 26 177.848 177.848 178.753 -0.905 18703 11479 1 32 . 1 1 26 26 ARG CA C 26 57.663 57.663 58.160 -0.497 18703 11480 1 32 . 1 1 26 26 ARG CB C 26 29.811 29.811 29.970 -0.159 18703 11481 1 32 . 1 1 26 26 ARG H H 26 8.770 8.770 8.152 0.618 18703 11482 1 32 . 1 1 27 27 ILE N N 27 118.104 118.104 119.351 -1.247 18703 11483 1 32 . 1 1 27 27 ILE HA H 27 3.787 3.787 3.652 0.135 18703 11484 1 32 . 1 1 27 27 ILE C C 27 177.473 177.473 177.751 -0.278 18703 11485 1 32 . 1 1 27 27 ILE CA C 27 63.036 63.036 65.080 -2.044 18703 11486 1 32 . 1 1 27 27 ILE CB C 27 36.664 36.664 37.557 -0.893 18703 11487 1 32 . 1 1 27 27 ILE H H 27 7.708 7.708 7.721 -0.013 18703 11488 1 32 . 1 1 28 28 GLU N N 28 119.934 119.934 120.151 -0.217 18703 11489 1 32 . 1 1 28 28 GLU HA H 28 3.954 3.954 3.932 0.022 18703 11490 1 32 . 1 1 28 28 GLU C C 28 179.514 179.514 178.617 0.897 18703 11491 1 32 . 1 1 28 28 GLU CA C 28 59.450 59.450 60.083 -0.633 18703 11492 1 32 . 1 1 28 28 GLU CB C 28 29.600 29.600 29.228 0.372 18703 11493 1 32 . 1 1 28 28 GLU H H 28 7.872 7.872 8.002 -0.130 18703 11494 1 32 . 1 1 29 29 GLU N N 29 118.134 118.134 119.467 -1.333 18703 11495 1 32 . 1 1 29 29 GLU HA H 29 4.028 4.028 4.081 -0.053 18703 11496 1 32 . 1 1 29 29 GLU C C 29 179.182 179.182 179.144 0.038 18703 11497 1 32 . 1 1 29 29 GLU CA C 29 59.173 59.173 58.728 0.445 18703 11498 1 32 . 1 1 29 29 GLU CB C 29 29.503 29.503 29.286 0.217 18703 11499 1 32 . 1 1 29 29 GLU H H 29 8.166 8.166 7.589 0.577 18703 11500 1 32 . 1 1 30 30 LEU N N 30 120.242 120.242 118.109 2.133 18703 11501 1 32 . 1 1 30 30 LEU HA H 30 4.028 4.028 4.053 -0.025 18703 11502 1 32 . 1 1 30 30 LEU C C 30 178.796 178.796 178.903 -0.107 18703 11503 1 32 . 1 1 30 30 LEU CA C 30 57.654 57.654 57.085 0.569 18703 11504 1 32 . 1 1 30 30 LEU CB C 30 41.629 41.629 41.788 -0.159 18703 11505 1 32 . 1 1 30 30 LEU H H 30 7.695 7.695 7.620 0.075 18703 11506 1 32 . 1 1 31 31 LYS N N 31 120.506 120.506 120.225 0.281 18703 11507 1 32 . 1 1 31 31 LYS HA H 31 3.532 3.532 4.038 -0.506 18703 11508 1 32 . 1 1 31 31 LYS C C 31 178.919 178.919 178.269 0.650 18703 11509 1 32 . 1 1 31 31 LYS CA C 31 60.240 60.240 59.301 0.939 18703 11510 1 32 . 1 1 31 31 LYS CB C 31 32.015 32.015 32.286 -0.271 18703 11511 1 32 . 1 1 31 31 LYS H H 31 8.561 8.561 7.719 0.842 18703 11512 1 32 . 1 1 32 32 LYS N N 32 118.566 118.566 118.412 0.154 18703 11513 1 32 . 1 1 32 32 LYS C C 32 179.392 179.392 179.006 0.386 18703 11514 1 32 . 1 1 32 32 LYS CA C 32 59.356 59.356 59.929 -0.573 18703 11515 1 32 . 1 1 32 32 LYS CB C 32 32.117 32.117 32.432 -0.315 18703 11516 1 32 . 1 1 32 32 LYS H H 32 7.699 7.699 7.555 0.144 18703 11517 1 32 . 1 1 33 33 LYS N N 33 118.964 118.964 117.856 1.108 18703 11518 1 32 . 1 1 33 33 LYS HA H 33 4.117 4.117 4.148 -0.031 18703 11519 1 32 . 1 1 33 33 LYS C C 33 178.355 178.355 178.083 0.272 18703 11520 1 32 . 1 1 33 33 LYS CA C 33 58.633 58.633 58.838 -0.205 18703 11521 1 32 . 1 1 33 33 LYS CB C 33 31.904 31.904 32.418 -0.514 18703 11522 1 32 . 1 1 33 33 LYS H H 33 7.752 7.752 7.532 0.220 18703 11523 1 32 . 1 1 34 34 CYS N N 34 119.956 119.956 118.788 1.168 18703 11524 1 32 . 1 1 34 34 CYS HA H 34 3.967 3.967 4.193 -0.226 18703 11525 1 32 . 1 1 34 34 CYS C C 34 175.521 175.521 176.948 -1.427 18703 11526 1 32 . 1 1 34 34 CYS CA C 34 60.987 60.987 62.520 -1.532 18703 11527 1 32 . 1 1 34 34 CYS CB C 34 36.600 36.600 26.533 10.067 18703 11528 1 32 . 1 1 34 34 CYS H H 34 8.393 8.393 7.589 0.804 18703 11529 1 32 . 1 1 35 35 GLU N N 35 120.327 120.327 119.468 0.859 18703 11530 1 32 . 1 1 35 35 GLU HA H 35 3.891 3.891 3.965 -0.074 18703 11531 1 32 . 1 1 35 35 GLU C C 35 179.684 179.684 178.594 1.090 18703 11532 1 32 . 1 1 35 35 GLU CA C 35 60.059 60.059 59.277 0.782 18703 11533 1 32 . 1 1 35 35 GLU CB C 35 29.718 29.718 28.639 1.079 18703 11534 1 32 . 1 1 35 35 GLU H H 35 8.558 8.558 8.006 0.552 18703 11535 1 32 . 1 1 36 36 GLU N N 36 120.190 120.190 119.811 0.379 18703 11536 1 32 . 1 1 36 36 GLU HA H 36 4.051 4.051 4.043 0.008 18703 11537 1 32 . 1 1 36 36 GLU C C 36 179.408 179.408 178.822 0.586 18703 11538 1 32 . 1 1 36 36 GLU CA C 36 59.148 59.148 58.801 0.346 18703 11539 1 32 . 1 1 36 36 GLU CB C 36 29.766 29.766 29.708 0.058 18703 11540 1 32 . 1 1 36 36 GLU H H 36 8.038 8.038 7.650 0.388 18703 11541 1 32 . 1 1 37 37 LEU N N 37 121.102 121.102 120.253 0.849 18703 11542 1 32 . 1 1 37 37 LEU HA H 37 4.079 4.079 4.141 -0.062 18703 11543 1 32 . 1 1 37 37 LEU C C 37 178.279 178.279 178.289 -0.010 18703 11544 1 32 . 1 1 37 37 LEU CA C 37 57.803 57.803 57.502 0.301 18703 11545 1 32 . 1 1 37 37 LEU CB C 37 41.502 41.502 41.871 -0.369 18703 11546 1 32 . 1 1 37 37 LEU H H 37 8.065 8.065 7.453 0.612 18703 11547 1 32 . 1 1 38 38 LYS N N 38 119.980 119.980 118.139 1.841 18703 11548 1 32 . 1 1 38 38 LYS HA H 38 3.851 3.851 3.888 -0.037 18703 11549 1 32 . 1 1 38 38 LYS C C 38 178.919 178.919 178.977 -0.058 18703 11550 1 32 . 1 1 38 38 LYS CA C 38 60.794 60.794 60.051 0.743 18703 11551 1 32 . 1 1 38 38 LYS CB C 38 32.863 32.863 32.356 0.507 18703 11552 1 32 . 1 1 38 38 LYS H H 38 8.741 8.741 7.544 1.197 18703 11553 1 32 . 1 1 39 39 LYS N N 39 118.307 118.307 117.175 1.132 18703 11554 1 32 . 1 1 39 39 LYS HA H 39 4.125 4.125 4.465 -0.340 18703 11555 1 32 . 1 1 39 39 LYS C C 39 178.622 178.622 178.257 0.365 18703 11556 1 32 . 1 1 39 39 LYS CA C 39 58.993 58.993 58.487 0.506 18703 11557 1 32 . 1 1 39 39 LYS CB C 39 32.097 32.097 32.300 -0.202 18703 11558 1 32 . 1 1 39 39 LYS H H 39 7.584 7.584 7.570 0.014 18703 11559 1 32 . 1 1 40 40 LYS N N 40 118.826 118.826 120.943 -2.117 18703 11560 1 32 . 1 1 40 40 LYS HA H 40 4.069 4.069 4.129 -0.060 18703 11561 1 32 . 1 1 40 40 LYS C C 40 179.802 179.802 178.838 0.964 18703 11562 1 32 . 1 1 40 40 LYS CA C 40 59.322 59.322 59.086 0.236 18703 11563 1 32 . 1 1 40 40 LYS CB C 40 32.505 32.505 32.137 0.368 18703 11564 1 32 . 1 1 40 40 LYS H H 40 7.945 7.945 7.343 0.602 18703 11565 1 32 . 1 1 41 41 ILE N N 41 118.958 118.958 117.973 0.985 18703 11566 1 32 . 1 1 41 41 ILE HA H 41 3.659 3.659 3.863 -0.204 18703 11567 1 32 . 1 1 41 41 ILE C C 41 178.146 178.146 177.536 0.610 18703 11568 1 32 . 1 1 41 41 ILE CA C 41 65.037 65.037 64.079 0.958 18703 11569 1 32 . 1 1 41 41 ILE CB C 41 37.950 37.950 37.689 0.261 18703 11570 1 32 . 1 1 41 41 ILE H H 41 8.369 8.369 7.607 0.762 18703 11571 1 32 . 1 1 42 42 GLU N N 42 120.331 120.331 119.171 1.160 18703 11572 1 32 . 1 1 42 42 GLU HA H 42 4.094 4.094 4.054 0.040 18703 11573 1 32 . 1 1 42 42 GLU C C 42 178.697 178.697 177.770 0.927 18703 11574 1 32 . 1 1 42 42 GLU CA C 42 58.927 58.927 59.099 -0.172 18703 11575 1 32 . 1 1 42 42 GLU CB C 42 29.399 29.399 29.929 -0.530 18703 11576 1 32 . 1 1 42 42 GLU H H 42 7.805 7.805 7.750 0.055 18703 11577 1 32 . 1 1 43 43 GLU N N 43 117.120 117.120 116.828 0.292 18703 11578 1 32 . 1 1 43 43 GLU HA H 43 4.291 4.291 4.149 0.142 18703 11579 1 32 . 1 1 43 43 GLU C C 43 177.551 177.551 177.631 -0.080 18703 11580 1 32 . 1 1 43 43 GLU CA C 43 56.800 56.800 57.096 -0.296 18703 11581 1 32 . 1 1 43 43 GLU CB C 43 29.931 29.931 29.670 0.261 18703 11582 1 32 . 1 1 43 43 GLU H H 43 7.701 7.701 7.640 0.061 18703 11583 1 32 . 1 1 44 44 LEU N N 44 120.940 120.940 120.541 0.399 18703 11584 1 32 . 1 1 44 44 LEU HA H 44 4.251 4.251 4.157 0.094 18703 11585 1 32 . 1 1 44 44 LEU C C 44 178.596 178.596 177.642 0.954 18703 11586 1 32 . 1 1 44 44 LEU CA C 44 56.448 56.448 55.746 0.702 18703 11587 1 32 . 1 1 44 44 LEU CB C 44 42.519 42.519 42.489 0.030 18703 11588 1 32 . 1 1 44 44 LEU H H 44 7.581 7.581 7.360 0.221 18703 11589 1 32 . 1 1 45 45 GLY N N 45 108.689 108.689 107.139 1.550 18703 11590 1 32 . 1 1 45 45 GLY C C 45 174.853 174.853 174.770 0.083 18703 11591 1 32 . 1 1 45 45 GLY CA C 45 46.233 46.233 45.030 1.203 18703 11592 1 32 . 1 1 45 45 GLY H H 45 8.232 8.232 8.219 0.013 18703 11593 1 32 . 1 1 46 46 GLY N N 46 108.029 108.029 109.557 -1.528 18703 11594 1 32 . 1 1 46 46 GLY C C 46 174.351 174.351 174.679 -0.328 18703 11595 1 32 . 1 1 46 46 GLY CA C 46 45.105 45.105 45.374 -0.269 18703 11596 1 32 . 1 1 46 46 GLY H H 46 8.176 8.176 8.424 -0.248 18703 11597 1 32 . 1 1 47 47 GLY N N 47 108.183 108.183 105.720 2.463 18703 11598 1 32 . 1 1 47 47 GLY C C 47 174.671 174.671 174.455 0.216 18703 11599 1 32 . 1 1 47 47 GLY CA C 47 45.254 45.254 44.389 0.865 18703 11600 1 32 . 1 1 47 47 GLY H H 47 8.290 8.290 7.745 0.545 18703 11601 1 32 . 1 1 48 48 GLY N N 48 108.616 108.616 109.012 -0.396 18703 11602 1 32 . 1 1 48 48 GLY C C 48 174.321 174.321 175.173 -0.852 18703 11603 1 32 . 1 1 48 48 GLY CA C 48 45.192 45.192 46.029 -0.837 18703 11604 1 32 . 1 1 48 48 GLY H H 48 8.027 8.027 8.400 -0.373 18703 11605 1 32 . 1 1 49 49 GLU N N 49 121.057 121.057 121.033 0.024 18703 11606 1 32 . 1 1 49 49 GLU HA H 49 4.425 4.425 4.532 -0.107 18703 11607 1 32 . 1 1 49 49 GLU C C 49 177.072 177.072 178.819 -1.747 18703 11608 1 32 . 1 1 49 49 GLU CA C 49 56.330 56.330 56.457 -0.127 18703 11609 1 32 . 1 1 49 49 GLU CB C 49 29.602 29.602 30.170 -0.568 18703 11610 1 32 . 1 1 49 49 GLU H H 49 8.486 8.486 7.921 0.565 18703 11611 1 32 . 1 1 50 50 VAL N N 50 122.122 122.122 121.817 0.305 18703 11612 1 32 . 1 1 50 50 VAL HA H 50 3.792 3.792 3.736 0.056 18703 11613 1 32 . 1 1 50 50 VAL C C 50 176.774 176.774 176.993 -0.219 18703 11614 1 32 . 1 1 50 50 VAL CA C 50 64.864 64.864 65.588 -0.724 18703 11615 1 32 . 1 1 50 50 VAL CB C 50 32.179 32.179 31.650 0.529 18703 11616 1 32 . 1 1 50 50 VAL H H 50 8.095 8.095 8.218 -0.123 18703 11617 1 32 . 1 1 51 51 LYS N N 51 120.602 120.602 118.563 2.039 18703 11618 1 32 . 1 1 51 51 LYS HA H 51 4.195 4.195 4.016 0.179 18703 11619 1 32 . 1 1 51 51 LYS C C 51 178.530 178.530 178.617 -0.087 18703 11620 1 32 . 1 1 51 51 LYS CA C 51 59.348 59.348 59.654 -0.305 18703 11621 1 32 . 1 1 51 51 LYS CB C 51 32.265 32.265 32.047 0.218 18703 11622 1 32 . 1 1 51 51 LYS H H 51 8.268 8.268 8.344 -0.076 18703 11623 1 32 . 1 1 52 52 LYS N N 52 117.547 117.547 119.923 -2.376 18703 11624 1 32 . 1 1 52 52 LYS HA H 52 4.162 4.162 4.083 0.079 18703 11625 1 32 . 1 1 52 52 LYS C C 52 179.132 179.132 179.204 -0.072 18703 11626 1 32 . 1 1 52 52 LYS CA C 52 58.811 58.811 58.848 -0.037 18703 11627 1 32 . 1 1 52 52 LYS CB C 52 32.054 32.054 31.861 0.193 18703 11628 1 32 . 1 1 52 52 LYS H H 52 7.595 7.595 7.714 -0.119 18703 11629 1 32 . 1 1 53 53 VAL N N 53 119.190 119.190 119.121 0.069 18703 11630 1 32 . 1 1 53 53 VAL HA H 53 3.767 3.767 3.679 0.088 18703 11631 1 32 . 1 1 53 53 VAL C C 53 177.933 177.933 178.037 -0.104 18703 11632 1 32 . 1 1 53 53 VAL CA C 53 66.065 66.065 65.687 0.378 18703 11633 1 32 . 1 1 53 53 VAL CB C 53 31.248 31.248 30.734 0.514 18703 11634 1 32 . 1 1 53 53 VAL H H 53 7.597 7.597 7.623 -0.026 18703 11635 1 32 . 1 1 54 54 GLU N N 54 120.226 120.226 119.451 0.775 18703 11636 1 32 . 1 1 54 54 GLU HA H 54 3.833 3.833 3.907 -0.074 18703 11637 1 32 . 1 1 54 54 GLU C C 54 179.352 179.352 178.427 0.925 18703 11638 1 32 . 1 1 54 54 GLU CA C 54 59.153 59.153 59.578 -0.425 18703 11639 1 32 . 1 1 54 54 GLU CB C 54 29.224 29.224 29.483 -0.259 18703 11640 1 32 . 1 1 54 54 GLU H H 54 8.609 8.609 7.623 0.986 18703 11641 1 32 . 1 1 55 55 GLU N N 55 119.148 119.148 119.163 -0.015 18703 11642 1 32 . 1 1 55 55 GLU HA H 55 4.084 4.084 4.112 -0.028 18703 11643 1 32 . 1 1 55 55 GLU C C 55 179.084 179.084 178.812 0.272 18703 11644 1 32 . 1 1 55 55 GLU CA C 55 59.295 59.295 59.006 0.289 18703 11645 1 32 . 1 1 55 55 GLU CB C 55 29.361 29.361 29.628 -0.267 18703 11646 1 32 . 1 1 55 55 GLU H H 55 7.713 7.713 7.948 -0.235 18703 11647 1 32 . 1 1 56 56 GLU N N 56 120.301 120.301 118.669 1.632 18703 11648 1 32 . 1 1 56 56 GLU HA H 56 4.079 4.079 4.123 -0.044 18703 11649 1 32 . 1 1 56 56 GLU C C 56 179.773 179.773 179.101 0.672 18703 11650 1 32 . 1 1 56 56 GLU CA C 56 59.528 59.528 59.361 0.168 18703 11651 1 32 . 1 1 56 56 GLU CB C 56 30.162 30.162 29.606 0.556 18703 11652 1 32 . 1 1 56 56 GLU H H 56 7.899 7.899 7.586 0.313 18703 11653 1 32 . 1 1 57 57 VAL N N 57 121.536 121.536 117.952 3.584 18703 11654 1 32 . 1 1 57 57 VAL HA H 57 3.540 3.540 3.862 -0.322 18703 11655 1 32 . 1 1 57 57 VAL C C 57 176.984 176.984 177.509 -0.525 18703 11656 1 32 . 1 1 57 57 VAL CA C 57 66.734 66.734 65.041 1.693 18703 11657 1 32 . 1 1 57 57 VAL CB C 57 31.425 31.425 30.989 0.436 18703 11658 1 32 . 1 1 57 57 VAL H H 57 8.652 8.652 7.453 1.199 18703 11659 1 32 . 1 1 58 58 LYS N N 58 120.219 120.219 120.240 -0.021 18703 11660 1 32 . 1 1 58 58 LYS HA H 58 4.199 4.199 4.085 0.114 18703 11661 1 32 . 1 1 58 58 LYS C C 58 178.972 178.972 178.671 0.301 18703 11662 1 32 . 1 1 58 58 LYS CA C 58 59.357 59.357 59.507 -0.150 18703 11663 1 32 . 1 1 58 58 LYS CB C 58 32.186 32.186 32.050 0.136 18703 11664 1 32 . 1 1 58 58 LYS H H 58 7.791 7.791 7.410 0.381 18703 11665 1 32 . 1 1 59 59 LYS N N 59 118.252 118.252 119.605 -1.353 18703 11666 1 32 . 1 1 59 59 LYS HA H 59 4.069 4.069 4.162 -0.093 18703 11667 1 32 . 1 1 59 59 LYS C C 59 179.180 179.180 178.613 0.567 18703 11668 1 32 . 1 1 59 59 LYS CA C 59 59.285 59.285 58.762 0.523 18703 11669 1 32 . 1 1 59 59 LYS CB C 59 32.345 32.345 32.200 0.145 18703 11670 1 32 . 1 1 59 59 LYS H H 59 7.849 7.849 7.496 0.353 18703 11671 1 32 . 1 1 60 60 LEU N N 60 121.243 121.243 119.701 1.542 18703 11672 1 32 . 1 1 60 60 LEU HA H 60 4.242 4.242 4.143 0.099 18703 11673 1 32 . 1 1 60 60 LEU C C 60 178.413 178.413 178.146 0.267 18703 11674 1 32 . 1 1 60 60 LEU CA C 60 57.798 57.798 57.215 0.583 18703 11675 1 32 . 1 1 60 60 LEU CB C 60 41.150 41.150 42.145 -0.995 18703 11676 1 32 . 1 1 60 60 LEU H H 60 7.825 7.825 7.546 0.279 18703 11677 1 32 . 1 1 61 61 GLU N N 61 118.844 118.844 120.078 -1.234 18703 11678 1 32 . 1 1 61 61 GLU HA H 61 3.800 3.800 3.931 -0.131 18703 11679 1 32 . 1 1 61 61 GLU C C 61 179.078 179.078 178.841 0.237 18703 11680 1 32 . 1 1 61 61 GLU CA C 61 60.104 60.104 59.916 0.188 18703 11681 1 32 . 1 1 61 61 GLU CB C 61 29.864 29.864 29.595 0.269 18703 11682 1 32 . 1 1 61 61 GLU H H 61 8.582 8.582 7.716 0.866 18703 11683 1 32 . 1 1 62 62 GLU N N 62 117.659 117.659 119.089 -1.430 18703 11684 1 32 . 1 1 62 62 GLU HA H 62 3.990 3.990 4.050 -0.060 18703 11685 1 32 . 1 1 62 62 GLU C C 62 178.847 178.847 178.867 -0.020 18703 11686 1 32 . 1 1 62 62 GLU CA C 62 59.067 59.067 59.053 0.014 18703 11687 1 32 . 1 1 62 62 GLU CB C 62 29.440 29.440 29.573 -0.133 18703 11688 1 32 . 1 1 62 62 GLU H H 62 8.032 8.032 7.675 0.357 18703 11689 1 32 . 1 1 63 63 GLU N N 63 119.290 119.290 118.425 0.865 18703 11690 1 32 . 1 1 63 63 GLU HA H 63 4.012 4.012 4.086 -0.074 18703 11691 1 32 . 1 1 63 63 GLU C C 63 179.784 179.784 179.054 0.730 18703 11692 1 32 . 1 1 63 63 GLU CA C 63 59.300 59.300 59.419 -0.119 18703 11693 1 32 . 1 1 63 63 GLU CB C 63 29.728 29.728 29.491 0.238 18703 11694 1 32 . 1 1 63 63 GLU H H 63 7.958 7.958 7.592 0.366 18703 11695 1 32 . 1 1 64 64 ILE N N 64 118.453 118.453 118.408 0.045 18703 11696 1 32 . 1 1 64 64 ILE HA H 64 3.711 3.711 3.829 -0.118 18703 11697 1 32 . 1 1 64 64 ILE C C 64 177.655 177.655 177.690 -0.035 18703 11698 1 32 . 1 1 64 64 ILE CA C 64 64.256 64.256 63.402 0.854 18703 11699 1 32 . 1 1 64 64 ILE CB C 64 38.002 38.002 37.715 0.287 18703 11700 1 32 . 1 1 64 64 ILE H H 64 8.160 8.160 7.487 0.673 18703 11701 1 32 . 1 1 65 65 LYS N N 65 118.871 118.871 118.771 0.100 18703 11702 1 32 . 1 1 65 65 LYS HA H 65 4.111 4.111 4.097 0.014 18703 11703 1 32 . 1 1 65 65 LYS C C 65 177.076 177.076 177.750 -0.674 18703 11704 1 32 . 1 1 65 65 LYS CA C 65 58.421 58.421 58.678 -0.257 18703 11705 1 32 . 1 1 65 65 LYS CB C 65 32.639 32.639 32.220 0.419 18703 11706 1 32 . 1 1 65 65 LYS H H 65 7.664 7.664 7.578 0.086 18703 11707 1 32 . 1 1 66 66 LYS N N 66 116.944 116.944 118.703 -1.759 18703 11708 1 32 . 1 1 66 66 LYS HA H 66 4.320 4.320 4.083 0.237 18703 11709 1 32 . 1 1 66 66 LYS C C 66 175.897 175.897 177.776 -1.879 18703 11710 1 32 . 1 1 66 66 LYS CA C 66 56.352 56.352 58.236 -1.884 18703 11711 1 32 . 1 1 66 66 LYS CB C 66 33.024 33.024 32.721 0.303 18703 11712 1 32 . 1 1 66 66 LYS H H 66 7.246 7.246 7.596 -0.350 18703 stop_ loop_ _SPARTA_output.Data_ID _SPARTA_output.Entity_delta_chem_shifts_ID _SPARTA_output.Conformer_ID _SPARTA_output.Data_type _SPARTA_output.Data_atom _SPARTA_output.Data_num_shifts _SPARTA_output.Data_value _SPARTA_output.Data_low_range _SPARTA_output.Data_high_range _SPARTA_output.Entry_ID 1 1 1 "Average Difference" N 63 1.450 -0.259 1.438 18703 2 1 1 "Average Difference" HA 71 0.184 0.003 0.186 18703 3 1 1 "Average Difference" C 64 0.704 -0.232 0.670 18703 4 1 1 "Average Difference" CA 64 0.701 -0.245 0.662 18703 5 1 1 "Average Difference" CB 56 1.377 -0.126 1.383 18703 6 1 1 "Average Difference" HN 64 0.499 -0.263 0.428 18703 7 1 2 "Average Difference" N 63 1.441 -0.092 1.450 18703 8 1 2 "Average Difference" HA 71 0.190 -0.003 0.191 18703 9 1 2 "Average Difference" C 64 0.757 -0.233 0.726 18703 10 1 2 "Average Difference" CA 64 0.699 -0.123 0.694 18703 11 1 2 "Average Difference" CB 56 1.374 -0.143 1.379 18703 12 1 2 "Average Difference" HN 64 0.495 -0.189 0.462 18703 13 1 3 "Average Difference" N 63 1.569 -0.296 1.553 18703 14 1 3 "Average Difference" HA 71 0.177 -0.005 0.178 18703 15 1 3 "Average Difference" C 64 0.793 -0.209 0.770 18703 16 1 3 "Average Difference" CA 64 0.713 -0.157 0.701 18703 17 1 3 "Average Difference" CB 56 1.384 -0.146 1.388 18703 18 1 3 "Average Difference" HN 64 0.509 -0.250 0.447 18703 19 1 4 "Average Difference" N 63 1.297 -0.279 1.276 18703 20 1 4 "Average Difference" HA 71 0.157 -0.003 0.158 18703 21 1 4 "Average Difference" C 64 0.650 -0.193 0.625 18703 22 1 4 "Average Difference" CA 64 0.687 -0.129 0.680 18703 23 1 4 "Average Difference" CB 56 1.363 -0.173 1.364 18703 24 1 4 "Average Difference" HN 64 0.508 -0.199 0.471 18703 25 1 5 "Average Difference" N 63 1.563 -0.313 1.544 18703 26 1 5 "Average Difference" HA 71 0.160 0.002 0.161 18703 27 1 5 "Average Difference" C 64 0.807 -0.296 0.757 18703 28 1 5 "Average Difference" CA 64 0.768 -0.185 0.751 18703 29 1 5 "Average Difference" CB 56 1.396 -0.145 1.401 18703 30 1 5 "Average Difference" HN 64 0.478 -0.246 0.413 18703 31 1 6 "Average Difference" N 63 1.634 -0.397 1.597 18703 32 1 6 "Average Difference" HA 71 0.184 0.006 0.185 18703 33 1 6 "Average Difference" C 64 0.867 -0.407 0.772 18703 34 1 6 "Average Difference" CA 64 0.672 -0.207 0.645 18703 35 1 6 "Average Difference" CB 56 1.395 -0.074 1.405 18703 36 1 6 "Average Difference" HN 64 0.502 -0.253 0.437 18703 37 1 7 "Average Difference" N 63 1.385 -0.331 1.355 18703 38 1 7 "Average Difference" HA 71 0.180 -0.025 0.180 18703 39 1 7 "Average Difference" C 64 0.793 -0.238 0.762 18703 40 1 7 "Average Difference" CA 64 0.711 -0.152 0.700 18703 41 1 7 "Average Difference" CB 56 1.381 -0.174 1.383 18703 42 1 7 "Average Difference" HN 64 0.511 -0.237 0.457 18703 43 1 8 "Average Difference" N 63 1.544 -0.279 1.531 18703 44 1 8 "Average Difference" HA 71 0.172 -0.001 0.174 18703 45 1 8 "Average Difference" C 64 0.687 -0.207 0.661 18703 46 1 8 "Average Difference" CA 64 0.699 -0.153 0.687 18703 47 1 8 "Average Difference" CB 56 1.405 -0.140 1.410 18703 48 1 8 "Average Difference" HN 64 0.526 -0.225 0.479 18703 49 1 9 "Average Difference" N 63 1.591 -0.249 1.584 18703 50 1 9 "Average Difference" HA 71 0.154 -0.002 0.155 18703 51 1 9 "Average Difference" C 64 0.801 -0.231 0.773 18703 52 1 9 "Average Difference" CA 64 0.740 -0.148 0.730 18703 53 1 9 "Average Difference" CB 56 1.391 -0.139 1.397 18703 54 1 9 "Average Difference" HN 64 0.508 -0.266 0.436 18703 55 1 10 "Average Difference" N 63 1.465 -0.418 1.415 18703 56 1 10 "Average Difference" HA 71 0.190 0.024 0.190 18703 57 1 10 "Average Difference" C 64 0.743 -0.225 0.714 18703 58 1 10 "Average Difference" CA 64 0.711 -0.130 0.705 18703 59 1 10 "Average Difference" CB 56 1.390 -0.109 1.398 18703 60 1 10 "Average Difference" HN 64 0.573 -0.217 0.534 18703 61 1 11 "Average Difference" N 63 1.192 -0.226 1.180 18703 62 1 11 "Average Difference" HA 71 0.170 0.015 0.170 18703 63 1 11 "Average Difference" C 64 0.739 -0.186 0.721 18703 64 1 11 "Average Difference" CA 64 0.755 -0.129 0.750 18703 65 1 11 "Average Difference" CB 56 1.413 -0.217 1.409 18703 66 1 11 "Average Difference" HN 64 0.530 -0.209 0.491 18703 67 1 12 "Average Difference" N 63 1.460 -0.239 1.452 18703 68 1 12 "Average Difference" HA 71 0.187 -0.017 0.188 18703 69 1 12 "Average Difference" C 64 0.820 -0.273 0.779 18703 70 1 12 "Average Difference" CA 64 0.786 -0.131 0.781 18703 71 1 12 "Average Difference" CB 56 1.388 -0.126 1.394 18703 72 1 12 "Average Difference" HN 64 0.500 -0.262 0.429 18703 73 1 13 "Average Difference" N 63 1.519 -0.346 1.491 18703 74 1 13 "Average Difference" HA 71 0.185 -0.015 0.186 18703 75 1 13 "Average Difference" C 64 0.789 -0.239 0.758 18703 76 1 13 "Average Difference" CA 64 0.807 -0.152 0.799 18703 77 1 13 "Average Difference" CB 56 1.425 -0.165 1.428 18703 78 1 13 "Average Difference" HN 64 0.495 -0.233 0.441 18703 79 1 14 "Average Difference" N 63 1.647 -0.269 1.637 18703 80 1 14 "Average Difference" HA 71 0.185 -0.025 0.185 18703 81 1 14 "Average Difference" C 64 0.774 -0.269 0.732 18703 82 1 14 "Average Difference" CA 64 0.722 -0.129 0.717 18703 83 1 14 "Average Difference" CB 56 1.380 -0.110 1.388 18703 84 1 14 "Average Difference" HN 64 0.510 -0.238 0.455 18703 85 1 15 "Average Difference" N 63 1.449 -0.326 1.423 18703 86 1 15 "Average Difference" HA 71 0.160 0.020 0.160 18703 87 1 15 "Average Difference" C 64 0.810 -0.324 0.748 18703 88 1 15 "Average Difference" CA 64 0.721 -0.179 0.704 18703 89 1 15 "Average Difference" CB 56 1.424 -0.111 1.433 18703 90 1 15 "Average Difference" HN 64 0.480 -0.218 0.431 18703 91 1 16 "Average Difference" N 63 1.604 -0.199 1.604 18703 92 1 16 "Average Difference" HA 71 0.155 0.014 0.155 18703 93 1 16 "Average Difference" C 64 0.719 -0.239 0.684 18703 94 1 16 "Average Difference" CA 64 0.690 -0.157 0.678 18703 95 1 16 "Average Difference" CB 56 1.385 -0.175 1.386 18703 96 1 16 "Average Difference" HN 64 0.521 -0.212 0.480 18703 97 1 17 "Average Difference" N 63 1.490 -0.148 1.495 18703 98 1 17 "Average Difference" HA 71 0.199 0.007 0.200 18703 99 1 17 "Average Difference" C 64 0.765 -0.169 0.752 18703 100 1 17 "Average Difference" CA 64 0.771 -0.151 0.762 18703 101 1 17 "Average Difference" CB 56 1.394 -0.148 1.398 18703 102 1 17 "Average Difference" HN 64 0.516 -0.192 0.483 18703 103 1 18 "Average Difference" N 63 1.405 -0.171 1.406 18703 104 1 18 "Average Difference" HA 71 0.170 -0.003 0.171 18703 105 1 18 "Average Difference" C 64 0.789 -0.198 0.770 18703 106 1 18 "Average Difference" CA 64 0.753 -0.134 0.747 18703 107 1 18 "Average Difference" CB 56 1.421 -0.174 1.424 18703 108 1 18 "Average Difference" HN 64 0.490 -0.233 0.434 18703 109 1 19 "Average Difference" N 63 1.547 -0.188 1.548 18703 110 1 19 "Average Difference" HA 71 0.189 0.003 0.190 18703 111 1 19 "Average Difference" C 64 0.716 -0.224 0.686 18703 112 1 19 "Average Difference" CA 64 0.755 -0.164 0.743 18703 113 1 19 "Average Difference" CB 56 1.382 -0.113 1.390 18703 114 1 19 "Average Difference" HN 64 0.554 -0.211 0.516 18703 115 1 20 "Average Difference" N 63 1.499 -0.180 1.500 18703 116 1 20 "Average Difference" HA 71 0.163 0.002 0.165 18703 117 1 20 "Average Difference" C 64 0.840 -0.333 0.777 18703 118 1 20 "Average Difference" CA 64 0.780 -0.143 0.773 18703 119 1 20 "Average Difference" CB 56 1.386 -0.151 1.390 18703 120 1 20 "Average Difference" HN 64 0.498 -0.228 0.446 18703 121 1 21 "Average Difference" N 63 1.391 -0.098 1.399 18703 122 1 21 "Average Difference" HA 71 0.177 0.020 0.177 18703 123 1 21 "Average Difference" C 64 0.799 -0.282 0.753 18703 124 1 21 "Average Difference" CA 64 0.679 -0.170 0.662 18703 125 1 21 "Average Difference" CB 56 1.399 -0.165 1.402 18703 126 1 21 "Average Difference" HN 64 0.501 -0.220 0.454 18703 127 1 22 "Average Difference" N 63 1.372 -0.242 1.361 18703 128 1 22 "Average Difference" HA 71 0.192 -0.021 0.192 18703 129 1 22 "Average Difference" C 64 0.702 -0.144 0.692 18703 130 1 22 "Average Difference" CA 64 0.672 -0.108 0.668 18703 131 1 22 "Average Difference" CB 56 1.397 -0.129 1.404 18703 132 1 22 "Average Difference" HN 64 0.505 -0.241 0.447 18703 133 1 23 "Average Difference" N 63 1.519 -0.337 1.493 18703 134 1 23 "Average Difference" HA 71 0.172 0.006 0.173 18703 135 1 23 "Average Difference" C 64 0.785 -0.164 0.773 18703 136 1 23 "Average Difference" CA 64 0.720 -0.050 0.724 18703 137 1 23 "Average Difference" CB 56 1.399 -0.209 1.395 18703 138 1 23 "Average Difference" HN 64 0.488 -0.211 0.444 18703 139 1 24 "Average Difference" N 63 1.415 -0.133 1.420 18703 140 1 24 "Average Difference" HA 71 0.200 -0.009 0.202 18703 141 1 24 "Average Difference" C 64 0.749 -0.249 0.712 18703 142 1 24 "Average Difference" CA 64 0.782 -0.222 0.756 18703 143 1 24 "Average Difference" CB 56 1.406 -0.179 1.407 18703 144 1 24 "Average Difference" HN 64 0.496 -0.243 0.436 18703 145 1 25 "Average Difference" N 63 1.405 -0.245 1.395 18703 146 1 25 "Average Difference" HA 71 0.190 -0.012 0.191 18703 147 1 25 "Average Difference" C 64 0.746 -0.273 0.700 18703 148 1 25 "Average Difference" CA 64 0.711 -0.175 0.694 18703 149 1 25 "Average Difference" CB 56 1.420 -0.136 1.426 18703 150 1 25 "Average Difference" HN 64 0.483 -0.214 0.436 18703 151 1 26 "Average Difference" N 63 1.563 -0.312 1.544 18703 152 1 26 "Average Difference" HA 71 0.182 -0.023 0.182 18703 153 1 26 "Average Difference" C 64 0.842 -0.288 0.798 18703 154 1 26 "Average Difference" CA 64 0.777 -0.135 0.771 18703 155 1 26 "Average Difference" CB 56 1.387 -0.135 1.393 18703 156 1 26 "Average Difference" HN 64 0.521 -0.240 0.466 18703 157 1 27 "Average Difference" N 63 1.457 -0.371 1.421 18703 158 1 27 "Average Difference" HA 71 0.150 0.021 0.149 18703 159 1 27 "Average Difference" C 64 0.811 -0.289 0.763 18703 160 1 27 "Average Difference" CA 64 0.751 -0.139 0.744 18703 161 1 27 "Average Difference" CB 56 1.389 -0.166 1.392 18703 162 1 27 "Average Difference" HN 64 0.531 -0.251 0.472 18703 163 1 28 "Average Difference" N 63 1.457 -0.377 1.418 18703 164 1 28 "Average Difference" HA 71 0.159 0.003 0.160 18703 165 1 28 "Average Difference" C 64 0.798 -0.278 0.753 18703 166 1 28 "Average Difference" CA 64 0.726 -0.117 0.722 18703 167 1 28 "Average Difference" CB 56 1.386 -0.147 1.391 18703 168 1 28 "Average Difference" HN 64 0.522 -0.241 0.467 18703 169 1 29 "Average Difference" N 63 1.505 -0.218 1.501 18703 170 1 29 "Average Difference" HA 71 0.172 -0.016 0.172 18703 171 1 29 "Average Difference" C 64 0.744 -0.317 0.678 18703 172 1 29 "Average Difference" CA 64 0.734 -0.145 0.726 18703 173 1 29 "Average Difference" CB 56 1.394 -0.167 1.397 18703 174 1 29 "Average Difference" HN 64 0.502 -0.250 0.439 18703 175 1 30 "Average Difference" N 63 1.508 -0.338 1.481 18703 176 1 30 "Average Difference" HA 71 0.170 -0.012 0.171 18703 177 1 30 "Average Difference" C 64 0.769 -0.199 0.748 18703 178 1 30 "Average Difference" CA 64 0.731 -0.159 0.719 18703 179 1 30 "Average Difference" CB 56 1.391 -0.145 1.396 18703 180 1 30 "Average Difference" HN 64 0.497 -0.254 0.430 18703 181 1 31 "Average Difference" N 63 1.550 -0.295 1.533 18703 182 1 31 "Average Difference" HA 71 0.177 -0.016 0.177 18703 183 1 31 "Average Difference" C 64 0.801 -0.200 0.782 18703 184 1 31 "Average Difference" CA 64 0.707 -0.131 0.700 18703 185 1 31 "Average Difference" CB 56 1.364 -0.126 1.370 18703 186 1 31 "Average Difference" HN 64 0.510 -0.276 0.433 18703 187 1 32 "Average Difference" N 63 1.497 -0.282 1.482 18703 188 1 32 "Average Difference" HA 71 0.187 -0.022 0.187 18703 189 1 32 "Average Difference" C 64 0.742 -0.214 0.716 18703 190 1 32 "Average Difference" CA 64 0.700 -0.114 0.696 18703 191 1 32 "Average Difference" CB 56 1.406 -0.156 1.409 18703 192 1 32 "Average Difference" HN 64 0.510 -0.251 0.447 18703 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 18703 _Entity_delta_chem_shifts.ID 2 _Entity_delta_chem_shifts.Details ; This saveframe contains the averaged SPARTA chemical shift over all the models used. ; loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 . 1 1 3 3 ARG HA H 3 4.246 4.246 4.372 -0.126 18703 2 1 . 1 1 3 3 ARG C C 3 178.379 178.379 177.111 1.268 18703 3 1 . 1 1 3 3 ARG CA C 3 58.367 58.367 57.180 1.187 18703 4 1 . 1 1 3 3 ARG CB C 3 30.691 30.691 30.775 -0.084 18703 5 1 . 1 1 3 3 ARG H H 3 7.905 7.905 8.418 -0.513 18703 6 1 . 1 1 4 4 VAL N N 4 118.966 118.966 120.783 -1.817 18703 7 1 . 1 1 4 4 VAL HA H 4 3.803 3.803 3.831 -0.028 18703 8 1 . 1 1 4 4 VAL C C 4 176.968 176.968 177.178 -0.210 18703 9 1 . 1 1 4 4 VAL CA C 4 65.441 65.441 65.093 0.348 18703 10 1 . 1 1 4 4 VAL CB C 4 31.710 31.710 31.584 0.126 18703 11 1 . 1 1 4 4 VAL H H 4 8.070 8.070 8.289 -0.219 18703 12 1 . 1 1 5 5 LYS N N 5 122.058 122.058 119.834 2.224 18703 13 1 . 1 1 5 5 LYS HA H 5 4.154 4.154 4.123 0.031 18703 14 1 . 1 1 5 5 LYS C C 5 178.553 178.553 178.586 -0.033 18703 15 1 . 1 1 5 5 LYS CA C 5 58.712 58.712 59.341 -0.629 18703 16 1 . 1 1 5 5 LYS CB C 5 31.788 31.788 32.002 -0.214 18703 17 1 . 1 1 5 5 LYS H H 5 7.798 7.798 8.358 -0.560 18703 18 1 . 1 1 6 6 ALA N N 6 119.955 119.955 120.507 -0.552 18703 19 1 . 1 1 6 6 ALA HA H 6 4.198 4.198 4.258 -0.060 18703 20 1 . 1 1 6 6 ALA C C 6 180.974 180.974 179.308 1.666 18703 21 1 . 1 1 6 6 ALA CA C 6 54.850 54.850 54.208 0.642 18703 22 1 . 1 1 6 6 ALA CB C 6 17.995 17.995 18.328 -0.333 18703 23 1 . 1 1 6 6 ALA H H 6 7.928 7.928 7.819 0.109 18703 24 1 . 1 1 7 7 LEU N N 7 119.211 119.211 119.578 -0.367 18703 25 1 . 1 1 7 7 LEU HA H 7 4.124 4.124 3.974 0.149 18703 26 1 . 1 1 7 7 LEU C C 7 178.353 178.353 178.558 -0.205 18703 27 1 . 1 1 7 7 LEU CA C 7 57.658 57.658 57.342 0.316 18703 28 1 . 1 1 7 7 LEU CB C 7 41.971 41.971 42.064 -0.093 18703 29 1 . 1 1 7 7 LEU H H 7 7.594 7.594 7.597 -0.003 18703 30 1 . 1 1 8 8 GLU N N 8 120.258 120.258 118.035 2.223 18703 31 1 . 1 1 8 8 GLU HA H 8 3.846 3.846 4.009 -0.163 18703 32 1 . 1 1 8 8 GLU C C 8 179.546 179.546 178.716 0.830 18703 33 1 . 1 1 8 8 GLU CA C 8 60.006 60.006 59.601 0.405 18703 34 1 . 1 1 8 8 GLU CB C 8 29.683 29.683 29.518 0.165 18703 35 1 . 1 1 8 8 GLU H H 8 8.382 8.382 7.796 0.586 18703 36 1 . 1 1 9 9 GLU N N 9 118.584 118.584 118.690 -0.106 18703 37 1 . 1 1 9 9 GLU HA H 9 4.039 4.039 4.129 -0.090 18703 38 1 . 1 1 9 9 GLU C C 9 179.635 179.635 178.639 0.996 18703 39 1 . 1 1 9 9 GLU CA C 9 59.235 59.235 58.624 0.611 18703 40 1 . 1 1 9 9 GLU CB C 9 29.358 29.358 29.107 0.251 18703 41 1 . 1 1 9 9 GLU H H 9 7.908 7.908 7.796 0.112 18703 42 1 . 1 1 10 10 LYS N N 10 120.956 120.956 120.000 0.956 18703 43 1 . 1 1 10 10 LYS HA H 10 4.190 4.190 4.127 0.063 18703 44 1 . 1 1 10 10 LYS C C 10 179.395 179.395 178.900 0.495 18703 45 1 . 1 1 10 10 LYS CA C 10 59.231 59.231 59.146 0.085 18703 46 1 . 1 1 10 10 LYS CB C 10 32.211 32.211 32.601 -0.390 18703 47 1 . 1 1 10 10 LYS H H 10 8.009 8.009 7.455 0.554 18703 48 1 . 1 1 11 11 VAL N N 11 119.577 119.577 118.099 1.478 18703 49 1 . 1 1 11 11 VAL HA H 11 3.844 3.844 3.694 0.150 18703 50 1 . 1 1 11 11 VAL C C 11 177.078 177.078 177.515 -0.437 18703 51 1 . 1 1 11 11 VAL CA C 11 66.407 66.407 65.910 0.497 18703 52 1 . 1 1 11 11 VAL CB C 11 31.252 31.252 31.376 -0.124 18703 53 1 . 1 1 11 11 VAL H H 11 8.488 8.488 7.503 0.985 18703 54 1 . 1 1 12 12 LYS N N 12 122.864 122.864 119.772 3.092 18703 55 1 . 1 1 12 12 LYS HA H 12 4.189 4.189 3.976 0.213 18703 56 1 . 1 1 12 12 LYS C C 12 178.755 178.755 178.251 0.504 18703 57 1 . 1 1 12 12 LYS CA C 12 59.375 59.375 59.586 -0.211 18703 58 1 . 1 1 12 12 LYS CB C 12 31.991 31.991 32.167 -0.176 18703 59 1 . 1 1 12 12 LYS H H 12 7.944 7.944 7.598 0.346 18703 60 1 . 1 1 13 13 ALA N N 13 121.202 121.202 120.606 0.596 18703 61 1 . 1 1 13 13 ALA HA H 13 4.209 4.209 4.299 -0.090 18703 62 1 . 1 1 13 13 ALA C C 13 181.060 181.060 179.429 1.631 18703 63 1 . 1 1 13 13 ALA CA C 13 54.710 54.710 54.138 0.572 18703 64 1 . 1 1 13 13 ALA CB C 13 17.861 17.861 18.423 -0.562 18703 65 1 . 1 1 13 13 ALA H H 13 7.563 7.563 7.453 0.110 18703 66 1 . 1 1 14 14 LEU N N 14 120.014 120.014 119.679 0.335 18703 67 1 . 1 1 14 14 LEU HA H 14 4.072 4.072 4.006 0.066 18703 68 1 . 1 1 14 14 LEU C C 14 177.862 177.862 178.183 -0.321 18703 69 1 . 1 1 14 14 LEU CA C 14 57.864 57.864 57.399 0.465 18703 70 1 . 1 1 14 14 LEU CB C 14 41.539 41.539 42.074 -0.535 18703 71 1 . 1 1 14 14 LEU H H 14 8.087 8.087 7.509 0.578 18703 72 1 . 1 1 15 15 GLU N N 15 121.644 121.644 120.152 1.492 18703 73 1 . 1 1 15 15 GLU HA H 15 3.692 3.692 4.006 -0.314 18703 74 1 . 1 1 15 15 GLU C C 15 177.819 177.819 178.268 -0.449 18703 75 1 . 1 1 15 15 GLU CA C 15 59.239 59.239 59.320 -0.081 18703 76 1 . 1 1 15 15 GLU CB C 15 28.865 28.865 29.587 -0.722 18703 77 1 . 1 1 15 15 GLU H H 15 8.542 8.542 7.686 0.856 18703 78 1 . 1 1 16 16 GLU N N 16 116.016 116.016 118.587 -2.571 18703 79 1 . 1 1 16 16 GLU HA H 16 3.955 3.955 3.985 -0.030 18703 80 1 . 1 1 16 16 GLU C C 16 179.159 179.159 179.062 0.097 18703 81 1 . 1 1 16 16 GLU CA C 16 59.324 59.324 59.141 0.183 18703 82 1 . 1 1 16 16 GLU CB C 16 29.060 29.060 29.143 -0.083 18703 83 1 . 1 1 16 16 GLU H H 16 7.492 7.492 7.962 -0.470 18703 84 1 . 1 1 17 17 LYS N N 17 118.546 118.546 118.869 -0.323 18703 85 1 . 1 1 17 17 LYS HA H 17 4.117 4.117 4.139 -0.022 18703 86 1 . 1 1 17 17 LYS C C 17 178.976 178.976 178.294 0.683 18703 87 1 . 1 1 17 17 LYS CA C 17 58.837 58.837 58.810 0.027 18703 88 1 . 1 1 17 17 LYS CB C 17 32.538 32.538 32.529 0.009 18703 89 1 . 1 1 17 17 LYS H H 17 7.720 7.720 7.477 0.243 18703 90 1 . 1 1 18 18 VAL N N 18 118.376 118.376 118.972 -0.596 18703 91 1 . 1 1 18 18 VAL HA H 18 3.711 3.711 3.766 -0.055 18703 92 1 . 1 1 18 18 VAL C C 18 178.765 178.765 178.473 0.292 18703 93 1 . 1 1 18 18 VAL CA C 18 66.237 66.237 65.844 0.393 18703 94 1 . 1 1 18 18 VAL CB C 18 31.682 31.682 31.735 -0.053 18703 95 1 . 1 1 18 18 VAL H H 18 8.754 8.754 7.496 1.258 18703 96 1 . 1 1 19 19 LYS N N 19 118.817 118.817 119.230 -0.413 18703 97 1 . 1 1 19 19 LYS HA H 19 4.078 4.078 3.978 0.100 18703 98 1 . 1 1 19 19 LYS C C 19 178.049 178.049 177.711 0.338 18703 99 1 . 1 1 19 19 LYS CA C 19 59.731 59.731 59.250 0.481 18703 100 1 . 1 1 19 19 LYS CB C 19 32.523 32.523 32.083 0.441 18703 101 1 . 1 1 19 19 LYS H H 19 8.299 8.299 8.550 -0.251 18703 102 1 . 1 1 20 20 ALA N N 20 119.656 119.656 119.198 0.458 18703 103 1 . 1 1 20 20 ALA HA H 20 4.347 4.347 4.349 -0.002 18703 104 1 . 1 1 20 20 ALA C C 20 178.532 178.532 178.175 0.357 18703 105 1 . 1 1 20 20 ALA CA C 20 52.853 52.853 52.593 0.260 18703 106 1 . 1 1 20 20 ALA CB C 20 18.832 18.832 19.203 -0.371 18703 107 1 . 1 1 20 20 ALA H H 20 7.425 7.425 7.580 -0.155 18703 108 1 . 1 1 21 21 LEU N N 21 118.594 118.594 118.975 -0.381 18703 109 1 . 1 1 21 21 LEU HA H 21 4.297 4.297 4.312 -0.015 18703 110 1 . 1 1 21 21 LEU C C 21 177.784 177.784 177.271 0.513 18703 111 1 . 1 1 21 21 LEU CA C 21 55.750 55.750 55.555 0.195 18703 112 1 . 1 1 21 21 LEU CB C 21 42.898 42.898 42.868 0.030 18703 113 1 . 1 1 21 21 LEU H H 21 7.508 7.508 7.761 -0.253 18703 114 1 . 1 1 22 22 GLY N N 22 106.650 106.650 106.065 0.585 18703 115 1 . 1 1 22 22 GLY C C 22 173.605 173.605 173.203 0.402 18703 116 1 . 1 1 22 22 GLY CA C 22 45.330 45.330 44.797 0.533 18703 117 1 . 1 1 22 22 GLY H H 22 7.814 7.814 8.129 -0.315 18703 118 1 . 1 1 23 23 GLY N N 23 108.011 108.011 107.824 0.187 18703 119 1 . 1 1 23 23 GLY C C 23 174.061 174.061 173.107 0.954 18703 120 1 . 1 1 23 23 GLY CA C 23 44.772 44.772 45.142 -0.370 18703 121 1 . 1 1 23 23 GLY H H 23 8.139 8.139 8.145 -0.006 18703 122 1 . 1 1 24 24 GLY N N 24 107.826 107.826 107.977 -0.151 18703 123 1 . 1 1 24 24 GLY C C 24 175.046 175.046 174.096 0.950 18703 124 1 . 1 1 24 24 GLY CA C 24 44.422 44.422 45.098 -0.676 18703 125 1 . 1 1 24 24 GLY H H 24 8.497 8.497 8.231 0.266 18703 126 1 . 1 1 25 25 GLY N N 25 108.830 108.830 109.954 -1.125 18703 127 1 . 1 1 25 25 GLY C C 25 176.272 176.272 175.600 0.672 18703 128 1 . 1 1 25 25 GLY CA C 25 47.101 47.101 45.448 1.653 18703 129 1 . 1 1 25 25 GLY H H 25 8.616 8.616 8.246 0.370 18703 130 1 . 1 1 26 26 ARG N N 26 123.109 123.109 123.341 -0.232 18703 131 1 . 1 1 26 26 ARG HA H 26 4.283 4.283 4.127 0.156 18703 132 1 . 1 1 26 26 ARG C C 26 177.848 177.848 178.163 -0.315 18703 133 1 . 1 1 26 26 ARG CA C 26 57.663 57.663 58.190 -0.527 18703 134 1 . 1 1 26 26 ARG CB C 26 29.811 29.811 29.542 0.269 18703 135 1 . 1 1 26 26 ARG H H 26 8.770 8.770 8.509 0.261 18703 136 1 . 1 1 27 27 ILE N N 27 118.104 118.104 118.746 -0.642 18703 137 1 . 1 1 27 27 ILE HA H 27 3.787 3.787 3.784 0.003 18703 138 1 . 1 1 27 27 ILE C C 27 177.473 177.473 177.787 -0.314 18703 139 1 . 1 1 27 27 ILE CA C 27 63.036 63.036 64.326 -1.290 18703 140 1 . 1 1 27 27 ILE CB C 27 36.664 36.664 37.512 -0.848 18703 141 1 . 1 1 27 27 ILE H H 27 7.708 7.708 7.966 -0.258 18703 142 1 . 1 1 28 28 GLU N N 28 119.934 119.934 119.878 0.056 18703 143 1 . 1 1 28 28 GLU HA H 28 3.954 3.954 3.902 0.052 18703 144 1 . 1 1 28 28 GLU C C 28 179.514 179.514 178.588 0.926 18703 145 1 . 1 1 28 28 GLU CA C 28 59.450 59.450 59.890 -0.440 18703 146 1 . 1 1 28 28 GLU CB C 28 29.600 29.600 29.297 0.303 18703 147 1 . 1 1 28 28 GLU H H 28 7.872 7.872 7.934 -0.062 18703 148 1 . 1 1 29 29 GLU N N 29 118.134 118.134 119.618 -1.484 18703 149 1 . 1 1 29 29 GLU HA H 29 4.028 4.028 4.095 -0.067 18703 150 1 . 1 1 29 29 GLU C C 29 179.182 179.182 179.164 0.018 18703 151 1 . 1 1 29 29 GLU CA C 29 59.173 59.173 59.036 0.137 18703 152 1 . 1 1 29 29 GLU CB C 29 29.503 29.503 29.398 0.105 18703 153 1 . 1 1 29 29 GLU H H 29 8.166 8.166 7.672 0.494 18703 154 1 . 1 1 30 30 LEU N N 30 120.242 120.242 117.807 2.435 18703 155 1 . 1 1 30 30 LEU HA H 30 4.028 4.028 4.101 -0.073 18703 156 1 . 1 1 30 30 LEU C C 30 178.796 178.796 178.757 0.039 18703 157 1 . 1 1 30 30 LEU CA C 30 57.654 57.654 56.826 0.828 18703 158 1 . 1 1 30 30 LEU CB C 30 41.629 41.629 41.810 -0.181 18703 159 1 . 1 1 30 30 LEU H H 30 7.695 7.695 7.553 0.142 18703 160 1 . 1 1 31 31 LYS N N 31 120.506 120.506 120.188 0.318 18703 161 1 . 1 1 31 31 LYS HA H 31 3.532 3.532 4.047 -0.515 18703 162 1 . 1 1 31 31 LYS C C 31 178.919 178.919 178.259 0.660 18703 163 1 . 1 1 31 31 LYS CA C 31 60.240 60.240 59.283 0.957 18703 164 1 . 1 1 31 31 LYS CB C 31 32.015 32.015 32.317 -0.302 18703 165 1 . 1 1 31 31 LYS H H 31 8.561 8.561 7.668 0.893 18703 166 1 . 1 1 32 32 LYS N N 32 118.566 118.566 118.795 -0.229 18703 167 1 . 1 1 32 32 LYS C C 32 179.392 179.392 179.114 0.278 18703 168 1 . 1 1 32 32 LYS CA C 32 59.356 59.356 59.720 -0.364 18703 169 1 . 1 1 32 32 LYS CB C 32 32.117 32.117 32.350 -0.233 18703 170 1 . 1 1 32 32 LYS H H 32 7.699 7.699 7.548 0.151 18703 171 1 . 1 1 33 33 LYS N N 33 118.964 118.964 118.109 0.855 18703 172 1 . 1 1 33 33 LYS HA H 33 4.117 4.117 4.164 -0.047 18703 173 1 . 1 1 33 33 LYS C C 33 178.355 178.355 178.552 -0.197 18703 174 1 . 1 1 33 33 LYS CA C 33 58.633 58.633 58.731 -0.098 18703 175 1 . 1 1 33 33 LYS CB C 33 31.904 31.904 32.288 -0.384 18703 176 1 . 1 1 33 33 LYS H H 33 7.752 7.752 7.610 0.142 18703 177 1 . 1 1 34 34 CYS N N 34 119.956 119.956 118.815 1.141 18703 178 1 . 1 1 34 34 CYS HA H 34 3.967 3.967 4.116 -0.149 18703 179 1 . 1 1 34 34 CYS C C 34 175.521 175.521 176.780 -1.259 18703 180 1 . 1 1 34 34 CYS CA C 34 60.987 60.987 62.967 -1.980 18703 181 1 . 1 1 34 34 CYS CB C 34 36.600 36.600 26.654 9.946 18703 182 1 . 1 1 34 34 CYS H H 34 8.393 8.393 7.631 0.762 18703 183 1 . 1 1 35 35 GLU N N 35 120.327 120.327 119.738 0.589 18703 184 1 . 1 1 35 35 GLU HA H 35 3.891 3.891 3.934 -0.043 18703 185 1 . 1 1 35 35 GLU C C 35 179.684 179.684 178.640 1.044 18703 186 1 . 1 1 35 35 GLU CA C 35 60.059 60.059 59.286 0.773 18703 187 1 . 1 1 35 35 GLU CB C 35 29.718 29.718 28.705 1.013 18703 188 1 . 1 1 35 35 GLU H H 35 8.558 8.558 7.849 0.709 18703 189 1 . 1 1 36 36 GLU N N 36 120.190 120.190 119.826 0.364 18703 190 1 . 1 1 36 36 GLU HA H 36 4.051 4.051 4.003 0.048 18703 191 1 . 1 1 36 36 GLU C C 36 179.408 179.408 178.943 0.465 18703 192 1 . 1 1 36 36 GLU CA C 36 59.148 59.148 58.924 0.224 18703 193 1 . 1 1 36 36 GLU CB C 36 29.766 29.766 29.655 0.111 18703 194 1 . 1 1 36 36 GLU H H 36 8.038 8.038 7.646 0.392 18703 195 1 . 1 1 37 37 LEU N N 37 121.102 121.102 119.901 1.201 18703 196 1 . 1 1 37 37 LEU HA H 37 4.079 4.079 4.179 -0.100 18703 197 1 . 1 1 37 37 LEU C C 37 178.279 178.279 178.331 -0.052 18703 198 1 . 1 1 37 37 LEU CA C 37 57.803 57.803 57.424 0.379 18703 199 1 . 1 1 37 37 LEU CB C 37 41.502 41.502 41.743 -0.242 18703 200 1 . 1 1 37 37 LEU H H 37 8.065 8.065 7.480 0.585 18703 201 1 . 1 1 38 38 LYS N N 38 119.980 119.980 118.938 1.042 18703 202 1 . 1 1 38 38 LYS HA H 38 3.851 3.851 3.904 -0.053 18703 203 1 . 1 1 38 38 LYS C C 38 178.919 178.919 179.140 -0.221 18703 204 1 . 1 1 38 38 LYS CA C 38 60.794 60.794 59.921 0.873 18703 205 1 . 1 1 38 38 LYS CB C 38 32.863 32.863 32.238 0.625 18703 206 1 . 1 1 38 38 LYS H H 38 8.741 8.741 7.793 0.948 18703 207 1 . 1 1 39 39 LYS N N 39 118.307 118.307 117.583 0.724 18703 208 1 . 1 1 39 39 LYS HA H 39 4.125 4.125 4.068 0.057 18703 209 1 . 1 1 39 39 LYS C C 39 178.622 178.622 178.497 0.125 18703 210 1 . 1 1 39 39 LYS CA C 39 58.993 58.993 59.154 -0.162 18703 211 1 . 1 1 39 39 LYS CB C 39 32.097 32.097 31.816 0.281 18703 212 1 . 1 1 39 39 LYS H H 39 7.584 7.584 7.714 -0.130 18703 213 1 . 1 1 40 40 LYS N N 40 118.826 118.826 119.620 -0.794 18703 214 1 . 1 1 40 40 LYS HA H 40 4.069 4.069 4.186 -0.117 18703 215 1 . 1 1 40 40 LYS C C 40 179.802 179.802 178.808 0.994 18703 216 1 . 1 1 40 40 LYS CA C 40 59.322 59.322 58.656 0.666 18703 217 1 . 1 1 40 40 LYS CB C 40 32.505 32.505 32.296 0.209 18703 218 1 . 1 1 40 40 LYS H H 40 7.945 7.945 7.358 0.587 18703 219 1 . 1 1 41 41 ILE N N 41 118.958 118.958 118.436 0.522 18703 220 1 . 1 1 41 41 ILE HA H 41 3.659 3.659 3.798 -0.139 18703 221 1 . 1 1 41 41 ILE C C 41 178.146 178.146 177.188 0.958 18703 222 1 . 1 1 41 41 ILE CA C 41 65.037 65.037 64.147 0.890 18703 223 1 . 1 1 41 41 ILE CB C 41 37.950 37.950 37.895 0.055 18703 224 1 . 1 1 41 41 ILE H H 41 8.369 8.369 8.005 0.364 18703 225 1 . 1 1 42 42 GLU N N 42 120.331 120.331 117.577 2.754 18703 226 1 . 1 1 42 42 GLU HA H 42 4.094 4.094 4.074 0.020 18703 227 1 . 1 1 42 42 GLU C C 42 178.697 178.697 177.753 0.944 18703 228 1 . 1 1 42 42 GLU CA C 42 58.927 58.927 58.742 0.185 18703 229 1 . 1 1 42 42 GLU CB C 42 29.399 29.399 29.938 -0.539 18703 230 1 . 1 1 42 42 GLU H H 42 7.805 7.805 7.674 0.131 18703 231 1 . 1 1 43 43 GLU N N 43 117.120 117.120 116.867 0.253 18703 232 1 . 1 1 43 43 GLU HA H 43 4.291 4.291 4.186 0.105 18703 233 1 . 1 1 43 43 GLU C C 43 177.551 177.551 177.541 0.010 18703 234 1 . 1 1 43 43 GLU CA C 43 56.800 56.800 57.003 -0.203 18703 235 1 . 1 1 43 43 GLU CB C 43 29.931 29.931 29.741 0.190 18703 236 1 . 1 1 43 43 GLU H H 43 7.701 7.701 7.610 0.091 18703 237 1 . 1 1 44 44 LEU N N 44 120.940 120.940 120.720 0.220 18703 238 1 . 1 1 44 44 LEU HA H 44 4.251 4.251 4.093 0.158 18703 239 1 . 1 1 44 44 LEU C C 44 178.596 178.596 177.205 1.391 18703 240 1 . 1 1 44 44 LEU CA C 44 56.448 56.448 55.464 0.984 18703 241 1 . 1 1 44 44 LEU CB C 44 42.519 42.519 42.547 -0.028 18703 242 1 . 1 1 44 44 LEU H H 44 7.581 7.581 7.383 0.198 18703 243 1 . 1 1 45 45 GLY N N 45 108.689 108.689 107.458 1.231 18703 244 1 . 1 1 45 45 GLY C C 45 174.853 174.853 174.038 0.815 18703 245 1 . 1 1 45 45 GLY CA C 45 46.233 46.233 45.194 1.039 18703 246 1 . 1 1 45 45 GLY H H 45 8.232 8.232 8.514 -0.282 18703 247 1 . 1 1 46 46 GLY N N 46 108.029 108.029 108.327 -0.298 18703 248 1 . 1 1 46 46 GLY C C 46 174.351 174.351 174.127 0.224 18703 249 1 . 1 1 46 46 GLY CA C 46 45.105 45.105 45.150 -0.045 18703 250 1 . 1 1 46 46 GLY H H 46 8.176 8.176 8.210 -0.034 18703 251 1 . 1 1 47 47 GLY N N 47 108.183 108.183 108.116 0.067 18703 252 1 . 1 1 47 47 GLY C C 47 174.671 174.671 174.784 -0.113 18703 253 1 . 1 1 47 47 GLY CA C 47 45.254 45.254 44.894 0.360 18703 254 1 . 1 1 47 47 GLY H H 47 8.290 8.290 8.148 0.142 18703 255 1 . 1 1 48 48 GLY N N 48 108.616 108.616 109.648 -1.032 18703 256 1 . 1 1 48 48 GLY C C 48 174.321 174.321 175.392 -1.071 18703 257 1 . 1 1 48 48 GLY CA C 48 45.192 45.192 45.568 -0.376 18703 258 1 . 1 1 48 48 GLY H H 48 8.027 8.027 8.351 -0.324 18703 259 1 . 1 1 49 49 GLU N N 49 121.057 121.057 122.062 -1.005 18703 260 1 . 1 1 49 49 GLU HA H 49 4.425 4.425 4.337 0.088 18703 261 1 . 1 1 49 49 GLU C C 49 177.072 177.072 178.340 -1.268 18703 262 1 . 1 1 49 49 GLU CA C 49 56.330 56.330 57.376 -1.046 18703 263 1 . 1 1 49 49 GLU CB C 49 29.602 29.602 29.881 -0.279 18703 264 1 . 1 1 49 49 GLU H H 49 8.486 8.486 8.379 0.107 18703 265 1 . 1 1 50 50 VAL N N 50 122.122 122.122 119.849 2.273 18703 266 1 . 1 1 50 50 VAL HA H 50 3.792 3.792 3.667 0.125 18703 267 1 . 1 1 50 50 VAL C C 50 176.774 176.774 177.359 -0.585 18703 268 1 . 1 1 50 50 VAL CA C 50 64.864 64.864 65.334 -0.470 18703 269 1 . 1 1 50 50 VAL CB C 50 32.179 32.179 31.420 0.759 18703 270 1 . 1 1 50 50 VAL H H 50 8.095 8.095 8.002 0.093 18703 271 1 . 1 1 51 51 LYS N N 51 120.602 120.602 118.327 2.275 18703 272 1 . 1 1 51 51 LYS HA H 51 4.195 4.195 4.072 0.123 18703 273 1 . 1 1 51 51 LYS C C 51 178.530 178.530 178.417 0.113 18703 274 1 . 1 1 51 51 LYS CA C 51 59.348 59.348 59.037 0.311 18703 275 1 . 1 1 51 51 LYS CB C 51 32.265 32.265 32.118 0.147 18703 276 1 . 1 1 51 51 LYS H H 51 8.268 8.268 7.971 0.297 18703 277 1 . 1 1 52 52 LYS N N 52 117.547 117.547 120.456 -2.909 18703 278 1 . 1 1 52 52 LYS HA H 52 4.162 4.162 4.089 0.073 18703 279 1 . 1 1 52 52 LYS C C 52 179.132 179.132 178.944 0.188 18703 280 1 . 1 1 52 52 LYS CA C 52 58.811 58.811 59.071 -0.260 18703 281 1 . 1 1 52 52 LYS CB C 52 32.054 32.054 32.168 -0.114 18703 282 1 . 1 1 52 52 LYS H H 52 7.595 7.595 7.751 -0.156 18703 283 1 . 1 1 53 53 VAL N N 53 119.190 119.190 118.730 0.460 18703 284 1 . 1 1 53 53 VAL HA H 53 3.767 3.767 3.761 0.006 18703 285 1 . 1 1 53 53 VAL C C 53 177.933 177.933 178.001 -0.068 18703 286 1 . 1 1 53 53 VAL CA C 53 66.065 66.065 66.018 0.047 18703 287 1 . 1 1 53 53 VAL CB C 53 31.248 31.248 31.177 0.070 18703 288 1 . 1 1 53 53 VAL H H 53 7.597 7.597 7.593 0.004 18703 289 1 . 1 1 54 54 GLU N N 54 120.226 120.226 119.205 1.021 18703 290 1 . 1 1 54 54 GLU HA H 54 3.833 3.833 3.996 -0.163 18703 291 1 . 1 1 54 54 GLU C C 54 179.352 179.352 178.601 0.751 18703 292 1 . 1 1 54 54 GLU CA C 54 59.153 59.153 59.552 -0.399 18703 293 1 . 1 1 54 54 GLU CB C 54 29.224 29.224 29.386 -0.161 18703 294 1 . 1 1 54 54 GLU H H 54 8.609 8.609 7.700 0.909 18703 295 1 . 1 1 55 55 GLU N N 55 119.148 119.148 119.273 -0.125 18703 296 1 . 1 1 55 55 GLU HA H 55 4.084 4.084 4.119 -0.035 18703 297 1 . 1 1 55 55 GLU C C 55 179.084 179.084 178.793 0.291 18703 298 1 . 1 1 55 55 GLU CA C 55 59.295 59.295 58.945 0.350 18703 299 1 . 1 1 55 55 GLU CB C 55 29.361 29.361 29.624 -0.263 18703 300 1 . 1 1 55 55 GLU H H 55 7.713 7.713 7.837 -0.124 18703 301 1 . 1 1 56 56 GLU N N 56 120.301 120.301 118.985 1.316 18703 302 1 . 1 1 56 56 GLU HA H 56 4.079 4.079 4.125 -0.046 18703 303 1 . 1 1 56 56 GLU C C 56 179.773 179.773 179.163 0.610 18703 304 1 . 1 1 56 56 GLU CA C 56 59.528 59.528 59.227 0.301 18703 305 1 . 1 1 56 56 GLU CB C 56 30.162 30.162 29.722 0.440 18703 306 1 . 1 1 56 56 GLU H H 56 7.899 7.899 7.578 0.321 18703 307 1 . 1 1 57 57 VAL N N 57 121.536 121.536 118.650 2.886 18703 308 1 . 1 1 57 57 VAL HA H 57 3.540 3.540 3.813 -0.273 18703 309 1 . 1 1 57 57 VAL C C 57 176.984 176.984 177.585 -0.601 18703 310 1 . 1 1 57 57 VAL CA C 57 66.734 66.734 65.483 1.251 18703 311 1 . 1 1 57 57 VAL CB C 57 31.425 31.425 31.400 0.025 18703 312 1 . 1 1 57 57 VAL H H 57 8.652 8.652 7.520 1.132 18703 313 1 . 1 1 58 58 LYS N N 58 120.219 120.219 120.007 0.212 18703 314 1 . 1 1 58 58 LYS HA H 58 4.199 4.199 4.094 0.105 18703 315 1 . 1 1 58 58 LYS C C 58 178.972 178.972 178.492 0.480 18703 316 1 . 1 1 58 58 LYS CA C 58 59.357 59.357 59.348 0.009 18703 317 1 . 1 1 58 58 LYS CB C 58 32.186 32.186 32.098 0.088 18703 318 1 . 1 1 58 58 LYS H H 58 7.791 7.791 7.469 0.322 18703 319 1 . 1 1 59 59 LYS N N 59 118.252 118.252 119.841 -1.589 18703 320 1 . 1 1 59 59 LYS HA H 59 4.069 4.069 4.149 -0.080 18703 321 1 . 1 1 59 59 LYS C C 59 179.180 179.180 178.491 0.689 18703 322 1 . 1 1 59 59 LYS CA C 59 59.285 59.285 59.021 0.264 18703 323 1 . 1 1 59 59 LYS CB C 59 32.345 32.345 32.366 -0.021 18703 324 1 . 1 1 59 59 LYS H H 59 7.849 7.849 7.515 0.334 18703 325 1 . 1 1 60 60 LEU N N 60 121.243 121.243 119.764 1.479 18703 326 1 . 1 1 60 60 LEU HA H 60 4.242 4.242 4.149 0.093 18703 327 1 . 1 1 60 60 LEU C C 60 178.413 178.413 178.178 0.235 18703 328 1 . 1 1 60 60 LEU CA C 60 57.798 57.798 57.237 0.561 18703 329 1 . 1 1 60 60 LEU CB C 60 41.150 41.150 42.191 -1.041 18703 330 1 . 1 1 60 60 LEU H H 60 7.825 7.825 7.566 0.259 18703 331 1 . 1 1 61 61 GLU N N 61 118.844 118.844 120.022 -1.178 18703 332 1 . 1 1 61 61 GLU HA H 61 3.800 3.800 3.929 -0.129 18703 333 1 . 1 1 61 61 GLU C C 61 179.078 179.078 178.553 0.525 18703 334 1 . 1 1 61 61 GLU CA C 61 60.104 60.104 59.933 0.171 18703 335 1 . 1 1 61 61 GLU CB C 61 29.864 29.864 29.650 0.214 18703 336 1 . 1 1 61 61 GLU H H 61 8.582 8.582 7.724 0.858 18703 337 1 . 1 1 62 62 GLU N N 62 117.659 117.659 118.683 -1.024 18703 338 1 . 1 1 62 62 GLU HA H 62 3.990 3.990 4.059 -0.070 18703 339 1 . 1 1 62 62 GLU C C 62 178.847 178.847 178.927 -0.080 18703 340 1 . 1 1 62 62 GLU CA C 62 59.067 59.067 58.930 0.137 18703 341 1 . 1 1 62 62 GLU CB C 62 29.440 29.440 29.663 -0.223 18703 342 1 . 1 1 62 62 GLU H H 62 8.032 8.032 7.632 0.400 18703 343 1 . 1 1 63 63 GLU N N 63 119.290 119.290 119.341 -0.051 18703 344 1 . 1 1 63 63 GLU HA H 63 4.012 4.012 4.086 -0.074 18703 345 1 . 1 1 63 63 GLU C C 63 179.784 179.784 179.310 0.474 18703 346 1 . 1 1 63 63 GLU CA C 63 59.300 59.300 59.275 0.025 18703 347 1 . 1 1 63 63 GLU CB C 63 29.728 29.728 29.546 0.182 18703 348 1 . 1 1 63 63 GLU H H 63 7.958 7.958 7.465 0.493 18703 349 1 . 1 1 64 64 ILE N N 64 118.453 118.453 119.023 -0.570 18703 350 1 . 1 1 64 64 ILE HA H 64 3.711 3.711 3.784 -0.073 18703 351 1 . 1 1 64 64 ILE C C 64 177.655 177.655 177.807 -0.152 18703 352 1 . 1 1 64 64 ILE CA C 64 64.256 64.256 64.057 0.199 18703 353 1 . 1 1 64 64 ILE CB C 64 38.002 38.002 37.610 0.392 18703 354 1 . 1 1 64 64 ILE H H 64 8.160 8.160 7.561 0.599 18703 355 1 . 1 1 65 65 LYS N N 65 118.871 118.871 118.884 -0.013 18703 356 1 . 1 1 65 65 LYS HA H 65 4.111 4.111 4.102 0.009 18703 357 1 . 1 1 65 65 LYS C C 65 177.076 177.076 177.738 -0.662 18703 358 1 . 1 1 65 65 LYS CA C 65 58.421 58.421 58.588 -0.167 18703 359 1 . 1 1 65 65 LYS CB C 65 32.639 32.639 32.249 0.390 18703 360 1 . 1 1 65 65 LYS H H 65 7.664 7.664 7.663 0.001 18703 361 1 . 1 1 66 66 LYS N N 66 116.944 116.944 118.043 -1.099 18703 362 1 . 1 1 66 66 LYS HA H 66 4.320 4.320 4.152 0.168 18703 363 1 . 1 1 66 66 LYS C C 66 175.897 175.897 177.541 -1.644 18703 364 1 . 1 1 66 66 LYS CA C 66 56.352 56.352 57.811 -1.459 18703 365 1 . 1 1 66 66 LYS CB C 66 33.024 33.024 32.992 0.032 18703 366 1 . 1 1 66 66 LYS H H 66 7.246 7.246 7.675 -0.429 18703 stop_ save_